*HEADER    HORMONE/GROWTH FACTOR                   31-JAN-02   1KX6              
*TITLE     NMR SOLUTION STRUCTURE OF GLUCAGON IN A LIPID-WATER                   
*TITLE    2 INTERPHASE                                                           
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: GLUCAGON;                                                  
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: THIS PROTEIN WAS CHEMICALLY SYNTHESIZED. IT           
*SOURCE   4 IS NATURALLY FOUND IN BOS TAURUS (BOVINE).                           
*KEYWDS    HORMONE                                                               
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    W.BRAUN, G.WIDER, K.H.LEE, K.WUTHRICH                                 
*REVDAT   1   13-FEB-02 1KX6    0                                                
 3  GLN  HA     4  GLY  HN       2.7
 4  GLY  HN     3  GLN  HA       2.7
 5  THR  HN     5  THR  HA       2.7
 5  THR  HA     6  PHE  HN       2.4
 5  THR  HB     6  PHE  HN       2.7
 6  PHE  HN     5  THR  HA       2.4
 6  PHE  HN     5  THR  HB       2.7
 7  THR  HN     7  THR  HA       2.7
 7  THR  HN     7  THR  HB       3.1
 7  THR  HA     8  SER  HN       2.7
 6  PHE  HN     6  PHE  QB       3.3
 5  THR  HN     5  THR  QG2      4.1
 5  THR  HA     5  THR  QG2      3.0
 6  PHE  HN     6  PHE  QB       3.3
 6  PHE  HA     6  PHE  QR       4.7
 5  THR  HB     6  PHE  QR       7.4
 5  THR  HB     7  THR  QG2      4.0
 5  THR  QG2    6  PHE  HN       6.0
 6  PHE  HN     5  THR  QG2      6.0
 6  PHE  QR     5  THR  HB       7.4
 6  PHE  HA    10  TYR  CG       7.0
 6  PHE  QR     7  THR  HA       7.4
 6  PHE  QR     7  THR  QG2      8.4
 7  THR  HN     7  THR  HB       3.1
 7  THR  HN     7  THR  QG2      3.4
 7  THR  HA     7  THR  QG2      3.7
 7  THR  HA     6  PHE  QR       7.4
 7  THR  QG2    5  THR  HB       4.0
 7  THR  QG2    6  PHE  QR       8.4
 7  THR  QG2    8  SER  HN       5.0
 7  THR  HA    10  TYR  CG       6.0
 7  THR  QG2   10  TYR  CG       8.0
 8  SER  HN     7  THR  HA       2.7
 8  SER  HN     8  SER  QB       3.3
 8  SER  HA     9  ASP  HN       2.7
 8  SER  HN     8  SER  QB       3.3
 8  SER  HN     7  THR  QG2      5.0
 9  ASP  HN     8  SER  HA       2.7
 9  ASP  HN     9  ASP  QB       3.3
 9  ASP  QB    10  TYR  HN       4.1
 9  ASP  HN     9  ASP  QB       3.3
10  TYR  HN     9  ASP  QB       4.1
10  TYR  HN    10  TYR  QB       3.3
10  TYR  HN    10  TYR  QB       3.3
11  SER  HN    11  SER  HA       2.4
11  SER  HN    12  LYS  HN       3.1
11  SER  HA    14  LEU  QB       6.0
11  SER  HA    14  LEU  HG       5.0
11  SER  HA    14  LEU  QQD      5.4
12  LYS  HN    11  SER  HN       3.1
12  LYS  HN    12  LYS  HA       2.4
12  LYS  HN    13  TYR  HN       4.0
12  LYS  QB    13  TYR  HN       4.1
12  LYS  HN    12  LYS  QG       4.1
12  LYS  HA    12  LYS  QD       5.0
13  TYR  HN    12  LYS  HN       4.0
13  TYR  HN    12  LYS  QB       4.1
13  TYR  HN    13  TYR  QB       3.7
13  TYR  HN    13  TYR  QB       3.7
 9  ASP  QB    10  TYR  CG       7.0
10  TYR  HA    13  TYR  CG       6.0
10  TYR  CG     6  PHE  HA       7.0
10  TYR  CG     7  THR  HA       6.0
10  TYR  CG     7  THR  QG2      8.0
10  TYR  CG     9  ASP  QB       7.0
10  TYR  CG    11  SER  HA       7.0
10  TYR  CG    14  LEU  QQD      7.4
10  TYR  CZ    14  LEU  QQD      7.4
11  SER  HA    10  TYR  CG       7.0
12  LYS  HA    13  TYR  CG       7.0
12  LYS  QB    13  TYR  CG       8.0
13  TYR  CG    10  TYR  HA       6.0
13  TYR  CG    12  LYS  HA       7.0
13  TYR  CG    12  LYS  QB       8.0
13  TYR  CG    14  LEU  QQD      9.4
14  LEU  HA    15  ASP  HN       2.7
14  LEU  HN    14  LEU  QD1      5.0
14  LEU  HN    14  LEU  QD2      5.0
14  LEU  HA    14  LEU  QQD      4.1
14  LEU  QB    11  SER  HA   6.0
14  LEU  HG    11  SER  HA   5.0
14  LEU  QQD   10  TYR  CZ   7.4
14  LEU  QQD   10  TYR  CG   7.4
14  LEU  QQD   11  SER  HA   5.4
14  LEU  QQD   13  TYR  CG   9.4
14  LEU  QQD   15  ASP  HN   7.4
15  ASP  HN    14  LEU  HA   2.7
15  ASP  HN    15  ASP  QB       3.3
15  ASP  HN    15  ASP  QB       3.3
15  ASP  HN    14  LEU  QQD      7.4
16  SER  HA    17  ARG  HN   2.7
17  ARG  HN    16  SER  HA   2.7
17  ARG  HN    17  ARG  QB   3.3
17  ARG  HN    18  ARG  HN   3.1
17  ARG  HN    18  ARG  HN   3.3
17  ARG  HA    20  GLN  QB   5.0
18  ARG  HN    17  ARG  HN   3.1
18  ARG  HN    18  ARG  QB   3.3
18  ARG  HN    18  ARG  HA   2.7
18  ARG  HN    19  ALA  HN   3.1
18  ARG  HN    18  ARG  QB   3.3
18  ARG  HN    18  ARG  QG   4.1
19  ALA  HN    18  ARG  HN   3.1
19  ALA  HN    19  ALA  QB   3.0
19  ALA  HN    19  ALA  HA   2.7
19  ALA  HA    20  GLN  HN   3.1
19  ALA  QB    20  GLN  HN    3.7
19  ALA  HN    19  ALA  QB    3.0
19  ALA  HA    22  PHE  HN    4.0
19  ALA  HA    22  PHE  QB    6.0
19  ALA  QB    22  PHE  QB    6.0
19  ALA  QB    23  VAL  HA    5.0
19  ALA  HA    22  PHE  QR    7.4
19  ALA  QB    22  PHE  QR    8.4
20  GLN  HN    19  ALA  QB    3.7
20  GLN  HN    19  ALA  HA    3.1
20  GLN  HN    20  GLN  HA    2.7
20  GLN  HN    20  GLN  QB    3.3
20  GLN  HA    21  ASP  HN    3.1
20  GLN  QB    21  ASP  HN    4.1
20  GLN  HN    20  GLN  QB    3.3
20  GLN  HA    23  VAL  HN    4.0
20  GLN  QB    17  ARG  HA       5.0
20  GLN  HA    23  VAL  QQG      6.4
21  ASP  HN    20  GLN  QB   4.1
21  ASP  HN    21  ASP  HA   2.7
21  ASP  QB    22  PHE  HN   4.1
21  ASP  HA    24  GLN  HN   4.0
21  ASP  HA    24  GLN  QB   5.0
22  PHE  HN    21  ASP  QB   4.1
22  PHE  HN    22  PHE  QB   3.3
22  PHE  QB    23  VAL  HN   4.1
22  PHE  HN    22  PHE  QB    3.3
22  PHE  HN    19  ALA  HA    4.0
22  PHE  HA    25  TRP  HN    5.0
22  PHE  QB    19  ALA  HA    6.0
22  PHE  QB    19  ALA  QB    6.0
22  PHE  HA    25  TRP  HE3      5.0
22  PHE  QR    19  ALA  HA    7.4
22  PHE  QR    19  ALA  QB    8.4
22  PHE  QR    23  VAL  QQG      8.8
22  PHE  QR    23  VAL  HN       7.4
22  PHE  QR    23  VAL  HA       7.4
22  PHE  QR    26  LEU  QQD      7.8
22  PHE  QB    26  LEU  QQD      6.4
23  VAL  HN    22  PHE  QB     4.1
23  VAL  HN    23  VAL  HB     2.7
23  VAL  HN    23  VAL  HA     2.7
23  VAL  HA    24  GLN  HN     3.1
23  VAL  HN    23  VAL  HB     2.7
23  VAL  HA    23  VAL  HB     3.7
23  VAL  HA    23  VAL  QG2      3.7
23  VAL  HN    20  GLN  HA     4.0
23  VAL  HA    19  ALA  QB       5.0
23  VAL  HA    26  LEU  HN       3.0
23  VAL  HN    22  PHE  QR       7.4
23  VAL  HA    22  PHE  QR       7.4
23  VAL  HA    26  LEU  QQD      5.4
23  VAL  QQG   20  GLN  HA       6.4
23  VAL  HB    24  GLN  HN       3.1
23  VAL  QQG   22  PHE  QR       8.8
23  VAL  QQG   24  GLN  HN       7.4
24  GLN  HN    23  VAL  HA       3.1
24  GLN  HN    23  VAL  HB       3.1
24  GLN  HN    24  GLN  HA       2.7
24  GLN  HN    24  GLN  QB       3.3
24  GLN  HN    25  TRP  HN       3.1
24  GLN  HA    25  TRP  HN       3.1
24  GLN  QB    25  TRP  HN       4.1
24  GLN  HN    24  GLN  QB       3.3
24  GLN  HN    21  ASP  HA       4.0
24  GLN  HA    27  MET  HN       4.0
24  GLN  HA    28  ASN  HN       4.0
24  GLN  QB    21  ASP  HA       5.0
24  GLN  HN    23  VAL  QQG      7.4
25  TRP  HN    24  GLN  HN       3.1
25  TRP  HN    24  GLN  HA       3.1
25  TRP  HN    24  GLN  QB     4.1
25  TRP  HN    25  TRP  QB     3.3
25  TRP  HN    25  TRP  HA     2.7
25  TRP  HN    26  LEU  HN     4.0
25  TRP  QB    26  LEU  HN     4.1
25  TRP  HN    25  TRP  QB     3.3
25  TRP  HN    25  TRP  HE3      5.0
25  TRP  HA    25  TRP  HD1      2.4
25  TRP  QB    25  TRP  HD1      3.7
25  TRP  QB    25  TRP  HE3      4.1
25  TRP  HN    22  PHE  HA       5.0
25  TRP  HD1   26  LEU  QQD      6.4
25  TRP  HE3   22  PHE  HA       5.0
25  TRP  HE3   26  LEU  HA       5.0
25  TRP  HE3   26  LEU  QB       6.0
25  TRP  HE3   26  LEU  QQD      5.4
25  TRP  HE3   26  LEU  HN       4.0
25  TRP  HZ3   26  LEU  QQD      6.4
25  TRP  HZ3   26  LEU  HA       5.0
25  TRP  HH2   26  LEU  QQD      7.4
25  TRP  HZ3   26  LEU  QB     6.0
26  LEU  HN    25  TRP  HN     4.0
26  LEU  HN    25  TRP  QB     4.1
26  LEU  HN    26  LEU  HA     2.7
26  LEU  HN    26  LEU  QB     3.7
26  LEU  HN    27  MET  HN     3.1
26  LEU  QB    27  MET  HN     4.1
26  LEU  HN    26  LEU  QB     3.7
26  LEU  HA    26  LEU  QQD      4.1
26  LEU  HN    23  VAL  HA       3.0
26  LEU  HN    25  TRP  HE3      4.0
26  LEU  HA    25  TRP  HE3      5.0
26  LEU  HA    25  TRP  HZ3      5.0
26  LEU  QQD   22  PHE  QR       7.8
26  LEU  QQD   22  PHE  QB       6.4
26  LEU  QQD   23  VAL  HA       5.4
26  LEU  QQD   25  TRP  HE3      5.4
26  LEU  QQD   25  TRP  HD1      6.4
26  LEU  QQD   25  TRP  HZ3      6.4
26  LEU  QQD   25  TRP  HH2      7.4
26  LEU  QQD   27  MET  HN       7.4
26  LEU  QQD   27  MET  QE       8.4
26  LEU  QB    25  TRP  HE3      6.0
26  LEU  QB    25  TRP  HZ3      6.0
27  MET  HN    26  LEU  HN       3.1
27  MET  HN    26  LEU  QB       4.1
27  MET  HN    27  MET  HA       2.7
27  MET  HN    27  MET  QB       3.7
27  MET  HN    28  ASN  HN       3.1
27  MET  HA    28  ASN  HN       3.1
27  MET  HN    27  MET  QB       3.7
27  MET  HN    27  MET  QG       4.1
27  MET  HN    24  GLN  HA       4.0
27  MET  HN    26  LEU  QQD      7.4
27  MET  QE    26  LEU  QQD      8.4
27  MET  QG    28  ASN  HN       6.0
28  ASN  HN    27  MET  HA       3.1
28  ASN  HN    28  ASN  QB       3.3
28  ASN  QB    29  THR  HN       3.7
28  ASN  HN    28  ASN  QB       3.3
28  ASN  HN    24  GLN  HA       4.0
28  ASN  HN    27  MET  QG       6.0
29  THR  HN    28  ASN  QB       3.7
29  THR  HN    29  THR  HB       4.0
29  THR  HN    29  THR  HA       2.4
29  THR  HN    29  THR  HB       4.0
29  THR  HN    29  THR  QG2      4.1
29  THR  HA    29  THR  QG2      3.0

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    HIS   1           H        HIS   1 -33.428   0.517 -22.394
    2    HA   HIS   1           HA       HIS   1 -31.073   1.294 -21.912
    3   1HB   HIS   1          1HB       HIS   1 -32.299  -0.186 -20.409
    4   2HB   HIS   1          2HB       HIS   1 -31.895  -1.577 -21.396
    5    HD1  HIS   1           1HD      HIS   1 -29.499   1.179 -20.246
    6    HD2  HIS   1           2HD      HIS   1 -30.179  -2.928 -19.728
    7    HE1  HIS   1           1HE      HIS   1 -27.537   0.296 -18.875
    8    H    SER   2           H        SER   2 -29.593   1.719 -23.542
    9    HA   SER   2           HA       SER   2 -28.039  -0.532 -24.342
   10   1HB   SER   2          1HB       SER   2 -28.178   0.166 -26.818
   11   2HB   SER   2          2HB       SER   2 -29.548  -0.713 -26.167
   12    HG   SER   2           HG       SER   2 -29.335   2.052 -26.869
   13    H    GLN   3           H        GLN   3 -25.879   0.096 -24.704
   14    HA   GLN   3           HA       GLN   3 -25.451   2.980 -24.772
   15   1HB   GLN   3          1HB       GLN   3 -23.480   2.683 -23.327
   16   2HB   GLN   3          2HB       GLN   3 -24.919   2.084 -22.527
   17   1HG   GLN   3          1HG       GLN   3 -24.329  -0.252 -23.312
   18   2HG   GLN   3          2HG       GLN   3 -22.842   0.385 -23.986
   19   1HE2  GLN   3          1HE2      GLN   3 -21.739  -1.061 -22.592
   20   2HE2  GLN   3          2HE2      GLN   3 -21.457  -0.680 -20.926
   21    H    GLY   4           H        GLY   4 -23.160   3.540 -25.623
   22   1HA   GLY   4          1HA       GLY   4 -21.318   2.968 -26.949
   23   2HA   GLY   4          2HA       GLY   4 -22.136   1.514 -27.485
   24    H    THR   5           H        THR   5 -22.804   5.097 -27.460
   25    HA   THR   5           HA       THR   5 -24.536   5.294 -29.503
   26    HB   THR   5           HB       THR   5 -23.530   7.573 -29.831
   27    HG1  THR   5           1HG      THR   5 -21.533   6.452 -28.000
   28   1HG2  THR   5          1HG2      THR   5 -24.758   6.855 -27.581
   29   2HG2  THR   5          2HG2      THR   5 -23.118   6.933 -26.893
   30   3HG2  THR   5          3HG2      THR   5 -23.845   8.382 -27.627
   31    H    PHE   6           H        PHE   6 -24.338   5.906 -31.800
   32    HA   PHE   6           HA       PHE   6 -22.629   4.016 -33.095
   33   1HB   PHE   6          1HB       PHE   6 -24.808   4.328 -34.055
   34   2HB   PHE   6          2HB       PHE   6 -24.779   6.059 -33.779
   35    HD1  PHE   6           1HD      PHE   6 -22.610   3.649 -35.650
   36    HD2  PHE   6           2HD      PHE   6 -24.825   7.268 -35.728
   37    HE1  PHE   6           1HE      PHE   6 -21.923   4.018 -38.036
   38    HE2  PHE   6           2HE      PHE   6 -24.137   7.637 -38.114
   39    HZ   PHE   6           HZ       PHE   6 -22.694   6.007 -39.239
   40    H    THR   7           H        THR   7 -22.634   7.503 -32.425
   41    HA   THR   7           HA       THR   7 -21.091   8.558 -34.369
   42    HB   THR   7           HB       THR   7 -22.079   9.539 -32.141
   43    HG1  THR   7           1HG      THR   7 -20.991  11.052 -33.373
   44   1HG2  THR   7          1HG2      THR   7 -19.398   9.747 -31.017
   45   2HG2  THR   7          2HG2      THR   7 -20.899   9.231 -30.210
   46   3HG2  THR   7          3HG2      THR   7 -19.892   8.037 -31.063
   47    H    SER   8           H        SER   8 -18.820   8.961 -34.695
   48    HA   SER   8           HA       SER   8 -16.806   8.228 -35.059
   49   1HB   SER   8          1HB       SER   8 -16.960   8.664 -32.389
   50   2HB   SER   8          2HB       SER   8 -16.546   6.962 -32.349
   51    HG   SER   8           HG       SER   8 -15.000   8.459 -34.155
   52    H    ASP   9           H        ASP   9 -15.249   6.018 -34.340
   53    HA   ASP   9           HA       ASP   9 -16.740   3.949 -35.652
   54   1HB   ASP   9          1HB       ASP   9 -13.981   4.751 -35.438
   55   2HB   ASP   9          2HB       ASP   9 -14.093   3.114 -34.822
   56    HD2  ASP   9           HD       ASP   9 -13.789   4.629 -37.989
   57    H    TYR  10           H        TYR  10 -17.341   4.781 -32.803
   58    HA   TYR  10           HA       TYR  10 -16.291   3.312 -30.818
   59   1HB   TYR  10          1HB       TYR  10 -19.175   3.966 -31.652
   60   2HB   TYR  10          2HB       TYR  10 -18.847   3.226 -30.098
   61    HD1  TYR  10           1HD      TYR  10 -20.187   5.487 -29.569
   62    HD2  TYR  10           2HD      TYR  10 -16.106   5.289 -30.839
   63    HE1  TYR  10           1HE      TYR  10 -19.756   7.784 -28.567
   64    HE2  TYR  10           2HE      TYR  10 -15.689   7.587 -29.833
   65    HH   TYR  10           HH       TYR  10 -17.832   9.707 -29.237
   66    H    SER  11           H        SER  11 -17.228   1.332 -29.660
   67    HA   SER  11           HA       SER  11 -18.034  -0.726 -29.642
   68   1HB   SER  11          1HB       SER  11 -19.466   0.043 -31.724
   69   2HB   SER  11          2HB       SER  11 -18.294  -0.868 -32.655
   70    HG   SER  11           HG       SER  11 -19.443  -2.138 -30.372
   71    H    LYS  12           H        LYS  12 -15.945  -1.414 -28.962
   72    HA   LYS  12           HA       LYS  12 -14.217  -2.818 -29.133
   73   1HB   LYS  12          1HB       LYS  12 -15.595  -3.448 -31.475
   74   2HB   LYS  12          2HB       LYS  12 -13.973  -3.087 -32.030
   75   1HG   LYS  12          1HG       LYS  12 -13.505  -4.601 -29.724
   76   2HG   LYS  12          2HG       LYS  12 -14.938  -5.357 -30.394
   77   1HD   LYS  12          1HD       LYS  12 -13.463  -6.505 -31.712
   78   2HD   LYS  12          2HD       LYS  12 -13.434  -5.043 -32.678
   79   1HE   LYS  12          1HE       LYS  12 -11.538  -5.490 -30.330
   80   2HE   LYS  12          2HE       LYS  12 -11.142  -5.980 -31.965
   81   1HZ   LYS  12          1HZ       LYS  12 -10.863  -3.438 -30.888
   82   2HZ   LYS  12          2HZ       LYS  12 -10.610  -3.864 -32.439
   83    H    TYR  13           H        TYR  13 -14.259  -0.583 -32.002
   84    HA   TYR  13           HA       TYR  13 -11.677  -0.041 -32.313
   85   1HB   TYR  13          1HB       TYR  13 -13.625   1.039 -33.485
   86   2HB   TYR  13          2HB       TYR  13 -14.066   1.882 -32.013
   87    HD1  TYR  13           1HD      TYR  13 -11.407   1.633 -34.613
   88    HD2  TYR  13           2HD      TYR  13 -13.135   3.998 -31.494
   89    HE1  TYR  13           1HE      TYR  13  -9.971   3.613 -35.309
   90    HE2  TYR  13           2HE      TYR  13 -11.694   5.970 -32.201
   91    HH   TYR  13           HH       TYR  13  -9.632   6.370 -33.347
   92    H    LEU  14           H        LEU  14 -13.726   1.176 -29.613
   93    HA   LEU  14           HA       LEU  14 -12.182   3.086 -28.532
   94   1HB   LEU  14          1HB       LEU  14 -13.637   0.867 -27.089
   95   2HB   LEU  14          2HB       LEU  14 -13.046   2.332 -26.329
   96    HG   LEU  14           HG       LEU  14 -14.926   2.530 -28.666
   97   1HD1  LEU  14          1HD1      LEU  14 -16.790   1.947 -27.536
   98   2HD1  LEU  14          2HD1      LEU  14 -15.651   0.932 -26.618
   99   3HD1  LEU  14          3HD1      LEU  14 -16.157   2.511 -25.971
  100   1HD2  LEU  14          1HD2      LEU  14 -14.347   4.661 -28.177
  101   2HD2  LEU  14          2HD2      LEU  14 -15.642   4.482 -26.968
  102   3HD2  LEU  14          3HD2      LEU  14 -13.940   4.286 -26.485
  103    H    ASP  15           H        ASP  15 -10.034   3.225 -28.200
  104    HA   ASP  15           HA       ASP  15  -8.791   0.977 -26.873
  105   1HB   ASP  15          1HB       ASP  15  -8.248   1.903 -29.626
  106   2HB   ASP  15          2HB       ASP  15  -6.805   1.902 -28.633
  107    HD2  ASP  15           HD       ASP  15  -5.831   0.055 -28.446
  108    H    SER  16           H        SER  16  -7.032   1.676 -25.488
  109    HA   SER  16           HA       SER  16  -5.772   4.112 -25.721
  110   1HB   SER  16          1HB       SER  16  -7.946   5.125 -25.159
  111   2HB   SER  16          2HB       SER  16  -8.086   4.114 -23.734
  112    HG   SER  16           HG       SER  16  -6.488   6.415 -24.174
  113    H    ARG  17           H        ARG  17  -4.107   2.479 -25.276
  114    HA   ARG  17           HA       ARG  17  -3.834   2.093 -22.428
  115   1HB   ARG  17          1HB       ARG  17  -4.707  -0.013 -23.946
  116   2HB   ARG  17          2HB       ARG  17  -2.978  -0.220 -24.143
  117   1HG   ARG  17          1HG       ARG  17  -2.655  -0.816 -21.941
  118   2HG   ARG  17          2HG       ARG  17  -3.835   0.333 -21.344
  119   1HD   ARG  17          1HD       ARG  17  -4.988  -1.643 -20.917
  120   2HD   ARG  17          2HD       ARG  17  -5.577  -1.319 -22.535
  121    HE   ARG  17           HE       ARG  17  -3.121  -2.850 -22.634
  122   1HH1  ARG  17          2HH2      ARG  17  -6.593  -3.173 -22.007
  123   2HH1  ARG  17          1HH2      ARG  17  -6.644  -4.846 -22.452
  124   1HH2  ARG  17          1HH       ARG  17  -4.630  -5.934 -23.163
  125    H    ARG  18           H        ARG  18  -2.516   4.084 -23.727
  126    HA   ARG  18           HA       ARG  18  -0.323   3.564 -25.178
  127   1HB   ARG  18          1HB       ARG  18  -1.367   5.762 -23.730
  128   2HB   ARG  18          2HB       ARG  18   0.260   5.575 -23.105
  129   1HG   ARG  18          1HG       ARG  18   0.677   5.267 -25.832
  130   2HG   ARG  18          2HG       ARG  18  -0.641   6.421 -25.810
  131   1HD   ARG  18          1HD       ARG  18   0.825   8.073 -25.288
  132   2HD   ARG  18          2HD       ARG  18   1.189   7.266 -23.776
  133    HE   ARG  18           HE       ARG  18   2.736   5.830 -25.494
  134   1HH1  ARG  18          2HH2      ARG  18   2.318   9.332 -25.153
  135   2HH1  ARG  18          1HH2      ARG  18   3.916   9.702 -25.708
  136   1HH2  ARG  18          1HH       ARG  18   5.385   7.914 -26.334
  137    H    ALA  19           H        ALA  19  -0.452   3.828 -21.544
  138    HA   ALA  19           HA       ALA  19   2.207   3.062 -21.143
  139   1HB   ALA  19          1HB       ALA  19  -0.008   2.527 -19.162
  140   2HB   ALA  19          2HB       ALA  19   1.648   3.112 -18.871
  141   3HB   ALA  19          3HB       ALA  19   0.432   4.199 -19.584
  142    H    GLN  20           H        GLN  20   1.090   0.947 -19.040
  143    HA   GLN  20           HA       GLN  20   1.058  -1.217 -18.875
  144   1HB   GLN  20          1HB       GLN  20  -0.939  -0.660 -20.661
  145   2HB   GLN  20          2HB       GLN  20   0.024  -1.763 -21.624
  146   1HG   GLN  20          1HG       GLN  20  -1.318  -3.302 -20.513
  147   2HG   GLN  20          2HG       GLN  20   0.024  -3.228 -19.388
  148   1HE2  GLN  20          1HE2      GLN  20  -2.908  -3.768 -19.110
  149   2HE2  GLN  20          2HE2      GLN  20  -3.470  -2.721 -17.850
  150    H    ASP  21           H        ASP  21   2.888  -2.444 -18.858
  151    HA   ASP  21           HA       ASP  21   4.514  -3.691 -19.652
  152   1HB   ASP  21          1HB       ASP  21   3.056  -3.443 -21.963
  153   2HB   ASP  21          2HB       ASP  21   4.516  -2.601 -22.442
  154    HD2  ASP  21           HD       ASP  21   5.361  -5.272 -23.772
  155    H    PHE  22           H        PHE  22   4.226  -0.459 -21.301
  156    HA   PHE  22           HA       PHE  22   7.029  -0.010 -21.294
  157   1HB   PHE  22          1HB       PHE  22   4.615   1.886 -21.524
  158   2HB   PHE  22          2HB       PHE  22   6.242   2.270 -22.050
  159    HD1  PHE  22           1HD      PHE  22   3.111   1.173 -23.118
  160    HD2  PHE  22           2HD      PHE  22   7.249   0.515 -23.793
  161    HE1  PHE  22           1HE      PHE  22   2.593   0.250 -25.394
  162    HE2  PHE  22           2HE      PHE  22   6.731  -0.408 -26.069
  163    HZ   PHE  22           HZ       PHE  22   4.409  -0.530 -26.842
  164    H    VAL  23           H        VAL  23   4.466   0.343 -18.944
  165    HA   VAL  23           HA       VAL  23   5.411   2.529 -17.507
  166    HB   VAL  23           HB       VAL  23   3.959   0.059 -16.536
  167   1HG1  VAL  23          1HG1      VAL  23   4.448   1.072 -14.549
  168   2HG1  VAL  23          2HG1      VAL  23   4.628   2.684 -15.283
  169   3HG1  VAL  23          3HG1      VAL  23   3.004   2.020 -14.981
  170   1HG2  VAL  23          1HG2      VAL  23   1.991   0.897 -17.321
  171   2HG2  VAL  23          2HG2      VAL  23   2.509   2.590 -17.142
  172   3HG2  VAL  23          3HG2      VAL  23   3.073   1.629 -18.530
  173    H    GLN  24           H        GLN  24   6.715  -0.669 -17.967
  174    HA   GLN  24           HA       GLN  24   8.143  -0.680 -15.507
  175   1HB   GLN  24          1HB       GLN  24   7.598  -2.527 -17.679
  176   2HB   GLN  24          2HB       GLN  24   9.319  -2.512 -17.354
  177   1HG   GLN  24          1HG       GLN  24   8.821  -3.974 -15.672
  178   2HG   GLN  24          2HG       GLN  24   8.312  -2.552 -14.783
  179   1HE2  GLN  24          1HE2      GLN  24   6.266  -2.325 -14.194
  180   2HE2  GLN  24          2HE2      GLN  24   4.946  -3.348 -14.655
  181    H    TRP  25           H        TRP  25   8.405   1.474 -17.830
  182    HA   TRP  25           HA       TRP  25  11.343   1.460 -17.770
  183   1HB   TRP  25          1HB       TRP  25  10.577   0.802 -19.994
  184   2HB   TRP  25          2HB       TRP  25   9.573   2.234 -20.096
  185    HD1  TRP  25           HD       TRP  25  13.393   1.527 -19.578
  186    HE1  TRP  25           1HE      TRP  25  14.840   3.314 -20.872
  187    HE3  TRP  25           3HE      TRP  25   9.454   4.245 -21.295
  188    HZ2  TRP  25           2HZ      TRP  25  14.190   5.613 -22.432
  189    HZ3  TRP  25           3HZ      TRP  25   9.947   6.246 -22.697
  190    HH2  TRP  25           HH       TRP  25  12.218   6.943 -23.271
  191    H    LEU  26           H        LEU  26   8.280   3.356 -18.215
  192    HA   LEU  26           HA       LEU  26   9.541   5.830 -17.638
  193   1HB   LEU  26          1HB       LEU  26   6.612   5.093 -17.585
  194   2HB   LEU  26          2HB       LEU  26   7.278   6.713 -17.630
  195    HG   LEU  26           HG       LEU  26   6.617   6.330 -19.824
  196   1HD1  LEU  26          1HD1      LEU  26   8.847   7.232 -19.812
  197   2HD1  LEU  26          2HD1      LEU  26   9.555   5.604 -19.677
  198   3HD1  LEU  26          3HD1      LEU  26   8.698   6.082 -21.162
  199   1HD2  LEU  26          1HD2      LEU  26   6.396   3.768 -19.299
  200   2HD2  LEU  26          2HD2      LEU  26   6.576   4.341 -20.974
  201   3HD2  LEU  26          3HD2      LEU  26   7.981   3.677 -20.105
  202    H    MET  27           H        MET  27   8.692   3.127 -15.724
  203    HA   MET  27           HA       MET  27   9.542   4.340 -13.402
  204   1HB   MET  27          1HB       MET  27   7.293   4.306 -12.152
  205   2HB   MET  27          2HB       MET  27   7.449   5.586 -13.338
  206   1HG   MET  27          1HG       MET  27   6.088   4.402 -14.950
  207   2HG   MET  27          2HG       MET  27   6.185   2.904 -14.045
  208   1HE   MET  27          1HE       MET  27   2.671   4.255 -14.319
  209   2HE   MET  27          2HE       MET  27   3.316   5.914 -14.329
  210   3HE   MET  27          3HE       MET  27   4.080   4.656 -15.330
  211    H    ASN  28           H        ASN  28  10.584   2.152 -14.076
  212    HA   ASN  28           HA       ASN  28   9.168  -0.194 -13.863
  213   1HB   ASN  28          1HB       ASN  28  11.438  -1.237 -13.451
  214   2HB   ASN  28          2HB       ASN  28  11.432  -0.133 -14.812
  215   1HD2  ASN  28          1HD2      ASN  28  12.952  -1.007 -11.994
  216   2HD2  ASN  28          2HD2      ASN  28  13.911   0.403 -11.691
  217    H    THR  29           H        THR  29   8.503  -1.424 -12.057
  218    HA   THR  29           HA       THR  29   7.869  -1.716  -9.925
  219    HB   THR  29           HB       THR  29   9.923  -2.068  -8.424
  220    HG1  THR  29           1HG      THR  29  11.942  -1.749  -9.785
  221   1HG2  THR  29          1HG2      THR  29  10.907  -3.269 -10.924
  222   2HG2  THR  29          2HG2      THR  29  10.286  -4.076  -9.464
  223   3HG2  THR  29          3HG2      THR  29   9.157  -3.525 -10.725
  Start of MODEL    2
    1    H    HIS   1           H        HIS   1   3.954 -12.781  -3.631
    2    HA   HIS   1           HA       HIS   1   1.406 -13.588  -4.637
    3   1HB   HIS   1          1HB       HIS   1   0.611 -14.658  -2.595
    4   2HB   HIS   1          2HB       HIS   1   1.924 -15.562  -3.322
    5    HD1  HIS   1           1HD      HIS   1   4.108 -15.821  -1.975
    6    HD2  HIS   1           2HD      HIS   1   1.264 -13.358  -0.120
    7    HE1  HIS   1           1HE      HIS   1   4.943 -15.432   0.405
    8    H    SER   2           H        SER   2  -0.381 -12.432  -3.448
    9    HA   SER   2           HA       SER   2  -1.242 -10.593  -2.686
   10   1HB   SER   2          1HB       SER   2   0.746 -11.347  -0.726
   11   2HB   SER   2          2HB       SER   2   0.680  -9.597  -0.800
   12    HG   SER   2           HG       SER   2  -0.865 -10.407   0.722
   13    H    GLN   3           H        GLN   3  -1.212  -9.121  -4.389
   14    HA   GLN   3           HA       GLN   3  -0.638  -7.395  -5.572
   15   1HB   GLN   3          1HB       GLN   3  -0.336  -6.245  -3.403
   16   2HB   GLN   3          2HB       GLN   3   1.323  -6.803  -3.311
   17   1HG   GLN   3          1HG       GLN   3   2.025  -5.053  -4.569
   18   2HG   GLN   3          2HG       GLN   3   0.957  -5.522  -5.876
   19   1HE2  GLN   3          1HE2      GLN   3   1.757  -3.061  -3.952
   20   2HE2  GLN   3          2HE2      GLN   3   0.272  -2.174  -3.854
   21    H    GLY   4           H        GLY   4   0.172  -8.869  -7.227
   22   1HA   GLY   4          1HA       GLY   4   2.601  -8.249  -8.313
   23   2HA   GLY   4          2HA       GLY   4   2.943  -9.612  -7.266
   24    H    THR   5           H        THR   5   1.311 -11.542  -7.479
   25    HA   THR   5           HA       THR   5   1.513 -12.696  -9.906
   26    HB   THR   5           HB       THR   5  -0.579 -14.013  -9.087
   27    HG1  THR   5           1HG      THR   5  -1.492 -12.218  -7.886
   28   1HG2  THR   5          1HG2      THR   5   2.067 -13.768  -7.863
   29   2HG2  THR   5          2HG2      THR   5   0.840 -14.096  -6.616
   30   3HG2  THR   5          3HG2      THR   5   1.031 -15.210  -7.991
   31    H    PHE   6           H        PHE   6  -0.067 -13.222 -11.617
   32    HA   PHE   6           HA       PHE   6  -0.914 -10.967 -12.911
   33   1HB   PHE   6          1HB       PHE   6  -2.459 -12.793 -14.068
   34   2HB   PHE   6          2HB       PHE   6  -0.722 -13.012 -14.150
   35    HD1  PHE   6           1HD      PHE   6  -3.784 -14.110 -12.403
   36    HD2  PHE   6           2HD      PHE   6   0.330 -14.871 -13.110
   37    HE1  PHE   6           1HE      PHE   6  -4.018 -16.368 -11.333
   38    HE2  PHE   6           2HE      PHE   6   0.096 -17.129 -12.040
   39    HZ   PHE   6           HZ       PHE   6  -2.075 -17.851 -11.164
   40    H    THR   7           H        THR   7  -2.748 -13.130 -10.681
   41    HA   THR   7           HA       THR   7  -5.290 -12.239 -11.074
   42    HB   THR   7           HB       THR   7  -4.221 -14.019  -9.445
   43    HG1  THR   7           1HG      THR   7  -6.349 -12.217  -8.539
   44   1HG2  THR   7          1HG2      THR   7  -3.419 -11.657  -8.095
   45   2HG2  THR   7          2HG2      THR   7  -4.851 -12.227  -7.204
   46   3HG2  THR   7          3HG2      THR   7  -3.447 -13.301  -7.414
   47    H    SER   8           H        SER   8  -6.667 -10.746  -9.788
   48    HA   SER   8           HA       SER   8  -7.185  -8.760  -9.084
   49   1HB   SER   8          1HB       SER   8  -5.609  -9.207  -7.213
   50   2HB   SER   8          2HB       SER   8  -4.286  -8.549  -8.156
   51    HG   SER   8           HG       SER   8  -6.512  -7.190  -6.965
   52    H    ASP   9           H        ASP   9  -7.340  -6.638  -9.979
   53    HA   ASP   9           HA       ASP   9  -7.120  -5.113 -11.504
   54   1HB   ASP   9          1HB       ASP   9  -4.816  -4.989 -10.201
   55   2HB   ASP   9          2HB       ASP   9  -4.136  -5.635 -11.681
   56    HD2  ASP   9           HD       ASP   9  -3.037  -3.814 -12.154
   57    H    TYR  10           H        TYR  10  -7.153  -8.135 -12.228
   58    HA   TYR  10           HA       TYR  10  -6.679  -7.748 -15.057
   59   1HB   TYR  10          1HB       TYR  10  -4.520  -8.642 -14.426
   60   2HB   TYR  10          2HB       TYR  10  -5.206  -9.609 -13.135
   61    HD1  TYR  10           1HD      TYR  10  -6.199 -11.800 -13.589
   62    HD2  TYR  10           2HD      TYR  10  -4.539  -9.437 -16.746
   63    HE1  TYR  10           1HE      TYR  10  -6.203 -13.830 -15.121
   64    HE2  TYR  10           2HE      TYR  10  -4.549 -11.474 -18.267
   65    HH   TYR  10           HH       TYR  10  -4.458 -14.197 -17.628
   66    H    SER  11           H        SER  11  -7.636  -9.521 -16.367
   67    HA   SER  11           HA       SER  11  -9.092 -11.096 -16.797
   68   1HB   SER  11          1HB       SER  11  -8.383 -11.783 -14.152
   69   2HB   SER  11          2HB       SER  11 -10.135 -11.751 -14.134
   70    HG   SER  11           HG       SER  11  -9.290 -13.849 -14.742
   71    H    LYS  12           H        LYS  12 -10.374  -9.337 -17.696
   72    HA   LYS  12           HA       LYS  12 -12.383  -8.422 -18.002
   73   1HB   LYS  12          1HB       LYS  12 -12.975 -10.307 -16.020
   74   2HB   LYS  12          2HB       LYS  12 -13.625  -8.805 -15.395
   75   1HG   LYS  12          1HG       LYS  12 -14.390  -8.670 -18.060
   76   2HG   LYS  12          2HG       LYS  12 -14.477 -10.394 -17.760
   77   1HD   LYS  12          1HD       LYS  12 -15.633  -8.799 -15.554
   78   2HD   LYS  12          2HD       LYS  12 -16.437  -8.511 -17.084
   79   1HE   LYS  12          1HE       LYS  12 -17.624 -10.404 -16.604
   80   2HE   LYS  12          2HE       LYS  12 -16.193 -11.266 -17.132
   81   1HZ   LYS  12          1HZ       LYS  12 -15.541 -10.763 -14.593
   82   2HZ   LYS  12          2HZ       LYS  12 -17.159 -10.848 -14.422
   83    H    TYR  13           H        TYR  13 -11.420  -7.987 -14.520
   84    HA   TYR  13           HA       TYR  13 -12.259  -5.468 -14.108
   85   1HB   TYR  13          1HB       TYR  13 -10.066  -7.296 -13.269
   86   2HB   TYR  13          2HB       TYR  13  -9.592  -5.619 -13.086
   87    HD1  TYR  13           1HD      TYR  13 -11.067  -4.081 -11.673
   88    HD2  TYR  13           2HD      TYR  13 -11.501  -8.337 -11.697
   89    HE1  TYR  13           1HE      TYR  13 -12.330  -3.971  -9.469
   90    HE2  TYR  13           2HE      TYR  13 -12.763  -8.213  -9.493
   91    HH   TYR  13           HH       TYR  13 -12.836  -5.357  -7.617
   92    H    LEU  14           H        LEU  14  -9.662  -6.492 -16.284
   93    HA   LEU  14           HA       LEU  14  -8.091  -4.308 -16.476
   94   1HB   LEU  14          1HB       LEU  14  -9.165  -6.111 -18.642
   95   2HB   LEU  14          2HB       LEU  14  -7.922  -4.909 -18.927
   96    HG   LEU  14           HG       LEU  14  -7.559  -6.986 -16.778
   97   1HD1  LEU  14          1HD1      LEU  14  -7.867  -7.546 -19.576
   98   2HD1  LEU  14          2HD1      LEU  14  -6.181  -7.852 -19.091
   99   3HD1  LEU  14          3HD1      LEU  14  -7.515  -8.659 -18.232
  100   1HD2  LEU  14          1HD2      LEU  14  -5.216  -6.283 -18.302
  101   2HD2  LEU  14          2HD2      LEU  14  -6.033  -4.815 -17.714
  102   3HD2  LEU  14          3HD2      LEU  14  -5.545  -6.083 -16.564
  103    H    ASP  15           H        ASP  15  -8.221  -2.209 -17.176
  104    HA   ASP  15           HA       ASP  15 -10.720  -1.480 -18.476
  105   1HB   ASP  15          1HB       ASP  15 -10.706  -0.837 -16.031
  106   2HB   ASP  15          2HB       ASP  15  -9.270   0.126 -16.318
  107    HD2  ASP  15           HD       ASP  15 -12.438   1.570 -15.987
  108    H    SER  16           H        SER  16  -7.528  -0.097 -17.355
  109    HA   SER  16           HA       SER  16  -7.362   1.477 -19.726
  110   1HB   SER  16          1HB       SER  16  -6.031   1.339 -17.112
  111   2HB   SER  16          2HB       SER  16  -4.873   1.577 -18.406
  112    HG   SER  16           HG       SER  16  -6.202   3.399 -19.144
  113    H    ARG  17           H        ARG  17  -6.084   1.072 -21.548
  114    HA   ARG  17           HA       ARG  17  -4.579  -1.419 -21.426
  115   1HB   ARG  17          1HB       ARG  17  -5.081  -1.704 -23.844
  116   2HB   ARG  17          2HB       ARG  17  -6.562  -1.578 -22.917
  117   1HG   ARG  17          1HG       ARG  17  -7.033   0.599 -23.694
  118   2HG   ARG  17          2HG       ARG  17  -5.355   0.948 -24.058
  119   1HD   ARG  17          1HD       ARG  17  -5.387  -0.384 -26.056
  120   2HD   ARG  17          2HD       ARG  17  -6.858  -1.211 -25.586
  121    HE   ARG  17           HE       ARG  17  -7.170   1.697 -25.872
  122   1HH1  ARG  17          2HH2      ARG  17  -7.331  -1.428 -27.533
  123   2HH1  ARG  17          1HH2      ARG  17  -8.371  -0.847 -28.790
  124   1HH2  ARG  17          1HH       ARG  17  -9.071   1.445 -28.768
  125    H    ARG  18           H        ARG  18  -4.233   1.859 -21.364
  126    HA   ARG  18           HA       ARG  18  -2.483   2.368 -23.451
  127   1HB   ARG  18          1HB       ARG  18  -3.332   3.693 -20.926
  128   2HB   ARG  18          2HB       ARG  18  -1.709   4.124 -21.426
  129   1HG   ARG  18          1HG       ARG  18  -2.568   4.738 -23.695
  130   2HG   ARG  18          2HG       ARG  18  -4.191   4.299 -23.201
  131   1HD   ARG  18          1HD       ARG  18  -2.509   6.452 -21.827
  132   2HD   ARG  18          2HD       ARG  18  -3.716   6.784 -23.054
  133    HE   ARG  18           HE       ARG  18  -4.224   5.923 -20.275
  134   1HH1  ARG  18          2HH2      ARG  18  -5.590   6.437 -23.503
  135   2HH1  ARG  18          1HH2      ARG  18  -7.224   6.519 -22.934
  136   1HH2  ARG  18          1HH       ARG  18  -7.665   6.277 -20.591
  137    H    ALA  19           H        ALA  19  -1.532   2.454 -19.948
  138    HA   ALA  19           HA       ALA  19   1.142   1.741 -20.579
  139   1HB   ALA  19          1HB       ALA  19   0.573   1.394 -17.798
  140   2HB   ALA  19          2HB       ALA  19   1.401   2.754 -18.593
  141   3HB   ALA  19          3HB       ALA  19  -0.364   2.794 -18.370
  142    H    GLN  20           H        GLN  20   2.143  -0.243 -20.566
  143    HA   GLN  20           HA       GLN  20   1.321  -2.399 -19.102
  144   1HB   GLN  20          1HB       GLN  20  -0.154  -2.083 -21.657
  145   2HB   GLN  20          2HB       GLN  20   0.575  -3.664 -21.452
  146   1HG   GLN  20          1HG       GLN  20  -0.917  -4.259 -19.835
  147   2HG   GLN  20          2HG       GLN  20  -0.700  -2.752 -18.966
  148   1HE2  GLN  20          1HE2      GLN  20  -2.233  -4.193 -21.815
  149   2HE2  GLN  20          2HE2      GLN  20  -3.628  -3.167 -21.868
  150    H    ASP  21           H        ASP  21   3.453  -2.973 -18.816
  151    HA   ASP  21           HA       ASP  21   5.259  -4.121 -19.365
  152   1HB   ASP  21          1HB       ASP  21   3.900  -4.751 -21.565
  153   2HB   ASP  21          2HB       ASP  21   4.945  -3.569 -22.327
  154    HD2  ASP  21           HD       ASP  21   6.452  -6.052 -19.990
  155    H    PHE  22           H        PHE  22   4.281  -0.981 -20.380
  156    HA   PHE  22           HA       PHE  22   6.996  -0.173 -21.079
  157   1HB   PHE  22          1HB       PHE  22   4.283   0.494 -21.843
  158   2HB   PHE  22          2HB       PHE  22   4.934   1.915 -21.051
  159    HD1  PHE  22           1HD      PHE  22   4.441   0.543 -24.131
  160    HD2  PHE  22           2HD      PHE  22   7.554   2.314 -21.854
  161    HE1  PHE  22           1HE      PHE  22   5.629   1.179 -26.249
  162    HE2  PHE  22           2HE      PHE  22   8.741   2.950 -23.972
  163    HZ   PHE  22           HZ       PHE  22   7.765   2.375 -26.144
  164    H    VAL  23           H        VAL  23   4.472   0.124 -18.589
  165    HA   VAL  23           HA       VAL  23   5.451   2.386 -17.291
  166    HB   VAL  23           HB       VAL  23   3.971  -0.030 -16.233
  167   1HG1  VAL  23          1HG1      VAL  23   4.341   0.873 -14.213
  168   2HG1  VAL  23          2HG1      VAL  23   4.974   2.384 -14.909
  169   3HG1  VAL  23          3HG1      VAL  23   3.219   2.161 -14.713
  170   1HG2  VAL  23          1HG2      VAL  23   2.620   0.888 -17.919
  171   2HG2  VAL  23          2HG2      VAL  23   2.010   1.635 -16.423
  172   3HG2  VAL  23          3HG2      VAL  23   3.077   2.559 -17.508
  173    H    GLN  24           H        GLN  24   6.785  -0.788 -17.674
  174    HA   GLN  24           HA       GLN  24   8.237  -0.728 -15.225
  175   1HB   GLN  24          1HB       GLN  24   7.887  -2.587 -17.516
  176   2HB   GLN  24          2HB       GLN  24   9.480  -2.638 -16.788
  177   1HG   GLN  24          1HG       GLN  24   8.584  -3.171 -14.610
  178   2HG   GLN  24          2HG       GLN  24   6.952  -2.755 -15.094
  179   1HE2  GLN  24          1HE2      GLN  24   8.278  -5.241 -14.050
  180   2HE2  GLN  24          2HE2      GLN  24   7.810  -6.515 -15.126
  181    H    TRP  25           H        TRP  25   8.448   1.405 -17.543
  182    HA   TRP  25           HA       TRP  25  11.381   1.446 -17.502
  183   1HB   TRP  25          1HB       TRP  25  10.690   0.644 -19.694
  184   2HB   TRP  25          2HB       TRP  25   9.618   2.017 -19.891
  185    HD1  TRP  25           HD       TRP  25  13.461   1.546 -19.268
  186    HE1  TRP  25           1HE      TRP  25  14.837   3.323 -20.651
  187    HE3  TRP  25           3HE      TRP  25   9.419   3.927 -21.231
  188    HZ2  TRP  25           2HZ      TRP  25  14.098   5.476 -22.372
  189    HZ3  TRP  25           3HZ      TRP  25   9.834   5.857 -22.754
  190    HH2  TRP  25           HH       TRP  25  12.077   6.639 -23.332
  191    H    LEU  26           H        LEU  26   8.281   3.233 -18.123
  192    HA   LEU  26           HA       LEU  26   9.447   5.769 -17.679
  193   1HB   LEU  26          1HB       LEU  26   6.547   4.932 -17.569
  194   2HB   LEU  26          2HB       LEU  26   7.152   6.571 -17.710
  195    HG   LEU  26           HG       LEU  26   6.515   6.051 -19.876
  196   1HD1  LEU  26          1HD1      LEU  26   8.717   6.998 -19.941
  197   2HD1  LEU  26          2HD1      LEU  26   9.467   5.405 -19.679
  198   3HD1  LEU  26          3HD1      LEU  26   8.608   5.744 -21.200
  199   1HD2  LEU  26          1HD2      LEU  26   6.357   3.515 -19.193
  200   2HD2  LEU  26          2HD2      LEU  26   6.495   3.999 -20.901
  201   3HD2  LEU  26          3HD2      LEU  26   7.929   3.417 -20.022
  202    H    MET  27           H        MET  27   8.725   3.164 -15.595
  203    HA   MET  27           HA       MET  27   9.403   4.711 -13.355
  204   1HB   MET  27          1HB       MET  27   6.498   3.966 -13.848
  205   2HB   MET  27          2HB       MET  27   7.089   3.955 -12.198
  206   1HG   MET  27          1HG       MET  27   8.074   6.373 -12.976
  207   2HG   MET  27          2HG       MET  27   6.703   6.280 -14.063
  208   1HE   MET  27          1HE       MET  27   4.794   7.078 -13.695
  209   2HE   MET  27          2HE       MET  27   3.915   5.824 -12.787
  210   3HE   MET  27          3HE       MET  27   3.960   7.496 -12.180
  211    H    ASN  28           H        ASN  28  10.192   2.258 -14.831
  212    HA   ASN  28           HA       ASN  28  10.598   0.124 -14.550
  213   1HB   ASN  28          1HB       ASN  28  11.873   1.545 -12.611
  214   2HB   ASN  28          2HB       ASN  28  10.916   0.509 -11.572
  215   1HD2  ASN  28          1HD2      ASN  28  12.386  -0.845 -10.789
  216   2HD2  ASN  28          2HD2      ASN  28  13.388  -1.912 -11.715
  217    H    THR  29           H        THR  29  10.310  -1.543 -12.111
  218    HA   THR  29           HA       THR  29   8.753  -3.064 -11.500
  219    HB   THR  29           HB       THR  29   7.012  -1.786  -9.975
  220    HG1  THR  29           1HG      THR  29   8.978   0.267 -10.679
  221   1HG2  THR  29          1HG2      THR  29   8.707  -2.382  -8.532
  222   2HG2  THR  29          2HG2      THR  29   9.968  -2.026  -9.737
  223   3HG2  THR  29          3HG2      THR  29   9.274  -0.710  -8.759
  Start of MODEL    3
    1    H    HIS   1           H        HIS   1 -11.074  10.230   0.186
    2    HA   HIS   1           HA       HIS   1 -11.264  13.043  -0.068
    3   1HB   HIS   1          1HB       HIS   1 -12.902  12.787   1.824
    4   2HB   HIS   1          2HB       HIS   1 -13.259  11.865   0.377
    5    HD1  HIS   1           1HD      HIS   1 -12.815  11.510   3.995
    6    HD2  HIS   1           2HD      HIS   1 -12.530   9.004   0.643
    7    HE1  HIS   1           1HE      HIS   1 -12.904   9.118   4.880
    8    H    SER   2           H        SER   2 -10.352  10.898   2.729
    9    HA   SER   2           HA       SER   2  -8.102  12.383   3.340
   10   1HB   SER   2          1HB       SER   2 -10.531  13.610   4.253
   11   2HB   SER   2          2HB       SER   2  -9.717  12.971   5.667
   12    HG   SER   2           HG       SER   2  -8.472  14.665   3.671
   13    H    GLN   3           H        GLN   3  -6.898  10.706   4.147
   14    HA   GLN   3           HA       GLN   3  -6.310   8.936   5.257
   15   1HB   GLN   3          1HB       GLN   3  -7.369  10.531   7.150
   16   2HB   GLN   3          2HB       GLN   3  -8.500   9.201   7.304
   17   1HG   GLN   3          1HG       GLN   3  -6.657   7.611   7.692
   18   2HG   GLN   3          2HG       GLN   3  -5.466   8.859   7.385
   19   1HE2  GLN   3          1HE2      GLN   3  -8.346   8.247   9.388
   20   2HE2  GLN   3          2HE2      GLN   3  -7.750   8.952  10.853
   21    H    GLY   4           H        GLY   4  -6.853   6.639   5.732
   22   1HA   GLY   4          1HA       GLY   4  -8.829   5.103   5.875
   23   2HA   GLY   4          2HA       GLY   4  -9.370   5.859   4.389
   24    H    THR   5           H        THR   5  -7.377   3.402   5.793
   25    HA   THR   5           HA       THR   5  -5.330   2.984   4.084
   26    HB   THR   5           HB       THR   5  -5.888   0.482   4.565
   27    HG1  THR   5           1HG      THR   5  -8.252   1.161   4.729
   28   1HG2  THR   5          1HG2      THR   5  -5.925   2.481   6.889
   29   2HG2  THR   5          2HG2      THR   5  -5.623   0.735   7.052
   30   3HG2  THR   5          3HG2      THR   5  -4.468   1.758   6.165
   31    H    PHE   6           H        PHE   6  -5.019   1.504   2.231
   32    HA   PHE   6           HA       PHE   6  -7.350   1.660   0.451
   33   1HB   PHE   6          1HB       PHE   6  -5.208   1.580  -1.234
   34   2HB   PHE   6          2HB       PHE   6  -5.795   3.097  -0.583
   35    HD1  PHE   6           1HD      PHE   6  -3.115   0.634  -0.493
   36    HD2  PHE   6           2HD      PHE   6  -4.587   4.220   1.234
   37    HE1  PHE   6           1HE      PHE   6  -0.865   1.063   0.534
   38    HE2  PHE   6           2HE      PHE   6  -2.337   4.648   2.262
   39    HZ   PHE   6           HZ       PHE   6  -0.503   3.065   1.900
   40    H    THR   7           H        THR   7  -7.494  -0.561   1.841
   41    HA   THR   7           HA       THR   7  -6.614  -2.596  -0.034
   42    HB   THR   7           HB       THR   7  -4.833  -2.176   1.863
   43    HG1  THR   7           1HG      THR   7  -6.163  -4.774   1.571
   44   1HG2  THR   7          1HG2      THR   7  -5.333  -3.623   3.875
   45   2HG2  THR   7          2HG2      THR   7  -6.353  -2.165   3.818
   46   3HG2  THR   7          3HG2      THR   7  -7.023  -3.740   3.329
   47    H    SER   8           H        SER   8  -7.972  -4.367  -0.141
   48    HA   SER   8           HA       SER   8  -9.807  -5.500   0.095
   49   1HB   SER   8          1HB       SER   8  -9.250  -6.132   2.309
   50   2HB   SER   8          2HB       SER   8  -9.495  -4.516   2.940
   51    HG   SER   8           HG       SER   8 -11.472  -6.463   2.172
   52    H    ASP   9           H        ASP   9 -12.027  -5.204  -0.398
   53    HA   ASP   9           HA       ASP   9 -13.818  -4.125  -0.969
   54   1HB   ASP   9          1HB       ASP   9 -13.771  -3.742   1.629
   55   2HB   ASP   9          2HB       ASP   9 -13.320  -2.094   1.239
   56    HD2  ASP   9           HD       ASP   9 -16.063  -3.750   2.003
   57    H    TYR  10           H        TYR  10 -10.969  -3.133  -1.746
   58    HA   TYR  10           HA       TYR  10 -11.872  -0.628  -2.942
   59   1HB   TYR  10          1HB       TYR  10 -10.470  -0.398  -0.720
   60   2HB   TYR  10          2HB       TYR  10  -9.137  -1.100  -1.615
   61    HD1  TYR  10           1HD      TYR  10 -11.675   1.607  -2.244
   62    HD2  TYR  10           2HD      TYR  10  -7.561   0.437  -2.317
   63    HE1  TYR  10           1HE      TYR  10 -11.028   3.912  -3.100
   64    HE2  TYR  10           2HE      TYR  10  -6.927   2.746  -3.172
   65    HH   TYR  10           HH       TYR  10  -9.180   5.343  -3.187
   66    H    SER  11           H        SER  11  -9.908   0.139  -4.497
   67    HA   SER  11           HA       SER  11  -8.401  -0.376  -6.043
   68   1HB   SER  11          1HB       SER  11  -7.977  -2.566  -4.609
   69   2HB   SER  11          2HB       SER  11  -8.916  -3.352  -5.863
   70    HG   SER  11           HG       SER  11  -7.362  -2.937  -7.373
   71    H    LYS  12           H        LYS  12 -11.469  -2.216  -5.790
   72    HA   LYS  12           HA       LYS  12 -11.983  -3.047  -8.262
   73   1HB   LYS  12          1HB       LYS  12 -14.374  -2.460  -7.832
   74   2HB   LYS  12          2HB       LYS  12 -13.590  -3.319  -6.522
   75   1HG   LYS  12          1HG       LYS  12 -13.292  -1.261  -5.244
   76   2HG   LYS  12          2HG       LYS  12 -13.799  -0.276  -6.602
   77   1HD   LYS  12          1HD       LYS  12 -15.801  -0.345  -5.427
   78   2HD   LYS  12          2HD       LYS  12 -16.023  -1.757  -6.441
   79   1HE   LYS  12          1HE       LYS  12 -14.611  -2.798  -4.265
   80   2HE   LYS  12          2HE       LYS  12 -15.630  -1.590  -3.508
   81   1HZ   LYS  12          1HZ       LYS  12 -17.403  -2.757  -5.118
   82   2HZ   LYS  12          2HZ       LYS  12 -16.424  -4.035  -4.874
   83    H    TYR  13           H        TYR  13 -11.877   0.373  -7.190
   84    HA   TYR  13           HA       TYR  13 -12.804   1.364  -9.705
   85   1HB   TYR  13          1HB       TYR  13 -11.256   2.573  -7.327
   86   2HB   TYR  13          2HB       TYR  13 -12.025   3.530  -8.577
   87    HD1  TYR  13           1HD      TYR  13 -12.399   2.361  -5.325
   88    HD2  TYR  13           2HD      TYR  13 -14.644   2.867  -8.932
   89    HE1  TYR  13           1HE      TYR  13 -14.560   2.386  -3.985
   90    HE2  TYR  13           2HE      TYR  13 -16.797   2.890  -7.580
   91    HH   TYR  13           HH       TYR  13 -16.730   2.973  -4.084
   92    H    LEU  14           H        LEU  14  -9.594   1.169  -8.022
   93    HA   LEU  14           HA       LEU  14  -8.068   2.473  -9.855
   94   1HB   LEU  14          1HB       LEU  14  -7.650   0.376  -7.829
   95   2HB   LEU  14          2HB       LEU  14  -6.421   0.448  -9.076
   96    HG   LEU  14           HG       LEU  14  -5.781   1.759  -7.128
   97   1HD1  LEU  14          1HD1      LEU  14  -5.516   2.518  -9.711
   98   2HD1  LEU  14          2HD1      LEU  14  -6.317   3.957  -9.034
   99   3HD1  LEU  14          3HD1      LEU  14  -4.785   3.379  -8.334
  100   1HD2  LEU  14          1HD2      LEU  14  -7.164   4.008  -6.891
  101   2HD2  LEU  14          2HD2      LEU  14  -8.480   2.979  -7.507
  102   3HD2  LEU  14          3HD2      LEU  14  -7.620   2.526  -6.016
  103    H    ASP  15           H        ASP  15  -8.297   2.289 -12.037
  104    HA   ASP  15           HA       ASP  15  -7.784  -0.352 -13.100
  105   1HB   ASP  15          1HB       ASP  15 -10.280   0.045 -13.100
  106   2HB   ASP  15          2HB       ASP  15 -10.028   1.476 -14.080
  107    HD2  ASP  15           HD       ASP  15  -8.807   0.829 -16.250
  108    H    SER  16           H        SER  16  -5.967  -0.014 -14.388
  109    HA   SER  16           HA       SER  16  -6.048   2.105 -16.298
  110   1HB   SER  16          1HB       SER  16  -4.392   2.278 -13.842
  111   2HB   SER  16          2HB       SER  16  -3.486   2.531 -15.321
  112    HG   SER  16           HG       SER  16  -5.913   3.939 -14.590
  113    H    ARG  17           H        ARG  17  -4.807   1.569 -18.139
  114    HA   ARG  17           HA       ARG  17  -3.462  -0.995 -17.906
  115   1HB   ARG  17          1HB       ARG  17  -3.730  -0.957 -20.494
  116   2HB   ARG  17          2HB       ARG  17  -5.185  -1.187 -19.545
  117   1HG   ARG  17          1HG       ARG  17  -4.482   1.663 -20.092
  118   2HG   ARG  17          2HG       ARG  17  -4.901   0.722 -21.510
  119   1HD   ARG  17          1HD       ARG  17  -6.991  -0.068 -20.188
  120   2HD   ARG  17          2HD       ARG  17  -6.607   1.187 -19.026
  121    HE   ARG  17           HE       ARG  17  -6.571   2.619 -21.341
  122   1HH1  ARG  17          2HH2      ARG  17  -8.922   0.260 -20.128
  123   2HH1  ARG  17          1HH2      ARG  17 -10.262   0.989 -20.948
  124   1HH2  ARG  17          1HH       ARG  17  -9.897   2.940 -22.291
  125    H    ARG  18           H        ARG  18  -2.993   2.397 -18.310
  126    HA   ARG  18           HA       ARG  18  -1.011   2.633 -20.103
  127   1HB   ARG  18          1HB       ARG  18  -1.898   4.089 -17.692
  128   2HB   ARG  18          2HB       ARG  18  -0.182   4.299 -17.980
  129   1HG   ARG  18          1HG       ARG  18  -0.911   4.754 -20.482
  130   2HG   ARG  18          2HG       ARG  18  -2.502   5.021 -19.797
  131   1HD   ARG  18          1HD       ARG  18  -0.872   6.504 -18.084
  132   2HD   ARG  18          2HD       ARG  18  -0.070   6.715 -19.628
  133    HE   ARG  18           HE       ARG  18  -2.999   7.091 -19.678
  134   1HH1  ARG  18          2HH2      ARG  18   0.174   8.646 -19.407
  135   2HH1  ARG  18          1HH2      ARG  18  -0.417  10.211 -19.858
  136   1HH2  ARG  18          1HH       ARG  18  -2.743  10.487 -20.362
  137    H    ALA  19           H        ALA  19  -0.602   1.982 -16.539
  138    HA   ALA  19           HA       ALA  19   2.170   1.633 -16.663
  139   1HB   ALA  19          1HB       ALA  19   0.411   0.229 -14.653
  140   2HB   ALA  19          2HB       ALA  19   1.973   1.048 -14.411
  141   3HB   ALA  19          3HB       ALA  19   0.496   2.007 -14.668
  142    H    GLN  20           H        GLN  20   1.780  -1.086 -15.094
  143    HA   GLN  20           HA       GLN  20   1.891  -3.221 -15.500
  144   1HB   GLN  20          1HB       GLN  20  -0.230  -2.727 -16.927
  145   2HB   GLN  20          2HB       GLN  20   0.826  -2.845 -18.320
  146   1HG   GLN  20          1HG       GLN  20   0.166  -5.066 -18.168
  147   2HG   GLN  20          2HG       GLN  20   1.591  -5.129 -17.151
  148   1HE2  GLN  20          1HE2      GLN  20   0.390  -7.038 -16.361
  149   2HE2  GLN  20          2HE2      GLN  20  -0.721  -6.843 -15.047
  150    H    ASP  21           H        ASP  21   2.286  -4.008 -18.623
  151    HA   ASP  21           HA       ASP  21   4.933  -4.510 -18.471
  152   1HB   ASP  21          1HB       ASP  21   2.884  -4.784 -20.381
  153   2HB   ASP  21          2HB       ASP  21   4.083  -3.814 -21.212
  154    HD2  ASP  21           HD       ASP  21   4.713  -7.445 -21.633
  155    H    PHE  22           H        PHE  22   3.276  -1.479 -19.021
  156    HA   PHE  22           HA       PHE  22   5.394  -0.208 -20.456
  157   1HB   PHE  22          1HB       PHE  22   2.659   0.189 -19.860
  158   2HB   PHE  22          2HB       PHE  22   3.440   1.418 -18.886
  159    HD1  PHE  22           1HD      PHE  22   4.194   0.102 -22.301
  160    HD2  PHE  22           2HD      PHE  22   3.163   3.460 -19.920
  161    HE1  PHE  22           1HE      PHE  22   4.373   1.586 -24.317
  162    HE2  PHE  22           2HE      PHE  22   3.342   4.944 -21.936
  163    HZ   PHE  22           HZ       PHE  22   3.945   3.990 -24.110
  164    H    VAL  23           H        VAL  23   4.588  -0.836 -17.085
  165    HA   VAL  23           HA       VAL  23   5.815   1.310 -15.855
  166    HB   VAL  23           HB       VAL  23   5.588  -1.587 -15.017
  167   1HG1  VAL  23          1HG1      VAL  23   6.794  -1.088 -13.211
  168   2HG1  VAL  23          2HG1      VAL  23   6.991   0.591 -13.770
  169   3HG1  VAL  23          3HG1      VAL  23   5.589   0.145 -12.768
  170   1HG2  VAL  23          1HG2      VAL  23   3.521   0.005 -15.564
  171   2HG2  VAL  23          2HG2      VAL  23   3.499  -1.132 -14.195
  172   3HG2  VAL  23          3HG2      VAL  23   3.857   0.589 -13.916
  173    H    GLN  24           H        GLN  24   7.167  -1.235 -17.799
  174    HA   GLN  24           HA       GLN  24   9.730  -1.129 -16.573
  175   1HB   GLN  24          1HB       GLN  24   8.370  -2.764 -18.524
  176   2HB   GLN  24          2HB       GLN  24   9.875  -2.212 -19.231
  177   1HG   GLN  24          1HG       GLN  24   9.625  -3.548 -16.494
  178   2HG   GLN  24          2HG       GLN  24  10.130  -4.364 -17.961
  179   1HE2  GLN  24          1HE2      GLN  24  11.004  -2.289 -15.378
  180   2HE2  GLN  24          2HE2      GLN  24  12.674  -2.048 -15.768
  181    H    TRP  25           H        TRP  25   8.176   1.277 -17.992
  182    HA   TRP  25           HA       TRP  25  10.541   2.171 -19.494
  183   1HB   TRP  25          1HB       TRP  25   8.734   1.688 -21.038
  184   2HB   TRP  25          2HB       TRP  25   7.627   2.683 -20.114
  185    HD1  TRP  25           HD       TRP  25  11.045   3.281 -21.941
  186    HE1  TRP  25           1HE      TRP  25  11.043   5.631 -23.141
  187    HE3  TRP  25           3HE      TRP  25   6.414   4.670 -20.365
  188    HZ2  TRP  25           2HZ      TRP  25   9.149   7.760 -23.292
  189    HZ3  TRP  25           3HZ      TRP  25   5.563   6.900 -21.083
  190    HH2  TRP  25           HH       TRP  25   6.850   8.424 -22.496
  191    H    LEU  26           H        LEU  26   7.577   3.105 -17.615
  192    HA   LEU  26           HA       LEU  26   8.501   5.721 -17.094
  193   1HB   LEU  26          1HB       LEU  26   6.437   4.081 -15.619
  194   2HB   LEU  26          2HB       LEU  26   6.642   5.819 -15.533
  195    HG   LEU  26           HG       LEU  26   4.830   5.570 -16.956
  196   1HD1  LEU  26          1HD1      LEU  26   6.367   7.101 -17.967
  197   2HD1  LEU  26          2HD1      LEU  26   7.285   5.773 -18.716
  198   3HD1  LEU  26          3HD1      LEU  26   5.627   6.126 -19.259
  199   1HD2  LEU  26          1HD2      LEU  26   5.423   3.008 -17.194
  200   2HD2  LEU  26          2HD2      LEU  26   4.362   3.830 -18.364
  201   3HD2  LEU  26          3HD2      LEU  26   6.072   3.539 -18.764
  202    H    MET  27           H        MET  27   9.560   2.671 -16.011
  203    HA   MET  27           HA       MET  27  11.001   2.057 -14.503
  204   1HB   MET  27          1HB       MET  27  11.464   4.973 -14.751
  205   2HB   MET  27          2HB       MET  27  11.912   4.384 -13.162
  206   1HG   MET  27          1HG       MET  27  13.381   2.662 -14.171
  207   2HG   MET  27          2HG       MET  27  12.871   3.130 -15.781
  208   1HE   MET  27          1HE       MET  27  13.994   4.957 -17.160
  209   2HE   MET  27          2HE       MET  27  12.809   5.925 -16.250
  210   3HE   MET  27          3HE       MET  27  14.483   6.504 -16.428
  211    H    ASN  28           H        ASN  28   9.118   1.150 -13.338
  212    HA   ASN  28           HA       ASN  28   8.997   2.295 -10.706
  213   1HB   ASN  28          1HB       ASN  28   6.687   2.201 -12.629
  214   2HB   ASN  28          2HB       ASN  28   6.333   1.680 -10.993
  215   1HD2  ASN  28          1HD2      ASN  28   5.851   4.151 -12.797
  216   2HD2  ASN  28          2HD2      ASN  28   6.158   5.504 -11.761
  217    H    THR  29           H        THR  29   7.844   0.660  -9.178
  218    HA   THR  29           HA       THR  29   8.069  -1.433  -8.349
  219    HB   THR  29           HB       THR  29   6.403  -2.961  -9.716
  220    HG1  THR  29           1HG      THR  29   6.025  -0.294 -10.866
  221   1HG2  THR  29          1HG2      THR  29   4.437  -1.419  -9.153
  222   2HG2  THR  29          2HG2      THR  29   5.527  -1.744  -7.784
  223   3HG2  THR  29          3HG2      THR  29   5.630  -0.196  -8.656
  Start of MODEL    4
    1    H    HIS   1           H        HIS   1 -28.132   6.772   2.213
    2    HA   HIS   1           HA       HIS   1 -27.406   8.588   1.122
    3   1HB   HIS   1          1HB       HIS   1 -29.474   9.798   1.973
    4   2HB   HIS   1          2HB       HIS   1 -28.499  10.364   3.314
    5    HD1  HIS   1           1HD      HIS   1 -29.171  12.774   2.179
    6    HD2  HIS   1           2HD      HIS   1 -26.412  10.390   0.106
    7    HE1  HIS   1           1HE      HIS   1 -27.993  14.319   0.525
    8    H    SER   2           H        SER   2 -27.207   9.201   4.707
    9    HA   SER   2           HA       SER   2 -24.447   9.847   4.406
   10   1HB   SER   2          1HB       SER   2 -26.256  10.797   6.096
   11   2HB   SER   2          2HB       SER   2 -25.811   9.411   7.071
   12    HG   SER   2           HG       SER   2 -24.329  11.736   6.449
   13    H    GLN   3           H        GLN   3 -22.871   8.775   6.145
   14    HA   GLN   3           HA       GLN   3 -21.794   7.019   6.828
   15   1HB   GLN   3          1HB       GLN   3 -24.611   5.926   7.032
   16   2HB   GLN   3          2HB       GLN   3 -23.244   4.884   7.375
   17   1HG   GLN   3          1HG       GLN   3 -23.064   7.544   8.683
   18   2HG   GLN   3          2HG       GLN   3 -24.448   6.603   9.200
   19   1HE2  GLN   3          1HE2      GLN   3 -20.950   6.471   8.684
   20   2HE2  GLN   3          2HE2      GLN   3 -20.576   5.330   9.933
   21    H    GLY   4           H        GLY   4 -20.591   5.297   5.909
   22   1HA   GLY   4          1HA       GLY   4 -20.441   3.438   4.433
   23   2HA   GLY   4          2HA       GLY   4 -21.656   4.166   3.401
   24    H    THR   5           H        THR   5 -18.697   3.291   3.018
   25    HA   THR   5           HA       THR   5 -18.015   5.475   1.296
   26    HB   THR   5           HB       THR   5 -15.711   5.700   2.517
   27    HG1  THR   5           1HG      THR   5 -15.698   4.699   4.519
   28   1HG2  THR   5          1HG2      THR   5 -17.956   6.638   4.324
   29   2HG2  THR   5          2HG2      THR   5 -16.481   7.503   3.828
   30   3HG2  THR   5          3HG2      THR   5 -17.835   7.324   2.686
   31    H    PHE   6           H        PHE   6 -16.087   4.979  -0.039
   32    HA   PHE   6           HA       PHE   6 -15.722   2.067  -0.167
   33   1HB   PHE   6          1HB       PHE   6 -15.192   2.928  -2.694
   34   2HB   PHE   6          2HB       PHE   6 -16.832   2.579  -2.185
   35    HD1  PHE   6           1HD      PHE   6 -18.469   4.277  -2.128
   36    HD2  PHE   6           2HD      PHE   6 -14.388   5.324  -2.631
   37    HE1  PHE   6           1HE      PHE   6 -19.142   6.630  -2.683
   38    HE2  PHE   6           2HE      PHE   6 -15.061   7.678  -3.186
   39    HZ   PHE   6           HZ       PHE   6 -17.430   8.303  -3.205
   40    H    THR   7           H        THR   7 -14.165   4.357   1.229
   41    HA   THR   7           HA       THR   7 -11.764   4.684  -0.248
   42    HB   THR   7           HB       THR   7 -12.745   6.175   1.610
   43    HG1  THR   7           1HG      THR   7 -10.582   6.584   1.122
   44   1HG2  THR   7          1HG2      THR   7 -12.704   5.510   3.819
   45   2HG2  THR   7          2HG2      THR   7 -12.740   3.863   3.145
   46   3HG2  THR   7          3HG2      THR   7 -11.188   4.602   3.606
   47    H    SER   8           H        SER   8 -11.831   2.227  -0.832
   48    HA   SER   8           HA       SER   8 -10.661   0.658   1.281
   49   1HB   SER   8          1HB       SER   8 -12.368   0.069  -0.850
   50   2HB   SER   8          2HB       SER   8 -10.833  -0.570  -1.401
   51    HG   SER   8           HG       SER   8 -11.832  -1.134   1.246
   52    H    ASP   9           H        ASP   9  -8.609   1.824   1.453
   53    HA   ASP   9           HA       ASP   9  -6.523   2.218   1.013
   54   1HB   ASP   9          1HB       ASP   9  -6.729  -0.388   0.596
   55   2HB   ASP   9          2HB       ASP   9  -6.498   0.029  -1.090
   56    HD2  ASP   9           HD       ASP   9  -3.399   0.628   1.398
   57    H    TYR  10           H        TYR  10  -8.802   3.227  -0.853
   58    HA   TYR  10           HA       TYR  10  -7.259   3.686  -3.300
   59   1HB   TYR  10          1HB       TYR  10 -10.175   4.082  -2.388
   60   2HB   TYR  10          2HB       TYR  10  -9.615   4.574  -3.974
   61    HD1  TYR  10           1HD      TYR  10  -7.790   2.209  -4.557
   62    HD2  TYR  10           2HD      TYR  10 -11.757   2.420  -2.969
   63    HE1  TYR  10           1HE      TYR  10  -8.278  -0.122  -5.447
   64    HE2  TYR  10           2HE      TYR  10 -12.232   0.088  -3.865
   65    HH   TYR  10           HH       TYR  10 -10.831  -1.294  -6.118
   66    H    SER  11           H        SER  11  -7.768   5.985  -4.294
   67    HA   SER  11           HA       SER  11  -7.849   8.180  -4.109
   68   1HB   SER  11          1HB       SER  11  -7.730   8.113  -1.080
   69   2HB   SER  11          2HB       SER  11  -8.408   9.353  -2.115
   70    HG   SER  11           HG       SER  11 -10.238   8.327  -1.556
   71    H    LYS  12           H        LYS  12  -5.724   8.183  -5.028
   72    HA   LYS  12           HA       LYS  12  -3.631   8.956  -5.035
   73   1HB   LYS  12          1HB       LYS  12  -4.490   9.874  -2.544
   74   2HB   LYS  12          2HB       LYS  12  -3.016   8.999  -2.182
   75   1HG   LYS  12          1HG       LYS  12  -2.238  10.357  -4.447
   76   2HG   LYS  12          2HG       LYS  12  -3.399  11.490  -3.786
   77   1HD   LYS  12          1HD       LYS  12  -1.276  10.263  -1.995
   78   2HD   LYS  12          2HD       LYS  12  -0.883  11.632  -3.015
   79   1HE   LYS  12          1HE       LYS  12  -2.683  12.976  -1.976
   80   2HE   LYS  12          2HE       LYS  12  -3.201  11.599  -1.024
   81   1HZ   LYS  12          1HZ       LYS  12  -1.458  13.383  -0.113
   82   2HZ   LYS  12          2HZ       LYS  12  -1.436  11.834   0.389
   83    H    TYR  13           H        TYR  13  -4.222   6.627  -2.314
   84    HA   TYR  13           HA       TYR  13  -1.799   5.212  -2.998
   85   1HB   TYR  13          1HB       TYR  13  -4.131   4.575  -1.088
   86   2HB   TYR  13          2HB       TYR  13  -2.520   3.891  -0.991
   87    HD1  TYR  13           1HD      TYR  13  -0.580   5.383  -0.345
   88    HD2  TYR  13           2HD      TYR  13  -4.652   6.665  -0.065
   89    HE1  TYR  13           1HE      TYR  13   0.110   7.252   1.235
   90    HE2  TYR  13           2HE      TYR  13  -3.949   8.530   1.514
   91    HH   TYR  13           HH       TYR  13  -1.107   9.705   1.759
   92    H    LEU  14           H        LEU  14  -3.347   5.178  -5.267
   93    HA   LEU  14           HA       LEU  14  -4.835   2.674  -5.202
   94   1HB   LEU  14          1HB       LEU  14  -4.539   4.712  -7.412
   95   2HB   LEU  14          2HB       LEU  14  -5.611   3.326  -7.410
   96    HG   LEU  14           HG       LEU  14  -6.077   4.986  -5.073
   97   1HD1  LEU  14          1HD1      LEU  14  -5.227   6.797  -6.480
   98   2HD1  LEU  14          2HD1      LEU  14  -6.378   6.351  -7.763
   99   3HD1  LEU  14          3HD1      LEU  14  -6.978   6.958  -6.201
  100   1HD2  LEU  14          1HD2      LEU  14  -7.496   3.247  -6.653
  101   2HD2  LEU  14          2HD2      LEU  14  -8.186   4.326  -5.417
  102   3HD2  LEU  14          3HD2      LEU  14  -8.168   4.826  -7.126
  103    H    ASP  15           H        ASP  15  -4.228   0.831  -6.357
  104    HA   ASP  15           HA       ASP  15  -1.433   0.752  -6.951
  105   1HB   ASP  15          1HB       ASP  15  -1.746  -1.650  -7.122
  106   2HB   ASP  15          2HB       ASP  15  -2.643  -1.088  -5.725
  107    HD2  ASP  15           HD       ASP  15  -5.732  -1.884  -7.080
  108    H    SER  16           H        SER  16  -0.562   0.636  -9.067
  109    HA   SER  16           HA       SER  16  -2.008   1.564 -11.171
  110   1HB   SER  16          1HB       SER  16  -0.115   0.966 -12.552
  111   2HB   SER  16          2HB       SER  16   0.504   1.437 -10.981
  112    HG   SER  16           HG       SER  16   1.291  -0.666 -12.087
  113    H    ARG  17           H        ARG  17  -2.941   0.559 -13.078
  114    HA   ARG  17           HA       ARG  17  -3.214  -2.303 -12.961
  115   1HB   ARG  17          1HB       ARG  17  -5.200  -1.036 -11.757
  116   2HB   ARG  17          2HB       ARG  17  -5.714  -0.622 -13.380
  117   1HG   ARG  17          1HG       ARG  17  -5.023  -3.480 -13.131
  118   2HG   ARG  17          2HG       ARG  17  -6.291  -3.010 -12.017
  119   1HD   ARG  17          1HD       ARG  17  -6.328  -2.419 -15.017
  120   2HD   ARG  17          2HD       ARG  17  -7.165  -3.761 -14.264
  121    HE   ARG  17           HE       ARG  17  -8.134  -1.663 -12.812
  122   1HH1  ARG  17          2HH2      ARG  17  -7.789  -2.106 -16.310
  123   2HH1  ARG  17          1HH2      ARG  17  -9.138  -1.091 -16.697
  124   1HH2  ARG  17          1HH       ARG  17 -10.373  -0.054 -14.924
  125    H    ARG  18           H        ARG  18  -4.030   0.815 -14.612
  126    HA   ARG  18           HA       ARG  18  -4.710  -0.172 -17.041
  127   1HB   ARG  18          1HB       ARG  18  -4.428   2.323 -16.000
  128   2HB   ARG  18          2HB       ARG  18  -2.973   2.290 -16.976
  129   1HG   ARG  18          1HG       ARG  18  -4.664   1.345 -18.845
  130   2HG   ARG  18          2HG       ARG  18  -5.855   2.170 -17.859
  131   1HD   ARG  18          1HD       ARG  18  -5.274   4.100 -18.909
  132   2HD   ARG  18          2HD       ARG  18  -3.741   4.031 -18.063
  133    HE   ARG  18           HE       ARG  18  -3.795   2.352 -20.461
  134   1HH1  ARG  18          2HH2      ARG  18  -3.196   5.627 -19.250
  135   2HH1  ARG  18          1HH2      ARG  18  -2.188   6.071 -20.586
  136   1HH2  ARG  18          1HH       ARG  18  -1.771   4.473 -22.323
  137    H    ALA  19           H        ALA  19  -1.447   1.272 -16.287
  138    HA   ALA  19           HA       ALA  19  -0.312  -0.324 -18.432
  139   1HB   ALA  19          1HB       ALA  19   0.964   1.784 -16.645
  140   2HB   ALA  19          2HB       ALA  19   1.615   1.131 -18.166
  141   3HB   ALA  19          3HB       ALA  19   0.145   2.133 -18.186
  142    H    GLN  20           H        GLN  20   0.974  -2.105 -18.125
  143    HA   GLN  20           HA       GLN  20   2.035  -2.540 -15.481
  144   1HB   GLN  20          1HB       GLN  20  -0.286  -3.639 -15.658
  145   2HB   GLN  20          2HB       GLN  20   0.410  -4.722 -16.847
  146   1HG   GLN  20          1HG       GLN  20   1.721  -5.838 -15.283
  147   2HG   GLN  20          2HG       GLN  20   1.938  -4.416 -14.282
  148   1HE2  GLN  20          1HE2      GLN  20   1.450  -6.569 -12.932
  149   2HE2  GLN  20          2HE2      GLN  20  -0.172  -6.675 -12.333
  150    H    ASP  21           H        ASP  21   2.778  -2.023 -18.490
  151    HA   ASP  21           HA       ASP  21   4.813  -4.091 -18.503
  152   1HB   ASP  21          1HB       ASP  21   2.914  -3.324 -20.735
  153   2HB   ASP  21          2HB       ASP  21   4.529  -3.868 -21.145
  154    HD2  ASP  21           HD       ASP  21   1.483  -4.833 -20.303
  155    H    PHE  22           H        PHE  22   3.513  -0.948 -19.730
  156    HA   PHE  22           HA       PHE  22   6.050  -0.098 -20.735
  157   1HB   PHE  22          1HB       PHE  22   3.208   0.724 -20.610
  158   2HB   PHE  22          2HB       PHE  22   4.256   2.095 -20.307
  159    HD1  PHE  22           1HD      PHE  22   6.132   2.534 -22.029
  160    HD2  PHE  22           2HD      PHE  22   2.789   0.036 -22.798
  161    HE1  PHE  22           1HE      PHE  22   6.504   2.795 -24.498
  162    HE2  PHE  22           2HE      PHE  22   3.161   0.296 -25.266
  163    HZ   PHE  22           HZ       PHE  22   5.015   1.673 -26.087
  164    H    VAL  23           H        VAL  23   4.346  -0.011 -17.657
  165    HA   VAL  23           HA       VAL  23   5.527   2.284 -16.581
  166    HB   VAL  23           HB       VAL  23   4.660  -0.218 -15.126
  167   1HG1  VAL  23          1HG1      VAL  23   5.460   1.050 -13.421
  168   2HG1  VAL  23          2HG1      VAL  23   5.311   2.571 -14.334
  169   3HG1  VAL  23          3HG1      VAL  23   3.875   1.847 -13.571
  170   1HG2  VAL  23          1HG2      VAL  23   3.108   1.406 -16.866
  171   2HG2  VAL  23          2HG2      VAL  23   2.554   0.113 -15.775
  172   3HG2  VAL  23          3HG2      VAL  23   2.614   1.797 -15.201
  173    H    GLN  24           H        GLN  24   6.841  -0.796 -17.472
  174    HA   GLN  24           HA       GLN  24   8.914  -0.743 -15.522
  175   1HB   GLN  24          1HB       GLN  24   7.834  -2.633 -17.375
  176   2HB   GLN  24          2HB       GLN  24   9.524  -2.437 -17.796
  177   1HG   GLN  24          1HG       GLN  24   9.768  -2.586 -15.082
  178   2HG   GLN  24          2HG       GLN  24   8.303  -3.527 -15.281
  179   1HE2  GLN  24          1HE2      GLN  24  10.522  -4.709 -14.312
  180   2HE2  GLN  24          2HE2      GLN  24  11.204  -5.825 -15.449
  181    H    TRP  25           H        TRP  25   8.354   1.453 -17.753
  182    HA   TRP  25           HA       TRP  25  11.180   1.649 -18.537
  183   1HB   TRP  25          1HB       TRP  25   9.857   0.969 -20.469
  184   2HB   TRP  25          2HB       TRP  25   8.766   2.320 -20.229
  185    HD1  TRP  25           HD       TRP  25  12.618   1.918 -20.838
  186    HE1  TRP  25           1HE      TRP  25  13.498   3.827 -22.434
  187    HE3  TRP  25           3HE      TRP  25   8.157   4.315 -21.294
  188    HZ2  TRP  25           2HZ      TRP  25  12.257   6.075 -23.680
  189    HZ3  TRP  25           3HZ      TRP  25   8.077   6.359 -22.719
  190    HH2  TRP  25           HH       TRP  25  10.032   7.244 -23.889
  191    H    LEU  26           H        LEU  26   8.003   3.342 -18.053
  192    HA   LEU  26           HA       LEU  26   9.207   5.887 -17.776
  193   1HB   LEU  26          1HB       LEU  26   6.482   4.934 -16.886
  194   2HB   LEU  26          2HB       LEU  26   6.993   6.600 -17.073
  195    HG   LEU  26           HG       LEU  26   5.747   6.200 -18.989
  196   1HD1  LEU  26          1HD1      LEU  26   7.356   6.089 -20.887
  197   2HD1  LEU  26          2HD1      LEU  26   7.816   7.245 -19.615
  198   3HD1  LEU  26          3HD1      LEU  26   8.637   5.670 -19.725
  199   1HD2  LEU  26          1HD2      LEU  26   7.116   3.648 -19.748
  200   2HD2  LEU  26          2HD2      LEU  26   5.855   3.619 -18.492
  201   3HD2  LEU  26          3HD2      LEU  26   5.474   4.224 -20.122
  202    H    MET  27           H        MET  27   8.355   3.219 -15.555
  203    HA   MET  27           HA       MET  27  10.190   4.019 -13.674
  204   1HB   MET  27          1HB       MET  27   8.684   4.867 -11.862
  205   2HB   MET  27          2HB       MET  27   8.623   5.922 -13.260
  206   1HG   MET  27          1HG       MET  27   6.624   3.952 -13.731
  207   2HG   MET  27          2HG       MET  27   6.469   4.365 -12.035
  208   1HE   MET  27          1HE       MET  27   4.399   5.983 -11.747
  209   2HE   MET  27          2HE       MET  27   3.718   6.673 -13.239
  210   3HE   MET  27          3HE       MET  27   4.091   4.934 -13.152
  211    H    ASN  28           H        ASN  28  10.523   1.710 -13.933
  212    HA   ASN  28           HA       ASN  28   8.518  -0.140 -13.516
  213   1HB   ASN  28          1HB       ASN  28  10.418  -1.754 -13.160
  214   2HB   ASN  28          2HB       ASN  28  10.671  -0.737 -14.565
  215   1HD2  ASN  28          1HD2      ASN  28  12.198   0.895 -14.540
  216   2HD2  ASN  28          2HD2      ASN  28  13.460   0.998 -13.359
  217    H    THR  29           H        THR  29   8.477  -1.740 -11.576
  218    HA   THR  29           HA       THR  29   7.864  -1.880  -9.407
  219    HB   THR  29           HB       THR  29  10.000  -1.727  -7.955
  220    HG1  THR  29           1HG      THR  29  10.815   0.026  -9.466
  221   1HG2  THR  29          1HG2      THR  29  10.223  -3.149 -10.661
  222   2HG2  THR  29          2HG2      THR  29  11.254  -3.473  -9.247
  223   3HG2  THR  29          3HG2      THR  29   9.514  -3.843  -9.183
  Start of MODEL    5
    1    H    HIS   1           H        HIS   1 -17.758  -3.727 -24.117
    2    HA   HIS   1           HA       HIS   1 -15.561  -3.176 -23.597
    3   1HB   HIS   1          1HB       HIS   1 -15.515  -0.740 -23.750
    4   2HB   HIS   1          2HB       HIS   1 -16.697  -1.433 -24.844
    5    HD1  HIS   1           1HD      HIS   1 -19.201  -0.894 -24.428
    6    HD2  HIS   1           2HD      HIS   1 -16.602   0.773 -21.589
    7    HE1  HIS   1           1HE      HIS   1 -20.582   0.787 -23.095
    8    H    SER   2           H        SER   2 -13.964  -2.717 -22.050
    9    HA   SER   2           HA       SER   2 -13.075  -2.543 -20.079
   10   1HB   SER   2          1HB       SER   2 -14.830  -0.413 -20.180
   11   2HB   SER   2          2HB       SER   2 -15.345  -1.201 -18.701
   12    HG   SER   2           HG       SER   2 -13.719   0.211 -18.086
   13    H    GLN   3           H        GLN   3 -13.110  -4.780 -19.552
   14    HA   GLN   3           HA       GLN   3 -15.485  -5.846 -18.365
   15   1HB   GLN   3          1HB       GLN   3 -13.100  -6.882 -19.647
   16   2HB   GLN   3          2HB       GLN   3 -13.294  -7.664 -18.091
   17   1HG   GLN   3          1HG       GLN   3 -15.697  -8.176 -18.689
   18   2HG   GLN   3          2HG       GLN   3 -15.427  -7.473 -20.271
   19   1HE2  GLN   3          1HE2      GLN   3 -16.250  -9.851 -20.511
   20   2HE2  GLN   3          2HE2      GLN   3 -15.025 -11.035 -20.824
   21    H    GLY   4           H        GLY   4 -15.281  -7.130 -16.233
   22   1HA   GLY   4          1HA       GLY   4 -14.474  -7.371 -14.099
   23   2HA   GLY   4          2HA       GLY   4 -13.246  -6.158 -14.402
   24    H    THR   5           H        THR   5 -16.100  -6.793 -12.728
   25    HA   THR   5           HA       THR   5 -17.729  -4.663 -12.859
   26    HB   THR   5           HB       THR   5 -18.095  -5.085 -10.405
   27    HG1  THR   5           1HG      THR   5 -15.795  -6.852 -10.814
   28   1HG2  THR   5          1HG2      THR   5 -18.057  -7.148 -12.472
   29   2HG2  THR   5          2HG2      THR   5 -17.600  -7.853 -10.903
   30   3HG2  THR   5          3HG2      THR   5 -19.151  -6.997 -11.076
   31    H    PHE   6           H        PHE   6 -17.958  -2.657 -11.591
   32    HA   PHE   6           HA       PHE   6 -15.320  -1.423 -11.210
   33   1HB   PHE   6          1HB       PHE   6 -16.975   0.673 -11.735
   34   2HB   PHE   6          2HB       PHE   6 -16.225  -0.232 -13.035
   35    HD1  PHE   6           1HD      PHE   6 -19.331   0.638 -11.414
   36    HD2  PHE   6           2HD      PHE   6 -17.544  -1.991 -14.226
   37    HE1  PHE   6           1HE      PHE   6 -21.598   0.081 -12.335
   38    HE2  PHE   6           2HE      PHE   6 -19.811  -2.547 -15.147
   39    HZ   PHE   6           HZ       PHE   6 -21.812  -1.505 -14.190
   40    H    THR   7           H        THR   7 -18.761  -1.616 -10.155
   41    HA   THR   7           HA       THR   7 -18.796   0.238  -8.160
   42    HB   THR   7           HB       THR   7 -20.580  -1.479  -9.099
   43    HG1  THR   7           1HG      THR   7 -21.609  -1.186  -6.877
   44   1HG2  THR   7          1HG2      THR   7 -20.891  -3.476  -7.912
   45   2HG2  THR   7          2HG2      THR   7 -19.112  -3.401  -7.892
   46   3HG2  THR   7          3HG2      THR   7 -20.042  -2.865  -6.472
   47    H    SER   8           H        SER   8 -18.899  -0.292  -5.698
   48    HA   SER   8           HA       SER   8 -17.809  -0.739  -3.877
   49   1HB   SER   8          1HB       SER   8 -18.186  -3.099  -4.346
   50   2HB   SER   8          2HB       SER   8 -16.827  -3.155  -5.452
   51    HG   SER   8           HG       SER   8 -16.713  -3.810  -2.941
   52    H    ASP   9           H        ASP   9 -15.330  -1.316  -3.031
   53    HA   ASP   9           HA       ASP   9 -13.814   0.785  -3.637
   54   1HB   ASP   9          1HB       ASP   9 -12.848  -2.036  -2.974
   55   2HB   ASP   9          2HB       ASP   9 -11.842  -0.606  -2.856
   56    HD2  ASP   9           HD       ASP   9 -13.935  -2.404  -0.659
   57    H    TYR  10           H        TYR  10 -12.981   1.459  -5.620
   58    HA   TYR  10           HA       TYR  10 -11.386  -0.332  -7.171
   59   1HB   TYR  10          1HB       TYR  10 -14.262   0.218  -7.707
   60   2HB   TYR  10          2HB       TYR  10 -13.262   0.700  -9.063
   61    HD1  TYR  10           1HD      TYR  10 -14.467  -2.139  -7.064
   62    HD2  TYR  10           2HD      TYR  10 -12.036  -0.960 -10.382
   63    HE1  TYR  10           1HE      TYR  10 -14.382  -4.550  -7.868
   64    HE2  TYR  10           2HE      TYR  10 -11.959  -3.375 -11.174
   65    HH   TYR  10           HH       TYR  10 -13.253  -5.376 -10.968
   66    H    SER  11           H        SER  11 -10.387   0.809  -9.064
   67    HA   SER  11           HA       SER  11  -9.751   2.619 -10.179
   68   1HB   SER  11          1HB       SER  11 -11.985   3.716  -9.225
   69   2HB   SER  11          2HB       SER  11 -10.879   4.564  -8.162
   70    HG   SER  11           HG       SER  11 -11.355   5.709 -10.189
   71    H    LYS  12           H        LYS  12  -9.687   2.560  -6.594
   72    HA   LYS  12           HA       LYS  12  -7.723   4.213  -5.909
   73   1HB   LYS  12          1HB       LYS  12  -8.766   1.689  -4.915
   74   2HB   LYS  12          2HB       LYS  12  -7.059   1.846  -4.554
   75   1HG   LYS  12          1HG       LYS  12  -8.649   4.328  -4.106
   76   2HG   LYS  12          2HG       LYS  12  -9.088   2.988  -3.066
   77   1HD   LYS  12          1HD       LYS  12  -6.398   2.793  -2.825
   78   2HD   LYS  12          2HD       LYS  12  -6.487   4.495  -3.232
   79   1HE   LYS  12          1HE       LYS  12  -6.794   4.746  -0.965
   80   2HE   LYS  12          2HE       LYS  12  -8.467   4.402  -1.359
   81   1HZ   LYS  12          1HZ       LYS  12  -7.441   2.986   0.454
   82   2HZ   LYS  12          2HZ       LYS  12  -8.180   2.141  -0.726
   83    H    TYR  13           H        TYR  13  -7.213   0.956  -7.413
   84    HA   TYR  13           HA       TYR  13  -4.591   1.944  -8.285
   85   1HB   TYR  13          1HB       TYR  13  -3.802  -0.432  -7.762
   86   2HB   TYR  13          2HB       TYR  13  -4.310   0.431  -6.324
   87    HD1  TYR  13           1HD      TYR  13  -4.859  -2.457  -8.416
   88    HD2  TYR  13           2HD      TYR  13  -6.629  -0.025  -5.374
   89    HE1  TYR  13           1HE      TYR  13  -6.493  -4.324  -7.864
   90    HE2  TYR  13           2HE      TYR  13  -8.257  -1.901  -4.832
   91    HH   TYR  13           HH       TYR  13  -8.699  -4.038  -5.128
   92    H    LEU  14           H        LEU  14  -6.202   2.364 -10.186
   93    HA   LEU  14           HA       LEU  14  -6.565  -0.122 -11.697
   94   1HB   LEU  14          1HB       LEU  14  -8.129   2.321 -11.355
   95   2HB   LEU  14          2HB       LEU  14  -7.898   1.894 -13.039
   96    HG   LEU  14           HG       LEU  14  -8.988  -0.192 -12.786
   97   1HD1  LEU  14          1HD1      LEU  14  -9.869  -0.797 -10.391
   98   2HD1  LEU  14          2HD1      LEU  14  -8.209  -1.215 -10.881
   99   3HD1  LEU  14          3HD1      LEU  14  -8.502   0.211  -9.856
  100   1HD2  LEU  14          1HD2      LEU  14 -10.896   1.090 -11.008
  101   2HD2  LEU  14          2HD2      LEU  14 -10.272   2.217 -12.236
  102   3HD2  LEU  14          3HD2      LEU  14 -11.030   0.687 -12.737
  103    H    ASP  15           H        ASP  15  -4.919  -0.566 -13.057
  104    HA   ASP  15           HA       ASP  15  -2.989   1.277 -13.722
  105   1HB   ASP  15          1HB       ASP  15  -3.214  -1.405 -13.952
  106   2HB   ASP  15          2HB       ASP  15  -3.621  -0.992 -15.606
  107    HD2  ASP  15           HD       ASP  15  -0.988  -1.468 -13.537
  108    H    SER  16           H        SER  16  -2.704   2.622 -15.593
  109    HA   SER  16           HA       SER  16  -5.128   3.168 -17.009
  110   1HB   SER  16          1HB       SER  16  -4.053   5.160 -17.747
  111   2HB   SER  16          2HB       SER  16  -3.481   4.921 -16.108
  112    HG   SER  16           HG       SER  16  -1.829   5.447 -17.832
  113    H    ARG  17           H        ARG  17  -5.542   2.714 -19.193
  114    HA   ARG  17           HA       ARG  17  -4.478   0.579 -20.353
  115   1HB   ARG  17          1HB       ARG  17  -6.252   2.657 -21.112
  116   2HB   ARG  17          2HB       ARG  17  -5.069   2.605 -22.404
  117   1HG   ARG  17          1HG       ARG  17  -5.653   0.442 -23.056
  118   2HG   ARG  17          2HG       ARG  17  -6.134  -0.036 -21.440
  119   1HD   ARG  17          1HD       ARG  17  -8.270   0.965 -21.626
  120   2HD   ARG  17          2HD       ARG  17  -7.754   2.084 -22.872
  121    HE   ARG  17           HE       ARG  17  -7.627  -0.756 -23.650
  122   1HH1  ARG  17          2HH2      ARG  17  -9.586   2.196 -23.628
  123   2HH1  ARG  17          1HH2      ARG  17 -10.608   1.676 -24.926
  124   1HH2  ARG  17          1HH       ARG  17 -10.230  -0.466 -25.931
  125    H    ARG  18           H        ARG  18  -3.511   4.016 -21.083
  126    HA   ARG  18           HA       ARG  18  -1.623   3.574 -22.912
  127   1HB   ARG  18          1HB       ARG  18  -1.740   5.570 -20.616
  128   2HB   ARG  18          2HB       ARG  18  -0.413   5.614 -21.760
  129   1HG   ARG  18          1HG       ARG  18  -2.768   5.392 -23.345
  130   2HG   ARG  18          2HG       ARG  18  -3.159   6.554 -22.093
  131   1HD   ARG  18          1HD       ARG  18  -1.660   8.121 -22.885
  132   2HD   ARG  18          2HD       ARG  18  -0.458   6.917 -23.306
  133    HE   ARG  18           HE       ARG  18  -2.447   6.443 -25.157
  134   1HH1  ARG  18          2HH2      ARG  18  -0.712   9.376 -24.187
  135   2HH1  ARG  18          1HH2      ARG  18  -0.855  10.125 -25.743
  136   1HH2  ARG  18          1HH       ARG  18  -1.991   8.962 -27.505
  137    H    ALA  19           H        ALA  19  -1.067   3.679 -19.311
  138    HA   ALA  19           HA       ALA  19   1.630   2.955 -19.447
  139   1HB   ALA  19          1HB       ALA  19   0.169   3.979 -17.531
  140   2HB   ALA  19          2HB       ALA  19  -0.181   2.281 -17.124
  141   3HB   ALA  19          3HB       ALA  19   1.498   2.873 -17.108
  142    H    GLN  20           H        GLN  20   0.942   0.717 -17.284
  143    HA   GLN  20           HA       GLN  20   0.989  -1.453 -17.230
  144   1HB   GLN  20          1HB       GLN  20  -1.319  -0.838 -18.616
  145   2HB   GLN  20          2HB       GLN  20  -0.549  -1.954 -19.725
  146   1HG   GLN  20          1HG       GLN  20  -0.468  -3.710 -18.081
  147   2HG   GLN  20          2HG       GLN  20  -0.798  -2.603 -16.762
  148   1HE2  GLN  20          1HE2      GLN  20  -2.087  -4.533 -19.299
  149   2HE2  GLN  20          2HE2      GLN  20  -3.775  -4.297 -18.990
  150    H    ASP  21           H        ASP  21   2.832  -2.589 -17.631
  151    HA   ASP  21           HA       ASP  21   4.297  -3.753 -18.783
  152   1HB   ASP  21          1HB       ASP  21   2.377  -3.550 -20.715
  153   2HB   ASP  21          2HB       ASP  21   3.638  -2.599 -21.475
  154    HD2  ASP  21           HD       ASP  21   2.870  -6.049 -20.936
  155    H    PHE  22           H        PHE  22   3.557  -0.510 -20.265
  156    HA   PHE  22           HA       PHE  22   6.271   0.051 -20.854
  157   1HB   PHE  22          1HB       PHE  22   3.718   1.006 -21.496
  158   2HB   PHE  22          2HB       PHE  22   4.281   2.260 -20.409
  159    HD1  PHE  22           1HD      PHE  22   4.680   4.079 -21.807
  160    HD2  PHE  22           2HD      PHE  22   6.244   0.282 -22.877
  161    HE1  PHE  22           1HE      PHE  22   5.959   5.136 -23.690
  162    HE2  PHE  22           2HE      PHE  22   7.523   1.339 -24.760
  163    HZ   PHE  22           HZ       PHE  22   7.365   3.754 -25.144
  164    H    VAL  23           H        VAL  23   4.321   0.207 -17.966
  165    HA   VAL  23           HA       VAL  23   5.490   2.395 -16.699
  166    HB   VAL  23           HB       VAL  23   4.412  -0.161 -15.493
  167   1HG1  VAL  23          1HG1      VAL  23   5.589   1.154 -13.841
  168   2HG1  VAL  23          2HG1      VAL  23   4.746   2.635 -14.358
  169   3HG1  VAL  23          3HG1      VAL  23   3.838   1.322 -13.570
  170   1HG2  VAL  23          1HG2      VAL  23   2.668   2.220 -15.636
  171   2HG2  VAL  23          2HG2      VAL  23   3.043   1.469 -17.206
  172   3HG2  VAL  23          3HG2      VAL  23   2.296   0.501 -15.912
  173    H    GLN  24           H        GLN  24   6.765  -0.724 -17.579
  174    HA   GLN  24           HA       GLN  24   8.728  -0.737 -15.514
  175   1HB   GLN  24          1HB       GLN  24   7.825  -2.528 -17.670
  176   2HB   GLN  24          2HB       GLN  24   9.569  -2.520 -17.509
  177   1HG   GLN  24          1HG       GLN  24   9.452  -3.147 -15.169
  178   2HG   GLN  24          2HG       GLN  24   7.728  -2.840 -15.101
  179   1HE2  GLN  24          1HE2      GLN  24  10.225  -4.861 -16.564
  180   2HE2  GLN  24          2HE2      GLN  24   9.259  -6.274 -16.825
  181    H    TRP  25           H        TRP  25   8.381   1.500 -17.713
  182    HA   TRP  25           HA       TRP  25  11.246   1.602 -18.342
  183   1HB   TRP  25          1HB       TRP  25  10.134   0.920 -20.367
  184   2HB   TRP  25          2HB       TRP  25   8.952   2.204 -20.213
  185    HD1  TRP  25           HD       TRP  25  12.851   2.014 -20.566
  186    HE1  TRP  25           1HE      TRP  25  13.730   3.975 -22.097
  187    HE3  TRP  25           3HE      TRP  25   8.309   4.180 -21.300
  188    HZ2  TRP  25           2HZ      TRP  25  12.455   6.162 -23.414
  189    HZ3  TRP  25           3HZ      TRP  25   8.214   6.225 -22.721
  190    HH2  TRP  25           HH       TRP  25  10.191   7.217 -23.762
  191    H    LEU  26           H        LEU  26   8.071   3.338 -18.071
  192    HA   LEU  26           HA       LEU  26   9.316   5.872 -17.755
  193   1HB   LEU  26          1HB       LEU  26   6.506   4.868 -17.308
  194   2HB   LEU  26          2HB       LEU  26   6.980   6.538 -17.069
  195    HG   LEU  26           HG       LEU  26   6.158   6.663 -19.191
  196   1HD1  LEU  26          1HD1      LEU  26   8.487   7.426 -19.253
  197   2HD1  LEU  26          2HD1      LEU  26   9.009   5.797 -19.747
  198   3HD1  LEU  26          3HD1      LEU  26   7.969   6.762 -20.821
  199   1HD2  LEU  26          1HD2      LEU  26   7.185   3.858 -19.697
  200   2HD2  LEU  26          2HD2      LEU  26   5.498   4.364 -19.438
  201   3HD2  LEU  26          3HD2      LEU  26   6.365   4.874 -20.907
  202    H    MET  27           H        MET  27   8.449   3.180 -15.638
  203    HA   MET  27           HA       MET  27  10.016   4.120 -13.587
  204   1HB   MET  27          1HB       MET  27   8.274   4.773 -11.910
  205   2HB   MET  27          2HB       MET  27   8.233   5.847 -13.294
  206   1HG   MET  27          1HG       MET  27   6.466   3.930 -14.146
  207   2HG   MET  27          2HG       MET  27   6.225   3.804 -12.415
  208   1HE   MET  27          1HE       MET  27   3.405   6.121 -14.169
  209   2HE   MET  27          2HE       MET  27   4.534   5.287 -15.263
  210   3HE   MET  27          3HE       MET  27   3.866   4.431 -13.852
  211    H    ASN  28           H        ASN  28  10.594   1.856 -13.865
  212    HA   ASN  28           HA       ASN  28   8.721  -0.174 -13.596
  213   1HB   ASN  28          1HB       ASN  28  10.943  -0.565 -14.595
  214   2HB   ASN  28          2HB       ASN  28  11.742  -0.116 -13.101
  215   1HD2  ASN  28          1HD2      ASN  28  12.482  -2.418 -14.044
  216   2HD2  ASN  28          2HD2      ASN  28  11.806  -3.771 -13.201
  217    H    THR  29           H        THR  29  11.291   1.058 -11.310
  218    HA   THR  29           HA       THR  29  11.555   0.637  -9.100
  219    HB   THR  29           HB       THR  29   8.755   1.604  -8.646
  220    HG1  THR  29           1HG      THR  29  10.838   2.977 -10.196
  221   1HG2  THR  29          1HG2      THR  29  10.114   3.545  -7.647
  222   2HG2  THR  29          2HG2      THR  29  10.377   1.969  -6.863
  223   3HG2  THR  29          3HG2      THR  29  11.578   2.602  -8.015
  Start of MODEL    6
    1    H    HIS   1           H        HIS   1 -14.479  -0.887 -17.656
    2    HA   HIS   1           HA       HIS   1 -15.217  -1.114 -15.566
    3   1HB   HIS   1          1HB       HIS   1 -12.500  -0.034 -14.906
    4   2HB   HIS   1          2HB       HIS   1 -13.741  -0.001 -13.669
    5    HD1  HIS   1           1HD      HIS   1 -14.682  -2.342 -12.837
    6    HD2  HIS   1           2HD      HIS   1 -11.423  -2.556 -15.469
    7    HE1  HIS   1           1HE      HIS   1 -13.787  -4.726 -12.674
    8    H    SER   2           H        SER   2 -13.473   2.073 -15.826
    9    HA   SER   2           HA       SER   2 -15.603   3.439 -14.626
   10   1HB   SER   2          1HB       SER   2 -13.035   4.054 -14.960
   11   2HB   SER   2          2HB       SER   2 -13.607   4.806 -16.436
   12    HG   SER   2           HG       SER   2 -15.120   5.404 -14.126
   13    H    GLN   3           H        GLN   3 -14.341   3.418 -18.046
   14    HA   GLN   3           HA       GLN   3 -17.010   3.439 -19.021
   15   1HB   GLN   3          1HB       GLN   3 -15.819   5.958 -18.543
   16   2HB   GLN   3          2HB       GLN   3 -15.653   5.713 -20.271
   17   1HG   GLN   3          1HG       GLN   3 -18.078   5.252 -20.476
   18   2HG   GLN   3          2HG       GLN   3 -18.275   5.375 -18.739
   19   1HE2  GLN   3          1HE2      GLN   3 -19.128   6.920 -21.281
   20   2HE2  GLN   3          2HE2      GLN   3 -18.899   8.586 -20.867
   21    H    GLY   4           H        GLY   4 -16.847   1.900 -20.591
   22   1HA   GLY   4          1HA       GLY   4 -15.833   1.892 -22.958
   23   2HA   GLY   4          2HA       GLY   4 -14.320   1.714 -22.091
   24    H    THR   5           H        THR   5 -17.676   0.301 -21.972
   25    HA   THR   5           HA       THR   5 -17.194  -2.043 -20.752
   26    HB   THR   5           HB       THR   5 -19.099  -2.898 -22.157
   27    HG1  THR   5           1HG      THR   5 -18.680  -0.332 -23.505
   28   1HG2  THR   5          1HG2      THR   5 -19.102  -0.406 -20.670
   29   2HG2  THR   5          2HG2      THR   5 -20.148  -0.220 -22.098
   30   3HG2  THR   5          3HG2      THR   5 -20.457  -1.530 -20.933
   31    H    PHE   6           H        PHE   6 -16.866  -4.280 -21.511
   32    HA   PHE   6           HA       PHE   6 -14.583  -4.302 -23.283
   33   1HB   PHE   6          1HB       PHE   6 -14.334  -5.630 -21.299
   34   2HB   PHE   6          2HB       PHE   6 -16.013  -6.132 -21.317
   35    HD1  PHE   6           1HD      PHE   6 -16.265  -8.392 -21.623
   36    HD2  PHE   6           2HD      PHE   6 -13.145  -6.409 -23.706
   37    HE1  PHE   6           1HE      PHE   6 -15.605 -10.561 -22.699
   38    HE2  PHE   6           2HE      PHE   6 -12.485  -8.578 -24.783
   39    HZ   PHE   6           HZ       PHE   6 -13.723 -10.628 -24.266
   40    H    THR   7           H        THR   7 -17.831  -5.904 -23.009
   41    HA   THR   7           HA       THR   7 -17.751  -7.491 -25.219
   42    HB   THR   7           HB       THR   7 -19.584  -7.021 -23.371
   43    HG1  THR   7           1HG      THR   7 -20.327  -7.356 -26.186
   44   1HG2  THR   7          1HG2      THR   7 -21.517  -5.750 -24.302
   45   2HG2  THR   7          2HG2      THR   7 -20.116  -4.675 -24.083
   46   3HG2  THR   7          3HG2      THR   7 -20.530  -5.276 -25.706
   47    H    SER   8           H        SER   8 -18.732  -7.257 -27.391
   48    HA   SER   8           HA       SER   8 -18.860  -6.315 -29.342
   49   1HB   SER   8          1HB       SER   8 -20.254  -4.545 -29.217
   50   2HB   SER   8          2HB       SER   8 -19.761  -4.231 -27.565
   51    HG   SER   8           HG       SER   8 -19.378  -2.528 -29.359
   52    H    ASP   9           H        ASP   9 -17.645  -4.648 -30.887
   53    HA   ASP   9           HA       ASP   9 -15.072  -5.213 -30.974
   54   1HB   ASP   9          1HB       ASP   9 -16.549  -2.678 -31.754
   55   2HB   ASP   9          2HB       ASP   9 -14.828  -2.811 -32.055
   56    HD2  ASP   9           HD       ASP   9 -14.591  -4.423 -34.430
   57    H    TYR  10           H        TYR  10 -13.473  -4.980 -29.402
   58    HA   TYR  10           HA       TYR  10 -12.903  -2.398 -28.335
   59   1HB   TYR  10          1HB       TYR  10 -14.449  -4.537 -26.872
   60   2HB   TYR  10          2HB       TYR  10 -13.124  -3.848 -25.956
   61    HD1  TYR  10           1HD      TYR  10 -16.432  -3.229 -27.401
   62    HD2  TYR  10           2HD      TYR  10 -13.152  -1.473 -25.290
   63    HE1  TYR  10           1HE      TYR  10 -17.896  -1.253 -26.756
   64    HE2  TYR  10           2HE      TYR  10 -14.626   0.497 -24.652
   65    HH   TYR  10           HH       TYR  10 -16.567   1.419 -24.821
   66    H    SER  11           H        SER  11 -10.744  -2.477 -28.789
   67    HA   SER  11           HA       SER  11  -8.931  -3.617 -27.310
   68   1HB   SER  11          1HB       SER  11 -10.089  -5.722 -29.084
   69   2HB   SER  11          2HB       SER  11  -8.339  -5.685 -29.010
   70    HG   SER  11           HG       SER  11  -9.533  -5.438 -26.493
   71    H    LYS  12           H        LYS  12  -9.728  -3.793 -30.858
   72    HA   LYS  12           HA       LYS  12  -7.360  -3.402 -32.000
   73   1HB   LYS  12          1HB       LYS  12 -10.096  -2.913 -32.685
   74   2HB   LYS  12          2HB       LYS  12  -9.141  -1.567 -33.274
   75   1HG   LYS  12          1HG       LYS  12  -7.805  -2.936 -34.658
   76   2HG   LYS  12          2HG       LYS  12  -8.108  -4.377 -33.708
   77   1HD   LYS  12          1HD       LYS  12 -10.579  -4.183 -34.471
   78   2HD   LYS  12          2HD       LYS  12 -10.025  -2.985 -35.624
   79   1HE   LYS  12          1HE       LYS  12  -8.540  -5.607 -35.522
   80   2HE   LYS  12          2HE       LYS  12 -10.138  -5.610 -36.239
   81   1HZ   LYS  12          1HZ       LYS  12  -8.633  -5.103 -37.980
   82   2HZ   LYS  12          2HZ       LYS  12  -9.310  -3.665 -37.626
   83    H    TYR  13           H        TYR  13  -9.406  -0.679 -30.728
   84    HA   TYR  13           HA       TYR  13  -6.905   0.854 -30.483
   85   1HB   TYR  13          1HB       TYR  13  -8.424   2.821 -30.929
   86   2HB   TYR  13          2HB       TYR  13  -8.513   1.669 -32.246
   87    HD1  TYR  13           1HD      TYR  13 -10.492   0.103 -32.394
   88    HD2  TYR  13           2HD      TYR  13 -10.350   3.362 -29.625
   89    HE1  TYR  13           1HE      TYR  13 -13.015  -0.020 -32.107
   90    HE2  TYR  13           2HE      TYR  13 -12.873   3.227 -29.348
   91    HH   TYR  13           HH       TYR  13 -14.823   2.281 -31.060
   92    H    LEU  14           H        LEU  14  -7.352  -0.730 -28.361
   93    HA   LEU  14           HA       LEU  14  -9.188   0.342 -26.495
   94   1HB   LEU  14          1HB       LEU  14  -7.874  -1.986 -26.739
   95   2HB   LEU  14          2HB       LEU  14  -6.819  -1.196 -25.584
   96    HG   LEU  14           HG       LEU  14  -8.584  -0.968 -23.982
   97   1HD1  LEU  14          1HD1      LEU  14 -10.325  -1.415 -26.321
   98   2HD1  LEU  14          2HD1      LEU  14 -10.847  -2.221 -24.822
   99   3HD1  LEU  14          3HD1      LEU  14 -10.595  -0.459 -24.845
  100   1HD2  LEU  14          1HD2      LEU  14  -7.429  -3.207 -24.293
  101   2HD2  LEU  14          2HD2      LEU  14  -8.976  -3.225 -23.414
  102   3HD2  LEU  14          3HD2      LEU  14  -8.912  -3.750 -25.113
  103    H    ASP  15           H        ASP  15  -8.966   1.936 -24.966
  104    HA   ASP  15           HA       ASP  15  -7.164   3.917 -25.368
  105   1HB   ASP  15          1HB       ASP  15  -9.041   3.104 -23.221
  106   2HB   ASP  15          2HB       ASP  15  -7.713   4.083 -22.632
  107    HD2  ASP  15           HD       ASP  15  -8.902   6.980 -24.152
  108    H    SER  16           H        SER  16  -5.374   4.676 -23.795
  109    HA   SER  16           HA       SER  16  -3.491   4.383 -22.759
  110   1HB   SER  16          1HB       SER  16  -4.767   1.844 -21.646
  111   2HB   SER  16          2HB       SER  16  -3.280   2.552 -21.046
  112    HG   SER  16           HG       SER  16  -4.575   4.556 -20.646
  113    H    ARG  17           H        ARG  17  -1.622   3.894 -23.848
  114    HA   ARG  17           HA       ARG  17  -1.300   1.174 -24.746
  115   1HB   ARG  17          1HB       ARG  17  -2.246   2.775 -26.621
  116   2HB   ARG  17          2HB       ARG  17  -0.629   3.450 -26.651
  117   1HG   ARG  17          1HG       ARG  17   0.296   1.569 -27.616
  118   2HG   ARG  17          2HG       ARG  17  -0.733   0.469 -26.719
  119   1HD   ARG  17          1HD       ARG  17  -2.494   0.618 -28.273
  120   2HD   ARG  17          2HD       ARG  17  -2.022   2.214 -28.822
  121    HE   ARG  17           HE       ARG  17  -0.668   1.205 -30.429
  122   1HH1  ARG  17          2HH2      ARG  17  -1.203  -1.125 -27.814
  123   2HH1  ARG  17          1HH2      ARG  17  -0.371  -2.411 -28.623
  124   1HH2  ARG  17          1HH       ARG  17   0.580  -2.017 -30.787
  125    H    ARG  18           H        ARG  18   0.165   4.511 -24.821
  126    HA   ARG  18           HA       ARG  18   2.739   3.892 -25.024
  127   1HB   ARG  18          1HB       ARG  18   1.223   6.139 -24.173
  128   2HB   ARG  18          2HB       ARG  18   2.396   5.890 -22.895
  129   1HG   ARG  18          1HG       ARG  18   4.185   5.727 -24.762
  130   2HG   ARG  18          2HG       ARG  18   2.955   6.322 -25.860
  131   1HD   ARG  18          1HD       ARG  18   3.015   7.980 -23.456
  132   2HD   ARG  18          2HD       ARG  18   4.626   7.864 -24.136
  133    HE   ARG  18           HE       ARG  18   2.264   9.097 -25.410
  134   1HH1  ARG  18          2HH2      ARG  18   5.586   7.942 -25.842
  135   2HH1  ARG  18          1HH2      ARG  18   5.855   8.875 -27.276
  136   1HH2  ARG  18          1HH       ARG  18   4.097  10.270 -28.117
  137    H    ALA  19           H        ALA  19   0.953   4.208 -21.860
  138    HA   ALA  19           HA       ALA  19   3.084   3.313 -20.284
  139   1HB   ALA  19          1HB       ALA  19   0.836   4.557 -19.721
  140   2HB   ALA  19          2HB       ALA  19   0.187   2.909 -19.541
  141   3HB   ALA  19          3HB       ALA  19   1.550   3.444 -18.528
  142    H    GLN  20           H        GLN  20   1.068   1.286 -18.926
  143    HA   GLN  20           HA       GLN  20   0.692  -0.858 -18.914
  144   1HB   GLN  20          1HB       GLN  20  -0.084  -0.394 -21.355
  145   2HB   GLN  20          2HB       GLN  20   1.440  -1.105 -21.849
  146   1HG   GLN  20          1HG       GLN  20   0.645  -3.028 -20.104
  147   2HG   GLN  20          2HG       GLN  20  -0.934  -2.409 -20.545
  148   1HE2  GLN  20          1HE2      GLN  20  -1.634  -4.093 -21.726
  149   2HE2  GLN  20          2HE2      GLN  20  -0.950  -4.614 -23.230
  150    H    ASP  21           H        ASP  21   2.381  -2.562 -21.100
  151    HA   ASP  21           HA       ASP  21   4.234  -3.501 -19.377
  152   1HB   ASP  21          1HB       ASP  21   3.520  -3.910 -22.068
  153   2HB   ASP  21          2HB       ASP  21   5.213  -3.465 -22.163
  154    HD2  ASP  21           HD       ASP  21   4.620  -6.402 -22.660
  155    H    PHE  22           H        PHE  22   4.181  -0.493 -21.161
  156    HA   PHE  22           HA       PHE  22   7.013  -0.117 -21.241
  157   1HB   PHE  22          1HB       PHE  22   4.701   0.932 -22.446
  158   2HB   PHE  22          2HB       PHE  22   5.123   2.211 -21.325
  159    HD1  PHE  22           1HD      PHE  22   7.447  -0.012 -23.186
  160    HD2  PHE  22           2HD      PHE  22   5.870   3.904 -22.754
  161    HE1  PHE  22           1HE      PHE  22   9.150   0.854 -24.815
  162    HE2  PHE  22           2HE      PHE  22   7.573   4.770 -24.383
  163    HZ   PHE  22           HZ       PHE  22   9.192   3.234 -25.393
  164    H    VAL  23           H        VAL  23   4.420   0.398 -18.919
  165    HA   VAL  23           HA       VAL  23   5.432   2.537 -17.490
  166    HB   VAL  23           HB       VAL  23   3.881   0.103 -16.587
  167   1HG1  VAL  23          1HG1      VAL  23   4.908   1.188 -14.660
  168   2HG1  VAL  23          2HG1      VAL  23   4.292   2.771 -15.193
  169   3HG1  VAL  23          3HG1      VAL  23   3.155   1.500 -14.679
  170   1HG2  VAL  23          1HG2      VAL  23   3.050   1.842 -18.429
  171   2HG2  VAL  23          2HG2      VAL  23   1.950   1.170 -17.202
  172   3HG2  VAL  23          3HG2      VAL  23   2.641   2.795 -16.982
  173    H    GLN  24           H        GLN  24   6.704  -0.663 -17.950
  174    HA   GLN  24           HA       GLN  24   8.121  -0.702 -15.482
  175   1HB   GLN  24          1HB       GLN  24   7.751  -2.489 -17.822
  176   2HB   GLN  24          2HB       GLN  24   9.346  -2.587 -17.103
  177   1HG   GLN  24          1HG       GLN  24   8.394  -3.076 -14.896
  178   2HG   GLN  24          2HG       GLN  24   6.769  -2.775 -15.478
  179   1HE2  GLN  24          1HE2      GLN  24   5.654  -4.537 -15.751
  180   2HE2  GLN  24          2HE2      GLN  24   6.218  -6.066 -16.338
  181    H    TRP  25           H        TRP  25   8.410   1.460 -17.795
  182    HA   TRP  25           HA       TRP  25  11.347   1.425 -17.718
  183   1HB   TRP  25          1HB       TRP  25  10.611   0.771 -19.946
  184   2HB   TRP  25          2HB       TRP  25   9.593   2.193 -20.058
  185    HD1  TRP  25           HD       TRP  25  13.417   1.534 -19.500
  186    HE1  TRP  25           1HE      TRP  25  14.855   3.332 -20.790
  187    HE3  TRP  25           3HE      TRP  25   9.461   4.188 -21.278
  188    HZ2  TRP  25           2HZ      TRP  25  14.191   5.611 -22.374
  189    HZ3  TRP  25           3HZ      TRP  25   9.944   6.186 -22.689
  190    HH2  TRP  25           HH       TRP  25  12.212   6.910 -23.243
  191    H    LEU  26           H        LEU  26   8.303   3.344 -18.197
  192    HA   LEU  26           HA       LEU  26   9.566   5.811 -17.623
  193   1HB   LEU  26          1HB       LEU  26   6.636   5.080 -17.547
  194   2HB   LEU  26          2HB       LEU  26   7.305   6.699 -17.606
  195    HG   LEU  26           HG       LEU  26   6.633   6.309 -19.793
  196   1HD1  LEU  26          1HD1      LEU  26   9.566   5.566 -19.652
  197   2HD1  LEU  26          2HD1      LEU  26   8.707   6.023 -21.143
  198   3HD1  LEU  26          3HD1      LEU  26   8.864   7.195 -19.812
  199   1HD2  LEU  26          1HD2      LEU  26   6.407   3.746 -19.242
  200   2HD2  LEU  26          2HD2      LEU  26   6.552   4.314 -20.923
  201   3HD2  LEU  26          3HD2      LEU  26   7.973   3.648 -20.083
  202    H    MET  27           H        MET  27   8.529   3.128 -15.695
  203    HA   MET  27           HA       MET  27   9.405   4.429 -13.367
  204   1HB   MET  27          1HB       MET  27   6.440   4.192 -13.934
  205   2HB   MET  27          2HB       MET  27   6.964   3.882 -12.291
  206   1HG   MET  27          1HG       MET  27   8.348   6.177 -12.714
  207   2HG   MET  27          2HG       MET  27   7.053   6.449 -13.862
  208   1HE   MET  27          1HE       MET  27   4.234   5.853 -12.813
  209   2HE   MET  27          2HE       MET  27   4.113   7.398 -11.937
  210   3HE   MET  27          3HE       MET  27   5.040   7.304 -13.454
  211    H    ASN  28           H        ASN  28  10.532   2.254 -14.277
  212    HA   ASN  28           HA       ASN  28   9.525  -0.173 -14.132
  213   1HB   ASN  28          1HB       ASN  28  12.075   0.854 -14.163
  214   2HB   ASN  28          2HB       ASN  28  12.066   0.149 -12.559
  215   1HD2  ASN  28          1HD2      ASN  28  13.745  -0.772 -14.498
  216   2HD2  ASN  28          2HD2      ASN  28  13.303  -2.370 -14.999
  217    H    THR  29           H        THR  29   9.521  -1.885 -12.353
  218    HA   THR  29           HA       THR  29   8.467  -2.476 -10.438
  219    HB   THR  29           HB       THR  29  10.533  -0.947  -8.899
  220    HG1  THR  29           1HG      THR  29  12.204  -2.100 -10.080
  221   1HG2  THR  29          1HG2      THR  29   9.173  -3.394  -8.616
  222   2HG2  THR  29          2HG2      THR  29  10.787  -3.876  -9.193
  223   3HG2  THR  29          3HG2      THR  29  10.624  -2.906  -7.709
  Start of MODEL    7
    1    H    HIS   1           H        HIS   1  -0.563 -14.419   8.096
    2    HA   HIS   1           HA       HIS   1  -0.407 -12.755  10.464
    3   1HB   HIS   1          1HB       HIS   1  -0.214 -15.430  10.157
    4   2HB   HIS   1          2HB       HIS   1   1.482 -15.011  10.025
    5    HD1  HIS   1           1HD      HIS   1   1.163 -16.587  12.395
    6    HD2  HIS   1           2HD      HIS   1   0.142 -12.519  12.472
    7    HE1  HIS   1           1HE      HIS   1   1.179 -15.892  14.850
    8    H    SER   2           H        SER   2   0.931 -11.027  10.564
    9    HA   SER   2           HA       SER   2   2.708  -9.787  10.297
   10   1HB   SER   2          1HB       SER   2   3.882 -12.195  10.095
   11   2HB   SER   2          2HB       SER   2   4.127 -11.684   8.437
   12    HG   SER   2           HG       SER   2   5.025 -10.347  10.840
   13    H    GLN   3           H        GLN   3   2.176 -11.682   7.230
   14    HA   GLN   3           HA       GLN   3   2.270  -9.158   5.805
   15   1HB   GLN   3          1HB       GLN   3   3.191 -11.821   5.239
   16   2HB   GLN   3          2HB       GLN   3   1.971 -11.426   4.044
   17   1HG   GLN   3          1HG       GLN   3   3.173  -9.548   3.236
   18   2HG   GLN   3          2HG       GLN   3   4.108  -9.384   4.708
   19   1HE2  GLN   3          1HE2      GLN   3   4.999  -9.553   1.958
   20   2HE2  GLN   3          2HE2      GLN   3   6.073 -10.906   1.830
   21    H    GLY   4           H        GLY   4   0.580  -8.601   4.242
   22   1HA   GLY   4          1HA       GLY   4  -2.041  -9.291   5.204
   23   2HA   GLY   4          2HA       GLY   4  -1.627  -8.181   3.913
   24    H    THR   5           H        THR   5  -1.776 -11.709   4.717
   25    HA   THR   5           HA       THR   5  -1.394 -12.842   2.297
   26    HB   THR   5           HB       THR   5  -3.248 -14.489   3.206
   27    HG1  THR   5           1HG      THR   5  -3.523 -13.830   5.581
   28   1HG2  THR   5          1HG2      THR   5  -1.733 -15.427   4.761
   29   2HG2  THR   5          2HG2      THR   5  -0.635 -14.467   3.741
   30   3HG2  THR   5          3HG2      THR   5  -1.169 -13.833   5.316
   31    H    PHE   6           H        PHE   6  -2.889 -13.709   0.641
   32    HA   PHE   6           HA       PHE   6  -4.129 -11.751  -0.740
   33   1HB   PHE   6          1HB       PHE   6  -5.532 -13.874  -1.585
   34   2HB   PHE   6          2HB       PHE   6  -3.799 -13.836  -1.845
   35    HD1  PHE   6           1HD      PHE   6  -6.478 -15.260   0.240
   36    HD2  PHE   6           2HD      PHE   6  -2.346 -15.367  -0.720
   37    HE1  PHE   6           1HE      PHE   6  -6.241 -17.419   1.498
   38    HE2  PHE   6           2HE      PHE   6  -2.109 -17.525   0.539
   39    HZ   PHE   6           HZ       PHE   6  -4.060 -18.526   1.633
   40    H    THR   7           H        THR   7  -5.614 -13.944   1.722
   41    HA   THR   7           HA       THR   7  -8.247 -13.345   1.417
   42    HB   THR   7           HB       THR   7  -6.945 -14.900   3.088
   43    HG1  THR   7           1HG      THR   7  -9.207 -14.878   3.208
   44   1HG2  THR   7          1HG2      THR   7  -6.214 -12.427   4.222
   45   2HG2  THR   7          2HG2      THR   7  -7.581 -12.965   5.226
   46   3HG2  THR   7          3HG2      THR   7  -6.148 -14.005   5.044
   47    H    SER   8           H        SER   8  -9.739 -11.870   2.449
   48    HA   SER   8           HA       SER   8 -10.409  -9.785   2.586
   49   1HB   SER   8          1HB       SER   8  -9.787  -8.693   4.647
   50   2HB   SER   8          2HB       SER   8  -9.744 -10.420   4.941
   51    HG   SER   8           HG       SER   8  -7.859  -9.109   5.739
   52    H    ASP   9           H        ASP   9  -9.185  -9.606   0.322
   53    HA   ASP   9           HA       ASP   9  -8.176  -7.070   0.170
   54   1HB   ASP   9          1HB       ASP   9  -6.191  -8.704   1.176
   55   2HB   ASP   9          2HB       ASP   9  -5.884  -8.848  -0.544
   56    HD2  ASP   9           HD       ASP   9  -3.852  -6.146  -0.067
   57    H    TYR  10           H        TYR  10  -7.582 -10.421  -1.137
   58    HA   TYR  10           HA       TYR  10  -7.321  -9.774  -3.801
   59   1HB   TYR  10          1HB       TYR  10  -7.656 -12.156  -4.040
   60   2HB   TYR  10          2HB       TYR  10  -7.107 -12.002  -2.383
   61    HD1  TYR  10           1HD      TYR  10  -9.589 -13.379  -4.477
   62    HD2  TYR  10           2HD      TYR  10  -9.036 -11.701  -0.581
   63    HE1  TYR  10           1HE      TYR  10 -11.691 -14.556  -3.664
   64    HE2  TYR  10           2HE      TYR  10 -11.140 -12.883   0.219
   65    HH   TYR  10           HH       TYR  10 -12.877 -14.049  -0.360
   66    H    SER  11           H        SER  11  -9.139 -10.982  -5.395
   67    HA   SER  11           HA       SER  11 -11.178 -10.963  -6.211
   68   1HB   SER  11          1HB       SER  11 -12.261  -9.305  -3.912
   69   2HB   SER  11          2HB       SER  11 -13.130 -10.416  -4.952
   70    HG   SER  11           HG       SER  11 -12.525 -11.154  -2.687
   71    H    LYS  12           H        LYS  12 -10.323  -9.610  -7.896
   72    HA   LYS  12           HA       LYS  12 -10.458  -7.837  -9.225
   73   1HB   LYS  12          1HB       LYS  12 -12.589  -7.351  -7.404
   74   2HB   LYS  12          2HB       LYS  12 -11.743  -5.831  -7.616
   75   1HG   LYS  12          1HG       LYS  12 -12.240  -7.443 -10.102
   76   2HG   LYS  12          2HG       LYS  12 -13.647  -6.721  -9.346
   77   1HD   LYS  12          1HD       LYS  12 -13.029  -4.590  -9.926
   78   2HD   LYS  12          2HD       LYS  12 -11.344  -4.863  -9.532
   79   1HE   LYS  12          1HE       LYS  12 -10.817  -5.654 -11.671
   80   2HE   LYS  12          2HE       LYS  12 -12.432  -6.269 -11.964
   81   1HZ   LYS  12          1HZ       LYS  12 -11.778  -3.373 -11.858
   82   2HZ   LYS  12          2HZ       LYS  12 -11.920  -4.221 -13.240
   83    H    TYR  13           H        TYR  13  -8.543  -8.376  -6.806
   84    HA   TYR  13           HA       TYR  13  -6.968  -6.003  -7.297
   85   1HB   TYR  13          1HB       TYR  13  -8.700  -6.179  -5.075
   86   2HB   TYR  13          2HB       TYR  13  -7.205  -6.812  -4.416
   87    HD1  TYR  13           1HD      TYR  13  -5.275  -5.377  -4.064
   88    HD2  TYR  13           2HD      TYR  13  -8.846  -3.834  -5.844
   89    HE1  TYR  13           1HE      TYR  13  -4.438  -3.004  -3.704
   90    HE2  TYR  13           2HE      TYR  13  -7.997  -1.466  -5.479
   91    HH   TYR  13           HH       TYR  13  -4.822  -0.779  -4.778
   92    H    LEU  14           H        LEU  14  -6.634  -8.705  -8.146
   93    HA   LEU  14           HA       LEU  14  -4.533  -9.654  -6.336
   94   1HB   LEU  14          1HB       LEU  14  -6.350 -11.013  -8.296
   95   2HB   LEU  14          2HB       LEU  14  -4.814 -11.742  -7.870
   96    HG   LEU  14           HG       LEU  14  -6.876 -10.944  -5.804
   97   1HD1  LEU  14          1HD1      LEU  14  -7.039 -13.071  -7.717
   98   2HD1  LEU  14          2HD1      LEU  14  -6.807 -13.762  -6.093
   99   3HD1  LEU  14          3HD1      LEU  14  -8.161 -12.648  -6.401
  100   1HD2  LEU  14          1HD2      LEU  14  -4.438 -11.276  -5.156
  101   2HD2  LEU  14          2HD2      LEU  14  -5.644 -12.242  -4.272
  102   3HD2  LEU  14          3HD2      LEU  14  -4.672 -12.994  -5.559
  103    H    ASP  15           H        ASP  15  -3.041  -7.984  -7.073
  104    HA   ASP  15           HA       ASP  15  -2.443  -7.536  -9.700
  105   1HB   ASP  15          1HB       ASP  15  -1.490  -6.703  -7.208
  106   2HB   ASP  15          2HB       ASP  15  -0.097  -7.522  -7.886
  107    HD2  ASP  15           HD       ASP  15   0.197  -5.001  -7.473
  108    H    SER  16           H        SER  16  -1.119  -8.630 -11.221
  109    HA   SER  16           HA       SER  16   0.531 -10.781 -10.218
  110   1HB   SER  16          1HB       SER  16  -1.601 -11.871 -10.797
  111   2HB   SER  16          2HB       SER  16  -1.591 -11.123 -12.382
  112    HG   SER  16           HG       SER  16  -0.804 -13.395 -12.286
  113    H    ARG  17           H        ARG  17   2.051  -8.905 -10.798
  114    HA   ARG  17           HA       ARG  17   3.325  -7.775 -12.165
  115   1HB   ARG  17          1HB       ARG  17   4.168 -10.244 -12.198
  116   2HB   ARG  17          2HB       ARG  17   3.491 -10.338 -13.812
  117   1HG   ARG  17          1HG       ARG  17   4.941  -7.958 -13.920
  118   2HG   ARG  17          2HG       ARG  17   5.936  -8.948 -12.872
  119   1HD   ARG  17          1HD       ARG  17   5.017 -10.579 -15.094
  120   2HD   ARG  17          2HD       ARG  17   5.702  -9.096 -15.730
  121    HE   ARG  17           HE       ARG  17   7.826  -9.704 -14.876
  122   1HH1  ARG  17          2HH2      ARG  17   5.348 -11.956 -13.717
  123   2HH1  ARG  17          1HH2      ARG  17   6.497 -13.106 -13.118
  124   1HH2  ARG  17          1HH       ARG  17   8.839 -12.652 -13.346
  125    H    ARG  18           H        ARG  18   0.539  -7.460 -12.863
  126    HA   ARG  18           HA       ARG  18  -0.184  -7.951 -15.389
  127   1HB   ARG  18          1HB       ARG  18  -1.099  -6.324 -13.299
  128   2HB   ARG  18          2HB       ARG  18  -0.814  -5.166 -14.583
  129   1HG   ARG  18          1HG       ARG  18  -2.117  -7.506 -15.706
  130   2HG   ARG  18          2HG       ARG  18  -3.022  -6.976 -14.302
  131   1HD   ARG  18          1HD       ARG  18  -3.540  -4.888 -15.240
  132   2HD   ARG  18          2HD       ARG  18  -2.107  -4.861 -16.249
  133    HE   ARG  18           HE       ARG  18  -3.725  -7.039 -17.118
  134   1HH1  ARG  18          2HH2      ARG  18  -3.838  -3.498 -17.050
  135   2HH1  ARG  18          1HH2      ARG  18  -4.848  -3.379 -18.452
  136   1HH2  ARG  18          1HH       ARG  18  -5.554  -5.382 -19.563
  137    H    ALA  19           H        ALA  19   1.586  -4.983 -14.231
  138    HA   ALA  19           HA       ALA  19   1.944  -3.889 -16.781
  139   1HB   ALA  19          1HB       ALA  19   3.617  -3.546 -14.259
  140   2HB   ALA  19          2HB       ALA  19   3.555  -2.432 -15.646
  141   3HB   ALA  19          3HB       ALA  19   2.116  -2.661 -14.623
  142    H    GLN  20           H        GLN  20   5.038  -3.653 -15.918
  143    HA   GLN  20           HA       GLN  20   6.921  -4.689 -16.344
  144   1HB   GLN  20          1HB       GLN  20   5.719  -6.818 -15.528
  145   2HB   GLN  20          2HB       GLN  20   5.427  -7.194 -17.214
  146   1HG   GLN  20          1HG       GLN  20   8.239  -6.444 -16.704
  147   2HG   GLN  20          2HG       GLN  20   7.738  -7.832 -15.758
  148   1HE2  GLN  20          1HE2      GLN  20   9.645  -8.104 -17.655
  149   2HE2  GLN  20          2HE2      GLN  20   9.074  -9.027 -19.005
  150    H    ASP  21           H        ASP  21   4.725  -3.552 -18.354
  151    HA   ASP  21           HA       ASP  21   6.364  -4.150 -20.679
  152   1HB   ASP  21          1HB       ASP  21   3.496  -4.669 -20.286
  153   2HB   ASP  21          2HB       ASP  21   3.762  -3.604 -21.652
  154    HD2  ASP  21           HD       ASP  21   4.545  -6.064 -23.724
  155    H    PHE  22           H        PHE  22   3.851  -2.088 -19.076
  156    HA   PHE  22           HA       PHE  22   4.750   0.175 -20.699
  157   1HB   PHE  22          1HB       PHE  22   2.249  -0.738 -19.273
  158   2HB   PHE  22          2HB       PHE  22   2.540   0.989 -19.232
  159    HD1  PHE  22           1HD      PHE  22   2.850   2.201 -21.458
  160    HD2  PHE  22           2HD      PHE  22   1.323  -1.749 -21.177
  161    HE1  PHE  22           1HE      PHE  22   1.855   2.422 -23.752
  162    HE2  PHE  22           2HE      PHE  22   0.328  -1.527 -23.471
  163    HZ   PHE  22           HZ       PHE  22   0.607   0.555 -24.731
  164    H    VAL  23           H        VAL  23   5.100  -1.288 -17.611
  165    HA   VAL  23           HA       VAL  23   5.566   1.279 -16.302
  166    HB   VAL  23           HB       VAL  23   5.318  -1.563 -15.316
  167   1HG1  VAL  23          1HG1      VAL  23   5.363  -0.265 -13.014
  168   2HG1  VAL  23          2HG1      VAL  23   6.870  -0.806 -13.792
  169   3HG1  VAL  23          3HG1      VAL  23   6.353   0.891 -13.938
  170   1HG2  VAL  23          1HG2      VAL  23   3.637   0.880 -14.676
  171   2HG2  VAL  23          2HG2      VAL  23   3.236  -0.303 -15.945
  172   3HG2  VAL  23          3HG2      VAL  23   3.306  -0.814 -14.241
  173    H    GLN  24           H        GLN  24   7.178  -1.291 -17.980
  174    HA   GLN  24           HA       GLN  24   9.621  -1.074 -16.573
  175   1HB   GLN  24          1HB       GLN  24   8.493  -2.724 -18.648
  176   2HB   GLN  24          2HB       GLN  24  10.019  -2.095 -19.237
  177   1HG   GLN  24          1HG       GLN  24  11.180  -2.907 -17.205
  178   2HG   GLN  24          2HG       GLN  24   9.660  -3.451 -16.523
  179   1HE2  GLN  24          1HE2      GLN  24  12.102  -4.916 -17.194
  180   2HE2  GLN  24          2HE2      GLN  24  11.654  -6.194 -18.275
  181    H    TRP  25           H        TRP  25   8.055   1.235 -18.247
  182    HA   TRP  25           HA       TRP  25  10.483   2.210 -19.588
  183   1HB   TRP  25          1HB       TRP  25   8.613   1.861 -21.099
  184   2HB   TRP  25          2HB       TRP  25   7.573   2.853 -20.097
  185    HD1  TRP  25           HD       TRP  25  10.978   3.419 -21.960
  186    HE1  TRP  25           1HE      TRP  25  11.031   5.817 -23.062
  187    HE3  TRP  25           3HE      TRP  25   6.408   4.873 -20.268
  188    HZ2  TRP  25           2HZ      TRP  25   9.197   8.003 -23.101
  189    HZ3  TRP  25           3HZ      TRP  25   5.614   7.154 -20.884
  190    HH2  TRP  25           HH       TRP  25   6.927   8.698 -22.249
  191    H    LEU  26           H        LEU  26   7.563   3.199 -17.656
  192    HA   LEU  26           HA       LEU  26   8.621   5.723 -16.994
  193   1HB   LEU  26          1HB       LEU  26   6.448   4.066 -15.705
  194   2HB   LEU  26          2HB       LEU  26   6.789   5.743 -15.324
  195    HG   LEU  26           HG       LEU  26   5.044   5.990 -16.780
  196   1HD1  LEU  26          1HD1      LEU  26   7.453   5.931 -18.616
  197   2HD1  LEU  26          2HD1      LEU  26   5.885   6.678 -19.003
  198   3HD1  LEU  26          3HD1      LEU  26   6.864   7.312 -17.659
  199   1HD2  LEU  26          1HD2      LEU  26   4.975   3.489 -17.234
  200   2HD2  LEU  26          2HD2      LEU  26   4.406   4.558 -18.539
  201   3HD2  LEU  26          3HD2      LEU  26   6.022   3.817 -18.636
  202    H    MET  27           H        MET  27   9.522   2.569 -16.063
  203    HA   MET  27           HA       MET  27  10.863   1.777 -14.548
  204   1HB   MET  27          1HB       MET  27  11.568   4.739 -14.425
  205   2HB   MET  27          2HB       MET  27  12.345   3.628 -13.315
  206   1HG   MET  27          1HG       MET  27  12.331   3.266 -16.351
  207   2HG   MET  27          2HG       MET  27  13.641   4.020 -15.464
  208   1HE   MET  27          1HE       MET  27  13.236   0.994 -17.288
  209   2HE   MET  27          2HE       MET  27  12.935  -0.340 -16.149
  210   3HE   MET  27          3HE       MET  27  11.709   0.929 -16.377
  211    H    ASN  28           H        ASN  28   8.807   1.197 -13.379
  212    HA   ASN  28           HA       ASN  28   8.652   2.699 -10.883
  213   1HB   ASN  28          1HB       ASN  28   6.598   2.429 -12.654
  214   2HB   ASN  28          2HB       ASN  28   6.371   0.932 -11.771
  215   1HD2  ASN  28          1HD2      ASN  28   5.620   0.934  -9.722
  216   2HD2  ASN  28          2HD2      ASN  28   5.085   2.339  -8.862
  217    H    THR  29           H        THR  29   8.439  -0.493 -12.571
  218    HA   THR  29           HA       THR  29   8.398  -2.599 -11.738
  219    HB   THR  29           HB       THR  29  10.805  -1.924 -10.086
  220    HG1  THR  29           1HG      THR  29  10.792  -0.245 -11.735
  221   1HG2  THR  29          1HG2      THR  29  10.217  -4.239 -11.082
  222   2HG2  THR  29          2HG2      THR  29  10.554  -3.524 -12.677
  223   3HG2  THR  29          3HG2      THR  29  11.846  -3.628 -11.457
  Start of MODEL    8
    1    H    HIS   1           H        HIS   1  -7.981  12.608 -25.839
    2    HA   HIS   1           HA       HIS   1  -8.541  13.936 -23.474
    3   1HB   HIS   1          1HB       HIS   1  -7.849  15.749 -25.504
    4   2HB   HIS   1          2HB       HIS   1  -9.600  15.801 -25.436
    5    HD1  HIS   1           1HD      HIS   1  -7.142  15.420 -22.517
    6    HD2  HIS   1           2HD      HIS   1 -10.074  18.054 -23.953
    7    HE1  HIS   1           1HE      HIS   1  -7.419  17.223 -20.733
    8    H    SER   2           H        SER   2  -9.556  11.687 -23.858
    9    HA   SER   2           HA       SER   2 -11.981  11.967 -25.433
   10   1HB   SER   2          1HB       SER   2 -10.101   9.844 -25.095
   11   2HB   SER   2          2HB       SER   2 -11.586   9.304 -24.338
   12    HG   SER   2           HG       SER   2 -11.071   9.196 -26.900
   13    H    GLN   3           H        GLN   3 -10.812  10.573 -22.276
   14    HA   GLN   3           HA       GLN   3 -12.657  11.901 -20.747
   15   1HB   GLN   3          1HB       GLN   3 -14.026  10.009 -22.202
   16   2HB   GLN   3          2HB       GLN   3 -13.639   9.088 -20.762
   17   1HG   GLN   3          1HG       GLN   3 -14.485  11.669 -19.858
   18   2HG   GLN   3          2HG       GLN   3 -15.623  11.188 -21.101
   19   1HE2  GLN   3          1HE2      GLN   3 -15.241  11.223 -17.943
   20   2HE2  GLN   3          2HE2      GLN   3 -16.048   9.775 -17.439
   21    H    GLY   4           H        GLY   4 -10.410  11.942 -19.820
   22   1HA   GLY   4          1HA       GLY   4 -10.196  10.165 -17.627
   23   2HA   GLY   4          2HA       GLY   4  -9.065   9.698 -18.882
   24    H    THR   5           H        THR   5 -10.277  12.816 -17.436
   25    HA   THR   5           HA       THR   5  -8.198  14.437 -17.951
   26    HB   THR   5           HB       THR   5  -8.874  15.593 -15.821
   27    HG1  THR   5           1HG      THR   5 -10.512  13.181 -15.546
   28   1HG2  THR   5          1HG2      THR   5 -10.723  14.708 -17.903
   29   2HG2  THR   5          2HG2      THR   5 -11.561  14.780 -16.334
   30   3HG2  THR   5          3HG2      THR   5 -10.743  16.226 -16.973
   31    H    PHE   6           H        PHE   6  -6.338  15.216 -16.679
   32    HA   PHE   6           HA       PHE   6  -4.935  12.896 -15.588
   33   1HB   PHE   6          1HB       PHE   6  -2.956  14.548 -15.987
   34   2HB   PHE   6          2HB       PHE   6  -3.779  13.987 -17.429
   35    HD1  PHE   6           1HD      PHE   6  -5.067  15.495 -18.789
   36    HD2  PHE   6           2HD      PHE   6  -3.309  16.846 -15.171
   37    HE1  PHE   6           1HE      PHE   6  -5.502  17.872 -19.466
   38    HE2  PHE   6           2HE      PHE   6  -3.744  19.224 -15.848
   39    HZ   PHE   6           HZ       PHE   6  -4.835  19.708 -17.987
   40    H    THR   7           H        THR   7  -5.810  16.332 -14.933
   41    HA   THR   7           HA       THR   7  -4.393  16.803 -12.656
   42    HB   THR   7           HB       THR   7  -6.134  18.223 -14.053
   43    HG1  THR   7           1HG      THR   7  -5.095  19.246 -12.328
   44   1HG2  THR   7          1HG2      THR   7  -8.029  16.561 -13.095
   45   2HG2  THR   7          2HG2      THR   7  -7.910  17.634 -11.680
   46   3HG2  THR   7          3HG2      THR   7  -8.345  18.304 -13.270
   47    H    SER   8           H        SER   8  -4.903  16.716 -10.364
   48    HA   SER   8           HA       SER   8  -5.430  15.655  -8.547
   49   1HB   SER   8          1HB       SER   8  -7.771  16.161  -9.143
   50   2HB   SER   8          2HB       SER   8  -7.866  14.712 -10.123
   51    HG   SER   8           HG       SER   8  -7.338  13.508  -8.072
   52    H    ASP   9           H        ASP   9  -5.045  13.606  -7.499
   53    HA   ASP   9           HA       ASP   9  -3.422  11.892  -8.674
   54   1HB   ASP   9          1HB       ASP   9  -5.570  10.834  -6.804
   55   2HB   ASP   9          2HB       ASP   9  -3.891  10.342  -6.901
   56    HD2  ASP   9           HD       ASP   9  -3.033  12.489  -4.384
   57    H    TYR  10           H        TYR  10  -3.680  10.719 -10.583
   58    HA   TYR  10           HA       TYR  10  -6.127   9.155 -10.878
   59   1HB   TYR  10          1HB       TYR  10  -6.540  10.132 -13.043
   60   2HB   TYR  10          2HB       TYR  10  -6.063  11.521 -12.088
   61    HD1  TYR  10           1HD      TYR  10  -3.410  11.973 -12.080
   62    HD2  TYR  10           2HD      TYR  10  -5.541   9.846 -15.119
   63    HE1  TYR  10           1HE      TYR  10  -1.550  12.468 -13.740
   64    HE2  TYR  10           2HE      TYR  10  -3.674  10.348 -16.769
   65    HH   TYR  10           HH       TYR  10  -1.935  11.994 -17.071
   66    H    SER  11           H        SER  11  -5.800   7.805 -13.110
   67    HA   SER  11           HA       SER  11  -4.638   6.349 -14.244
   68   1HB   SER  11          1HB       SER  11  -2.623   8.304 -13.635
   69   2HB   SER  11          2HB       SER  11  -1.898   6.725 -13.403
   70    HG   SER  11           HG       SER  11  -3.421   7.382 -15.769
   71    H    LYS  12           H        LYS  12  -5.750   4.907 -12.635
   72    HA   LYS  12           HA       LYS  12  -4.274   2.873 -11.742
   73   1HB   LYS  12          1HB       LYS  12  -4.133   3.360  -9.214
   74   2HB   LYS  12          2HB       LYS  12  -2.899   4.024 -10.266
   75   1HG   LYS  12          1HG       LYS  12  -4.915   5.989 -10.292
   76   2HG   LYS  12          2HG       LYS  12  -4.912   5.426  -8.632
   77   1HD   LYS  12          1HD       LYS  12  -2.211   5.628  -9.063
   78   2HD   LYS  12          2HD       LYS  12  -2.781   6.878 -10.150
   79   1HE   LYS  12          1HE       LYS  12  -2.616   8.124  -8.192
   80   2HE   LYS  12          2HE       LYS  12  -4.279   7.590  -8.050
   81   1HZ   LYS  12          1HZ       LYS  12  -3.680   5.969  -6.484
   82   2HZ   LYS  12          2HZ       LYS  12  -2.106   5.953  -6.901
   83    H    TYR  13           H        TYR  13  -6.876   5.168 -10.804
   84    HA   TYR  13           HA       TYR  13  -8.487   3.027  -9.739
   85   1HB   TYR  13          1HB       TYR  13  -8.731   5.186  -8.692
   86   2HB   TYR  13          2HB       TYR  13  -8.585   6.037 -10.217
   87    HD1  TYR  13           1HD      TYR  13 -10.902   3.588  -8.557
   88    HD2  TYR  13           2HD      TYR  13 -10.500   7.011 -11.091
   89    HE1  TYR  13           1HE      TYR  13 -13.433   3.796  -8.690
   90    HE2  TYR  13           2HE      TYR  13 -13.031   7.208 -11.215
   91    HH   TYR  13           HH       TYR  13 -15.013   6.191  -9.280
   92    H    LEU  14           H        LEU  14  -8.287   5.047 -12.708
   93    HA   LEU  14           HA       LEU  14 -10.650   3.709 -13.753
   94   1HB   LEU  14          1HB       LEU  14 -10.298   5.317 -15.655
   95   2HB   LEU  14          2HB       LEU  14 -10.732   6.007 -14.103
   96    HG   LEU  14           HG       LEU  14  -8.918   7.162 -15.529
   97   1HD1  LEU  14          1HD1      LEU  14  -7.688   6.897 -12.900
   98   2HD1  LEU  14          2HD1      LEU  14  -8.461   8.302 -13.672
   99   3HD1  LEU  14          3HD1      LEU  14  -9.453   7.104 -12.808
  100   1HD2  LEU  14          1HD2      LEU  14  -6.609   6.365 -15.084
  101   2HD2  LEU  14          2HD2      LEU  14  -7.291   4.886 -14.366
  102   3HD2  LEU  14          3HD2      LEU  14  -7.565   5.248 -16.087
  103    H    ASP  15           H        ASP  15 -10.195   3.436 -16.409
  104    HA   ASP  15           HA       ASP  15  -9.073   1.084 -16.719
  105   1HB   ASP  15          1HB       ASP  15 -10.038   2.991 -18.426
  106   2HB   ASP  15          2HB       ASP  15  -8.344   3.041 -18.873
  107    HD2  ASP  15           HD       ASP  15 -11.178   1.327 -19.071
  108    H    SER  16           H        SER  16  -6.916   0.356 -17.679
  109    HA   SER  16           HA       SER  16  -4.759   2.211 -17.465
  110   1HB   SER  16          1HB       SER  16  -3.473   0.869 -15.818
  111   2HB   SER  16          2HB       SER  16  -4.940   1.522 -15.118
  112    HG   SER  16           HG       SER  16  -4.541  -1.182 -16.076
  113    H    ARG  17           H        ARG  17  -5.248   1.371 -19.819
  114    HA   ARG  17           HA       ARG  17  -4.128  -1.259 -20.212
  115   1HB   ARG  17          1HB       ARG  17  -5.920   0.569 -21.738
  116   2HB   ARG  17          2HB       ARG  17  -4.764  -0.285 -22.741
  117   1HG   ARG  17          1HG       ARG  17  -5.508  -2.458 -21.807
  118   2HG   ARG  17          2HG       ARG  17  -6.604  -1.638 -20.711
  119   1HD   ARG  17          1HD       ARG  17  -7.761  -0.631 -22.765
  120   2HD   ARG  17          2HD       ARG  17  -6.764  -1.672 -23.761
  121    HE   ARG  17           HE       ARG  17  -9.022  -2.499 -22.075
  122   1HH1  ARG  17          2HH2      ARG  17  -6.111  -3.591 -23.775
  123   2HH1  ARG  17          1HH2      ARG  17  -6.635  -5.239 -23.872
  124   1HH2  ARG  17          1HH       ARG  17  -8.757  -5.852 -22.941
  125    H    ARG  18           H        ARG  18  -3.623   2.214 -21.043
  126    HA   ARG  18           HA       ARG  18  -1.642   2.009 -22.844
  127   1HB   ARG  18          1HB       ARG  18  -2.469   4.003 -20.797
  128   2HB   ARG  18          2HB       ARG  18  -0.792   4.158 -21.279
  129   1HG   ARG  18          1HG       ARG  18  -2.939   3.849 -23.399
  130   2HG   ARG  18          2HG       ARG  18  -2.677   5.413 -22.652
  131   1HD   ARG  18          1HD       ARG  18  -0.077   4.427 -23.301
  132   2HD   ARG  18          2HD       ARG  18  -1.080   4.069 -24.693
  133    HE   ARG  18           HE       ARG  18  -1.403   6.388 -25.065
  134   1HH1  ARG  18          2HH2      ARG  18   0.304   5.854 -22.006
  135   2HH1  ARG  18          1HH2      ARG  18   0.752   7.517 -21.823
  136   1HH2  ARG  18          1HH       ARG  18   0.085   9.103 -23.491
  137    H    ALA  19           H        ALA  19  -1.193   2.340 -19.238
  138    HA   ALA  19           HA       ALA  19   1.570   1.912 -19.300
  139   1HB   ALA  19          1HB       ALA  19   1.407   1.952 -16.961
  140   2HB   ALA  19          2HB       ALA  19  -0.023   2.884 -17.467
  141   3HB   ALA  19          3HB       ALA  19  -0.200   1.186 -16.961
  142    H    GLN  20           H        GLN  20   1.096  -0.254 -17.011
  143    HA   GLN  20           HA       GLN  20   1.401  -2.396 -16.827
  144   1HB   GLN  20          1HB       GLN  20  -0.959  -2.116 -18.267
  145   2HB   GLN  20          2HB       GLN  20  -0.066  -3.259 -19.252
  146   1HG   GLN  20          1HG       GLN  20  -0.713  -4.881 -17.803
  147   2HG   GLN  20          2HG       GLN  20   0.374  -4.171 -16.626
  148   1HE2  GLN  20          1HE2      GLN  20  -0.390  -3.091 -14.907
  149   2HE2  GLN  20          2HE2      GLN  20  -2.065  -2.866 -14.528
  150    H    ASP  21           H        ASP  21   3.381  -3.297 -17.171
  151    HA   ASP  21           HA       ASP  21   4.972  -4.354 -18.254
  152   1HB   ASP  21          1HB       ASP  21   3.013  -4.549 -20.158
  153   2HB   ASP  21          2HB       ASP  21   4.155  -3.538 -21.021
  154    HD2  ASP  21           HD       ASP  21   6.120  -4.626 -21.705
  155    H    PHE  22           H        PHE  22   3.803  -1.380 -20.001
  156    HA   PHE  22           HA       PHE  22   6.398  -0.526 -20.716
  157   1HB   PHE  22          1HB       PHE  22   3.732   0.058 -21.322
  158   2HB   PHE  22          2HB       PHE  22   4.156   1.443 -20.337
  159    HD1  PHE  22           1HD      PHE  22   5.958  -0.511 -22.971
  160    HD2  PHE  22           2HD      PHE  22   4.611   3.284 -21.632
  161    HE1  PHE  22           1HE      PHE  22   7.036   0.574 -24.961
  162    HE2  PHE  22           2HE      PHE  22   5.689   4.369 -23.623
  163    HZ   PHE  22           HZ       PHE  22   6.889   3.001 -25.263
  164    H    VAL  23           H        VAL  23   4.461  -0.298 -17.795
  165    HA   VAL  23           HA       VAL  23   5.444   2.071 -16.737
  166    HB   VAL  23           HB       VAL  23   4.788  -0.406 -15.150
  167   1HG1  VAL  23          1HG1      VAL  23   5.232   2.379 -14.536
  168   2HG1  VAL  23          2HG1      VAL  23   3.568   1.918 -14.101
  169   3HG1  VAL  23          3HG1      VAL  23   4.947   1.010 -13.434
  170   1HG2  VAL  23          1HG2      VAL  23   2.429   1.098 -15.469
  171   2HG2  VAL  23          2HG2      VAL  23   3.117   0.927 -17.102
  172   3HG2  VAL  23          3HG2      VAL  23   2.782  -0.520 -16.121
  173    H    GLN  24           H        GLN  24   7.010  -0.977 -17.381
  174    HA   GLN  24           HA       GLN  24   9.005  -0.620 -15.383
  175   1HB   GLN  24          1HB       GLN  24   8.990  -2.486 -17.796
  176   2HB   GLN  24          2HB       GLN  24  10.049  -2.609 -16.405
  177   1HG   GLN  24          1HG       GLN  24   7.960  -2.838 -14.944
  178   2HG   GLN  24          2HG       GLN  24   7.012  -2.925 -16.415
  179   1HE2  GLN  24          1HE2      GLN  24  10.146  -4.254 -15.352
  180   2HE2  GLN  24          2HE2      GLN  24   9.818  -5.914 -15.725
  181    H    TRP  25           H        TRP  25   8.366   1.329 -17.829
  182    HA   TRP  25           HA       TRP  25  11.189   1.615 -18.607
  183   1HB   TRP  25          1HB       TRP  25   9.917   0.871 -20.510
  184   2HB   TRP  25          2HB       TRP  25   8.699   2.104 -20.246
  185    HD1  TRP  25           HD       TRP  25  12.553   2.095 -20.963
  186    HE1  TRP  25           1HE      TRP  25  13.187   4.073 -22.590
  187    HE3  TRP  25           3HE      TRP  25   7.859   4.020 -21.299
  188    HZ2  TRP  25           2HZ      TRP  25  11.688   6.174 -23.809
  189    HZ3  TRP  25           3HZ      TRP  25   7.530   6.036 -22.729
  190    HH2  TRP  25           HH       TRP  25   9.351   7.108 -23.958
  191    H    LEU  26           H        LEU  26   7.993   3.216 -17.998
  192    HA   LEU  26           HA       LEU  26   9.091   5.816 -17.893
  193   1HB   LEU  26          1HB       LEU  26   6.504   4.773 -16.732
  194   2HB   LEU  26          2HB       LEU  26   6.914   6.451 -17.025
  195    HG   LEU  26           HG       LEU  26   5.531   5.924 -18.808
  196   1HD1  LEU  26          1HD1      LEU  26   6.990   5.758 -20.839
  197   2HD1  LEU  26          2HD1      LEU  26   7.461   7.025 -19.681
  198   3HD1  LEU  26          3HD1      LEU  26   8.375   5.500 -19.752
  199   1HD2  LEU  26          1HD2      LEU  26   5.867   3.351 -18.212
  200   2HD2  LEU  26          2HD2      LEU  26   5.190   3.891 -19.768
  201   3HD2  LEU  26          3HD2      LEU  26   6.903   3.420 -19.658
  202    H    MET  27           H        MET  27   8.248   3.333 -15.406
  203    HA   MET  27           HA       MET  27  10.319   3.929 -13.764
  204   1HB   MET  27          1HB       MET  27   9.011   5.201 -11.910
  205   2HB   MET  27          2HB       MET  27   9.476   6.146 -13.311
  206   1HG   MET  27          1HG       MET  27   7.114   5.461 -14.270
  207   2HG   MET  27          2HG       MET  27   6.731   5.047 -12.612
  208   1HE   MET  27          1HE       MET  27   5.047   8.402 -13.588
  209   2HE   MET  27          2HE       MET  27   6.213   8.234 -14.922
  210   3HE   MET  27          3HE       MET  27   5.308   6.813 -14.348
  211    H    ASN  28           H        ASN  28  10.187   1.634 -13.586
  212    HA   ASN  28           HA       ASN  28   8.773   0.724 -11.405
  213   1HB   ASN  28          1HB       ASN  28   6.937   0.937 -13.341
  214   2HB   ASN  28          2HB       ASN  28   7.654  -0.553 -13.923
  215   1HD2  ASN  28          1HD2      ASN  28   6.553  -2.246 -13.333
  216   2HD2  ASN  28          2HD2      ASN  28   5.784  -2.528 -11.807
  217    H    THR  29           H        THR  29   9.234  -1.663 -11.072
  218    HA   THR  29           HA       THR  29  10.781  -3.284 -11.043
  219    HB   THR  29           HB       THR  29  10.844  -4.535 -13.241
  220    HG1  THR  29           1HG      THR  29  10.886  -2.374 -14.413
  221   1HG2  THR  29          1HG2      THR  29   8.800  -4.985 -12.055
  222   2HG2  THR  29          2HG2      THR  29   8.197  -3.330 -12.316
  223   3HG2  THR  29          3HG2      THR  29   8.271  -4.475 -13.677
  Start of MODEL    9
    1    H    HIS   1           H        HIS   1 -14.707  27.275 -17.550
    2    HA   HIS   1           HA       HIS   1 -15.853  24.973 -18.915
    3   1HB   HIS   1          1HB       HIS   1 -13.963  23.772 -17.677
    4   2HB   HIS   1          2HB       HIS   1 -13.532  24.843 -18.995
    5    HD1  HIS   1           1HD      HIS   1 -11.819  26.612 -18.490
    6    HD2  HIS   1           2HD      HIS   1 -13.589  25.062 -15.017
    7    HE1  HIS   1           1HE      HIS   1 -10.556  27.639 -16.525
    8    H    SER   2           H        SER   2 -16.909  23.283 -17.790
    9    HA   SER   2           HA       SER   2 -18.538  24.015 -15.765
   10   1HB   SER   2          1HB       SER   2 -17.615  21.428 -16.927
   11   2HB   SER   2          2HB       SER   2 -18.325  21.309 -15.329
   12    HG   SER   2           HG       SER   2 -19.969  21.100 -16.925
   13    H    GLN   3           H        GLN   3 -18.560  23.701 -13.453
   14    HA   GLN   3           HA       GLN   3 -15.897  23.695 -12.357
   15   1HB   GLN   3          1HB       GLN   3 -16.943  24.549 -10.322
   16   2HB   GLN   3          2HB       GLN   3 -17.542  25.454 -11.698
   17   1HG   GLN   3          1HG       GLN   3 -19.528  23.786 -11.741
   18   2HG   GLN   3          2HG       GLN   3 -18.973  23.239 -10.172
   19   1HE2  GLN   3          1HE2      GLN   3 -20.254  24.022  -8.685
   20   2HE2  GLN   3          2HE2      GLN   3 -20.801  25.657  -8.526
   21    H    GLY   4           H        GLY   4 -14.980  21.830 -11.630
   22   1HA   GLY   4          1HA       GLY   4 -15.547  20.137  -9.783
   23   2HA   GLY   4          2HA       GLY   4 -16.772  19.604 -10.916
   24    H    THR   5           H        THR   5 -13.218  20.334 -10.748
   25    HA   THR   5           HA       THR   5 -12.340  19.171 -13.021
   26    HB   THR   5           HB       THR   5 -10.284  18.597 -11.540
   27    HG1  THR   5           1HG      THR   5 -10.902  18.503  -9.418
   28   1HG2  THR   5          1HG2      THR   5  -9.831  20.773 -12.119
   29   2HG2  THR   5          2HG2      THR   5 -11.545  21.235 -11.999
   30   3HG2  THR   5          3HG2      THR   5 -10.526  21.208 -10.540
   31    H    PHE   6           H        PHE   6 -11.298  17.058 -13.472
   32    HA   PHE   6           HA       PHE   6 -13.180  15.004 -12.948
   33   1HB   PHE   6          1HB       PHE   6 -11.988  15.083 -15.075
   34   2HB   PHE   6          2HB       PHE   6 -10.441  15.301 -14.281
   35    HD1  PHE   6           1HD      PHE   6 -13.133  12.829 -14.890
   36    HD2  PHE   6           2HD      PHE   6  -9.101  13.447 -13.719
   37    HE1  PHE   6           1HE      PHE   6 -12.714  10.358 -15.027
   38    HE2  PHE   6           2HE      PHE   6  -8.682  10.976 -13.857
   39    HZ   PHE   6           HZ       PHE   6 -10.494   9.461 -14.509
   40    H    THR   7           H        THR   7  -9.597  15.147 -12.314
   41    HA   THR   7           HA       THR   7  -9.398  12.946 -10.726
   42    HB   THR   7           HB       THR   7  -7.645  14.701 -11.643
   43    HG1  THR   7           1HG      THR   7  -7.460  12.674 -10.195
   44   1HG2  THR   7          1HG2      THR   7  -6.998  16.442 -10.231
   45   2HG2  THR   7          2HG2      THR   7  -8.734  16.423  -9.840
   46   3HG2  THR   7          3HG2      THR   7  -7.572  15.601  -8.771
   47    H    SER   8           H        SER   8 -10.003  12.279  -8.748
   48    HA   SER   8           HA       SER   8 -10.315  13.948  -6.593
   49   1HB   SER   8          1HB       SER   8 -12.444  14.368  -8.299
   50   2HB   SER   8          2HB       SER   8 -13.091  13.112  -7.262
   51    HG   SER   8           HG       SER   8 -12.828  15.749  -6.721
   52    H    ASP   9           H        ASP   9  -9.259  12.205  -5.548
   53    HA   ASP   9           HA       ASP   9  -9.014  10.292  -4.557
   54   1HB   ASP   9          1HB       ASP   9 -11.378  11.166  -3.684
   55   2HB   ASP   9          2HB       ASP   9 -12.001   9.793  -4.578
   56    HD2  ASP   9           HD       ASP   9 -10.004  10.660  -1.906
   57    H    TYR  10           H        TYR  10  -9.523  10.447  -7.612
   58    HA   TYR  10           HA       TYR  10 -10.834   8.004  -8.297
   59   1HB   TYR  10          1HB       TYR  10 -10.078  10.425  -9.488
   60   2HB   TYR  10          2HB       TYR  10  -8.841   9.352 -10.113
   61    HD1  TYR  10           1HD      TYR  10  -9.388   7.584 -11.699
   62    HD2  TYR  10           2HD      TYR  10 -12.443  10.118 -10.104
   63    HE1  TYR  10           1HE      TYR  10 -11.001   6.781 -13.493
   64    HE2  TYR  10           2HE      TYR  10 -14.046   9.307 -11.903
   65    HH   TYR  10           HH       TYR  10 -12.934   7.324 -14.545
   66    H    SER  11           H        SER  11  -9.489   6.549  -9.992
   67    HA   SER  11           HA       SER  11  -7.674   5.358 -10.455
   68   1HB   SER  11          1HB       SER  11  -6.364   7.337  -9.198
   69   2HB   SER  11          2HB       SER  11  -6.178   6.119  -7.953
   70    HG   SER  11           HG       SER  11  -5.594   5.371 -10.647
   71    H    LYS  12           H        LYS  12  -8.829   5.697  -7.077
   72    HA   LYS  12           HA       LYS  12  -8.071   3.460  -5.859
   73   1HB   LYS  12          1HB       LYS  12 -10.641   4.985  -5.880
   74   2HB   LYS  12          2HB       LYS  12 -10.613   3.447  -5.042
   75   1HG   LYS  12          1HG       LYS  12  -8.269   4.516  -4.113
   76   2HG   LYS  12          2HG       LYS  12  -9.172   5.991  -4.395
   77   1HD   LYS  12          1HD       LYS  12 -11.120   4.818  -3.098
   78   2HD   LYS  12          2HD       LYS  12  -9.905   3.670  -2.572
   79   1HE   LYS  12          1HE       LYS  12  -8.733   6.232  -2.171
   80   2HE   LYS  12          2HE       LYS  12 -10.391   6.395  -1.629
   81   1HZ   LYS  12          1HZ       LYS  12 -10.094   4.593  -0.112
   82   2HZ   LYS  12          2HZ       LYS  12  -8.670   4.141  -0.760
   83    H    TYR  13           H        TYR  13 -10.852   3.613  -8.190
   84    HA   TYR  13           HA       TYR  13 -11.261   0.821  -8.148
   85   1HB   TYR  13          1HB       TYR  13 -11.841   2.900 -10.343
   86   2HB   TYR  13          2HB       TYR  13 -12.748   1.427 -10.057
   87    HD1  TYR  13           1HD      TYR  13 -14.305   1.258  -8.142
   88    HD2  TYR  13           2HD      TYR  13 -12.212   4.889  -9.001
   89    HE1  TYR  13           1HE      TYR  13 -15.905   2.543  -6.641
   90    HE2  TYR  13           2HE      TYR  13 -13.819   6.162  -7.497
   91    HH   TYR  13           HH       TYR  13 -16.367   4.444  -5.718
   92    H    LEU  14           H        LEU  14  -9.942   2.962 -10.782
   93    HA   LEU  14           HA       LEU  14  -8.635   0.589 -11.874
   94   1HB   LEU  14          1HB       LEU  14  -9.154   1.398 -13.853
   95   2HB   LEU  14          2HB       LEU  14 -10.121   2.609 -13.035
   96    HG   LEU  14           HG       LEU  14  -8.094   4.103 -12.994
   97   1HD1  LEU  14          1HD1      LEU  14  -6.751   2.755 -15.199
   98   2HD1  LEU  14          2HD1      LEU  14  -6.086   3.456 -13.704
   99   3HD1  LEU  14          3HD1      LEU  14  -6.725   1.794 -13.701
  100   1HD2  LEU  14          1HD2      LEU  14  -9.994   4.099 -14.727
  101   2HD2  LEU  14          2HD2      LEU  14  -8.491   4.965 -15.127
  102   3HD2  LEU  14          3HD2      LEU  14  -8.806   3.358 -15.826
  103    H    ASP  15           H        ASP  15  -6.542   0.223 -11.398
  104    HA   ASP  15           HA       ASP  15  -5.020   2.526 -10.487
  105   1HB   ASP  15          1HB       ASP  15  -3.456   0.755  -9.548
  106   2HB   ASP  15          2HB       ASP  15  -5.055   0.774  -8.832
  107    HD2  ASP  15           HD       ASP  15  -5.774  -2.412  -9.676
  108    H    SER  16           H        SER  16  -4.438   3.258 -12.668
  109    HA   SER  16           HA       SER  16  -3.495   3.180 -14.653
  110   1HB   SER  16          1HB       SER  16  -1.238   1.795 -13.141
  111   2HB   SER  16          2HB       SER  16  -1.078   2.796 -14.571
  112    HG   SER  16           HG       SER  16  -0.562   4.084 -12.776
  113    H    ARG  17           H        ARG  17  -5.108   1.518 -15.436
  114    HA   ARG  17           HA       ARG  17  -3.999  -1.136 -15.615
  115   1HB   ARG  17          1HB       ARG  17  -6.265  -1.711 -16.582
  116   2HB   ARG  17          2HB       ARG  17  -6.357  -1.006 -14.980
  117   1HG   ARG  17          1HG       ARG  17  -7.436   0.873 -15.727
  118   2HG   ARG  17          2HG       ARG  17  -6.410   1.022 -17.139
  119   1HD   ARG  17          1HD       ARG  17  -8.437  -1.227 -17.035
  120   2HD   ARG  17          2HD       ARG  17  -8.988   0.395 -17.404
  121    HE   ARG  17           HE       ARG  17  -6.860   0.131 -19.114
  122   1HH1  ARG  17          2HH2      ARG  17  -9.638  -1.968 -18.459
  123   2HH1  ARG  17          1HH2      ARG  17  -9.668  -2.635 -20.057
  124   1HH2  ARG  17          1HH       ARG  17  -8.048  -1.905 -21.665
  125    H    ARG  18           H        ARG  18  -4.312   1.814 -17.431
  126    HA   ARG  18           HA       ARG  18  -4.582   0.870 -19.981
  127   1HB   ARG  18          1HB       ARG  18  -3.332   3.316 -18.728
  128   2HB   ARG  18          2HB       ARG  18  -3.017   3.034 -20.429
  129   1HG   ARG  18          1HG       ARG  18  -5.755   2.574 -20.280
  130   2HG   ARG  18          2HG       ARG  18  -5.542   3.836 -19.083
  131   1HD   ARG  18          1HD       ARG  18  -5.474   5.353 -20.772
  132   2HD   ARG  18          2HD       ARG  18  -3.950   4.658 -21.285
  133    HE   ARG  18           HE       ARG  18  -6.315   3.180 -22.219
  134   1HH1  ARG  18          2HH2      ARG  18  -4.006   5.762 -22.960
  135   2HH1  ARG  18          1HH2      ARG  18  -4.296   5.702 -24.666
  136   1HH2  ARG  18          1HH       ARG  18  -5.884   4.129 -25.532
  137    H    ALA  19           H        ALA  19  -1.443   2.103 -18.603
  138    HA   ALA  19           HA       ALA  19  -0.015   0.352 -20.416
  139   1HB   ALA  19          1HB       ALA  19   0.592   2.759 -20.101
  140   2HB   ALA  19          2HB       ALA  19   1.000   2.402 -18.406
  141   3HB   ALA  19          3HB       ALA  19   1.930   1.648 -19.723
  142    H    GLN  20           H        GLN  20   1.025  -1.519 -19.836
  143    HA   GLN  20           HA       GLN  20   1.444  -1.986 -17.021
  144   1HB   GLN  20          1HB       GLN  20  -0.855  -2.913 -17.718
  145   2HB   GLN  20          2HB       GLN  20   0.007  -4.066 -18.717
  146   1HG   GLN  20          1HG       GLN  20   1.377  -4.498 -16.446
  147   2HG   GLN  20          2HG       GLN  20  -0.073  -3.847 -15.707
  148   1HE2  GLN  20          1HE2      GLN  20  -0.439  -5.876 -14.759
  149   2HE2  GLN  20          2HE2      GLN  20  -1.134  -7.196 -15.640
  150    H    ASP  21           H        ASP  21   2.869  -1.577 -19.796
  151    HA   ASP  21           HA       ASP  21   4.695  -3.790 -19.356
  152   1HB   ASP  21          1HB       ASP  21   3.014  -3.616 -21.586
  153   2HB   ASP  21          2HB       ASP  21   4.499  -2.895 -22.174
  154    HD2  ASP  21           HD       ASP  21   5.105  -5.963 -23.222
  155    H    PHE  22           H        PHE  22   3.945  -0.573 -20.827
  156    HA   PHE  22           HA       PHE  22   6.700   0.068 -21.240
  157   1HB   PHE  22          1HB       PHE  22   3.973   1.104 -21.746
  158   2HB   PHE  22          2HB       PHE  22   5.028   2.396 -21.208
  159    HD1  PHE  22           1HD      PHE  22   5.913   3.633 -22.924
  160    HD2  PHE  22           2HD      PHE  22   5.356  -0.531 -23.518
  161    HE1  PHE  22           1HE      PHE  22   6.846   3.839 -25.245
  162    HE2  PHE  22           2HE      PHE  22   6.289  -0.326 -25.839
  163    HZ   PHE  22           HZ       PHE  22   7.023   1.857 -26.675
  164    H    VAL  23           H        VAL  23   4.357   0.342 -18.623
  165    HA   VAL  23           HA       VAL  23   5.451   2.546 -17.300
  166    HB   VAL  23           HB       VAL  23   4.076   0.139 -16.096
  167   1HG1  VAL  23          1HG1      VAL  23   3.211   1.862 -14.485
  168   2HG1  VAL  23          2HG1      VAL  23   4.968   1.585 -14.398
  169   3HG1  VAL  23          3HG1      VAL  23   4.334   3.032 -15.219
  170   1HG2  VAL  23          1HG2      VAL  23   2.285   2.332 -16.596
  171   2HG2  VAL  23          2HG2      VAL  23   3.095   1.876 -18.114
  172   3HG2  VAL  23          3HG2      VAL  23   2.199   0.653 -17.182
  173    H    GLN  24           H        GLN  24   6.681  -0.639 -17.887
  174    HA   GLN  24           HA       GLN  24   8.262  -0.724 -15.522
  175   1HB   GLN  24          1HB       GLN  24   7.782  -2.455 -17.898
  176   2HB   GLN  24          2HB       GLN  24   9.385  -2.588 -17.203
  177   1HG   GLN  24          1HG       GLN  24   7.938  -2.663 -14.904
  178   2HG   GLN  24          2HG       GLN  24   6.724  -3.297 -15.998
  179   1HE2  GLN  24          1HE2      GLN  24   6.769  -5.358 -16.517
  180   2HE2  GLN  24          2HE2      GLN  24   8.070  -6.469 -16.249
  181    H    TRP  25           H        TRP  25   8.393   1.484 -17.805
  182    HA   TRP  25           HA       TRP  25  11.328   1.456 -17.922
  183   1HB   TRP  25          1HB       TRP  25  10.443   0.831 -20.107
  184   2HB   TRP  25          2HB       TRP  25   9.431   2.261 -20.134
  185    HD1  TRP  25           HD       TRP  25  13.278   1.571 -19.825
  186    HE1  TRP  25           1HE      TRP  25  14.644   3.377 -21.179
  187    HE3  TRP  25           3HE      TRP  25   9.237   4.271 -21.321
  188    HZ2  TRP  25           2HZ      TRP  25  13.899   5.680 -22.690
  189    HZ3  TRP  25           3HZ      TRP  25   9.644   6.284 -22.733
  190    HH2  TRP  25           HH       TRP  25  11.878   7.001 -23.418
  191    H    LEU  26           H        LEU  26   8.260   3.379 -18.201
  192    HA   LEU  26           HA       LEU  26   9.552   5.838 -17.659
  193   1HB   LEU  26          1HB       LEU  26   6.631   5.101 -17.432
  194   2HB   LEU  26          2HB       LEU  26   7.294   6.722 -17.499
  195    HG   LEU  26           HG       LEU  26   6.507   6.374 -19.653
  196   1HD1  LEU  26          1HD1      LEU  26   8.502   6.107 -21.119
  197   2HD1  LEU  26          2HD1      LEU  26   8.739   7.252 -19.777
  198   3HD1  LEU  26          3HD1      LEU  26   9.440   5.618 -19.688
  199   1HD2  LEU  26          1HD2      LEU  26   7.817   3.712 -20.056
  200   2HD2  LEU  26          2HD2      LEU  26   6.295   3.805 -19.139
  201   3HD2  LEU  26          3HD2      LEU  26   6.362   4.400 -20.815
  202    H    MET  27           H        MET  27   8.381   3.164 -15.706
  203    HA   MET  27           HA       MET  27   9.530   4.318 -13.418
  204   1HB   MET  27          1HB       MET  27   6.537   4.446 -13.830
  205   2HB   MET  27          2HB       MET  27   7.092   4.020 -12.224
  206   1HG   MET  27          1HG       MET  27   8.722   6.141 -12.629
  207   2HG   MET  27          2HG       MET  27   7.441   6.607 -13.731
  208   1HE   MET  27          1HE       MET  27   5.297   8.313 -12.287
  209   2HE   MET  27          2HE       MET  27   5.307   6.911 -13.384
  210   3HE   MET  27          3HE       MET  27   4.351   6.859 -11.884
  211    H    ASN  28           H        ASN  28  10.564   2.161 -13.979
  212    HA   ASN  28           HA       ASN  28   9.064  -0.175 -13.748
  213   1HB   ASN  28          1HB       ASN  28  11.361   0.053 -14.824
  214   2HB   ASN  28          2HB       ASN  28  12.057   0.227 -13.225
  215   1HD2  ASN  28          1HD2      ASN  28  12.740  -1.516 -12.242
  216   2HD2  ASN  28          2HD2      ASN  28  12.297  -3.155 -12.585
  217    H    THR  29           H        THR  29  11.405   1.511 -11.515
  218    HA   THR  29           HA       THR  29  11.842   1.169  -9.332
  219    HB   THR  29           HB       THR  29   9.707   1.618  -7.967
  220    HG1  THR  29           1HG      THR  29   8.457   0.411  -9.724
  221   1HG2  THR  29          1HG2      THR  29   9.237   3.552 -10.084
  222   2HG2  THR  29          2HG2      THR  29  10.009   3.817  -8.502
  223   3HG2  THR  29          3HG2      THR  29  10.992   3.314  -9.898
  Start of MODEL   10
    1    H    HIS   1           H        HIS   1 -20.555 -20.026 -34.539
    2    HA   HIS   1           HA       HIS   1 -22.321 -18.673 -33.495
    3   1HB   HIS   1          1HB       HIS   1 -20.272 -18.216 -31.650
    4   2HB   HIS   1          2HB       HIS   1 -20.456 -16.679 -32.472
    5    HD1  HIS   1           1HD      HIS   1 -23.238 -16.003 -32.702
    6    HD2  HIS   1           2HD      HIS   1 -21.947 -18.406 -29.516
    7    HE1  HIS   1           1HE      HIS   1 -25.039 -15.831 -30.902
    8    H    SER   2           H        SER   2 -23.118 -17.398 -35.102
    9    HA   SER   2           HA       SER   2 -21.650 -16.884 -37.341
   10   1HB   SER   2          1HB       SER   2 -24.174 -15.576 -36.253
   11   2HB   SER   2          2HB       SER   2 -23.538 -15.195 -37.841
   12    HG   SER   2           HG       SER   2 -23.831 -17.363 -38.499
   13    H    GLN   3           H        GLN   3 -20.106 -15.367 -37.855
   14    HA   GLN   3           HA       GLN   3 -19.949 -13.069 -36.064
   15   1HB   GLN   3          1HB       GLN   3 -17.863 -14.865 -37.246
   16   2HB   GLN   3          2HB       GLN   3 -17.454 -13.164 -37.144
   17   1HG   GLN   3          1HG       GLN   3 -17.626 -13.120 -34.783
   18   2HG   GLN   3          2HG       GLN   3 -18.662 -14.532 -34.728
   19   1HE2  GLN   3          1HE2      GLN   3 -17.610 -15.981 -33.582
   20   2HE2  GLN   3          2HE2      GLN   3 -15.996 -16.546 -33.852
   21    H    GLY   4           H        GLY   4 -21.656 -12.209 -37.648
   22   1HA   GLY   4          1HA       GLY   4 -20.889 -11.656 -40.338
   23   2HA   GLY   4          2HA       GLY   4 -22.263 -11.010 -39.463
   24    H    THR   5           H        THR   5 -22.219  -8.808 -39.439
   25    HA   THR   5           HA       THR   5 -20.169  -7.182 -40.089
   26    HB   THR   5           HB       THR   5 -21.450  -5.497 -38.591
   27    HG1  THR   5           1HG      THR   5 -22.126  -7.187 -37.061
   28   1HG2  THR   5          1HG2      THR   5 -23.065  -7.328 -40.444
   29   2HG2  THR   5          2HG2      THR   5 -23.627  -5.752 -39.838
   30   3HG2  THR   5          3HG2      THR   5 -22.220  -5.837 -40.925
   31    H    PHE   6           H        PHE   6 -18.770  -5.713 -38.832
   32    HA   PHE   6           HA       PHE   6 -17.156  -7.226 -37.099
   33   1HB   PHE   6          1HB       PHE   6 -17.369  -4.186 -37.531
   34   2HB   PHE   6          2HB       PHE   6 -15.951  -5.027 -36.936
   35    HD1  PHE   6           1HD      PHE   6 -17.212  -3.464 -39.703
   36    HD2  PHE   6           2HD      PHE   6 -15.272  -7.084 -38.636
   37    HE1  PHE   6           1HE      PHE   6 -16.367  -3.705 -42.054
   38    HE2  PHE   6           2HE      PHE   6 -14.427  -7.324 -40.987
   39    HZ   PHE   6           HZ       PHE   6 -14.985  -5.632 -42.668
   40    H    THR   7           H        THR   7 -18.987  -4.145 -36.445
   41    HA   THR   7           HA       THR   7 -18.668  -4.015 -33.764
   42    HB   THR   7           HB       THR   7 -19.948  -2.505 -35.498
   43    HG1  THR   7           1HG      THR   7 -20.980  -3.139 -32.822
   44   1HG2  THR   7          1HG2      THR   7 -22.317  -3.968 -34.247
   45   2HG2  THR   7          2HG2      THR   7 -22.346  -2.724 -35.520
   46   3HG2  THR   7          3HG2      THR   7 -21.742  -4.359 -35.886
   47    H    SER   8           H        SER   8 -18.738  -5.589 -32.283
   48    HA   SER   8           HA       SER   8 -21.150  -6.707 -31.574
   49   1HB   SER   8          1HB       SER   8 -20.700  -8.016 -33.740
   50   2HB   SER   8          2HB       SER   8 -19.342  -8.757 -32.918
   51    HG   SER   8           HG       SER   8 -20.890 -10.184 -32.388
   52    H    ASP   9           H        ASP   9 -20.951  -7.564 -29.473
   53    HA   ASP   9           HA       ASP   9 -20.035  -8.056 -27.571
   54   1HB   ASP   9          1HB       ASP   9 -19.011 -10.020 -28.354
   55   2HB   ASP   9          2HB       ASP   9 -17.980  -9.160 -29.481
   56    HD2  ASP   9           HD       ASP   9 -15.687 -10.293 -27.166
   57    H    TYR  10           H        TYR  10 -16.846  -7.443 -29.164
   58    HA   TYR  10           HA       TYR  10 -15.710  -5.882 -27.314
   59   1HB   TYR  10          1HB       TYR  10 -14.239  -5.333 -29.126
   60   2HB   TYR  10          2HB       TYR  10 -15.057  -6.745 -29.765
   61    HD1  TYR  10           1HD      TYR  10 -15.422  -3.011 -29.674
   62    HD2  TYR  10           2HD      TYR  10 -16.005  -6.626 -31.887
   63    HE1  TYR  10           1HE      TYR  10 -16.192  -1.663 -31.687
   64    HE2  TYR  10           2HE      TYR  10 -16.773  -5.265 -33.893
   65    HH   TYR  10           HH       TYR  10 -16.932  -1.717 -33.710
   66    H    SER  11           H        SER  11 -15.704  -3.750 -26.615
   67    HA   SER  11           HA       SER  11 -16.417  -1.539 -27.790
   68   1HB   SER  11          1HB       SER  11 -18.903  -3.116 -27.262
   69   2HB   SER  11          2HB       SER  11 -18.974  -1.417 -26.837
   70    HG   SER  11           HG       SER  11 -18.254  -0.917 -29.037
   71    H    LYS  12           H        LYS  12 -14.992  -0.798 -26.152
   72    HA   LYS  12           HA       LYS  12 -14.497   0.179 -24.229
   73   1HB   LYS  12          1HB       LYS  12 -17.343  -0.336 -23.322
   74   2HB   LYS  12          2HB       LYS  12 -16.210   0.814 -22.643
   75   1HG   LYS  12          1HG       LYS  12 -16.659   2.365 -24.251
   76   2HG   LYS  12          2HG       LYS  12 -16.490   1.194 -25.543
   77   1HD   LYS  12          1HD       LYS  12 -18.752   1.623 -25.773
   78   2HD   LYS  12          2HD       LYS  12 -18.858   0.330 -24.596
   79   1HE   LYS  12          1HE       LYS  12 -18.424   2.913 -23.271
   80   2HE   LYS  12          2HE       LYS  12 -19.836   2.973 -24.307
   81   1HZ   LYS  12          1HZ       LYS  12 -19.776   1.872 -21.819
   82   2HZ   LYS  12          2HZ       LYS  12 -20.944   1.597 -22.920
   83    H    TYR  13           H        TYR  13 -16.753  -2.575 -23.476
   84    HA   TYR  13           HA       TYR  13 -15.736  -3.469 -21.180
   85   1HB   TYR  13          1HB       TYR  13 -16.749  -4.704 -23.761
   86   2HB   TYR  13          2HB       TYR  13 -16.078  -5.819 -22.587
   87    HD1  TYR  13           1HD      TYR  13 -18.511  -2.959 -22.719
   88    HD2  TYR  13           2HD      TYR  13 -17.525  -6.768 -21.040
   89    HE1  TYR  13           1HE      TYR  13 -20.728  -2.992 -21.475
   90    HE2  TYR  13           2HE      TYR  13 -19.745  -6.789 -19.802
   91    HH   TYR  13           HH       TYR  13 -21.927  -5.809 -20.006
   92    H    LEU  14           H        LEU  14 -14.161  -3.690 -24.381
   93    HA   LEU  14           HA       LEU  14 -12.322  -5.610 -24.048
   94   1HB   LEU  14          1HB       LEU  14 -11.909  -2.855 -25.215
   95   2HB   LEU  14          2HB       LEU  14 -10.815  -4.205 -25.440
   96    HG   LEU  14           HG       LEU  14 -13.660  -4.678 -26.173
   97   1HD1  LEU  14          1HD1      LEU  14 -11.855  -2.832 -27.756
   98   2HD1  LEU  14          2HD1      LEU  14 -13.324  -3.605 -28.399
   99   3HD1  LEU  14          3HD1      LEU  14 -13.443  -2.455 -27.046
  100   1HD2  LEU  14          1HD2      LEU  14 -11.904  -6.402 -26.410
  101   2HD2  LEU  14          2HD2      LEU  14 -12.675  -5.979 -27.957
  102   3HD2  LEU  14          3HD2      LEU  14 -11.055  -5.351 -27.568
  103    H    ASP  15           H        ASP  15 -10.117  -5.730 -23.246
  104    HA   ASP  15           HA       ASP  15  -9.801  -3.988 -20.933
  105   1HB   ASP  15          1HB       ASP  15  -9.948  -6.677 -20.896
  106   2HB   ASP  15          2HB       ASP  15  -8.244  -6.549 -21.286
  107    HD2  ASP  15           HD       ASP  15  -7.607  -6.357 -17.924
  108    H    SER  16           H        SER  16  -8.571  -2.292 -21.947
  109    HA   SER  16           HA       SER  16  -6.634  -2.709 -23.849
  110   1HB   SER  16          1HB       SER  16  -6.869  -0.476 -21.784
  111   2HB   SER  16          2HB       SER  16  -5.832  -0.411 -23.195
  112    HG   SER  16           HG       SER  16  -7.939   0.644 -23.487
  113    H    ARG  17           H        ARG  17  -4.197  -1.778 -23.284
  114    HA   ARG  17           HA       ARG  17  -3.279  -2.763 -20.777
  115   1HB   ARG  17          1HB       ARG  17  -2.881  -4.292 -23.334
  116   2HB   ARG  17          2HB       ARG  17  -1.477  -4.154 -22.295
  117   1HG   ARG  17          1HG       ARG  17  -2.983  -4.954 -20.359
  118   2HG   ARG  17          2HG       ARG  17  -4.197  -5.326 -21.567
  119   1HD   ARG  17          1HD       ARG  17  -2.662  -6.892 -22.700
  120   2HD   ARG  17          2HD       ARG  17  -1.352  -6.442 -21.627
  121    HE   ARG  17           HE       ARG  17  -3.444  -7.276 -19.941
  122   1HH1  ARG  17          2HH2      ARG  17  -1.489  -8.732 -22.512
  123   2HH1  ARG  17          1HH2      ARG  17  -1.612 -10.335 -21.868
  124   1HH2  ARG  17          1HH       ARG  17  -2.862 -10.699 -19.856
  125    H    ARG  18           H        ARG  18  -3.148  -0.189 -21.417
  126    HA   ARG  18           HA       ARG  18  -1.289   0.720 -23.149
  127   1HB   ARG  18          1HB       ARG  18  -2.704   1.727 -20.796
  128   2HB   ARG  18          2HB       ARG  18  -1.080   2.384 -20.835
  129   1HG   ARG  18          1HG       ARG  18  -1.426   3.174 -23.165
  130   2HG   ARG  18          2HG       ARG  18  -3.025   2.456 -23.191
  131   1HD   ARG  18          1HD       ARG  18  -3.632   4.611 -22.587
  132   2HD   ARG  18          2HD       ARG  18  -3.352   3.967 -20.981
  133    HE   ARG  18           HE       ARG  18  -1.370   5.242 -20.812
  134   1HH1  ARG  18          2HH2      ARG  18  -2.613   5.375 -24.128
  135   2HH1  ARG  18          1HH2      ARG  18  -1.547   6.653 -24.608
  136   1HH2  ARG  18          1HH       ARG  18   0.002   7.550 -23.015
  137    H    ALA  19           H        ALA  19  -0.779   0.201 -19.572
  138    HA   ALA  19           HA       ALA  19   1.988   0.585 -19.677
  139   1HB   ALA  19          1HB       ALA  19   1.942  -0.347 -17.410
  140   2HB   ALA  19          2HB       ALA  19   0.563   0.754 -17.645
  141   3HB   ALA  19          3HB       ALA  19   0.314  -1.008 -17.693
  142    H    GLN  20           H        GLN  20   2.291  -2.109 -18.037
  143    HA   GLN  20           HA       GLN  20   3.170  -4.060 -18.400
  144   1HB   GLN  20          1HB       GLN  20   0.744  -4.133 -19.711
  145   2HB   GLN  20          2HB       GLN  20   1.831  -4.623 -20.996
  146   1HG   GLN  20          1HG       GLN  20   2.593  -5.982 -18.541
  147   2HG   GLN  20          2HG       GLN  20   0.875  -6.205 -18.807
  148   1HE2  GLN  20          1HE2      GLN  20   2.068  -8.430 -18.938
  149   2HE2  GLN  20          2HE2      GLN  20   2.394  -9.007 -20.539
  150    H    ASP  21           H        ASP  21   5.279  -4.351 -18.969
  151    HA   ASP  21           HA       ASP  21   7.149  -4.229 -20.058
  152   1HB   ASP  21          1HB       ASP  21   5.521  -5.578 -21.713
  153   2HB   ASP  21          2HB       ASP  21   5.752  -4.175 -22.737
  154    HD2  ASP  21           HD       ASP  21   7.174  -7.173 -22.111
  155    H    PHE  22           H        PHE  22   5.279  -1.732 -19.703
  156    HA   PHE  22           HA       PHE  22   6.862   0.011 -21.436
  157   1HB   PHE  22          1HB       PHE  22   3.875  -0.361 -21.147
  158   2HB   PHE  22          2HB       PHE  22   4.422   1.301 -21.240
  159    HD1  PHE  22           1HD      PHE  22   5.069  -1.930 -23.012
  160    HD2  PHE  22           2HD      PHE  22   4.427   2.253 -23.331
  161    HE1  PHE  22           1HE      PHE  22   5.173  -2.105 -25.514
  162    HE2  PHE  22           2HE      PHE  22   4.530   2.078 -25.833
  163    HZ   PHE  22           HZ       PHE  22   4.902  -0.099 -26.895
  164    H    VAL  23           H        VAL  23   4.626  -0.297 -18.605
  165    HA   VAL  23           HA       VAL  23   5.400   2.220 -17.532
  166    HB   VAL  23           HB       VAL  23   3.774  -0.135 -16.648
  167   1HG1  VAL  23          1HG1      VAL  23   4.690   0.266 -14.562
  168   2HG1  VAL  23          2HG1      VAL  23   4.938   2.000 -14.882
  169   3HG1  VAL  23          3HG1      VAL  23   3.302   1.380 -14.552
  170   1HG2  VAL  23          1HG2      VAL  23   3.162   2.826 -16.943
  171   2HG2  VAL  23          2HG2      VAL  23   2.759   1.550 -18.116
  172   3HG2  VAL  23          3HG2      VAL  23   1.996   1.553 -16.508
  173    H    GLN  24           H        GLN  24   6.842  -0.923 -17.683
  174    HA   GLN  24           HA       GLN  24   8.241  -0.660 -15.216
  175   1HB   GLN  24          1HB       GLN  24   7.596  -2.780 -16.883
  176   2HB   GLN  24          2HB       GLN  24   9.301  -2.567 -17.225
  177   1HG   GLN  24          1HG       GLN  24   9.960  -3.144 -15.071
  178   2HG   GLN  24          2HG       GLN  24   8.516  -2.481 -14.331
  179   1HE2  GLN  24          1HE2      GLN  24   8.586  -4.487 -13.119
  180   2HE2  GLN  24          2HE2      GLN  24   7.845  -5.916 -13.759
  181    H    TRP  25           H        TRP  25   8.437   1.408 -17.526
  182    HA   TRP  25           HA       TRP  25  11.370   1.472 -17.538
  183   1HB   TRP  25          1HB       TRP  25  10.725   0.672 -19.712
  184   2HB   TRP  25          2HB       TRP  25   9.537   1.948 -19.891
  185    HD1  TRP  25           HD       TRP  25  13.419   1.810 -19.356
  186    HE1  TRP  25           1HE      TRP  25  14.608   3.683 -20.784
  187    HE3  TRP  25           3HE      TRP  25   9.146   3.820 -21.243
  188    HZ2  TRP  25           2HZ      TRP  25  13.650   5.749 -22.504
  189    HZ3  TRP  25           3HZ      TRP  25   9.361   5.763 -22.789
  190    HH2  TRP  25           HH       TRP  25  11.516   6.727 -23.426
  191    H    LEU  26           H        LEU  26   8.246   3.234 -18.112
  192    HA   LEU  26           HA       LEU  26   9.398   5.780 -17.693
  193   1HB   LEU  26          1HB       LEU  26   6.551   4.781 -17.704
  194   2HB   LEU  26          2HB       LEU  26   6.982   6.469 -17.511
  195    HG   LEU  26           HG       LEU  26   6.570   6.427 -19.752
  196   1HD1  LEU  26          1HD1      LEU  26   8.660   6.377 -21.027
  197   2HD1  LEU  26          2HD1      LEU  26   8.866   7.205 -19.464
  198   3HD1  LEU  26          3HD1      LEU  26   9.469   5.544 -19.678
  199   1HD2  LEU  26          1HD2      LEU  26   5.982   4.057 -19.852
  200   2HD2  LEU  26          2HD2      LEU  26   6.963   4.539 -21.257
  201   3HD2  LEU  26          3HD2      LEU  26   7.706   3.622 -19.925
  202    H    MET  27           H        MET  27   8.820   3.181 -15.590
  203    HA   MET  27           HA       MET  27   9.543   4.688 -13.372
  204   1HB   MET  27          1HB       MET  27   7.386   4.436 -12.060
  205   2HB   MET  27          2HB       MET  27   7.222   5.525 -13.423
  206   1HG   MET  27          1HG       MET  27   6.427   3.408 -14.758
  207   2HG   MET  27          2HG       MET  27   6.229   2.659 -13.186
  208   1HE   MET  27          1HE       MET  27   4.268   4.729 -15.829
  209   2HE   MET  27          2HE       MET  27   3.958   6.227 -14.918
  210   3HE   MET  27          3HE       MET  27   5.630   5.733 -15.279
  211    H    ASN  28           H        ASN  28  10.231   2.222 -14.814
  212    HA   ASN  28           HA       ASN  28  10.507   0.060 -14.549
  213   1HB   ASN  28          1HB       ASN  28  11.883   1.425 -12.634
  214   2HB   ASN  28          2HB       ASN  28  10.899   0.429 -11.579
  215   1HD2  ASN  28          1HD2      ASN  28  12.893  -0.522 -10.914
  216   2HD2  ASN  28          2HD2      ASN  28  13.631  -1.793 -11.831
  217    H    THR  29           H        THR  29  10.188  -1.511 -12.004
  218    HA   THR  29           HA       THR  29   8.583  -2.957 -11.335
  219    HB   THR  29           HB       THR  29   6.868  -1.561  -9.887
  220    HG1  THR  29           1HG      THR  29   8.890   0.405 -10.679
  221   1HG2  THR  29          1HG2      THR  29   9.194  -0.475  -8.752
  222   2HG2  THR  29          2HG2      THR  29   8.516  -2.077  -8.373
  223   3HG2  THR  29          3HG2      THR  29   9.793  -1.919  -9.603
  Start of MODEL   11
    1    H    HIS   1           H        HIS   1   6.256  -6.902  -6.479
    2    HA   HIS   1           HA       HIS   1   6.594  -9.025  -4.493
    3   1HB   HIS   1          1HB       HIS   1   7.049  -6.362  -4.193
    4   2HB   HIS   1          2HB       HIS   1   5.368  -6.442  -3.705
    5    HD1  HIS   1           1HD      HIS   1   8.792  -7.777  -2.752
    6    HD2  HIS   1           2HD      HIS   1   4.895  -7.599  -1.208
    7    HE1  HIS   1           1HE      HIS   1   8.948  -8.553  -0.327
    8    H    SER   2           H        SER   2   4.082  -6.591  -5.507
    9    HA   SER   2           HA       SER   2   1.900  -6.729  -5.499
   10   1HB   SER   2          1HB       SER   2   2.946  -8.867  -7.214
   11   2HB   SER   2          2HB       SER   2   1.333  -9.245  -6.645
   12    HG   SER   2           HG       SER   2   0.871  -6.878  -7.330
   13    H    GLN   3           H        GLN   3   1.374  -6.833  -3.258
   14    HA   GLN   3           HA       GLN   3   0.001  -9.116  -2.479
   15   1HB   GLN   3          1HB       GLN   3   2.308 -10.022  -2.143
   16   2HB   GLN   3          2HB       GLN   3   2.658  -8.709  -1.036
   17   1HG   GLN   3          1HG       GLN   3   0.241  -9.768  -0.057
   18   2HG   GLN   3          2HG       GLN   3   1.132 -11.187  -0.571
   19   1HE2  GLN   3          1HE2      GLN   3   0.417  -9.823   2.076
   20   2HE2  GLN   3          2HE2      GLN   3   1.891  -9.814   2.985
   21    H    GLY   4           H        GLY   4  -1.606  -8.349  -1.166
   22   1HA   GLY   4          1HA       GLY   4  -2.026  -7.215   0.974
   23   2HA   GLY   4          2HA       GLY   4  -1.010  -5.908   0.400
   24    H    THR   5           H        THR   5  -3.979  -7.797  -0.479
   25    HA   THR   5           HA       THR   5  -5.825  -7.217  -1.587
   26    HB   THR   5           HB       THR   5  -6.906  -5.226  -0.713
   27    HG1  THR   5           1HG      THR   5  -5.261  -3.682  -1.201
   28   1HG2  THR   5          1HG2      THR   5  -6.487  -5.324   1.655
   29   2HG2  THR   5          2HG2      THR   5  -6.120  -6.964   1.067
   30   3HG2  THR   5          3HG2      THR   5  -4.796  -5.824   1.409
   31    H    PHE   6           H        PHE   6  -6.859  -5.737  -3.263
   32    HA   PHE   6           HA       PHE   6  -4.715  -4.935  -5.087
   33   1HB   PHE   6          1HB       PHE   6  -7.694  -5.357  -5.668
   34   2HB   PHE   6          2HB       PHE   6  -6.371  -5.448  -6.814
   35    HD1  PHE   6           1HD      PHE   6  -8.419  -7.275  -4.504
   36    HD2  PHE   6           2HD      PHE   6  -4.759  -7.393  -6.649
   37    HE1  PHE   6           1HE      PHE   6  -8.310  -9.762  -4.182
   38    HE2  PHE   6           2HE      PHE   6  -4.650  -9.880  -6.328
   39    HZ   PHE   6           HZ       PHE   6  -6.427 -11.035  -5.098
   40    H    THR   7           H        THR   7  -7.885  -3.922  -3.683
   41    HA   THR   7           HA       THR   7  -8.301  -1.586  -5.025
   42    HB   THR   7           HB       THR   7  -9.607  -2.851  -3.101
   43    HG1  THR   7           1HG      THR   7 -10.572  -0.646  -2.679
   44   1HG2  THR   7          1HG2      THR   7  -9.435  -1.728  -0.921
   45   2HG2  THR   7          2HG2      THR   7  -7.834  -2.388  -1.331
   46   3HG2  THR   7          3HG2      THR   7  -8.160  -0.650  -1.538
   47    H    SER   8           H        SER   8  -8.110   0.712  -3.984
   48    HA   SER   8           HA       SER   8  -6.841   2.390  -3.447
   49   1HB   SER   8          1HB       SER   8  -6.476   1.236  -1.288
   50   2HB   SER   8          2HB       SER   8  -5.132   0.340  -1.969
   51    HG   SER   8           HG       SER   8  -5.166   2.880  -0.910
   52    H    ASP   9           H        ASP   9  -4.233   3.091  -3.494
   53    HA   ASP   9           HA       ASP   9  -2.502   3.417  -4.757
   54   1HB   ASP   9          1HB       ASP   9  -1.616   1.268  -4.396
   55   2HB   ASP   9          2HB       ASP   9  -2.954   0.467  -5.195
   56    HD2  ASP   9           HD       ASP   9   0.238   1.620  -5.784
   57    H    TYR  10           H        TYR  10  -3.905   0.926  -6.975
   58    HA   TYR  10           HA       TYR  10  -3.759   2.585  -9.224
   59   1HB   TYR  10          1HB       TYR  10  -4.700   0.620 -10.255
   60   2HB   TYR  10          2HB       TYR  10  -3.931  -0.040  -8.825
   61    HD1  TYR  10           1HD      TYR  10  -5.168  -1.376  -7.359
   62    HD2  TYR  10           2HD      TYR  10  -7.235   1.274 -10.006
   63    HE1  TYR  10           1HE      TYR  10  -7.392  -2.371  -6.631
   64    HE2  TYR  10           2HE      TYR  10  -9.451   0.271  -9.269
   65    HH   TYR  10           HH       TYR  10 -10.370  -1.508  -8.255
   66    H    SER  11           H        SER  11  -6.432   1.804  -6.940
   67    HA   SER  11           HA       SER  11  -8.597   2.583  -8.180
   68   1HB   SER  11          1HB       SER  11  -7.618   2.853  -5.402
   69   2HB   SER  11          2HB       SER  11  -8.893   3.990  -5.790
   70    HG   SER  11           HG       SER  11 -10.047   2.005  -6.708
   71    H    LYS  12           H        LYS  12  -6.194   4.886  -6.727
   72    HA   LYS  12           HA       LYS  12  -7.325   7.260  -7.109
   73   1HB   LYS  12          1HB       LYS  12  -4.550   6.244  -7.274
   74   2HB   LYS  12          2HB       LYS  12  -4.811   7.811  -8.012
   75   1HG   LYS  12          1HG       LYS  12  -6.149   8.329  -5.769
   76   2HG   LYS  12          2HG       LYS  12  -5.225   6.984  -5.128
   77   1HD   LYS  12          1HD       LYS  12  -3.327   8.547  -6.538
   78   2HD   LYS  12          2HD       LYS  12  -4.346   9.718  -5.724
   79   1HE   LYS  12          1HE       LYS  12  -4.042   8.191  -3.604
   80   2HE   LYS  12          2HE       LYS  12  -2.706   7.477  -4.486
   81   1HZ   LYS  12          1HZ       LYS  12  -1.887   9.856  -4.777
   82   2HZ   LYS  12          2HZ       LYS  12  -2.982  10.307  -3.660
   83    H    TYR  13           H        TYR  13  -5.661   5.378  -9.728
   84    HA   TYR  13           HA       TYR  13  -6.480   7.268 -11.714
   85   1HB   TYR  13          1HB       TYR  13  -5.241   4.460 -11.585
   86   2HB   TYR  13          2HB       TYR  13  -5.585   5.209 -13.131
   87    HD1  TYR  13           1HD      TYR  13  -4.331   7.222 -13.861
   88    HD2  TYR  13           2HD      TYR  13  -3.377   5.187 -10.221
   89    HE1  TYR  13           1HE      TYR  13  -2.084   8.409 -13.778
   90    HE2  TYR  13           2HE      TYR  13  -1.133   6.381 -10.150
   91    HH   TYR  13           HH       TYR  13   0.405   7.414 -11.754
   92    H    LEU  14           H        LEU  14  -7.425   3.895 -10.776
   93    HA   LEU  14           HA       LEU  14  -9.207   2.683 -11.254
   94   1HB   LEU  14          1HB       LEU  14 -10.232   5.426 -10.935
   95   2HB   LEU  14          2HB       LEU  14 -11.309   4.336 -11.786
   96    HG   LEU  14           HG       LEU  14 -10.096   3.454  -9.185
   97   1HD1  LEU  14          1HD1      LEU  14 -12.394   4.446  -8.260
   98   2HD1  LEU  14          2HD1      LEU  14 -10.878   5.379  -8.268
   99   3HD1  LEU  14          3HD1      LEU  14 -12.088   5.637  -9.547
  100   1HD2  LEU  14          1HD2      LEU  14 -11.347   1.688  -9.719
  101   2HD2  LEU  14          2HD2      LEU  14 -12.756   2.694  -9.303
  102   3HD2  LEU  14          3HD2      LEU  14 -12.212   2.579 -10.994
  103    H    ASP  15           H        ASP  15  -7.861   2.121 -13.224
  104    HA   ASP  15           HA       ASP  15  -9.530   2.048 -15.422
  105   1HB   ASP  15          1HB       ASP  15  -8.444   4.517 -15.370
  106   2HB   ASP  15          2HB       ASP  15  -7.088   3.684 -16.104
  107    HD2  ASP  15           HD       ASP  15  -8.922   5.597 -17.768
  108    H    SER  16           H        SER  16  -6.011   2.420 -14.535
  109    HA   SER  16           HA       SER  16  -4.265   1.175 -14.862
  110   1HB   SER  16          1HB       SER  16  -6.422  -0.914 -14.577
  111   2HB   SER  16          2HB       SER  16  -4.814  -1.440 -15.032
  112    HG   SER  16           HG       SER  16  -4.360   0.220 -13.033
  113    H    ARG  17           H        ARG  17  -3.355   1.694 -16.844
  114    HA   ARG  17           HA       ARG  17  -3.704  -0.145 -18.932
  115   1HB   ARG  17          1HB       ARG  17  -5.441   2.168 -18.952
  116   2HB   ARG  17          2HB       ARG  17  -4.279   2.366 -20.250
  117   1HG   ARG  17          1HG       ARG  17  -5.153   0.634 -21.473
  118   2HG   ARG  17          2HG       ARG  17  -5.357  -0.390 -20.065
  119   1HD   ARG  17          1HD       ARG  17  -7.309   1.359 -19.480
  120   2HD   ARG  17          2HD       ARG  17  -7.254   1.670 -21.204
  121    HE   ARG  17           HE       ARG  17  -8.121  -0.827 -19.894
  122   1HH1  ARG  17          2HH2      ARG  17  -7.160   0.720 -22.934
  123   2HH1  ARG  17          1HH2      ARG  17  -7.915  -0.481 -23.928
  124   1HH2  ARG  17          1HH       ARG  17  -9.060  -2.313 -22.890
  125    H    ARG  18           H        ARG  18  -2.848   3.336 -18.274
  126    HA   ARG  18           HA       ARG  18  -0.847   3.582 -20.063
  127   1HB   ARG  18          1HB       ARG  18  -1.502   4.833 -17.417
  128   2HB   ARG  18          2HB       ARG  18   0.135   5.091 -17.986
  129   1HG   ARG  18          1HG       ARG  18  -2.307   5.604 -19.740
  130   2HG   ARG  18          2HG       ARG  18  -1.613   6.840 -18.710
  131   1HD   ARG  18          1HD       ARG  18   0.529   6.726 -19.892
  132   2HD   ARG  18          2HD       ARG  18   0.015   5.317 -20.797
  133    HE   ARG  18           HE       ARG  18  -1.333   6.691 -22.183
  134   1HH1  ARG  18          2HH2      ARG  18   0.015   8.578 -19.505
  135   2HH1  ARG  18          1HH2      ARG  18  -0.416  10.105 -20.200
  136   1HH2  ARG  18          1HH       ARG  18  -1.542  10.155 -22.315
  137    H    ALA  19           H        ALA  19  -0.518   2.626 -16.560
  138    HA   ALA  19           HA       ALA  19   2.221   2.080 -16.706
  139   1HB   ALA  19          1HB       ALA  19   0.342   0.665 -14.815
  140   2HB   ALA  19          2HB       ALA  19   1.963   1.333 -14.507
  141   3HB   ALA  19          3HB       ALA  19   0.570   2.426 -14.690
  142    H    GLN  20           H        GLN  20   1.607  -0.716 -15.352
  143    HA   GLN  20           HA       GLN  20   1.575  -2.815 -15.922
  144   1HB   GLN  20          1HB       GLN  20  -0.507  -2.063 -17.289
  145   2HB   GLN  20          2HB       GLN  20   0.534  -2.146 -18.696
  146   1HG   GLN  20          1HG       GLN  20  -0.114  -4.341 -18.770
  147   2HG   GLN  20          2HG       GLN  20   1.110  -4.567 -17.536
  148   1HE2  GLN  20          1HE2      GLN  20  -1.866  -5.412 -18.302
  149   2HE2  GLN  20          2HE2      GLN  20  -2.636  -5.553 -16.757
  150    H    ASP  21           H        ASP  21   1.905  -3.381 -19.101
  151    HA   ASP  21           HA       ASP  21   4.508  -4.087 -19.009
  152   1HB   ASP  21          1HB       ASP  21   2.623  -3.351 -21.254
  153   2HB   ASP  21          2HB       ASP  21   4.303  -3.655 -21.649
  154    HD2  ASP  21           HD       ASP  21   1.396  -5.610 -21.305
  155    H    PHE  22           H        PHE  22   3.078  -0.909 -19.308
  156    HA   PHE  22           HA       PHE  22   5.284   0.312 -20.652
  157   1HB   PHE  22          1HB       PHE  22   2.596   0.864 -20.082
  158   2HB   PHE  22          2HB       PHE  22   3.408   1.901 -18.926
  159    HD1  PHE  22           1HD      PHE  22   1.687   2.546 -21.480
  160    HD2  PHE  22           2HD      PHE  22   5.852   2.514 -20.666
  161    HE1  PHE  22           1HE      PHE  22   2.051   4.262 -23.275
  162    HE2  PHE  22           2HE      PHE  22   6.216   4.230 -22.462
  163    HZ   PHE  22           HZ       PHE  22   4.311   5.083 -23.745
  164    H    VAL  23           H        VAL  23   4.438  -0.522 -17.337
  165    HA   VAL  23           HA       VAL  23   5.819   1.428 -15.950
  166    HB   VAL  23           HB       VAL  23   5.381  -1.501 -15.336
  167   1HG1  VAL  23          1HG1      VAL  23   6.611  -1.227 -13.498
  168   2HG1  VAL  23          2HG1      VAL  23   6.933   0.469 -13.933
  169   3HG1  VAL  23          3HG1      VAL  23   5.498   0.056 -12.964
  170   1HG2  VAL  23          1HG2      VAL  23   3.436   0.280 -15.753
  171   2HG2  VAL  23          2HG2      VAL  23   3.325  -0.968 -14.488
  172   3HG2  VAL  23          3HG2      VAL  23   3.803   0.693 -14.061
  173    H    GLN  24           H        GLN  24   6.978  -1.048 -18.097
  174    HA   GLN  24           HA       GLN  24   9.545  -1.219 -16.879
  175   1HB   GLN  24          1HB       GLN  24   8.064  -2.629 -18.906
  176   2HB   GLN  24          2HB       GLN  24   9.584  -2.122 -19.615
  177   1HG   GLN  24          1HG       GLN  24  10.525  -3.014 -17.226
  178   2HG   GLN  24          2HG       GLN  24   9.086  -4.008 -17.330
  179   1HE2  GLN  24          1HE2      GLN  24   9.711  -5.948 -17.914
  180   2HE2  GLN  24          2HE2      GLN  24  10.725  -6.357 -19.257
  181    H    TRP  25           H        TRP  25   8.185   1.394 -18.083
  182    HA   TRP  25           HA       TRP  25  10.613   2.227 -19.513
  183   1HB   TRP  25          1HB       TRP  25   8.836   1.925 -21.135
  184   2HB   TRP  25          2HB       TRP  25   7.750   2.923 -20.188
  185    HD1  TRP  25           HD       TRP  25  11.248   3.441 -21.883
  186    HE1  TRP  25           1HE      TRP  25  11.403   5.852 -22.945
  187    HE3  TRP  25           3HE      TRP  25   6.650   4.984 -20.354
  188    HZ2  TRP  25           2HZ      TRP  25   9.626   8.083 -23.024
  189    HZ3  TRP  25           3HZ      TRP  25   5.937   7.293 -20.966
  190    HH2  TRP  25           HH       TRP  25   7.342   8.823 -22.254
  191    H    LEU  26           H        LEU  26   7.647   3.203 -17.661
  192    HA   LEU  26           HA       LEU  26   8.684   5.737 -16.972
  193   1HB   LEU  26          1HB       LEU  26   6.494   4.130 -15.650
  194   2HB   LEU  26          2HB       LEU  26   6.785   5.848 -15.461
  195    HG   LEU  26           HG       LEU  26   5.006   5.769 -16.946
  196   1HD1  LEU  26          1HD1      LEU  26   5.901   6.414 -19.188
  197   2HD1  LEU  26          2HD1      LEU  26   6.648   7.276 -17.821
  198   3HD1  LEU  26          3HD1      LEU  26   7.522   5.948 -18.621
  199   1HD2  LEU  26          1HD2      LEU  26   4.501   4.137 -18.469
  200   2HD2  LEU  26          2HD2      LEU  26   6.208   3.782 -18.830
  201   3HD2  LEU  26          3HD2      LEU  26   5.479   3.199 -17.315
  202    H    MET  27           H        MET  27   9.444   2.541 -15.965
  203    HA   MET  27           HA       MET  27  10.883   1.807 -14.499
  204   1HB   MET  27          1HB       MET  27  11.528   4.617 -14.667
  205   2HB   MET  27          2HB       MET  27  11.592   4.189 -12.969
  206   1HG   MET  27          1HG       MET  27  13.311   2.591 -13.291
  207   2HG   MET  27          2HG       MET  27  12.931   2.370 -14.988
  208   1HE   MET  27          1HE       MET  27  14.607   5.145 -16.840
  209   2HE   MET  27          2HE       MET  27  13.637   3.653 -16.832
  210   3HE   MET  27          3HE       MET  27  12.883   5.207 -16.402
  211    H    ASN  28           H        ASN  28   9.071   0.756 -13.437
  212    HA   ASN  28           HA       ASN  28   7.314   1.738 -11.740
  213   1HB   ASN  28          1HB       ASN  28   8.193  -0.795 -12.356
  214   2HB   ASN  28          2HB       ASN  28   8.736  -0.694 -10.692
  215   1HD2  ASN  28          1HD2      ASN  28   7.076  -2.530 -10.794
  216   2HD2  ASN  28          2HD2      ASN  28   5.450  -2.133 -10.346
  217    H    THR  29           H        THR  29  10.737   0.805 -10.948
  218    HA   THR  29           HA       THR  29  11.903   1.044  -9.021
  219    HB   THR  29           HB       THR  29  12.226   3.547  -8.601
  220    HG1  THR  29           1HG      THR  29  10.289   3.671 -10.787
  221   1HG2  THR  29          1HG2      THR  29  12.804   4.138 -11.012
  222   2HG2  THR  29          2HG2      THR  29  13.517   2.602 -10.465
  223   3HG2  THR  29          3HG2      THR  29  12.074   2.592 -11.507
  Start of MODEL   12
    1    H    HIS   1           H        HIS   1 -23.342  16.852 -31.146
    2    HA   HIS   1           HA       HIS   1 -20.966  16.564 -31.545
    3   1HB   HIS   1          1HB       HIS   1 -22.591  14.248 -32.627
    4   2HB   HIS   1          2HB       HIS   1 -20.990  14.167 -31.921
    5    HD1  HIS   1           1HD      HIS   1 -23.121  12.444 -30.650
    6    HD2  HIS   1           2HD      HIS   1 -22.397  16.396 -29.448
    7    HE1  HIS   1           1HE      HIS   1 -24.018  12.643 -28.270
    8    H    SER   2           H        SER   2 -19.446  17.188 -32.987
    9    HA   SER   2           HA       SER   2 -19.298  16.154 -35.527
   10   1HB   SER   2          1HB       SER   2 -21.076  18.453 -35.331
   11   2HB   SER   2          2HB       SER   2 -19.695  18.857 -36.331
   12    HG   SER   2           HG       SER   2 -21.002  16.347 -36.763
   13    H    GLN   3           H        GLN   3 -17.609  17.571 -36.901
   14    HA   GLN   3           HA       GLN   3 -15.652  18.504 -37.028
   15   1HB   GLN   3          1HB       GLN   3 -17.042  20.240 -35.374
   16   2HB   GLN   3          2HB       GLN   3 -15.615  19.906 -34.413
   17   1HG   GLN   3          1HG       GLN   3 -14.193  20.966 -35.891
   18   2HG   GLN   3          2HG       GLN   3 -15.079  20.425 -37.303
   19   1HE2  GLN   3          1HE2      GLN   3 -14.300  22.866 -37.504
   20   2HE2  GLN   3          2HE2      GLN   3 -15.542  24.041 -37.222
   21    H    GLY   4           H        GLY   4 -13.748  17.408 -36.793
   22   1HA   GLY   4          1HA       GLY   4 -13.222  16.167 -34.158
   23   2HA   GLY   4          2HA       GLY   4 -12.912  15.367 -35.686
   24    H    THR   5           H        THR   5 -11.494  16.774 -37.302
   25    HA   THR   5           HA       THR   5  -9.422  17.495 -37.705
   26    HB   THR   5           HB       THR   5  -8.966  19.717 -36.805
   27    HG1  THR   5           1HG      THR   5  -9.231  19.177 -34.552
   28   1HG2  THR   5          1HG2      THR   5 -11.998  19.330 -36.628
   29   2HG2  THR   5          2HG2      THR   5 -11.137  20.856 -36.940
   30   3HG2  THR   5          3HG2      THR   5 -11.120  19.559 -38.159
   31    H    PHE   6           H        PHE   6  -7.149  17.888 -36.822
   32    HA   PHE   6           HA       PHE   6  -6.693  15.795 -34.865
   33   1HB   PHE   6          1HB       PHE   6  -5.280  15.625 -36.791
   34   2HB   PHE   6          2HB       PHE   6  -5.169  17.364 -36.976
   35    HD1  PHE   6           1HD      PHE   6  -3.367  18.568 -36.045
   36    HD2  PHE   6           2HD      PHE   6  -3.977  14.521 -34.924
   37    HE1  PHE   6           1HE      PHE   6  -1.131  18.547 -34.904
   38    HE2  PHE   6           2HE      PHE   6  -1.741  14.500 -33.783
   39    HZ   PHE   6           HZ       PHE   6  -0.345  16.513 -33.786
   40    H    THR   7           H        THR   7  -6.145  19.317 -35.385
   41    HA   THR   7           HA       THR   7  -4.477  19.880 -33.295
   42    HB   THR   7           HB       THR   7  -5.609  21.350 -35.183
   43    HG1  THR   7           1HG      THR   7  -4.041  22.009 -33.486
   44   1HG2  THR   7          1HG2      THR   7  -7.412  22.786 -34.345
   45   2HG2  THR   7          2HG2      THR   7  -7.960  21.097 -34.221
   46   3HG2  THR   7          3HG2      THR   7  -7.392  21.957 -32.770
   47    H    SER   8           H        SER   8  -5.224  21.249 -31.268
   48    HA   SER   8           HA       SER   8  -6.038  19.583 -29.395
   49   1HB   SER   8          1HB       SER   8  -5.418  22.202 -29.409
   50   2HB   SER   8          2HB       SER   8  -7.149  22.374 -29.200
   51    HG   SER   8           HG       SER   8  -6.793  20.667 -27.402
   52    H    ASP   9           H        ASP   9  -7.730  18.126 -29.767
   53    HA   ASP   9           HA       ASP   9 -10.318  19.102 -29.360
   54   1HB   ASP   9          1HB       ASP   9  -9.829  19.543 -31.894
   55   2HB   ASP   9          2HB       ASP   9  -9.916  17.802 -32.082
   56    HD2  ASP   9           HD       ASP   9 -11.783  19.145 -33.459
   57    H    TYR  10           H        TYR  10  -8.243  16.515 -30.830
   58    HA   TYR  10           HA       TYR  10  -9.786  14.314 -30.530
   59   1HB   TYR  10          1HB       TYR  10  -7.390  13.302 -29.917
   60   2HB   TYR  10          2HB       TYR  10  -7.588  14.085 -31.472
   61    HD1  TYR  10           1HD      TYR  10  -6.980  15.362 -27.987
   62    HD2  TYR  10           2HD      TYR  10  -5.688  15.267 -32.065
   63    HE1  TYR  10           1HE      TYR  10  -5.082  16.960 -27.431
   64    HE2  TYR  10           2HE      TYR  10  -3.795  16.865 -31.495
   65    HH   TYR  10           HH       TYR  10  -3.565  18.739 -29.488
   66    H    SER  11           H        SER  11  -9.335  12.452 -28.851
   67    HA   SER  11           HA       SER  11  -8.526  12.662 -26.385
   68   1HB   SER  11          1HB       SER  11 -10.904  14.422 -26.688
   69   2HB   SER  11          2HB       SER  11 -10.988  13.330 -25.320
   70    HG   SER  11           HG       SER  11  -9.864  15.569 -25.128
   71    H    LYS  12           H        LYS  12 -11.868  12.238 -27.781
   72    HA   LYS  12           HA       LYS  12 -12.773  10.142 -26.421
   73   1HB   LYS  12          1HB       LYS  12 -13.151  11.210 -29.102
   74   2HB   LYS  12          2HB       LYS  12 -13.391   9.475 -29.072
   75   1HG   LYS  12          1HG       LYS  12 -14.845   9.901 -26.941
   76   2HG   LYS  12          2HG       LYS  12 -14.824  11.587 -27.417
   77   1HD   LYS  12          1HD       LYS  12 -16.551  11.152 -28.819
   78   2HD   LYS  12          2HD       LYS  12 -15.454  10.199 -29.799
   79   1HE   LYS  12          1HE       LYS  12 -15.942   8.226 -28.207
   80   2HE   LYS  12          2HE       LYS  12 -17.224   9.205 -27.523
   81   1HZ   LYS  12          1HZ       LYS  12 -17.563   9.324 -30.273
   82   2HZ   LYS  12          2HZ       LYS  12 -17.249   7.757 -29.959
   83    H    TYR  13           H        TYR  13 -10.602   9.815 -29.319
   84    HA   TYR  13           HA       TYR  13 -10.278   7.043 -29.002
   85   1HB   TYR  13          1HB       TYR  13  -8.433   9.204 -30.197
   86   2HB   TYR  13          2HB       TYR  13  -8.413   7.508 -30.639
   87    HD1  TYR  13           1HD      TYR  13 -10.308   6.532 -31.947
   88    HD2  TYR  13           2HD      TYR  13 -10.037  10.726 -31.146
   89    HE1  TYR  13           1HE      TYR  13 -11.989   7.001 -33.796
   90    HE2  TYR  13           2HE      TYR  13 -11.720  11.181 -32.996
   91    HH   TYR  13           HH       TYR  13 -12.487  10.098 -35.035
   92    H    LEU  14           H        LEU  14  -8.009   9.791 -28.258
   93    HA   LEU  14           HA       LEU  14  -5.973   8.370 -27.183
   94   1HB   LEU  14          1HB       LEU  14  -7.096  11.088 -26.732
   95   2HB   LEU  14          2HB       LEU  14  -5.899  10.509 -25.591
   96    HG   LEU  14           HG       LEU  14  -4.900  11.860 -27.371
   97   1HD1  LEU  14          1HD1      LEU  14  -3.033  10.672 -27.175
   98   2HD1  LEU  14          2HD1      LEU  14  -4.009   9.378 -26.440
   99   3HD1  LEU  14          3HD1      LEU  14  -3.683   9.362 -28.190
  100   1HD2  LEU  14          1HD2      LEU  14  -4.960  11.342 -29.651
  101   2HD2  LEU  14          2HD2      LEU  14  -5.572   9.696 -29.360
  102   3HD2  LEU  14          3HD2      LEU  14  -6.635  11.100 -29.101
  103    H    ASP  15           H        ASP  15  -5.739   6.951 -25.543
  104    HA   ASP  15           HA       ASP  15  -7.214   7.371 -23.142
  105   1HB   ASP  15          1HB       ASP  15  -8.453   5.781 -25.033
  106   2HB   ASP  15          2HB       ASP  15  -7.522   4.581 -24.158
  107    HD2  ASP  15           HD       ASP  15 -10.120   3.957 -23.060
  108    H    SER  16           H        SER  16  -6.548   5.497 -21.511
  109    HA   SER  16           HA       SER  16  -3.938   5.428 -21.141
  110   1HB   SER  16          1HB       SER  16  -5.462   4.539 -19.485
  111   2HB   SER  16          2HB       SER  16  -5.977   3.248 -20.551
  112    HG   SER  16           HG       SER  16  -3.208   3.288 -20.111
  113    H    ARG  17           H        ARG  17  -2.105   4.334 -21.900
  114    HA   ARG  17           HA       ARG  17  -2.202   1.915 -23.202
  115   1HB   ARG  17          1HB       ARG  17  -3.182   3.826 -24.920
  116   2HB   ARG  17          2HB       ARG  17  -1.474   3.933 -25.296
  117   1HG   ARG  17          1HG       ARG  17  -1.402   1.471 -25.711
  118   2HG   ARG  17          2HG       ARG  17  -3.104   1.347 -25.310
  119   1HD   ARG  17          1HD       ARG  17  -2.610   3.422 -27.348
  120   2HD   ARG  17          2HD       ARG  17  -2.029   1.851 -27.864
  121    HE   ARG  17           HE       ARG  17  -4.835   2.599 -27.326
  122   1HH1  ARG  17          2HH2      ARG  17  -2.544  -0.037 -27.924
  123   2HH1  ARG  17          1HH2      ARG  17  -3.770  -1.158 -28.412
  124   1HH2  ARG  17          1HH       ARG  17  -6.062  -0.457 -28.433
  125    H    ARG  18           H        ARG  18  -0.581   5.167 -23.440
  126    HA   ARG  18           HA       ARG  18   1.900   4.461 -24.016
  127   1HB   ARG  18          1HB       ARG  18   0.638   6.643 -22.489
  128   2HB   ARG  18          2HB       ARG  18   2.272   6.340 -21.933
  129   1HG   ARG  18          1HG       ARG  18   2.971   7.596 -23.694
  130   2HG   ARG  18          2HG       ARG  18   2.554   6.230 -24.710
  131   1HD   ARG  18          1HD       ARG  18   0.611   7.219 -25.492
  132   2HD   ARG  18          2HD       ARG  18   0.261   8.000 -23.963
  133    HE   ARG  18           HE       ARG  18   2.608   9.062 -25.410
  134   1HH1  ARG  18          2HH2      ARG  18  -0.855   9.402 -24.739
  135   2HH1  ARG  18          1HH2      ARG  18  -0.913  11.062 -25.231
  136   1HH2  ARG  18          1HH       ARG  18   1.089  12.129 -26.004
  137    H    ALA  19           H        ALA  19   0.555   4.604 -20.632
  138    HA   ALA  19           HA       ALA  19   2.847   3.582 -19.401
  139   1HB   ALA  19          1HB       ALA  19   1.546   3.605 -17.461
  140   2HB   ALA  19          2HB       ALA  19   0.710   4.804 -18.477
  141   3HB   ALA  19          3HB       ALA  19   0.059   3.154 -18.330
  142    H    GLN  20           H        GLN  20   0.982   1.484 -17.940
  143    HA   GLN  20           HA       GLN  20   0.573  -0.652 -18.026
  144   1HB   GLN  20          1HB       GLN  20  -0.497  -0.014 -20.311
  145   2HB   GLN  20          2HB       GLN  20   0.941  -0.700 -21.041
  146   1HG   GLN  20          1HG       GLN  20  -0.373  -2.609 -20.986
  147   2HG   GLN  20          2HG       GLN  20   0.382  -2.760 -19.412
  148   1HE2  GLN  20          1HE2      GLN  20  -0.816  -2.771 -17.636
  149   2HE2  GLN  20          2HE2      GLN  20  -2.521  -2.475 -17.547
  150    H    ASP  21           H        ASP  21   1.944  -2.213 -20.520
  151    HA   ASP  21           HA       ASP  21   3.981  -3.289 -19.114
  152   1HB   ASP  21          1HB       ASP  21   3.116  -4.245 -21.210
  153   2HB   ASP  21          2HB       ASP  21   3.712  -2.876 -22.127
  154    HD2  ASP  21           HD       ASP  21   4.410  -5.171 -22.963
  155    H    PHE  22           H        PHE  22   3.760  -0.162 -20.666
  156    HA   PHE  22           HA       PHE  22   6.566   0.194 -21.073
  157   1HB   PHE  22          1HB       PHE  22   4.153   1.341 -21.919
  158   2HB   PHE  22          2HB       PHE  22   4.702   2.529 -20.754
  159    HD1  PHE  22           1HD      PHE  22   4.363   2.868 -23.780
  160    HD2  PHE  22           2HD      PHE  22   7.729   1.934 -21.370
  161    HE1  PHE  22           1HE      PHE  22   5.880   3.866 -25.512
  162    HE2  PHE  22           2HE      PHE  22   9.246   2.931 -23.103
  163    HZ   PHE  22           HZ       PHE  22   8.304   3.885 -25.153
  164    H    VAL  23           H        VAL  23   4.288   0.572 -18.416
  165    HA   VAL  23           HA       VAL  23   5.510   2.592 -16.979
  166    HB   VAL  23           HB       VAL  23   4.039   0.114 -16.062
  167   1HG1  VAL  23          1HG1      VAL  23   4.672   0.711 -13.995
  168   2HG1  VAL  23          2HG1      VAL  23   5.318   2.273 -14.551
  169   3HG1  VAL  23          3HG1      VAL  23   3.584   2.106 -14.189
  170   1HG2  VAL  23          1HG2      VAL  23   3.017   1.988 -17.657
  171   2HG2  VAL  23          2HG2      VAL  23   2.066   1.242 -16.349
  172   3HG2  VAL  23          3HG2      VAL  23   2.812   2.840 -16.107
  173    H    GLN  24           H        GLN  24   6.656  -0.580 -17.814
  174    HA   GLN  24           HA       GLN  24   8.377  -0.793 -15.554
  175   1HB   GLN  24          1HB       GLN  24   7.407  -2.529 -17.588
  176   2HB   GLN  24          2HB       GLN  24   9.147  -2.482 -17.798
  177   1HG   GLN  24          1HG       GLN  24   8.851  -2.666 -15.015
  178   2HG   GLN  24          2HG       GLN  24   7.553  -3.678 -15.617
  179   1HE2  GLN  24          1HE2      GLN  24  10.878  -3.369 -15.043
  180   2HE2  GLN  24          2HE2      GLN  24  11.438  -4.846 -15.754
  181    H    TRP  25           H        TRP  25   8.414   1.515 -17.723
  182    HA   TRP  25           HA       TRP  25  11.334   1.469 -17.985
  183   1HB   TRP  25          1HB       TRP  25  10.399   0.820 -20.141
  184   2HB   TRP  25          2HB       TRP  25   9.372   2.240 -20.152
  185    HD1  TRP  25           HD       TRP  25  13.230   1.580 -19.957
  186    HE1  TRP  25           1HE      TRP  25  14.543   3.391 -21.357
  187    HE3  TRP  25           3HE      TRP  25   9.128   4.254 -21.327
  188    HZ2  TRP  25           2HZ      TRP  25  13.736   5.688 -22.846
  189    HZ3  TRP  25           3HZ      TRP  25   9.478   6.268 -22.754
  190    HH2  TRP  25           HH       TRP  25  11.685   6.997 -23.511
  191    H    LEU  26           H        LEU  26   8.238   3.354 -18.153
  192    HA   LEU  26           HA       LEU  26   9.533   5.832 -17.680
  193   1HB   LEU  26          1HB       LEU  26   6.624   5.082 -17.364
  194   2HB   LEU  26          2HB       LEU  26   7.277   6.705 -17.468
  195    HG   LEU  26           HG       LEU  26   6.419   6.318 -19.593
  196   1HD1  LEU  26          1HD1      LEU  26   8.633   7.235 -19.785
  197   2HD1  LEU  26          2HD1      LEU  26   9.363   5.614 -19.713
  198   3HD1  LEU  26          3HD1      LEU  26   8.372   6.082 -21.115
  199   1HD2  LEU  26          1HD2      LEU  26   7.769   3.675 -20.004
  200   2HD2  LEU  26          2HD2      LEU  26   6.267   3.754 -19.052
  201   3HD2  LEU  26          3HD2      LEU  26   6.284   4.330 -20.736
  202    H    MET  27           H        MET  27   8.317   3.192 -15.672
  203    HA   MET  27           HA       MET  27   9.587   4.304 -13.428
  204   1HB   MET  27          1HB       MET  27   6.597   4.588 -13.764
  205   2HB   MET  27          2HB       MET  27   7.166   4.135 -12.169
  206   1HG   MET  27          1HG       MET  27   8.896   6.163 -12.613
  207   2HG   MET  27          2HG       MET  27   7.624   6.696 -13.694
  208   1HE   MET  27          1HE       MET  27   5.694   8.138 -12.879
  209   2HE   MET  27          2HE       MET  27   5.027   6.488 -12.881
  210   3HE   MET  27          3HE       MET  27   4.691   7.582 -11.518
  211    H    ASN  28           H        ASN  28  10.501   2.097 -13.978
  212    HA   ASN  28           HA       ASN  28   8.820  -0.134 -13.560
  213   1HB   ASN  28          1HB       ASN  28  10.927  -1.440 -13.760
  214   2HB   ASN  28          2HB       ASN  28  10.846  -0.226 -15.021
  215   1HD2  ASN  28          1HD2      ASN  28  13.227  -1.277 -14.443
  216   2HD2  ASN  28          2HD2      ASN  28  14.258  -0.158 -13.615
  217    H    THR  29           H        THR  29   9.359  -1.813 -11.782
  218    HA   THR  29           HA       THR  29   9.220  -2.187  -9.564
  219    HB   THR  29           HB       THR  29  11.516  -1.804  -8.500
  220    HG1  THR  29           1HG      THR  29  11.733   0.246  -9.829
  221   1HG2  THR  29          1HG2      THR  29  12.820  -2.882 -10.553
  222   2HG2  THR  29          2HG2      THR  29  11.555  -3.829  -9.732
  223   3HG2  THR  29          3HG2      THR  29  11.195  -3.007 -11.270
  Start of MODEL   13
    1    H    HIS   1           H        HIS   1 -13.869  -3.195  -8.188
    2    HA   HIS   1           HA       HIS   1 -14.001  -0.766  -9.810
    3   1HB   HIS   1          1HB       HIS   1 -12.171  -1.146  -8.034
    4   2HB   HIS   1          2HB       HIS   1 -11.505  -2.327  -9.144
    5    HD1  HIS   1           1HD      HIS   1  -9.682  -1.369 -10.539
    6    HD2  HIS   1           2HD      HIS   1 -12.621   1.484  -9.636
    7    HE1  HIS   1           1HE      HIS   1  -8.922   0.809 -11.629
    8    H    SER   2           H        SER   2 -15.521  -2.270 -11.150
    9    HA   SER   2           HA       SER   2 -13.877  -3.988 -12.828
   10   1HB   SER   2          1HB       SER   2 -16.172  -4.659 -11.584
   11   2HB   SER   2          2HB       SER   2 -16.879  -3.961 -13.027
   12    HG   SER   2           HG       SER   2 -14.730  -5.821 -13.341
   13    H    GLN   3           H        GLN   3 -14.267  -3.891 -15.215
   14    HA   GLN   3           HA       GLN   3 -14.318  -2.780 -17.081
   15   1HB   GLN   3          1HB       GLN   3 -16.860  -2.023 -15.735
   16   2HB   GLN   3          2HB       GLN   3 -16.388  -0.955 -17.043
   17   1HG   GLN   3          1HG       GLN   3 -15.895  -3.393 -18.212
   18   2HG   GLN   3          2HG       GLN   3 -17.211  -3.827 -17.140
   19   1HE2  GLN   3          1HE2      GLN   3 -16.525  -2.908 -20.158
   20   2HE2  GLN   3          2HE2      GLN   3 -17.973  -2.081 -20.626
   21    H    GLY   4           H        GLY   4 -14.305  -0.433 -18.143
   22   1HA   GLY   4          1HA       GLY   4 -12.527   1.174 -16.460
   23   2HA   GLY   4          2HA       GLY   4 -12.715   1.265 -18.200
   24    H    THR   5           H        THR   5 -14.860   1.557 -15.268
   25    HA   THR   5           HA       THR   5 -16.844   3.076 -16.255
   26    HB   THR   5           HB       THR   5 -17.022   3.960 -13.914
   27    HG1  THR   5           1HG      THR   5 -14.410   2.637 -13.722
   28   1HG2  THR   5          1HG2      THR   5 -15.816   1.255 -13.424
   29   2HG2  THR   5          2HG2      THR   5 -17.394   1.898 -12.908
   30   3HG2  THR   5          3HG2      THR   5 -17.175   1.305 -14.572
   31    H    PHE   6           H        PHE   6 -17.355   5.404 -16.177
   32    HA   PHE   6           HA       PHE   6 -14.959   6.960 -16.857
   33   1HB   PHE   6          1HB       PHE   6 -16.993   8.246 -18.135
   34   2HB   PHE   6          2HB       PHE   6 -16.162   6.898 -18.884
   35    HD1  PHE   6           1HD      PHE   6 -19.283   8.090 -17.526
   36    HD2  PHE   6           2HD      PHE   6 -17.200   4.621 -18.802
   37    HE1  PHE   6           1HE      PHE   6 -21.458   6.851 -17.706
   38    HE2  PHE   6           2HE      PHE   6 -19.375   3.381 -18.982
   39    HZ   PHE   6           HZ       PHE   6 -21.478   4.511 -18.432
   40    H    THR   7           H        THR   7 -15.668   6.825 -14.178
   41    HA   THR   7           HA       THR   7 -16.512   9.565 -13.728
   42    HB   THR   7           HB       THR   7 -18.553   7.897 -13.716
   43    HG1  THR   7           1HG      THR   7 -19.334   9.467 -12.318
   44   1HG2  THR   7          1HG2      THR   7 -16.915   6.599 -11.793
   45   2HG2  THR   7          2HG2      THR   7 -18.125   7.492 -10.841
   46   3HG2  THR   7          3HG2      THR   7 -18.650   6.313 -12.068
   47    H    SER   8           H        SER   8 -16.500   9.824 -11.101
   48    HA   SER   8           HA       SER   8 -15.212   9.979  -9.362
   49   1HB   SER   8          1HB       SER   8 -15.666   7.482  -9.259
   50   2HB   SER   8          2HB       SER   8 -14.135   7.214 -10.069
   51    HG   SER   8           HG       SER   8 -14.375   7.281  -7.523
   52    H    ASP   9           H        ASP   9 -12.708   9.772  -8.591
   53    HA   ASP   9           HA       ASP   9 -11.253  11.455 -10.014
   54   1HB   ASP   9          1HB       ASP   9 -10.405   9.066  -8.340
   55   2HB   ASP   9          2HB       ASP   9  -9.195  10.112  -9.055
   56    HD2  ASP   9           HD       ASP   9 -10.039  12.798  -6.902
   57    H    TYR  10           H        TYR  10 -10.877  11.328 -12.248
   58    HA   TYR  10           HA       TYR  10  -9.524   8.918 -13.205
   59   1HB   TYR  10          1HB       TYR  10 -11.127   8.726 -15.007
   60   2HB   TYR  10          2HB       TYR  10 -12.134   9.075 -13.616
   61    HD1  TYR  10           1HD      TYR  10 -11.162  10.131 -16.904
   62    HD2  TYR  10           2HD      TYR  10 -12.848  11.519 -13.225
   63    HE1  TYR  10           1HE      TYR  10 -12.128  12.155 -18.102
   64    HE2  TYR  10           2HE      TYR  10 -13.808  13.538 -14.435
   65    HH   TYR  10           HH       TYR  10 -12.788  14.644 -17.182
   66    H    SER  11           H        SER  11  -9.290   9.618 -15.892
   67    HA   SER  11           HA       SER  11  -8.112  10.813 -17.266
   68   1HB   SER  11          1HB       SER  11  -8.392  13.173 -17.362
   69   2HB   SER  11          2HB       SER  11  -9.866  12.580 -16.623
   70    HG   SER  11           HG       SER  11  -8.258  14.436 -15.640
   71    H    LYS  12           H        LYS  12  -6.443   9.420 -15.851
   72    HA   LYS  12           HA       LYS  12  -4.072  10.726 -15.779
   73   1HB   LYS  12          1HB       LYS  12  -3.719  10.974 -13.258
   74   2HB   LYS  12          2HB       LYS  12  -4.641  12.221 -14.075
   75   1HG   LYS  12          1HG       LYS  12  -6.734  10.716 -13.437
   76   2HG   LYS  12          2HG       LYS  12  -5.645  10.013 -12.257
   77   1HD   LYS  12          1HD       LYS  12  -5.179  12.719 -11.879
   78   2HD   LYS  12          2HD       LYS  12  -6.875  12.723 -12.319
   79   1HE   LYS  12          1HE       LYS  12  -7.343  12.143 -10.173
   80   2HE   LYS  12          2HE       LYS  12  -6.666  10.564 -10.522
   81   1HZ   LYS  12          1HZ       LYS  12  -4.425  11.712  -9.987
   82   2HZ   LYS  12          2HZ       LYS  12  -5.318  12.866  -9.263
   83    H    TYR  13           H        TYR  13  -6.114   8.415 -13.892
   84    HA   TYR  13           HA       TYR  13  -3.882   6.513 -14.031
   85   1HB   TYR  13          1HB       TYR  13  -6.288   7.100 -12.265
   86   2HB   TYR  13          2HB       TYR  13  -5.772   5.429 -12.359
   87    HD1  TYR  13           1HD      TYR  13  -3.768   8.599 -12.255
   88    HD2  TYR  13           2HD      TYR  13  -4.754   4.908 -10.330
   89    HE1  TYR  13           1HE      TYR  13  -1.997   9.041 -10.484
   90    HE2  TYR  13           2HE      TYR  13  -2.981   5.362  -8.566
   91    HH   TYR  13           HH       TYR  13  -0.566   7.314  -8.901
   92    H    LEU  14           H        LEU  14  -4.755   6.541 -16.471
   93    HA   LEU  14           HA       LEU  14  -6.855   4.491 -16.614
   94   1HB   LEU  14          1HB       LEU  14  -6.107   6.603 -18.640
   95   2HB   LEU  14          2HB       LEU  14  -7.309   5.349 -18.874
   96    HG   LEU  14           HG       LEU  14  -7.472   7.464 -16.711
   97   1HD1  LEU  14          1HD1      LEU  14  -7.699   8.774 -18.588
   98   2HD1  LEU  14          2HD1      LEU  14  -8.414   7.462 -19.556
   99   3HD1  LEU  14          3HD1      LEU  14  -9.385   8.278 -18.308
  100   1HD2  LEU  14          1HD2      LEU  14  -9.176   5.160 -17.513
  101   2HD2  LEU  14          2HD2      LEU  14  -8.883   5.877 -15.910
  102   3HD2  LEU  14          3HD2      LEU  14 -10.000   6.669 -17.048
  103    H    ASP  15           H        ASP  15  -6.569   3.233 -18.866
  104    HA   ASP  15           HA       ASP  15  -4.419   1.634 -18.563
  105   1HB   ASP  15          1HB       ASP  15  -6.363   2.229 -20.737
  106   2HB   ASP  15          2HB       ASP  15  -4.874   1.499 -21.301
  107    HD2  ASP  15           HD       ASP  15  -6.665  -0.072 -21.800
  108    H    SER  16           H        SER  16  -4.879   4.305 -21.008
  109    HA   SER  16           HA       SER  16  -3.484   5.464 -22.204
  110   1HB   SER  16          1HB       SER  16  -2.156   5.276 -19.539
  111   2HB   SER  16          2HB       SER  16  -1.125   5.822 -20.847
  112    HG   SER  16           HG       SER  16  -2.044   7.734 -20.638
  113    H    ARG  17           H        ARG  17  -2.894   4.318 -24.040
  114    HA   ARG  17           HA       ARG  17  -1.637   1.975 -24.166
  115   1HB   ARG  17          1HB       ARG  17  -2.392   3.970 -25.989
  116   2HB   ARG  17          2HB       ARG  17  -0.667   3.828 -26.267
  117   1HG   ARG  17          1HG       ARG  17  -2.279   1.285 -26.045
  118   2HG   ARG  17          2HG       ARG  17  -2.431   2.228 -27.515
  119   1HD   ARG  17          1HD       ARG  17  -0.473   1.359 -28.266
  120   2HD   ARG  17          2HD       ARG  17   0.371   2.112 -26.927
  121    HE   ARG  17           HE       ARG  17  -0.882  -0.227 -25.911
  122   1HH1  ARG  17          2HH2      ARG  17   1.676   0.611 -28.214
  123   2HH1  ARG  17          1HH2      ARG  17   2.545  -0.869 -27.979
  124   1HH2  ARG  17          1HH       ARG  17   1.695  -2.495 -26.437
  125    H    ARG  18           H        ARG  18  -0.070   5.251 -24.160
  126    HA   ARG  18           HA       ARG  18   2.478   4.573 -24.559
  127   1HB   ARG  18          1HB       ARG  18   1.053   6.787 -23.389
  128   2HB   ARG  18          2HB       ARG  18   2.423   6.455 -22.348
  129   1HG   ARG  18          1HG       ARG  18   3.920   6.481 -24.399
  130   2HG   ARG  18          2HG       ARG  18   2.533   6.953 -25.360
  131   1HD   ARG  18          1HD       ARG  18   2.679   8.699 -23.049
  132   2HD   ARG  18          2HD       ARG  18   4.260   8.643 -23.801
  133    HE   ARG  18           HE       ARG  18   1.966   9.986 -24.851
  134   1HH1  ARG  18          2HH2      ARG  18   4.620   7.921 -25.969
  135   2HH1  ARG  18          1HH2      ARG  18   4.612   8.570 -27.575
  136   1HH2  ARG  18          1HH       ARG  18   3.038  10.286 -28.141
  137    H    ALA  19           H        ALA  19   0.896   4.799 -21.280
  138    HA   ALA  19           HA       ALA  19   3.073   3.728 -19.890
  139   1HB   ALA  19          1HB       ALA  19   0.210   3.434 -18.982
  140   2HB   ALA  19          2HB       ALA  19   1.659   3.840 -18.032
  141   3HB   ALA  19          3HB       ALA  19   0.939   5.051 -19.119
  142    H    GLN  20           H        GLN  20   1.040   1.737 -18.499
  143    HA   GLN  20           HA       GLN  20   0.546  -0.382 -18.568
  144   1HB   GLN  20          1HB       GLN  20  -0.323   0.235 -20.943
  145   2HB   GLN  20          2HB       GLN  20   1.136  -0.528 -21.544
  146   1HG   GLN  20          1HG       GLN  20  -0.044  -2.476 -21.470
  147   2HG   GLN  20          2HG       GLN  20   0.226  -2.429 -19.739
  148   1HE2  GLN  20          1HE2      GLN  20  -1.995  -3.496 -21.332
  149   2HE2  GLN  20          2HE2      GLN  20  -3.445  -2.749 -20.750
  150    H    ASP  21           H        ASP  21   2.035  -2.064 -20.909
  151    HA   ASP  21           HA       ASP  21   3.919  -3.173 -19.327
  152   1HB   ASP  21          1HB       ASP  21   3.970  -2.830 -22.363
  153   2HB   ASP  21          2HB       ASP  21   4.982  -3.963 -21.488
  154    HD2  ASP  21           HD       ASP  21   1.893  -5.570 -22.762
  155    H    PHE  22           H        PHE  22   3.936  -0.086 -20.972
  156    HA   PHE  22           HA       PHE  22   6.775   0.153 -21.182
  157   1HB   PHE  22          1HB       PHE  22   4.422   1.399 -22.156
  158   2HB   PHE  22          2HB       PHE  22   5.074   2.602 -21.061
  159    HD1  PHE  22           1HD      PHE  22   4.861   2.105 -24.310
  160    HD2  PHE  22           2HD      PHE  22   7.947   2.378 -21.410
  161    HE1  PHE  22           1HE      PHE  22   6.466   2.854 -26.088
  162    HE2  PHE  22           2HE      PHE  22   9.552   3.127 -23.188
  163    HZ   PHE  22           HZ       PHE  22   8.792   3.356 -25.506
  164    H    VAL  23           H        VAL  23   4.333   0.683 -18.704
  165    HA   VAL  23           HA       VAL  23   5.526   2.695 -17.232
  166    HB   VAL  23           HB       VAL  23   3.905   0.297 -16.355
  167   1HG1  VAL  23          1HG1      VAL  23   3.361   1.594 -14.345
  168   2HG1  VAL  23          2HG1      VAL  23   5.112   1.292 -14.458
  169   3HG1  VAL  23          3HG1      VAL  23   4.456   2.893 -14.876
  170   1HG2  VAL  23          1HG2      VAL  23   1.999   1.468 -16.834
  171   2HG2  VAL  23          2HG2      VAL  23   2.768   3.051 -16.570
  172   3HG2  VAL  23          3HG2      VAL  23   3.069   2.157 -18.079
  173    H    GLN  24           H        GLN  24   6.606  -0.537 -17.908
  174    HA   GLN  24           HA       GLN  24   8.142  -0.771 -15.525
  175   1HB   GLN  24          1HB       GLN  24   7.412  -2.448 -17.791
  176   2HB   GLN  24          2HB       GLN  24   9.136  -2.561 -17.502
  177   1HG   GLN  24          1HG       GLN  24   8.397  -2.796 -14.951
  178   2HG   GLN  24          2HG       GLN  24   6.854  -3.259 -15.640
  179   1HE2  GLN  24          1HE2      GLN  24   6.558  -5.244 -16.391
  180   2HE2  GLN  24          2HE2      GLN  24   7.771  -6.469 -16.554
  181    H    TRP  25           H        TRP  25   8.422   1.492 -17.746
  182    HA   TRP  25           HA       TRP  25  11.354   1.343 -17.781
  183   1HB   TRP  25          1HB       TRP  25  10.577   0.758 -19.997
  184   2HB   TRP  25          2HB       TRP  25   9.550   2.177 -20.057
  185    HD1  TRP  25           HD       TRP  25  13.390   1.521 -19.627
  186    HE1  TRP  25           1HE      TRP  25  14.784   3.349 -20.922
  187    HE3  TRP  25           3HE      TRP  25   9.376   4.201 -21.226
  188    HZ2  TRP  25           2HZ      TRP  25  14.067   5.659 -22.437
  189    HZ3  TRP  25           3HZ      TRP  25   9.811   6.230 -22.608
  190    HH2  TRP  25           HH       TRP  25  12.059   6.970 -23.217
  191    H    LEU  26           H        LEU  26   8.369   3.377 -18.158
  192    HA   LEU  26           HA       LEU  26   9.753   5.775 -17.523
  193   1HB   LEU  26          1HB       LEU  26   6.830   5.057 -17.726
  194   2HB   LEU  26          2HB       LEU  26   7.401   6.671 -17.355
  195    HG   LEU  26           HG       LEU  26   7.093   6.882 -19.601
  196   1HD1  LEU  26          1HD1      LEU  26   9.449   7.380 -19.137
  197   2HD1  LEU  26          2HD1      LEU  26   9.884   5.702 -19.541
  198   3HD1  LEU  26          3HD1      LEU  26   9.215   6.774 -20.794
  199   1HD2  LEU  26          1HD2      LEU  26   7.890   3.977 -19.925
  200   2HD2  LEU  26          2HD2      LEU  26   6.255   4.672 -20.036
  201   3HD2  LEU  26          3HD2      LEU  26   7.477   5.073 -21.267
  202    H    MET  27           H        MET  27   8.182   3.185 -15.705
  203    HA   MET  27           HA       MET  27   9.115   4.448 -13.301
  204   1HB   MET  27          1HB       MET  27   6.198   3.978 -14.000
  205   2HB   MET  27          2HB       MET  27   6.688   3.762 -12.331
  206   1HG   MET  27          1HG       MET  27   7.271   6.293 -13.942
  207   2HG   MET  27          2HG       MET  27   5.870   6.109 -12.906
  208   1HE   MET  27          1HE       MET  27   8.937   7.515 -13.349
  209   2HE   MET  27          2HE       MET  27   9.761   7.698 -11.782
  210   3HE   MET  27          3HE       MET  27   9.996   6.219 -12.743
  211    H    ASN  28           H        ASN  28  10.358   2.320 -14.324
  212    HA   ASN  28           HA       ASN  28   9.251  -0.151 -13.927
  213   1HB   ASN  28          1HB       ASN  28  11.516   0.526 -15.029
  214   2HB   ASN  28          2HB       ASN  28  12.189   0.513 -13.412
  215   1HD2  ASN  28          1HD2      ASN  28  13.523  -1.132 -14.606
  216   2HD2  ASN  28          2HD2      ASN  28  13.026  -2.789 -14.524
  217    H    THR  29           H        THR  29  11.588   1.672 -11.789
  218    HA   THR  29           HA       THR  29  12.128   1.364  -9.629
  219    HB   THR  29           HB       THR  29  10.051   1.682  -8.157
  220    HG1  THR  29           1HG      THR  29   8.692   0.405  -9.671
  221   1HG2  THR  29          1HG2      THR  29   9.168   3.682  -9.819
  222   2HG2  THR  29          2HG2      THR  29  10.620   3.838  -8.801
  223   3HG2  THR  29          3HG2      THR  29  10.780   3.384 -10.515
  Start of MODEL   14
    1    H    HIS   1           H        HIS   1 -20.931  14.101 -16.706
    2    HA   HIS   1           HA       HIS   1 -19.495  12.275 -18.492
    3   1HB   HIS   1          1HB       HIS   1 -19.107  15.153 -17.778
    4   2HB   HIS   1          2HB       HIS   1 -17.678  14.186 -18.088
    5    HD1  HIS   1           1HD      HIS   1 -19.258  16.544 -19.875
    6    HD2  HIS   1           2HD      HIS   1 -18.775  12.457 -20.687
    7    HE1  HIS   1           1HE      HIS   1 -19.522  16.281 -22.399
    8    H    SER   2           H        SER   2 -19.972  10.817 -16.474
    9    HA   SER   2           HA       SER   2 -17.630  11.095 -14.779
   10   1HB   SER   2          1HB       SER   2 -20.416  11.268 -13.931
   11   2HB   SER   2          2HB       SER   2 -19.643   9.889 -13.175
   12    HG   SER   2           HG       SER   2 -17.905  11.357 -12.484
   13    H    GLN   3           H        GLN   3 -16.412   9.257 -14.997
   14    HA   GLN   3           HA       GLN   3 -17.887   6.787 -15.466
   15   1HB   GLN   3          1HB       GLN   3 -15.809   8.061 -17.111
   16   2HB   GLN   3          2HB       GLN   3 -15.372   6.424 -16.666
   17   1HG   GLN   3          1HG       GLN   3 -17.414   5.519 -17.615
   18   2HG   GLN   3          2HG       GLN   3 -18.119   7.114 -17.792
   19   1HE2  GLN   3          1HE2      GLN   3 -16.511   4.649 -19.314
   20   2HE2  GLN   3          2HE2      GLN   3 -15.919   5.465 -20.723
   21    H    GLY   4           H        GLY   4 -17.712   6.665 -13.044
   22   1HA   GLY   4          1HA       GLY   4 -16.204   4.848 -11.975
   23   2HA   GLY   4          2HA       GLY   4 -14.994   6.111 -12.076
   24    H    THR   5           H        THR   5 -16.989   4.689  -9.922
   25    HA   THR   5           HA       THR   5 -18.580   6.466  -8.688
   26    HB   THR   5           HB       THR   5 -17.956   5.222  -6.596
   27    HG1  THR   5           1HG      THR   5 -15.930   4.118  -8.404
   28   1HG2  THR   5          1HG2      THR   5 -19.196   4.058  -8.645
   29   2HG2  THR   5          2HG2      THR   5 -17.645   3.206  -8.843
   30   3HG2  THR   5          3HG2      THR   5 -18.558   3.051  -7.323
   31    H    PHE   6           H        PHE   6 -18.328   7.893  -6.794
   32    HA   PHE   6           HA       PHE   6 -15.791   9.359  -7.007
   33   1HB   PHE   6          1HB       PHE   6 -17.104  11.351  -6.854
   34   2HB   PHE   6          2HB       PHE   6 -18.154  10.312  -7.795
   35    HD1  PHE   6           1HD      PHE   6 -17.846  12.263  -4.832
   36    HD2  PHE   6           2HD      PHE   6 -19.961   8.999  -6.528
   37    HE1  PHE   6           1HE      PHE   6 -19.663  12.553  -3.124
   38    HE2  PHE   6           2HE      PHE   6 -21.777   9.288  -4.821
   39    HZ   PHE   6           HZ       PHE   6 -21.607  11.061  -3.139
   40    H    THR   7           H        THR   7 -16.148   7.097  -5.245
   41    HA   THR   7           HA       THR   7 -15.701   8.473  -2.728
   42    HB   THR   7           HB       THR   7 -18.232   7.809  -3.048
   43    HG1  THR   7           1HG      THR   7 -16.620   6.691  -0.866
   44   1HG2  THR   7          1HG2      THR   7 -18.809   5.580  -2.990
   45   2HG2  THR   7          2HG2      THR   7 -17.159   5.295  -3.592
   46   3HG2  THR   7          3HG2      THR   7 -17.501   5.189  -1.848
   47    H    SER   8           H        SER   8 -14.713   7.033  -1.084
   48    HA   SER   8           HA       SER   8 -13.237   5.564  -0.471
   49   1HB   SER   8          1HB       SER   8 -14.897   3.874  -1.276
   50   2HB   SER   8          2HB       SER   8 -14.147   3.897  -2.860
   51    HG   SER   8           HG       SER   8 -12.606   3.308  -0.495
   52    H    ASP   9           H        ASP   9 -11.113   4.344  -1.271
   53    HA   ASP   9           HA       ASP   9  -9.407   6.069  -2.290
   54   1HB   ASP   9          1HB       ASP   9  -8.031   4.107  -3.060
   55   2HB   ASP   9          2HB       ASP   9  -8.681   3.908  -1.445
   56    HD2  ASP   9           HD       ASP   9 -10.317   2.460  -1.191
   57    H    TYR  10           H        TYR  10  -9.380   7.223  -4.224
   58    HA   TYR  10           HA       TYR  10  -9.847   5.798  -6.698
   59   1HB   TYR  10          1HB       TYR  10 -11.861   7.318  -5.306
   60   2HB   TYR  10          2HB       TYR  10 -11.299   8.374  -6.587
   61    HD1  TYR  10           1HD      TYR  10 -12.608   4.924  -5.984
   62    HD2  TYR  10           2HD      TYR  10 -12.122   8.130  -8.774
   63    HE1  TYR  10           1HE      TYR  10 -14.099   3.710  -7.648
   64    HE2  TYR  10           2HE      TYR  10 -13.614   6.906 -10.429
   65    HH   TYR  10           HH       TYR  10 -14.260   3.774 -10.297
   66    H    SER  11           H        SER  11  -9.213   7.103  -8.607
   67    HA   SER  11           HA       SER  11  -8.135   8.727  -9.642
   68   1HB   SER  11          1HB       SER  11  -8.789  10.128  -7.392
   69   2HB   SER  11          2HB       SER  11  -7.045  10.100  -7.216
   70    HG   SER  11           HG       SER  11  -6.892  11.580  -8.747
   71    H    LYS  12           H        LYS  12  -6.641   7.114 -10.342
   72    HA   LYS  12           HA       LYS  12  -4.028   7.456  -9.965
   73   1HB   LYS  12          1HB       LYS  12  -3.489   5.500  -8.326
   74   2HB   LYS  12          2HB       LYS  12  -3.850   7.095  -7.699
   75   1HG   LYS  12          1HG       LYS  12  -5.695   6.337  -6.613
   76   2HG   LYS  12          2HG       LYS  12  -6.330   5.607  -8.074
   77   1HD   LYS  12          1HD       LYS  12  -4.956   3.588  -7.719
   78   2HD   LYS  12          2HD       LYS  12  -4.168   4.325  -6.339
   79   1HE   LYS  12          1HE       LYS  12  -6.144   4.235  -5.000
   80   2HE   LYS  12          2HE       LYS  12  -7.191   4.033  -6.391
   81   1HZ   LYS  12          1HZ       LYS  12  -6.721   1.807  -6.498
   82   2HZ   LYS  12          2HZ       LYS  12  -5.182   1.954  -5.984
   83    H    TYR  13           H        TYR  13  -6.693   5.092 -10.170
   84    HA   TYR  13           HA       TYR  13  -5.169   3.759 -12.304
   85   1HB   TYR  13          1HB       TYR  13  -6.192   1.662 -11.458
   86   2HB   TYR  13          2HB       TYR  13  -5.428   2.466 -10.102
   87    HD1  TYR  13           1HD      TYR  13  -8.557   1.287 -11.513
   88    HD2  TYR  13           2HD      TYR  13  -6.842   3.723  -8.442
   89    HE1  TYR  13           1HE      TYR  13 -10.756   1.239 -10.237
   90    HE2  TYR  13           2HE      TYR  13  -9.047   3.666  -7.176
   91    HH   TYR  13           HH       TYR  13 -11.402   3.344  -7.681
   92    H    LEU  14           H        LEU  14  -6.119   4.485 -14.165
   93    HA   LEU  14           HA       LEU  14  -8.949   3.940 -14.450
   94   1HB   LEU  14          1HB       LEU  14  -7.803   6.686 -14.972
   95   2HB   LEU  14          2HB       LEU  14  -9.427   6.157 -15.365
   96    HG   LEU  14           HG       LEU  14  -8.390   6.125 -12.528
   97   1HD1  LEU  14          1HD1      LEU  14  -9.522   8.434 -14.098
   98   2HD1  LEU  14          2HD1      LEU  14  -9.712   8.324 -12.332
   99   3HD1  LEU  14          3HD1      LEU  14  -8.085   8.379 -13.050
  100   1HD2  LEU  14          1HD2      LEU  14 -10.446   4.816 -13.157
  101   2HD2  LEU  14          2HD2      LEU  14 -10.679   6.042 -11.888
  102   3HD2  LEU  14          3HD2      LEU  14 -11.227   6.367 -13.550
  103    H    ASP  15           H        ASP  15  -9.504   3.363 -16.561
  104    HA   ASP  15           HA       ASP  15  -9.186   2.619 -18.571
  105   1HB   ASP  15          1HB       ASP  15  -8.796   4.954 -19.196
  106   2HB   ASP  15          2HB       ASP  15  -7.129   4.870 -18.663
  107    HD2  ASP  15           HD       ASP  15  -6.137   4.278 -21.805
  108    H    SER  16           H        SER  16  -8.306   0.526 -18.086
  109    HA   SER  16           HA       SER  16  -5.435   0.394 -17.740
  110   1HB   SER  16          1HB       SER  16  -6.938  -0.808 -16.132
  111   2HB   SER  16          2HB       SER  16  -7.557  -1.780 -17.452
  112    HG   SER  16           HG       SER  16  -4.773  -1.671 -16.652
  113    H    ARG  17           H        ARG  17  -4.663   0.703 -19.886
  114    HA   ARG  17           HA       ARG  17  -4.665  -1.591 -21.458
  115   1HB   ARG  17          1HB       ARG  17  -6.972  -0.675 -22.034
  116   2HB   ARG  17          2HB       ARG  17  -6.199   0.766 -22.663
  117   1HG   ARG  17          1HG       ARG  17  -4.767  -1.072 -24.043
  118   2HG   ARG  17          2HG       ARG  17  -6.212  -2.028 -23.781
  119   1HD   ARG  17          1HD       ARG  17  -7.509   0.099 -24.638
  120   2HD   ARG  17          2HD       ARG  17  -5.953   0.617 -25.256
  121    HE   ARG  17           HE       ARG  17  -7.596  -1.578 -26.283
  122   1HH1  ARG  17          2HH2      ARG  17  -4.305  -0.276 -26.116
  123   2HH1  ARG  17          1HH2      ARG  17  -3.772  -1.104 -27.541
  124   1HH2  ARG  17          1HH       ARG  17  -5.310  -2.506 -28.728
  125    H    ARG  18           H        ARG  18  -4.316   1.985 -21.242
  126    HA   ARG  18           HA       ARG  18  -2.571   2.340 -23.312
  127   1HB   ARG  18          1HB       ARG  18  -3.358   3.800 -20.857
  128   2HB   ARG  18          2HB       ARG  18  -1.717   4.162 -21.352
  129   1HG   ARG  18          1HG       ARG  18  -3.531   4.116 -23.662
  130   2HG   ARG  18          2HG       ARG  18  -4.090   5.245 -22.444
  131   1HD   ARG  18          1HD       ARG  18  -1.165   5.398 -22.890
  132   2HD   ARG  18          2HD       ARG  18  -2.091   5.748 -24.336
  133    HE   ARG  18           HE       ARG  18  -3.418   7.260 -22.493
  134   1HH1  ARG  18          2HH2      ARG  18   0.045   6.933 -23.169
  135   2HH1  ARG  18          1HH2      ARG  18   0.423   8.544 -22.657
  136   1HH2  ARG  18          1HH       ARG  18  -1.335   9.968 -21.866
  137    H    ALA  19           H        ALA  19  -1.585   2.406 -19.806
  138    HA   ALA  19           HA       ALA  19   1.100   1.733 -20.486
  139   1HB   ALA  19          1HB       ALA  19   0.566   1.392 -17.694
  140   2HB   ALA  19          2HB       ALA  19   1.393   2.744 -18.504
  141   3HB   ALA  19          3HB       ALA  19  -0.370   2.796 -18.261
  142    H    GLN  20           H        GLN  20   2.100  -0.250 -20.491
  143    HA   GLN  20           HA       GLN  20   1.303  -2.404 -19.007
  144   1HB   GLN  20          1HB       GLN  20  -0.179  -2.110 -21.571
  145   2HB   GLN  20          2HB       GLN  20   0.521  -3.696 -21.313
  146   1HG   GLN  20          1HG       GLN  20  -0.684  -2.801 -18.831
  147   2HG   GLN  20          2HG       GLN  20  -1.850  -2.599 -20.123
  148   1HE2  GLN  20          1HE2      GLN  20  -2.339  -4.375 -18.156
  149   2HE2  GLN  20          2HE2      GLN  20  -2.230  -6.008 -18.724
  150    H    ASP  21           H        ASP  21   3.439  -2.972 -18.747
  151    HA   ASP  21           HA       ASP  21   5.239  -4.122 -19.317
  152   1HB   ASP  21          1HB       ASP  21   3.814  -4.642 -21.565
  153   2HB   ASP  21          2HB       ASP  21   5.022  -3.588 -22.272
  154    HD2  ASP  21           HD       ASP  21   5.990  -7.065 -22.493
  155    H    PHE  22           H        PHE  22   4.246  -0.983 -20.323
  156    HA   PHE  22           HA       PHE  22   6.952  -0.172 -21.053
  157   1HB   PHE  22          1HB       PHE  22   4.345   0.419 -21.962
  158   2HB   PHE  22          2HB       PHE  22   4.702   1.798 -20.942
  159    HD1  PHE  22           1HD      PHE  22   5.006   3.535 -22.467
  160    HD2  PHE  22           2HD      PHE  22   7.046  -0.133 -23.090
  161    HE1  PHE  22           1HE      PHE  22   6.314   4.580 -24.337
  162    HE2  PHE  22           2HE      PHE  22   8.354   0.912 -24.960
  163    HZ   PHE  22           HZ       PHE  22   7.973   3.256 -25.561
  164    H    VAL  23           H        VAL  23   4.458   0.122 -18.531
  165    HA   VAL  23           HA       VAL  23   5.453   2.384 -17.244
  166    HB   VAL  23           HB       VAL  23   3.993  -0.034 -16.160
  167   1HG1  VAL  23          1HG1      VAL  23   5.112   1.352 -14.407
  168   2HG1  VAL  23          2HG1      VAL  23   4.173   2.754 -14.972
  169   3HG1  VAL  23          3HG1      VAL  23   3.337   1.340 -14.287
  170   1HG2  VAL  23          1HG2      VAL  23   3.070   2.540 -17.443
  171   2HG2  VAL  23          2HG2      VAL  23   2.619   0.864 -17.839
  172   3HG2  VAL  23          3HG2      VAL  23   2.020   1.616 -16.342
  173    H    GLN  24           H        GLN  24   6.786  -0.788 -17.648
  174    HA   GLN  24           HA       GLN  24   8.268  -0.729 -15.217
  175   1HB   GLN  24          1HB       GLN  24   7.531  -2.698 -17.070
  176   2HB   GLN  24          2HB       GLN  24   9.260  -2.544 -17.315
  177   1HG   GLN  24          1HG       GLN  24   9.468  -2.675 -14.721
  178   2HG   GLN  24          2HG       GLN  24   7.798  -3.206 -14.728
  179   1HE2  GLN  24          1HE2      GLN  24   7.334  -5.258 -15.099
  180   2HE2  GLN  24          2HE2      GLN  24   8.435  -6.483 -15.634
  181    H    TRP  25           H        TRP  25   8.447   1.407 -17.533
  182    HA   TRP  25           HA       TRP  25  11.380   1.452 -17.529
  183   1HB   TRP  25          1HB       TRP  25  10.666   0.647 -19.712
  184   2HB   TRP  25          2HB       TRP  25   9.590   2.018 -19.898
  185    HD1  TRP  25           HD       TRP  25  13.439   1.552 -19.318
  186    HE1  TRP  25           1HE      TRP  25  14.799   3.329 -20.718
  187    HE3  TRP  25           3HE      TRP  25   9.374   3.928 -21.237
  188    HZ2  TRP  25           2HZ      TRP  25  14.038   5.480 -22.432
  189    HZ3  TRP  25           3HZ      TRP  25   9.770   5.857 -22.765
  190    HH2  TRP  25           HH       TRP  25  12.005   6.641 -23.369
  191    H    LEU  26           H        LEU  26   8.270   3.232 -18.115
  192    HA   LEU  26           HA       LEU  26   9.437   5.771 -17.684
  193   1HB   LEU  26          1HB       LEU  26   6.539   4.930 -17.545
  194   2HB   LEU  26          2HB       LEU  26   7.141   6.569 -17.692
  195    HG   LEU  26           HG       LEU  26   6.482   6.049 -19.852
  196   1HD1  LEU  26          1HD1      LEU  26   8.562   5.748 -21.197
  197   2HD1  LEU  26          2HD1      LEU  26   8.682   7.000 -19.937
  198   3HD1  LEU  26          3HD1      LEU  26   9.437   5.408 -19.685
  199   1HD2  LEU  26          1HD2      LEU  26   6.332   3.514 -19.171
  200   2HD2  LEU  26          2HD2      LEU  26   6.460   3.997 -20.879
  201   3HD2  LEU  26          3HD2      LEU  26   7.900   3.416 -20.008
  202    H    MET  27           H        MET  27   8.709   3.164 -15.593
  203    HA   MET  27           HA       MET  27   9.426   4.705 -13.359
  204   1HB   MET  27          1HB       MET  27   6.511   4.033 -13.853
  205   2HB   MET  27          2HB       MET  27   7.095   3.931 -12.204
  206   1HG   MET  27          1HG       MET  27   8.145   6.353 -12.850
  207   2HG   MET  27          2HG       MET  27   6.796   6.349 -13.968
  208   1HE   MET  27          1HE       MET  27   4.803   7.245 -13.508
  209   2HE   MET  27          2HE       MET  27   4.108   5.713 -12.925
  210   3HE   MET  27          3HE       MET  27   3.861   7.213 -11.998
  211    H    ASN  28           H        ASN  28  10.181   2.246 -14.839
  212    HA   ASN  28           HA       ASN  28  10.554   0.102 -14.564
  213   1HB   ASN  28          1HB       ASN  28  11.864   1.530 -12.632
  214   2HB   ASN  28          2HB       ASN  28  10.941   0.457 -11.598
  215   1HD2  ASN  28          1HD2      ASN  28  12.460  -0.882 -10.877
  216   2HD2  ASN  28          2HD2      ASN  28  13.450  -1.919 -11.849
  217    H    THR  29           H        THR  29  10.299  -1.508 -12.056
  218    HA   THR  29           HA       THR  29   8.778  -2.971 -11.291
  219    HB   THR  29           HB       THR  29   6.996  -1.751  -9.899
  220    HG1  THR  29           1HG      THR  29   6.687   0.342 -10.550
  221   1HG2  THR  29          1HG2      THR  29   8.540  -0.949  -8.325
  222   2HG2  THR  29          2HG2      THR  29   9.621  -1.960  -9.314
  223   3HG2  THR  29          3HG2      THR  29   9.567  -0.199  -9.570
  Start of MODEL   15
    1    H    HIS   1           H        HIS   1 -19.785   5.349  -2.122
    2    HA   HIS   1           HA       HIS   1 -20.909   4.433   0.218
    3   1HB   HIS   1          1HB       HIS   1 -21.361   4.164  -2.507
    4   2HB   HIS   1          2HB       HIS   1 -21.026   2.521  -1.999
    5    HD1  HIS   1           1HD      HIS   1 -23.488   5.343  -1.480
    6    HD2  HIS   1           2HD      HIS   1 -22.996   1.323  -0.389
    7    HE1  HIS   1           1HE      HIS   1 -25.709   4.600  -0.469
    8    H    SER   2           H        SER   2 -19.221   3.888   1.710
    9    HA   SER   2           HA       SER   2 -18.022   2.442   2.808
   10   1HB   SER   2          1HB       SER   2 -19.511   0.728   1.015
   11   2HB   SER   2          2HB       SER   2 -17.888   0.086   1.173
   12    HG   SER   2           HG       SER   2 -19.727  -0.451   2.840
   13    H    GLN   3           H        GLN   3 -17.476   1.743  -0.729
   14    HA   GLN   3           HA       GLN   3 -15.702   1.851  -1.977
   15   1HB   GLN   3          1HB       GLN   3 -15.478   4.121  -0.470
   16   2HB   GLN   3          2HB       GLN   3 -13.965   3.341  -0.056
   17   1HG   GLN   3          1HG       GLN   3 -13.100   3.560  -2.188
   18   2HG   GLN   3          2HG       GLN   3 -14.650   3.304  -2.963
   19   1HE2  GLN   3          1HE2      GLN   3 -15.757   4.971  -3.706
   20   2HE2  GLN   3          2HE2      GLN   3 -15.409   6.645  -3.428
   21    H    GLY   4           H        GLY   4 -13.693   0.709  -2.359
   22   1HA   GLY   4          1HA       GLY   4 -13.133  -1.266  -0.279
   23   2HA   GLY   4          2HA       GLY   4 -12.662  -1.329  -1.966
   24    H    THR   5           H        THR   5 -11.122  -1.527   0.713
   25    HA   THR   5           HA       THR   5  -9.562   0.574   1.317
   26    HB   THR   5           HB       THR   5  -7.836  -1.161   1.872
   27    HG1  THR   5           1HG      THR   5  -9.737  -2.843   0.401
   28   1HG2  THR   5          1HG2      THR   5  -9.126  -2.374   3.413
   29   2HG2  THR   5          2HG2      THR   5 -10.257  -1.048   3.051
   30   3HG2  THR   5          3HG2      THR   5 -10.451  -2.627   2.252
   31    H    PHE   6           H        PHE   6  -7.350   1.232   0.712
   32    HA   PHE   6           HA       PHE   6  -7.278   1.894  -2.006
   33   1HB   PHE   6          1HB       PHE   6  -6.174   3.306  -0.377
   34   2HB   PHE   6          2HB       PHE   6  -5.394   1.942   0.398
   35    HD1  PHE   6           1HD      PHE   6  -3.201   1.364  -0.163
   36    HD2  PHE   6           2HD      PHE   6  -5.390   3.919  -2.749
   37    HE1  PHE   6           1HE      PHE   6  -1.120   1.794  -1.499
   38    HE2  PHE   6           2HE      PHE   6  -3.309   4.349  -4.086
   39    HZ   PHE   6           HZ       PHE   6  -1.199   3.282  -3.445
   40    H    THR   7           H        THR   7  -5.396  -0.501  -0.035
   41    HA   THR   7           HA       THR   7  -3.638  -1.368  -1.937
   42    HB   THR   7           HB       THR   7  -4.062  -1.999   0.603
   43    HG1  THR   7           1HG      THR   7  -2.274  -2.980  -0.313
   44   1HG2  THR   7          1HG2      THR   7  -6.262  -3.333  -0.453
   45   2HG2  THR   7          2HG2      THR   7  -5.021  -4.609  -0.460
   46   3HG2  THR   7          3HG2      THR   7  -5.444  -3.787   1.061
   47    H    SER   8           H        SER   8  -3.725  -3.725  -2.923
   48    HA   SER   8           HA       SER   8  -5.178  -3.640  -5.128
   49   1HB   SER   8          1HB       SER   8  -4.599  -6.189  -3.554
   50   2HB   SER   8          2HB       SER   8  -4.937  -6.112  -5.271
   51    HG   SER   8           HG       SER   8  -2.962  -5.237  -5.685
   52    H    ASP   9           H        ASP   9  -7.341  -2.964  -5.075
   53    HA   ASP   9           HA       ASP   9  -9.276  -4.846  -4.677
   54   1HB   ASP   9          1HB       ASP   9  -8.468  -4.116  -2.196
   55   2HB   ASP   9          2HB       ASP   9  -9.596  -2.807  -2.484
   56    HD2  ASP   9           HD       ASP   9  -9.408  -6.248  -2.133
   57    H    TYR  10           H        TYR  10  -8.453  -1.349  -4.151
   58    HA   TYR  10           HA       TYR  10 -10.931  -0.355  -5.072
   59   1HB   TYR  10          1HB       TYR  10  -9.776   1.729  -4.726
   60   2HB   TYR  10          2HB       TYR  10  -8.915   0.649  -3.648
   61    HD1  TYR  10           1HD      TYR  10  -7.195  -0.851  -5.562
   62    HD2  TYR  10           2HD      TYR  10  -8.178   3.310  -5.385
   63    HE1  TYR  10           1HE      TYR  10  -5.016  -0.278  -6.739
   64    HE2  TYR  10           2HE      TYR  10  -5.995   3.868  -6.562
   65    HH   TYR  10           HH       TYR  10  -3.544   1.478  -7.043
   66    H    SER  11           H        SER  11 -10.089   1.695  -6.894
   67    HA   SER  11           HA       SER  11 -10.070   2.031  -9.042
   68   1HB   SER  11          1HB       SER  11  -7.901  -0.114  -9.078
   69   2HB   SER  11          2HB       SER  11  -8.164   1.087 -10.326
   70    HG   SER  11           HG       SER  11  -6.956   2.432  -9.196
   71    H    LYS  12           H        LYS  12 -12.215   0.480  -8.436
   72    HA   LYS  12           HA       LYS  12 -13.687  -0.971  -9.215
   73   1HB   LYS  12          1HB       LYS  12 -12.464   0.249 -11.481
   74   2HB   LYS  12          2HB       LYS  12 -12.747  -1.432 -11.887
   75   1HG   LYS  12          1HG       LYS  12 -15.112  -0.813 -10.608
   76   2HG   LYS  12          2HG       LYS  12 -14.713   0.739 -11.317
   77   1HD   LYS  12          1HD       LYS  12 -14.908  -0.042 -13.507
   78   2HD   LYS  12          2HD       LYS  12 -14.418  -1.672 -13.089
   79   1HE   LYS  12          1HE       LYS  12 -16.763  -1.811 -13.595
   80   2HE   LYS  12          2HE       LYS  12 -16.650  -1.924 -11.850
   81   1HZ   LYS  12          1HZ       LYS  12 -17.835   0.163 -13.436
   82   2HZ   LYS  12          2HZ       LYS  12 -18.104  -0.212 -11.874
   83    H    TYR  13           H        TYR  13 -10.923  -1.848  -8.120
   84    HA   TYR  13           HA       TYR  13 -10.066  -3.813  -7.528
   85   1HB   TYR  13          1HB       TYR  13 -12.727  -4.356  -8.291
   86   2HB   TYR  13          2HB       TYR  13 -11.828  -5.439  -9.335
   87    HD1  TYR  13           1HD      TYR  13  -9.751  -6.623  -7.882
   88    HD2  TYR  13           2HD      TYR  13 -13.560  -5.372  -6.389
   89    HE1  TYR  13           1HE      TYR  13  -9.560  -8.293  -5.975
   90    HE2  TYR  13           2HE      TYR  13 -13.356  -7.046  -4.487
   91    HH   TYR  13           HH       TYR  13 -12.178  -8.612  -3.590
   92    H    LEU  14           H        LEU  14  -9.434  -2.289 -10.102
   93    HA   LEU  14           HA       LEU  14  -8.661  -4.339 -11.948
   94   1HB   LEU  14          1HB       LEU  14  -8.026  -2.622 -13.353
   95   2HB   LEU  14          2HB       LEU  14  -9.401  -1.970 -12.483
   96    HG   LEU  14           HG       LEU  14  -7.787  -0.783 -10.957
   97   1HD1  LEU  14          1HD1      LEU  14  -5.711  -1.669 -11.010
   98   2HD1  LEU  14          2HD1      LEU  14  -5.851  -2.187 -12.708
   99   3HD1  LEU  14          3HD1      LEU  14  -5.482  -0.489 -12.323
  100   1HD2  LEU  14          1HD2      LEU  14  -7.796  -0.138 -13.914
  101   2HD2  LEU  14          2HD2      LEU  14  -8.897   0.471 -12.656
  102   3HD2  LEU  14          3HD2      LEU  14  -7.186   0.963 -12.656
  103    H    ASP  15           H        ASP  15  -6.358  -4.631 -12.647
  104    HA   ASP  15           HA       ASP  15  -4.511  -4.082 -10.480
  105   1HB   ASP  15          1HB       ASP  15  -5.155  -6.775 -11.727
  106   2HB   ASP  15          2HB       ASP  15  -3.570  -6.482 -11.041
  107    HD2  ASP  15           HD       ASP  15  -5.877  -8.154 -10.288
  108    H    SER  16           H        SER  16  -2.176  -5.097 -11.450
  109    HA   SER  16           HA       SER  16  -1.382  -3.439 -13.390
  110   1HB   SER  16          1HB       SER  16  -0.328  -5.747 -12.043
  111   2HB   SER  16          2HB       SER  16   0.055  -5.922 -13.744
  112    HG   SER  16           HG       SER  16   0.724  -3.715 -12.000
  113    H    ARG  17           H        ARG  17  -2.103  -3.147 -15.465
  114    HA   ARG  17           HA       ARG  17  -2.189  -5.383 -17.194
  115   1HB   ARG  17          1HB       ARG  17  -4.529  -5.147 -15.909
  116   2HB   ARG  17          2HB       ARG  17  -4.806  -3.861 -17.067
  117   1HG   ARG  17          1HG       ARG  17  -3.769  -6.464 -18.158
  118   2HG   ARG  17          2HG       ARG  17  -5.424  -6.453 -17.582
  119   1HD   ARG  17          1HD       ARG  17  -4.753  -4.094 -19.254
  120   2HD   ARG  17          2HD       ARG  17  -4.591  -5.615 -20.108
  121    HE   ARG  17           HE       ARG  17  -7.046  -5.740 -18.699
  122   1HH1  ARG  17          2HH2      ARG  17  -5.621  -3.816 -21.311
  123   2HH1  ARG  17          1HH2      ARG  17  -7.144  -3.485 -22.066
  124   1HH2  ARG  17          1HH       ARG  17  -9.150  -4.370 -21.099
  125    H    ARG  18           H        ARG  18  -3.745  -2.094 -16.899
  126    HA   ARG  18           HA       ARG  18  -3.327  -1.387 -19.506
  127   1HB   ARG  18          1HB       ARG  18  -3.579   0.285 -16.965
  128   2HB   ARG  18          2HB       ARG  18  -3.495   1.026 -18.550
  129   1HG   ARG  18          1HG       ARG  18  -5.627   0.375 -19.120
  130   2HG   ARG  18          2HG       ARG  18  -5.462  -1.197 -18.365
  131   1HD   ARG  18          1HD       ARG  18  -6.357  -0.479 -16.375
  132   2HD   ARG  18          2HD       ARG  18  -5.475   1.035 -16.410
  133    HE   ARG  18           HE       ARG  18  -8.189   0.617 -17.316
  134   1HH1  ARG  18          2HH2      ARG  18  -5.277   2.504 -18.033
  135   2HH1  ARG  18          1HH2      ARG  18  -6.151   3.807 -18.767
  136   1HH2  ARG  18          1HH       ARG  18  -8.541   3.686 -18.904
  137    H    ALA  19           H        ALA  19  -1.520  -0.035 -16.640
  138    HA   ALA  19           HA       ALA  19   0.560   1.004 -18.201
  139   1HB   ALA  19          1HB       ALA  19  -0.296   1.023 -15.503
  140   2HB   ALA  19          2HB       ALA  19   1.365   0.384 -15.485
  141   3HB   ALA  19          3HB       ALA  19   1.028   1.967 -16.225
  142    H    GLN  20           H        GLN  20  -0.266  -2.226 -17.378
  143    HA   GLN  20           HA       GLN  20   2.036  -3.467 -16.832
  144   1HB   GLN  20          1HB       GLN  20  -0.386  -4.373 -17.328
  145   2HB   GLN  20          2HB       GLN  20   0.204  -4.601 -18.962
  146   1HG   GLN  20          1HG       GLN  20   2.268  -5.761 -17.673
  147   2HG   GLN  20          2HG       GLN  20   1.060  -5.982 -16.422
  148   1HE2  GLN  20          1HE2      GLN  20   2.444  -7.902 -18.163
  149   2HE2  GLN  20          2HE2      GLN  20   1.222  -8.819 -18.979
  150    H    ASP  21           H        ASP  21   3.973  -3.955 -17.844
  151    HA   ASP  21           HA       ASP  21   5.407  -4.264 -19.487
  152   1HB   ASP  21          1HB       ASP  21   3.246  -4.581 -20.991
  153   2HB   ASP  21          2HB       ASP  21   3.601  -2.957 -21.543
  154    HD2  ASP  21           HD       ASP  21   5.673  -3.836 -23.827
  155    H    PHE  22           H        PHE  22   3.325  -1.311 -19.954
  156    HA   PHE  22           HA       PHE  22   5.327   0.366 -20.884
  157   1HB   PHE  22          1HB       PHE  22   2.595   0.473 -19.664
  158   2HB   PHE  22          2HB       PHE  22   3.521   1.936 -19.392
  159    HD1  PHE  22           1HD      PHE  22   2.649   3.549 -20.802
  160    HD2  PHE  22           2HD      PHE  22   3.390  -0.331 -22.354
  161    HE1  PHE  22           1HE      PHE  22   2.050   4.354 -23.102
  162    HE2  PHE  22           2HE      PHE  22   2.791   0.475 -24.654
  163    HZ   PHE  22           HZ       PHE  22   2.128   2.808 -25.001
  164    H    VAL  23           H        VAL  23   4.407  -0.618 -17.573
  165    HA   VAL  23           HA       VAL  23   5.672   1.405 -16.167
  166    HB   VAL  23           HB       VAL  23   5.391  -1.513 -15.423
  167   1HG1  VAL  23          1HG1      VAL  23   5.447  -0.778 -13.133
  168   2HG1  VAL  23          2HG1      VAL  23   6.876  -0.116 -13.963
  169   3HG1  VAL  23          3HG1      VAL  23   5.476   0.931 -13.627
  170   1HG2  VAL  23          1HG2      VAL  23   3.179  -1.245 -15.388
  171   2HG2  VAL  23          2HG2      VAL  23   3.351   0.131 -14.272
  172   3HG2  VAL  23          3HG2      VAL  23   3.368   0.404 -16.031
  173    H    GLN  24           H        GLN  24   6.979  -1.076 -18.209
  174    HA   GLN  24           HA       GLN  24   9.480  -1.205 -16.861
  175   1HB   GLN  24          1HB       GLN  24   8.187  -2.856 -18.617
  176   2HB   GLN  24          2HB       GLN  24   9.286  -2.052 -19.719
  177   1HG   GLN  24          1HG       GLN  24  10.172  -3.364 -17.107
  178   2HG   GLN  24          2HG       GLN  24  10.211  -4.173 -18.661
  179   1HE2  GLN  24          1HE2      GLN  24  12.129  -2.824 -16.535
  180   2HE2  GLN  24          2HE2      GLN  24  13.345  -2.078 -17.517
  181    H    TRP  25           H        TRP  25   8.137   1.381 -18.167
  182    HA   TRP  25           HA       TRP  25  10.614   2.232 -19.505
  183   1HB   TRP  25          1HB       TRP  25   8.861   1.986 -21.153
  184   2HB   TRP  25          2HB       TRP  25   7.761   2.955 -20.192
  185    HD1  TRP  25           HD       TRP  25  11.283   3.534 -21.817
  186    HE1  TRP  25           1HE      TRP  25  11.442   5.971 -22.816
  187    HE3  TRP  25           3HE      TRP  25   6.649   5.010 -20.333
  188    HZ2  TRP  25           2HZ      TRP  25   9.652   8.193 -22.871
  189    HZ3  TRP  25           3HZ      TRP  25   5.932   7.329 -20.899
  190    HH2  TRP  25           HH       TRP  25   7.349   8.900 -22.123
  191    H    LEU  26           H        LEU  26   7.637   3.218 -17.674
  192    HA   LEU  26           HA       LEU  26   8.682   5.726 -16.929
  193   1HB   LEU  26          1HB       LEU  26   6.496   4.094 -15.631
  194   2HB   LEU  26          2HB       LEU  26   6.787   5.808 -15.408
  195    HG   LEU  26           HG       LEU  26   5.010   5.769 -16.891
  196   1HD1  LEU  26          1HD1      LEU  26   5.908   6.424 -19.137
  197   2HD1  LEU  26          2HD1      LEU  26   6.647   7.277 -17.760
  198   3HD1  LEU  26          3HD1      LEU  26   7.526   5.955 -18.564
  199   1HD2  LEU  26          1HD2      LEU  26   5.472   3.197 -17.298
  200   2HD2  LEU  26          2HD2      LEU  26   4.478   4.157 -18.420
  201   3HD2  LEU  26          3HD2      LEU  26   6.177   3.804 -18.816
  202    H    MET  27           H        MET  27   9.466   2.520 -15.990
  203    HA   MET  27           HA       MET  27  10.864   1.739 -14.515
  204   1HB   MET  27          1HB       MET  27  11.533   4.588 -14.626
  205   2HB   MET  27          2HB       MET  27  11.762   4.007 -12.989
  206   1HG   MET  27          1HG       MET  27  13.349   2.342 -13.675
  207   2HG   MET  27          2HG       MET  27  12.867   2.446 -15.356
  208   1HE   MET  27          1HE       MET  27  12.822   4.377 -16.624
  209   2HE   MET  27          2HE       MET  27  13.522   5.968 -16.238
  210   3HE   MET  27          3HE       MET  27  14.512   4.734 -17.053
  211    H    ASN  28           H        ASN  28   8.981   0.793 -13.439
  212    HA   ASN  28           HA       ASN  28   7.319   1.855 -11.706
  213   1HB   ASN  28          1HB       ASN  28   7.836  -0.431 -10.317
  214   2HB   ASN  28          2HB       ASN  28   6.976  -0.437 -11.844
  215   1HD2  ASN  28          1HD2      ASN  28   9.206  -2.028 -10.223
  216   2HD2  ASN  28          2HD2      ASN  28  10.274  -2.576 -11.471
  217    H    THR  29           H        THR  29  10.510   0.383 -10.701
  218    HA   THR  29           HA       THR  29  11.670   0.616  -8.786
  219    HB   THR  29           HB       THR  29  12.425   3.054  -8.538
  220    HG1  THR  29           1HG      THR  29  10.436   4.060  -9.178
  221   1HG2  THR  29          1HG2      THR  29  12.995   1.305 -10.612
  222   2HG2  THR  29          2HG2      THR  29  12.320   2.694 -11.497
  223   3HG2  THR  29          3HG2      THR  29  13.732   2.916 -10.436
  Start of MODEL   16
    1    H    HIS   1           H        HIS   1 -19.273 -27.579  -7.796
    2    HA   HIS   1           HA       HIS   1 -21.372 -27.268  -7.167
    3   1HB   HIS   1          1HB       HIS   1 -20.055 -25.155  -5.708
    4   2HB   HIS   1          2HB       HIS   1 -21.604 -24.584  -6.296
    5    HD1  HIS   1           1HD      HIS   1 -23.761 -25.719  -5.349
    6    HD2  HIS   1           2HD      HIS   1 -20.176 -27.197  -3.748
    7    HE1  HIS   1           1HE      HIS   1 -24.407 -27.104  -3.305
    8    H    SER   2           H        SER   2 -20.107 -24.079  -8.387
    9    HA   SER   2           HA       SER   2 -21.931 -24.424 -10.625
   10   1HB   SER   2          1HB       SER   2 -21.572 -21.900  -8.954
   11   2HB   SER   2          2HB       SER   2 -22.384 -21.923 -10.506
   12    HG   SER   2           HG       SER   2 -23.741 -23.730  -9.436
   13    H    GLN   3           H        GLN   3 -21.284 -23.049 -12.550
   14    HA   GLN   3           HA       GLN   3 -19.834 -22.267 -13.967
   15   1HB   GLN   3          1HB       GLN   3 -18.715 -21.284 -11.399
   16   2HB   GLN   3          2HB       GLN   3 -17.540 -21.380 -12.696
   17   1HG   GLN   3          1HG       GLN   3 -18.355 -19.416 -13.483
   18   2HG   GLN   3          2HG       GLN   3 -19.820 -20.268 -13.931
   19   1HE2  GLN   3          1HE2      GLN   3 -21.601 -19.415 -13.210
   20   2HE2  GLN   3          2HE2      GLN   3 -21.831 -18.530 -11.738
   21    H    GLY   4           H        GLY   4 -18.297 -23.230 -15.320
   22   1HA   GLY   4          1HA       GLY   4 -17.138 -25.713 -14.319
   23   2HA   GLY   4          2HA       GLY   4 -17.273 -25.190 -15.986
   24    H    THR   5           H        THR   5 -15.353 -24.708 -16.944
   25    HA   THR   5           HA       THR   5 -12.927 -24.677 -15.755
   26    HB   THR   5           HB       THR   5 -12.253 -23.325 -17.816
   27    HG1  THR   5           1HG      THR   5 -14.458 -22.181 -17.605
   28   1HG2  THR   5          1HG2      THR   5 -13.890 -25.815 -17.837
   29   2HG2  THR   5          2HG2      THR   5 -13.905 -24.921 -19.376
   30   3HG2  THR   5          3HG2      THR   5 -12.361 -25.464 -18.677
   31    H    PHE   6           H        PHE   6 -11.343 -22.953 -15.303
   32    HA   PHE   6           HA       PHE   6 -12.333 -21.233 -13.358
   33   1HB   PHE   6          1HB       PHE   6  -9.947 -20.210 -13.748
   34   2HB   PHE   6          2HB       PHE   6 -10.010 -21.910 -13.325
   35    HD1  PHE   6           1HD      PHE   6  -9.521 -19.540 -16.104
   36    HD2  PHE   6           2HD      PHE   6  -9.296 -23.591 -14.862
   37    HE1  PHE   6           1HE      PHE   6  -8.233 -20.106 -18.182
   38    HE2  PHE   6           2HE      PHE   6  -8.007 -24.157 -16.940
   39    HZ   PHE   6           HZ       PHE   6  -7.491 -22.407 -18.576
   40    H    THR   7           H        THR   7 -11.426 -20.669 -16.812
   41    HA   THR   7           HA       THR   7 -11.600 -17.922 -16.856
   42    HB   THR   7           HB       THR   7 -10.898 -19.689 -18.662
   43    HG1  THR   7           1HG      THR   7 -11.555 -18.006 -20.258
   44   1HG2  THR   7          1HG2      THR   7 -13.769 -19.203 -19.567
   45   2HG2  THR   7          2HG2      THR   7 -12.566 -20.310 -20.272
   46   3HG2  THR   7          3HG2      THR   7 -13.315 -20.691 -18.703
   47    H    SER   8           H        SER   8 -13.141 -16.728 -15.898
   48    HA   SER   8           HA       SER   8 -15.596 -16.481 -17.033
   49   1HB   SER   8          1HB       SER   8 -15.618 -18.849 -15.597
   50   2HB   SER   8          2HB       SER   8 -16.246 -17.720 -14.412
   51    HG   SER   8           HG       SER   8 -18.098 -17.641 -15.476
   52    H    ASP   9           H        ASP   9 -13.701 -14.689 -16.234
   53    HA   ASP   9           HA       ASP   9 -15.065 -12.887 -14.760
   54   1HB   ASP   9          1HB       ASP   9 -14.125 -14.879 -13.020
   55   2HB   ASP   9          2HB       ASP   9 -12.911 -13.623 -12.872
   56    HD2  ASP   9           HD       ASP   9 -13.434 -12.853 -10.949
   57    H    TYR  10           H        TYR  10 -11.751 -14.378 -14.982
   58    HA   TYR  10           HA       TYR  10 -10.184 -12.170 -14.803
   59   1HB   TYR  10          1HB       TYR  10  -9.987 -14.444 -16.872
   60   2HB   TYR  10          2HB       TYR  10  -8.631 -13.565 -16.194
   61    HD1  TYR  10           1HD      TYR  10 -10.802 -16.404 -15.831
   62    HD2  TYR  10           2HD      TYR  10  -8.159 -13.816 -13.681
   63    HE1  TYR  10           1HE      TYR  10 -10.584 -18.144 -13.990
   64    HE2  TYR  10           2HE      TYR  10  -7.950 -15.564 -11.847
   65    HH   TYR  10           HH       TYR  10  -9.998 -17.905 -11.350
   66    H    SER  11           H        SER  11  -8.798 -11.307 -16.808
   67    HA   SER  11           HA       SER  11  -8.712 -10.346 -18.793
   68   1HB   SER  11          1HB       SER  11 -10.692 -12.087 -19.382
   69   2HB   SER  11          2HB       SER  11 -11.637 -10.612 -19.428
   70    HG   SER  11           HG       SER  11 -10.075 -11.577 -21.361
   71    H    LYS  12           H        LYS  12  -8.331  -8.356 -17.702
   72    HA   LYS  12           HA       LYS  12  -8.794  -6.158 -17.546
   73   1HB   LYS  12          1HB       LYS  12 -11.766  -6.644 -17.697
   74   2HB   LYS  12          2HB       LYS  12 -10.870  -5.188 -18.078
   75   1HG   LYS  12          1HG       LYS  12  -9.771  -7.216 -19.752
   76   2HG   LYS  12          2HG       LYS  12 -11.506  -7.457 -19.803
   77   1HD   LYS  12          1HD       LYS  12 -11.911  -5.408 -20.823
   78   2HD   LYS  12          2HD       LYS  12 -10.566  -4.618 -20.025
   79   1HE   LYS  12          1HE       LYS  12  -9.143  -5.066 -21.750
   80   2HE   LYS  12          2HE       LYS  12  -9.629  -6.748 -21.821
   81   1HZ   LYS  12          1HZ       LYS  12 -10.982  -4.456 -23.123
   82   2HZ   LYS  12          2HZ       LYS  12 -10.325  -5.758 -23.848
   83    H    TYR  13           H        TYR  13 -10.876  -8.550 -15.854
   84    HA   TYR  13           HA       TYR  13 -10.980  -6.867 -13.502
   85   1HB   TYR  13          1HB       TYR  13 -12.054  -9.508 -14.564
   86   2HB   TYR  13          2HB       TYR  13 -12.025  -9.315 -12.822
   87    HD1  TYR  13           1HD      TYR  13 -12.939  -6.782 -12.124
   88    HD2  TYR  13           2HD      TYR  13 -14.104  -9.078 -15.541
   89    HE1  TYR  13           1HE      TYR  13 -15.141  -5.515 -12.234
   90    HE2  TYR  13           2HE      TYR  13 -16.301  -7.804 -15.640
   91    HH   TYR  13           HH       TYR  13 -17.737  -6.549 -13.791
   92    H    LEU  14           H        LEU  14  -8.297  -7.481 -14.236
   93    HA   LEU  14           HA       LEU  14  -7.499  -9.710 -12.578
   94   1HB   LEU  14          1HB       LEU  14  -6.293  -8.003 -14.655
   95   2HB   LEU  14          2HB       LEU  14  -5.201  -8.479 -13.370
   96    HG   LEU  14           HG       LEU  14  -5.126  -9.989 -15.320
   97   1HD1  LEU  14          1HD1      LEU  14  -5.033 -12.021 -14.107
   98   2HD1  LEU  14          2HD1      LEU  14  -4.621 -10.728 -12.955
   99   3HD1  LEU  14          3HD1      LEU  14  -6.243 -11.461 -12.927
  100   1HD2  LEU  14          1HD2      LEU  14  -8.049 -10.163 -14.786
  101   2HD2  LEU  14          2HD2      LEU  14  -7.152 -10.190 -16.323
  102   3HD2  LEU  14          3HD2      LEU  14  -7.217 -11.649 -15.305
  103    H    ASP  15           H        ASP  15  -7.287  -9.505 -10.421
  104    HA   ASP  15           HA       ASP  15  -7.645  -7.304  -8.993
  105   1HB   ASP  15          1HB       ASP  15  -6.267  -8.394  -7.191
  106   2HB   ASP  15          2HB       ASP  15  -7.411  -9.486  -7.944
  107    HD2  ASP  15           HD       ASP  15  -3.877 -10.529  -7.431
  108    H    SER  16           H        SER  16  -6.602  -5.308  -9.069
  109    HA   SER  16           HA       SER  16  -5.071  -3.821  -9.595
  110   1HB   SER  16          1HB       SER  16  -3.106  -3.861  -8.106
  111   2HB   SER  16          2HB       SER  16  -4.548  -4.350  -7.239
  112    HG   SER  16           HG       SER  16  -3.151  -6.476  -8.446
  113    H    ARG  17           H        ARG  17  -4.706  -4.120 -11.854
  114    HA   ARG  17           HA       ARG  17  -2.094  -5.087 -12.432
  115   1HB   ARG  17          1HB       ARG  17  -4.078  -6.981 -12.661
  116   2HB   ARG  17          2HB       ARG  17  -4.143  -6.279 -14.265
  117   1HG   ARG  17          1HG       ARG  17  -1.535  -6.558 -14.272
  118   2HG   ARG  17          2HG       ARG  17  -1.781  -7.625 -12.904
  119   1HD   ARG  17          1HD       ARG  17  -2.756  -9.284 -14.190
  120   2HD   ARG  17          2HD       ARG  17  -3.574  -8.143 -15.239
  121    HE   ARG  17           HE       ARG  17  -0.663  -8.130 -15.575
  122   1HH1  ARG  17          2HH2      ARG  17  -3.683  -9.672 -16.602
  123   2HH1  ARG  17          1HH2      ARG  17  -3.030 -10.232 -18.106
  124   1HH2  ARG  17          1HH       ARG  17  -0.746  -9.749 -18.646
  125    H    ARG  18           H        ARG  18  -2.895  -2.491 -12.535
  126    HA   ARG  18           HA       ARG  18  -4.197  -1.737 -14.859
  127   1HB   ARG  18          1HB       ARG  18  -4.084  -0.067 -13.186
  128   2HB   ARG  18          2HB       ARG  18  -2.387  -0.358 -12.863
  129   1HG   ARG  18          1HG       ARG  18  -1.682   1.043 -14.549
  130   2HG   ARG  18          2HG       ARG  18  -2.959   0.547 -15.641
  131   1HD   ARG  18          1HD       ARG  18  -4.446   1.871 -13.750
  132   2HD   ARG  18          2HD       ARG  18  -2.940   2.757 -13.622
  133    HE   ARG  18           HE       ARG  18  -3.815   2.351 -16.392
  134   1HH1  ARG  18          2HH2      ARG  18  -4.065   4.460 -13.555
  135   2HH1  ARG  18          1HH2      ARG  18  -4.529   5.852 -14.476
  136   1HH2  ARG  18          1HH       ARG  18  -4.735   5.668 -16.857
  137    H    ALA  19           H        ALA  19  -0.664  -1.364 -14.021
  138    HA   ALA  19           HA       ALA  19  -0.083  -1.829 -16.866
  139   1HB   ALA  19          1HB       ALA  19   0.126   0.587 -16.035
  140   2HB   ALA  19          2HB       ALA  19   1.481   0.016 -15.030
  141   3HB   ALA  19          3HB       ALA  19   1.572  -0.112 -16.803
  142    H    GLN  20           H        GLN  20   1.454  -3.377 -17.288
  143    HA   GLN  20           HA       GLN  20   3.215  -4.135 -15.143
  144   1HB   GLN  20          1HB       GLN  20   0.891  -5.548 -15.339
  145   2HB   GLN  20          2HB       GLN  20   1.869  -6.449 -16.480
  146   1HG   GLN  20          1HG       GLN  20   2.544  -7.569 -14.586
  147   2HG   GLN  20          2HG       GLN  20   3.683  -6.242 -14.467
  148   1HE2  GLN  20          1HE2      GLN  20   0.818  -7.717 -13.219
  149   2HE2  GLN  20          2HE2      GLN  20   0.605  -6.732 -11.810
  150    H    ASP  21           H        ASP  21   3.100  -2.925 -18.016
  151    HA   ASP  21           HA       ASP  21   5.256  -4.595 -18.988
  152   1HB   ASP  21          1HB       ASP  21   3.187  -5.238 -20.237
  153   2HB   ASP  21          2HB       ASP  21   2.936  -3.563 -20.688
  154    HD2  ASP  21           HD       ASP  21   3.165  -4.029 -22.932
  155    H    PHE  22           H        PHE  22   3.287  -1.567 -19.182
  156    HA   PHE  22           HA       PHE  22   5.324  -0.128 -20.574
  157   1HB   PHE  22          1HB       PHE  22   2.953   0.921 -18.932
  158   2HB   PHE  22          2HB       PHE  22   3.694   1.700 -20.316
  159    HD1  PHE  22           1HD      PHE  22   1.298  -0.793 -19.214
  160    HD2  PHE  22           2HD      PHE  22   3.278   0.839 -22.594
  161    HE1  PHE  22           1HE      PHE  22  -0.398  -1.862 -20.724
  162    HE2  PHE  22           2HE      PHE  22   1.582  -0.230 -24.104
  163    HZ   PHE  22           HZ       PHE  22  -0.236  -1.568 -23.151
  164    H    VAL  23           H        VAL  23   4.649  -0.957 -17.249
  165    HA   VAL  23           HA       VAL  23   5.729   1.315 -16.008
  166    HB   VAL  23           HB       VAL  23   5.642  -1.548 -15.036
  167   1HG1  VAL  23          1HG1      VAL  23   6.861   0.609 -13.852
  168   2HG1  VAL  23          2HG1      VAL  23   5.237   0.658 -13.125
  169   3HG1  VAL  23          3HG1      VAL  23   6.229  -0.814 -12.990
  170   1HG2  VAL  23          1HG2      VAL  23   3.523   0.581 -15.223
  171   2HG2  VAL  23          2HG2      VAL  23   3.421  -1.158 -15.591
  172   3HG2  VAL  23          3HG2      VAL  23   3.481  -0.608 -13.899
  173    H    GLN  24           H        GLN  24   7.149  -1.232 -17.886
  174    HA   GLN  24           HA       GLN  24   9.673  -1.120 -16.584
  175   1HB   GLN  24          1HB       GLN  24   8.385  -2.841 -18.423
  176   2HB   GLN  24          2HB       GLN  24   9.738  -2.173 -19.315
  177   1HG   GLN  24          1HG       GLN  24  10.190  -3.170 -16.492
  178   2HG   GLN  24          2HG       GLN  24  10.058  -4.336 -17.794
  179   1HE2  GLN  24          1HE2      GLN  24  12.025  -5.022 -18.198
  180   2HE2  GLN  24          2HE2      GLN  24  13.422  -4.049 -18.516
  181    H    TRP  25           H        TRP  25   8.151   1.281 -18.056
  182    HA   TRP  25           HA       TRP  25  10.550   2.174 -19.506
  183   1HB   TRP  25          1HB       TRP  25   8.741   1.734 -21.063
  184   2HB   TRP  25          2HB       TRP  25   7.647   2.738 -20.131
  185    HD1  TRP  25           HD       TRP  25  11.084   3.302 -21.932
  186    HE1  TRP  25           1HE      TRP  25  11.125   5.664 -23.109
  187    HE3  TRP  25           3HE      TRP  25   6.463   4.742 -20.375
  188    HZ2  TRP  25           2HZ      TRP  25   9.262   7.821 -23.253
  189    HZ3  TRP  25           3HZ      TRP  25   5.649   6.991 -21.078
  190    HH2  TRP  25           HH       TRP  25   6.967   8.510 -22.467
  191    H    LEU  26           H        LEU  26   7.582   3.141 -17.647
  192    HA   LEU  26           HA       LEU  26   8.543   5.731 -17.084
  193   1HB   LEU  26          1HB       LEU  26   6.448   4.102 -15.641
  194   2HB   LEU  26          2HB       LEU  26   6.678   5.836 -15.528
  195    HG   LEU  26           HG       LEU  26   4.874   5.639 -16.965
  196   1HD1  LEU  26          1HD1      LEU  26   6.442   7.152 -17.954
  197   2HD1  LEU  26          2HD1      LEU  26   7.342   5.815 -18.710
  198   3HD1  LEU  26          3HD1      LEU  26   5.694   6.202 -19.260
  199   1HD2  LEU  26          1HD2      LEU  26   4.377   3.922 -18.390
  200   2HD2  LEU  26          2HD2      LEU  26   6.082   3.606 -18.792
  201   3HD2  LEU  26          3HD2      LEU  26   5.422   3.068 -17.229
  202    H    MET  27           H        MET  27   9.535   2.646 -16.018
  203    HA   MET  27           HA       MET  27  10.950   1.989 -14.503
  204   1HB   MET  27          1HB       MET  27  11.520   4.867 -14.797
  205   2HB   MET  27          2HB       MET  27  11.889   4.332 -13.169
  206   1HG   MET  27          1HG       MET  27  13.346   2.534 -14.042
  207   2HG   MET  27          2HG       MET  27  12.902   2.930 -15.690
  208   1HE   MET  27          1HE       MET  27  14.516   6.262 -16.430
  209   2HE   MET  27          2HE       MET  27  13.261   5.059 -16.814
  210   3HE   MET  27          3HE       MET  27  12.948   6.311 -15.589
  211    H    ASN  28           H        ASN  28   9.030   1.142 -13.348
  212    HA   ASN  28           HA       ASN  28   8.787   2.484 -10.782
  213   1HB   ASN  28          1HB       ASN  28   6.706   2.262 -12.742
  214   2HB   ASN  28          2HB       ASN  28   6.311   1.098 -11.493
  215   1HD2  ASN  28          1HD2      ASN  28   4.884   1.919 -10.175
  216   2HD2  ASN  28          2HD2      ASN  28   4.887   3.502  -9.474
  217    H    THR  29           H        THR  29   8.137  -0.449 -12.825
  218    HA   THR  29           HA       THR  29   7.527  -2.365 -11.086
  219    HB   THR  29           HB       THR  29   9.809  -2.840 -13.031
  220    HG1  THR  29           1HG      THR  29   8.208  -2.473 -14.702
  221   1HG2  THR  29          1HG2      THR  29   8.520  -4.799 -13.625
  222   2HG2  THR  29          2HG2      THR  29   8.492  -4.733 -11.846
  223   3HG2  THR  29          3HG2      THR  29   7.078  -4.186 -12.780
  Start of MODEL   17
    1    H    HIS   1           H        HIS   1 -16.260   4.948   1.809
    2    HA   HIS   1           HA       HIS   1 -16.009   3.288   0.272
    3   1HB   HIS   1          1HB       HIS   1 -16.119   1.596   2.707
    4   2HB   HIS   1          2HB       HIS   1 -16.739   0.860   1.243
    5    HD1  HIS   1           1HD      HIS   1 -13.560   2.561   2.517
    6    HD2  HIS   1           2HD      HIS   1 -14.809  -0.117  -0.460
    7    HE1  HIS   1           1HE      HIS   1 -11.436   1.696   1.397
    8    H    SER   2           H        SER   2 -17.687   1.882  -0.912
    9    HA   SER   2           HA       SER   2 -20.298   1.813   0.034
   10   1HB   SER   2          1HB       SER   2 -20.117   4.299  -0.325
   11   2HB   SER   2          2HB       SER   2 -19.776   4.009  -2.019
   12    HG   SER   2           HG       SER   2 -22.217   3.624  -0.570
   13    H    GLN   3           H        GLN   3 -18.461   2.475  -3.043
   14    HA   GLN   3           HA       GLN   3 -18.981  -0.161  -3.935
   15   1HB   GLN   3          1HB       GLN   3 -21.078   1.479  -4.450
   16   2HB   GLN   3          2HB       GLN   3 -20.094   1.863  -5.848
   17   1HG   GLN   3          1HG       GLN   3 -19.976  -0.968  -5.616
   18   2HG   GLN   3          2HG       GLN   3 -21.649  -0.553  -5.298
   19   1HE2  GLN   3          1HE2      GLN   3 -22.564  -1.218  -7.141
   20   2HE2  GLN   3          2HE2      GLN   3 -22.245  -0.571  -8.715
   21    H    GLY   4           H        GLY   4 -18.079  -0.408  -6.306
   22   1HA   GLY   4          1HA       GLY   4 -16.676   0.890  -7.923
   23   2HA   GLY   4          2HA       GLY   4 -15.726   1.371  -6.530
   24    H    THR   5           H        THR   5 -13.955   0.145  -6.041
   25    HA   THR   5           HA       THR   5 -12.453  -1.495  -6.193
   26    HB   THR   5           HB       THR   5 -13.249  -3.631  -5.359
   27    HG1  THR   5           1HG      THR   5 -14.931  -4.169  -6.767
   28   1HG2  THR   5          1HG2      THR   5 -15.416  -1.654  -4.496
   29   2HG2  THR   5          2HG2      THR   5 -14.795  -3.047  -3.579
   30   3HG2  THR   5          3HG2      THR   5 -13.766  -1.617  -3.830
   31    H    PHE   6           H        PHE   6 -11.666  -3.479  -7.422
   32    HA   PHE   6           HA       PHE   6 -12.744  -3.321 -10.150
   33   1HB   PHE   6          1HB       PHE   6 -10.170  -4.135 -10.488
   34   2HB   PHE   6          2HB       PHE   6 -10.569  -2.433 -10.362
   35    HD1  PHE   6           1HD      PHE   6 -10.203  -1.234  -8.218
   36    HD2  PHE   6           2HD      PHE   6  -8.920  -5.240  -8.778
   37    HE1  PHE   6           1HE      PHE   6  -8.683  -1.025  -6.232
   38    HE2  PHE   6           2HE      PHE   6  -7.400  -5.031  -6.792
   39    HZ   PHE   6           HZ       PHE   6  -7.299  -2.926  -5.543
   40    H    THR   7           H        THR   7 -11.321  -5.358  -7.557
   41    HA   THR   7           HA       THR   7 -11.043  -7.747  -8.832
   42    HB   THR   7           HB       THR   7 -10.679  -6.955  -6.334
   43    HG1  THR   7           1HG      THR   7 -11.811  -9.558  -7.092
   44   1HG2  THR   7          1HG2      THR   7 -12.410  -7.234  -4.832
   45   2HG2  THR   7          2HG2      THR   7 -13.449  -6.978  -6.254
   46   3HG2  THR   7          3HG2      THR   7 -13.068  -8.631  -5.717
   47    H    SER   8           H        SER   8 -12.294  -9.462  -9.497
   48    HA   SER   8           HA       SER   8 -14.051 -10.233 -10.572
   49   1HB   SER   8          1HB       SER   8 -15.843 -10.975  -9.092
   50   2HB   SER   8          2HB       SER   8 -14.315 -11.093  -8.242
   51    HG   SER   8           HG       SER   8 -15.505  -8.599  -7.896
   52    H    ASP   9           H        ASP   9 -13.948  -7.915 -11.716
   53    HA   ASP   9           HA       ASP   9 -16.585  -7.195 -12.179
   54   1HB   ASP   9          1HB       ASP   9 -15.951  -6.010  -9.899
   55   2HB   ASP   9          2HB       ASP   9 -15.024  -4.922 -10.912
   56    HD2  ASP   9           HD       ASP   9 -17.739  -3.159 -11.964
   57    H    TYR  10           H        TYR  10 -13.251  -5.728 -11.937
   58    HA   TYR  10           HA       TYR  10 -13.434  -4.348 -14.388
   59   1HB   TYR  10          1HB       TYR  10 -11.157  -3.806 -13.804
   60   2HB   TYR  10          2HB       TYR  10 -11.876  -4.149 -12.243
   61    HD1  TYR  10           1HD      TYR  10  -8.899  -4.386 -13.478
   62    HD2  TYR  10           2HD      TYR  10 -11.960  -7.156 -12.356
   63    HE1  TYR  10           1HE      TYR  10  -7.139  -6.170 -13.054
   64    HE2  TYR  10           2HE      TYR  10 -10.190  -8.931 -11.935
   65    HH   TYR  10           HH       TYR  10  -8.090  -9.462 -12.155
   66    H    SER  11           H        SER  11 -12.328  -4.764 -16.402
   67    HA   SER  11           HA       SER  11 -10.766  -6.712 -17.140
   68   1HB   SER  11          1HB       SER  11 -13.398  -7.905 -16.451
   69   2HB   SER  11          2HB       SER  11 -12.787  -8.384 -18.022
   70    HG   SER  11           HG       SER  11 -12.102  -9.757 -16.174
   71    H    LYS  12           H        LYS  12 -14.241  -6.156 -18.099
   72    HA   LYS  12           HA       LYS  12 -14.051  -6.122 -20.750
   73   1HB   LYS  12          1HB       LYS  12 -15.836  -5.076 -18.799
   74   2HB   LYS  12          2HB       LYS  12 -15.607  -3.822 -20.001
   75   1HG   LYS  12          1HG       LYS  12 -15.970  -6.592 -21.078
   76   2HG   LYS  12          2HG       LYS  12 -17.372  -5.900 -20.287
   77   1HD   LYS  12          1HD       LYS  12 -17.477  -4.056 -21.805
   78   2HD   LYS  12          2HD       LYS  12 -15.827  -4.290 -22.348
   79   1HE   LYS  12          1HE       LYS  12 -17.419  -6.707 -22.816
   80   2HE   LYS  12          2HE       LYS  12 -18.180  -5.313 -23.557
   81   1HZ   LYS  12          1HZ       LYS  12 -16.499  -6.399 -25.003
   82   2HZ   LYS  12          2HZ       LYS  12 -16.131  -4.836 -24.728
   83    H    TYR  13           H        TYR  13 -13.288  -3.256 -18.654
   84    HA   TYR  13           HA       TYR  13 -12.051  -1.989 -20.969
   85   1HB   TYR  13          1HB       TYR  13 -11.950  -0.084 -19.240
   86   2HB   TYR  13          2HB       TYR  13 -13.576  -0.667 -19.534
   87    HD1  TYR  13           1HD      TYR  13 -10.711  -0.907 -17.167
   88    HD2  TYR  13           2HD      TYR  13 -14.896  -1.554 -17.773
   89    HE1  TYR  13           1HE      TYR  13 -11.010  -1.348 -14.681
   90    HE2  TYR  13           2HE      TYR  13 -15.181  -1.992 -15.285
   91    HH   TYR  13           HH       TYR  13 -13.317  -1.055 -13.066
   92    H    LEU  14           H        LEU  14 -11.239  -3.882 -18.158
   93    HA   LEU  14           HA       LEU  14  -9.331  -4.367 -17.145
   94   1HB   LEU  14          1HB       LEU  14  -8.772  -4.270 -20.022
   95   2HB   LEU  14          2HB       LEU  14  -7.340  -4.130 -19.021
   96    HG   LEU  14           HG       LEU  14  -9.320  -6.326 -18.482
   97   1HD1  LEU  14          1HD1      LEU  14  -7.913  -7.774 -20.016
   98   2HD1  LEU  14          2HD1      LEU  14  -9.021  -6.626 -20.806
   99   3HD1  LEU  14          3HD1      LEU  14  -7.281  -6.262 -20.711
  100   1HD2  LEU  14          1HD2      LEU  14  -6.396  -5.843 -17.952
  101   2HD2  LEU  14          2HD2      LEU  14  -7.703  -6.241 -16.811
  102   3HD2  LEU  14          3HD2      LEU  14  -7.081  -7.485 -17.921
  103    H    ASP  15           H        ASP  15  -9.209  -2.714 -15.603
  104    HA   ASP  15           HA       ASP  15  -8.474  -0.137 -16.140
  105   1HB   ASP  15          1HB       ASP  15  -8.922  -1.804 -13.839
  106   2HB   ASP  15          2HB       ASP  15  -7.415  -0.953 -13.566
  107    HD2  ASP  15           HD       ASP  15  -8.487   0.621 -11.936
  108    H    SER  16           H        SER  16  -6.310   0.887 -15.174
  109    HA   SER  16           HA       SER  16  -4.162   1.142 -15.342
  110   1HB   SER  16          1HB       SER  16  -4.489  -1.204 -13.890
  111   2HB   SER  16          2HB       SER  16  -3.361  -1.704 -15.134
  112    HG   SER  16           HG       SER  16  -1.934   0.005 -14.516
  113    H    ARG  17           H        ARG  17  -4.430   1.693 -17.646
  114    HA   ARG  17           HA       ARG  17  -3.671  -0.468 -19.423
  115   1HB   ARG  17          1HB       ARG  17  -5.750   1.167 -19.746
  116   2HB   ARG  17          2HB       ARG  17  -4.547   2.283 -20.360
  117   1HG   ARG  17          1HG       ARG  17  -4.568   1.216 -22.357
  118   2HG   ARG  17          2HG       ARG  17  -4.004  -0.252 -21.584
  119   1HD   ARG  17          1HD       ARG  17  -6.093  -0.794 -22.687
  120   2HD   ARG  17          2HD       ARG  17  -6.417  -0.781 -20.964
  121    HE   ARG  17           HE       ARG  17  -7.023   1.793 -21.607
  122   1HH1  ARG  17          2HH2      ARG  17  -7.933  -1.247 -23.183
  123   2HH1  ARG  17          1HH2      ARG  17  -9.432  -0.627 -23.790
  124   1HH2  ARG  17          1HH       ARG  17 -10.039   1.643 -23.322
  125    H    ARG  18           H        ARG  18  -3.000   3.037 -18.717
  126    HA   ARG  18           HA       ARG  18  -0.944   3.401 -20.426
  127   1HB   ARG  18          1HB       ARG  18  -1.842   4.605 -17.859
  128   2HB   ARG  18          2HB       ARG  18  -0.137   4.854 -18.182
  129   1HG   ARG  18          1HG       ARG  18  -0.819   5.648 -20.537
  130   2HG   ARG  18          2HG       ARG  18  -2.479   5.625 -19.978
  131   1HD   ARG  18          1HD       ARG  18  -2.058   7.326 -18.318
  132   2HD   ARG  18          2HD       ARG  18  -0.320   7.151 -18.463
  133    HE   ARG  18           HE       ARG  18  -1.656   7.936 -20.963
  134   1HH1  ARG  18          2HH2      ARG  18  -0.088   9.092 -18.003
  135   2HH1  ARG  18          1HH2      ARG  18   0.285  10.650 -18.662
  136   1HH2  ARG  18          1HH       ARG  18  -0.357  11.157 -20.915
  137    H    ALA  19           H        ALA  19  -0.662   2.480 -16.906
  138    HA   ALA  19           HA       ALA  19   2.090   1.996 -17.009
  139   1HB   ALA  19          1HB       ALA  19   1.825   1.299 -14.797
  140   2HB   ALA  19          2HB       ALA  19   0.400   2.342 -15.021
  141   3HB   ALA  19          3HB       ALA  19   0.230   0.573 -15.108
  142    H    GLN  20           H        GLN  20   1.539  -0.782 -15.603
  143    HA   GLN  20           HA       GLN  20   1.534  -2.895 -16.130
  144   1HB   GLN  20          1HB       GLN  20  -0.514  -2.207 -17.580
  145   2HB   GLN  20          2HB       GLN  20   0.576  -2.296 -18.950
  146   1HG   GLN  20          1HG       GLN  20   1.185  -4.685 -17.882
  147   2HG   GLN  20          2HG       GLN  20  -0.398  -4.516 -17.150
  148   1HE2  GLN  20          1HE2      GLN  20   0.189  -6.518 -18.937
  149   2HE2  GLN  20          2HE2      GLN  20  -0.698  -6.303 -20.410
  150    H    ASP  21           H        ASP  21   1.981  -3.517 -19.284
  151    HA   ASP  21           HA       ASP  21   4.590  -4.177 -19.090
  152   1HB   ASP  21          1HB       ASP  21   2.602  -3.849 -21.229
  153   2HB   ASP  21          2HB       ASP  21   4.214  -3.483 -21.811
  154    HD2  ASP  21           HD       ASP  21   2.117  -5.990 -21.290
  155    H    PHE  22           H        PHE  22   3.119  -1.031 -19.502
  156    HA   PHE  22           HA       PHE  22   5.347   0.201 -20.798
  157   1HB   PHE  22          1HB       PHE  22   2.610   0.718 -20.184
  158   2HB   PHE  22          2HB       PHE  22   3.483   1.890 -19.217
  159    HD1  PHE  22           1HD      PHE  22   2.554   0.882 -22.585
  160    HD2  PHE  22           2HD      PHE  22   4.867   3.610 -20.302
  161    HE1  PHE  22           1HE      PHE  22   2.797   2.361 -24.599
  162    HE2  PHE  22           2HE      PHE  22   5.111   5.089 -22.316
  163    HZ   PHE  22           HZ       PHE  22   4.073   4.447 -24.440
  164    H    VAL  23           H        VAL  23   4.414  -0.590 -17.498
  165    HA   VAL  23           HA       VAL  23   5.713   1.413 -16.106
  166    HB   VAL  23           HB       VAL  23   5.294  -1.509 -15.454
  167   1HG1  VAL  23          1HG1      VAL  23   5.319  -0.062 -13.070
  168   2HG1  VAL  23          2HG1      VAL  23   6.593  -1.153 -13.667
  169   3HG1  VAL  23          3HG1      VAL  23   6.691   0.594 -13.994
  170   1HG2  VAL  23          1HG2      VAL  23   3.216  -0.975 -14.647
  171   2HG2  VAL  23          2HG2      VAL  23   3.668   0.704 -14.269
  172   3HG2  VAL  23          3HG2      VAL  23   3.341   0.228 -15.952
  173    H    GLN  24           H        GLN  24   6.983  -1.077 -18.168
  174    HA   GLN  24           HA       GLN  24   9.508  -1.199 -16.866
  175   1HB   GLN  24          1HB       GLN  24   8.142  -2.545 -19.078
  176   2HB   GLN  24          2HB       GLN  24   9.795  -2.156 -19.510
  177   1HG   GLN  24          1HG       GLN  24  10.595  -3.240 -17.394
  178   2HG   GLN  24          2HG       GLN  24   8.941  -3.643 -16.981
  179   1HE2  GLN  24          1HE2      GLN  24  10.260  -5.757 -16.976
  180   2HE2  GLN  24          2HE2      GLN  24  10.178  -6.717 -18.416
  181    H    TRP  25           H        TRP  25   8.147   1.386 -18.146
  182    HA   TRP  25           HA       TRP  25  10.600   2.233 -19.529
  183   1HB   TRP  25          1HB       TRP  25   8.822   1.967 -21.152
  184   2HB   TRP  25          2HB       TRP  25   7.739   2.951 -20.187
  185    HD1  TRP  25           HD       TRP  25  11.240   3.496 -21.868
  186    HE1  TRP  25           1HE      TRP  25  11.395   5.922 -22.895
  187    HE3  TRP  25           3HE      TRP  25   6.635   5.010 -20.332
  188    HZ2  TRP  25           2HZ      TRP  25   9.615   8.152 -22.948
  189    HZ3  TRP  25           3HZ      TRP  25   5.921   7.326 -20.913
  190    HH2  TRP  25           HH       TRP  25   7.327   8.877 -22.174
  191    H    LEU  26           H        LEU  26   7.640   3.219 -17.670
  192    HA   LEU  26           HA       LEU  26   8.692   5.734 -16.950
  193   1HB   LEU  26          1HB       LEU  26   6.509   4.115 -15.631
  194   2HB   LEU  26          2HB       LEU  26   6.805   5.830 -15.421
  195    HG   LEU  26           HG       LEU  26   5.020   5.783 -16.894
  196   1HD1  LEU  26          1HD1      LEU  26   7.525   5.958 -18.584
  197   2HD1  LEU  26          2HD1      LEU  26   5.904   6.433 -19.144
  198   3HD1  LEU  26          3HD1      LEU  26   6.658   7.285 -17.775
  199   1HD2  LEU  26          1HD2      LEU  26   5.473   3.210 -17.291
  200   2HD2  LEU  26          2HD2      LEU  26   4.483   4.166 -18.420
  201   3HD2  LEU  26          3HD2      LEU  26   6.182   3.805 -18.811
  202    H    MET  27           H        MET  27   9.420   2.514 -15.962
  203    HA   MET  27           HA       MET  27  10.854   1.750 -14.508
  204   1HB   MET  27          1HB       MET  27  11.560   4.551 -14.695
  205   2HB   MET  27          2HB       MET  27  11.663   4.109 -13.003
  206   1HG   MET  27          1HG       MET  27  13.238   2.321 -13.466
  207   2HG   MET  27          2HG       MET  27  12.950   2.419 -15.192
  208   1HE   MET  27          1HE       MET  27  13.055   4.500 -16.430
  209   2HE   MET  27          2HE       MET  27  14.249   5.801 -16.210
  210   3HE   MET  27          3HE       MET  27  14.776   4.193 -16.762
  211    H    ASN  28           H        ASN  28   9.013   0.767 -13.419
  212    HA   ASN  28           HA       ASN  28   7.319   1.807 -11.698
  213   1HB   ASN  28          1HB       ASN  28   8.014  -0.738 -12.327
  214   2HB   ASN  28          2HB       ASN  28   8.748  -0.678 -10.737
  215   1HD2  ASN  28          1HD2      ASN  28   7.279  -2.237 -10.017
  216   2HD2  ASN  28          2HD2      ASN  28   5.640  -1.854  -9.606
  217    H    THR  29           H        THR  29  10.599   0.500 -10.759
  218    HA   THR  29           HA       THR  29  11.719   0.725  -8.803
  219    HB   THR  29           HB       THR  29  11.457   3.698  -9.065
  220    HG1  THR  29           1HG      THR  29  12.301   1.808 -11.150
  221   1HG2  THR  29          1HG2      THR  29  13.999   3.062  -9.804
  222   2HG2  THR  29          2HG2      THR  29  13.519   3.197  -8.095
  223   3HG2  THR  29          3HG2      THR  29  13.605   1.598  -8.872
  Start of MODEL   18
    1    H    HIS   1           H        HIS   1  -0.601  23.832  -7.987
    2    HA   HIS   1           HA       HIS   1  -1.338  22.265  -9.437
    3   1HB   HIS   1          1HB       HIS   1  -3.700  21.688  -8.866
    4   2HB   HIS   1          2HB       HIS   1  -2.648  21.931  -7.485
    5    HD1  HIS   1           1HD      HIS   1  -5.770  23.161  -9.053
    6    HD2  HIS   1           2HD      HIS   1  -3.109  24.435  -6.072
    7    HE1  HIS   1           1HE      HIS   1  -6.985  24.980  -7.741
    8    H    SER   2           H        SER   2  -2.141  21.790 -11.498
    9    HA   SER   2           HA       SER   2  -2.648  24.033 -13.100
   10   1HB   SER   2          1HB       SER   2  -3.062  22.260 -14.891
   11   2HB   SER   2          2HB       SER   2  -1.499  22.190 -14.102
   12    HG   SER   2           HG       SER   2  -3.303  20.225 -14.295
   13    H    GLN   3           H        GLN   3  -4.578  25.109 -13.269
   14    HA   GLN   3           HA       GLN   3  -6.971  23.568 -12.666
   15   1HB   GLN   3          1HB       GLN   3  -6.092  26.323 -12.096
   16   2HB   GLN   3          2HB       GLN   3  -7.707  26.267 -12.773
   17   1HG   GLN   3          1HG       GLN   3  -6.801  24.545 -10.419
   18   2HG   GLN   3          2HG       GLN   3  -7.614  26.087 -10.236
   19   1HE2  GLN   3          1HE2      GLN   3  -8.062  22.876 -10.209
   20   2HE2  GLN   3          2HE2      GLN   3  -9.726  22.742 -10.672
   21    H    GLY   4           H        GLY   4  -7.087  22.592 -14.805
   22   1HA   GLY   4          1HA       GLY   4  -8.553  22.792 -16.671
   23   2HA   GLY   4          2HA       GLY   4  -8.116  24.482 -16.824
   24    H    THR   5           H        THR   5  -7.557  21.359 -18.026
   25    HA   THR   5           HA       THR   5  -5.463  22.310 -19.732
   26    HB   THR   5           HB       THR   5  -3.944  20.327 -18.950
   27    HG1  THR   5           1HG      THR   5  -4.656  19.401 -17.041
   28   1HG2  THR   5          1HG2      THR   5  -3.681  22.894 -18.330
   29   2HG2  THR   5          2HG2      THR   5  -4.310  22.385 -16.745
   30   3HG2  THR   5          3HG2      THR   5  -2.800  21.681 -17.371
   31    H    PHE   6           H        PHE   6  -4.906  20.709 -21.426
   32    HA   PHE   6           HA       PHE   6  -7.313  19.350 -22.182
   33   1HB   PHE   6          1HB       PHE   6  -4.498  19.417 -23.422
   34   2HB   PHE   6          2HB       PHE   6  -5.970  18.983 -24.269
   35    HD1  PHE   6           1HD      PHE   6  -3.904  21.712 -23.068
   36    HD2  PHE   6           2HD      PHE   6  -7.640  20.723 -24.821
   37    HE1  PHE   6           1HE      PHE   6  -4.217  24.106 -23.753
   38    HE2  PHE   6           2HE      PHE   6  -7.952  23.117 -25.506
   39    HZ   PHE   6           HZ       PHE   6  -6.237  24.780 -24.965
   40    H    THR   7           H        THR   7  -3.830  18.304 -21.966
   41    HA   THR   7           HA       THR   7  -4.213  15.621 -22.217
   42    HB   THR   7           HB       THR   7  -2.068  17.142 -21.935
   43    HG1  THR   7           1HG      THR   7  -1.669  14.965 -22.303
   44   1HG2  THR   7          1HG2      THR   7  -2.742  17.613 -19.433
   45   2HG2  THR   7          2HG2      THR   7  -2.207  15.941 -19.140
   46   3HG2  THR   7          3HG2      THR   7  -1.058  17.146 -19.770
   47    H    SER   8           H        SER   8  -3.935  13.884 -20.481
   48    HA   SER   8           HA       SER   8  -4.914  12.761 -18.898
   49   1HB   SER   8          1HB       SER   8  -4.303  13.458 -16.815
   50   2HB   SER   8          2HB       SER   8  -3.550  14.791 -17.666
   51    HG   SER   8           HG       SER   8  -4.884  15.612 -15.986
   52    H    ASP   9           H        ASP   9  -6.872  12.945 -17.071
   53    HA   ASP   9           HA       ASP   9  -8.990  13.235 -16.687
   54   1HB   ASP   9          1HB       ASP   9  -9.354  15.483 -16.715
   55   2HB   ASP   9          2HB       ASP   9  -8.291  15.712 -18.089
   56    HD2  ASP   9           HD       ASP   9  -9.331  16.081 -20.057
   57    H    TYR  10           H        TYR  10  -8.619  14.238 -20.182
   58    HA   TYR  10           HA       TYR  10 -10.759  12.443 -20.932
   59   1HB   TYR  10          1HB       TYR  10 -10.641  13.741 -22.958
   60   2HB   TYR  10          2HB       TYR  10 -10.123  14.896 -21.747
   61    HD1  TYR  10           1HD      TYR  10  -9.519  14.941 -24.760
   62    HD2  TYR  10           2HD      TYR  10  -7.314  13.464 -21.404
   63    HE1  TYR  10           1HE      TYR  10  -7.342  15.297 -26.024
   64    HE2  TYR  10           2HE      TYR  10  -5.145  13.824 -22.680
   65    HH   TYR  10           HH       TYR  10  -4.933  14.108 -25.828
   66    H    SER  11           H        SER  11  -8.570  11.007 -19.842
   67    HA   SER  11           HA       SER  11  -6.554  10.208 -21.298
   68   1HB   SER  11          1HB       SER  11  -6.843   9.010 -19.313
   69   2HB   SER  11          2HB       SER  11  -8.530   8.663 -19.636
   70    HG   SER  11           HG       SER  11  -7.878   7.117 -21.247
   71    H    LYS  12           H        LYS  12  -9.995   9.320 -21.927
   72    HA   LYS  12           HA       LYS  12  -9.850   7.411 -23.770
   73   1HB   LYS  12          1HB       LYS  12 -11.815   8.554 -24.888
   74   2HB   LYS  12          2HB       LYS  12 -11.967   8.254 -23.169
   75   1HG   LYS  12          1HG       LYS  12 -10.819  10.746 -23.112
   76   2HG   LYS  12          2HG       LYS  12 -11.693  10.852 -24.627
   77   1HD   LYS  12          1HD       LYS  12 -13.749   9.941 -23.324
   78   2HD   LYS  12          2HD       LYS  12 -12.831  10.257 -21.865
   79   1HE   LYS  12          1HE       LYS  12 -12.486  12.664 -23.037
   80   2HE   LYS  12          2HE       LYS  12 -13.969  12.214 -23.855
   81   1HZ   LYS  12          1HZ       LYS  12 -15.027  12.849 -21.993
   82   2HZ   LYS  12          2HZ       LYS  12 -14.374  11.592 -21.189
   83    H    TYR  13           H        TYR  13  -9.618  10.928 -24.675
   84    HA   TYR  13           HA       TYR  13  -9.023  10.715 -27.277
   85   1HB   TYR  13          1HB       TYR  13  -8.213  12.431 -24.931
   86   2HB   TYR  13          2HB       TYR  13  -7.210  12.633 -26.353
   87    HD1  TYR  13           1HD      TYR  13  -7.819  14.273 -27.877
   88    HD2  TYR  13           2HD      TYR  13 -10.858  12.471 -25.464
   89    HE1  TYR  13           1HE      TYR  13  -9.550  15.850 -28.866
   90    HE2  TYR  13           2HE      TYR  13 -12.579  14.054 -26.461
   91    HH   TYR  13           HH       TYR  13 -12.922  15.379 -28.347
   92    H    LEU  14           H        LEU  14  -6.703  10.222 -24.548
   93    HA   LEU  14           HA       LEU  14  -4.505   9.803 -26.303
   94   1HB   LEU  14          1HB       LEU  14  -5.027   9.912 -23.432
   95   2HB   LEU  14          2HB       LEU  14  -3.856   8.680 -23.859
   96    HG   LEU  14           HG       LEU  14  -2.795  10.811 -23.274
   97   1HD1  LEU  14          1HD1      LEU  14  -1.465  11.093 -25.458
   98   2HD1  LEU  14          2HD1      LEU  14  -1.455   9.500 -24.664
   99   3HD1  LEU  14          3HD1      LEU  14  -2.487   9.778 -26.087
  100   1HD2  LEU  14          1HD2      LEU  14  -3.296  12.829 -24.150
  101   2HD2  LEU  14          2HD2      LEU  14  -3.636  12.171 -25.768
  102   3HD2  LEU  14          3HD2      LEU  14  -4.862  12.052 -24.483
  103    H    ASP  15           H        ASP  15  -3.318   7.747 -26.546
  104    HA   ASP  15           HA       ASP  15  -4.787   5.798 -27.607
  105   1HB   ASP  15          1HB       ASP  15  -2.094   6.191 -27.003
  106   2HB   ASP  15          2HB       ASP  15  -2.465   4.746 -26.084
  107    HD2  ASP  15           HD       ASP  15  -1.461   3.323 -29.139
  108    H    SER  16           H        SER  16  -5.227   3.489 -26.801
  109    HA   SER  16           HA       SER  16  -6.371   3.658 -24.184
  110   1HB   SER  16          1HB       SER  16  -7.258   1.360 -24.761
  111   2HB   SER  16          2HB       SER  16  -7.723   2.618 -25.889
  112    HG   SER  16           HG       SER  16  -6.210   0.336 -26.322
  113    H    ARG  17           H        ARG  17  -5.666   2.541 -22.334
  114    HA   ARG  17           HA       ARG  17  -4.213   1.651 -20.996
  115   1HB   ARG  17          1HB       ARG  17  -5.128  -0.387 -22.343
  116   2HB   ARG  17          2HB       ARG  17  -3.584  -0.394 -23.171
  117   1HG   ARG  17          1HG       ARG  17  -2.524  -0.411 -20.773
  118   2HG   ARG  17          2HG       ARG  17  -4.125  -0.855 -20.215
  119   1HD   ARG  17          1HD       ARG  17  -3.267  -2.461 -22.545
  120   2HD   ARG  17          2HD       ARG  17  -2.172  -2.622 -21.186
  121    HE   ARG  17           HE       ARG  17  -3.901  -3.623 -19.903
  122   1HH1  ARG  17          2HH2      ARG  17  -5.168  -2.452 -22.998
  123   2HH1  ARG  17          1HH2      ARG  17  -6.668  -3.304 -22.848
  124   1HH2  ARG  17          1HH       ARG  17  -7.065  -4.648 -20.903
  125    H    ARG  18           H        ARG  18  -3.019   3.811 -22.044
  126    HA   ARG  18           HA       ARG  18  -0.869   3.538 -23.655
  127   1HB   ARG  18          1HB       ARG  18  -1.901   5.500 -21.789
  128   2HB   ARG  18          2HB       ARG  18  -0.165   5.410 -21.572
  129   1HG   ARG  18          1HG       ARG  18  -1.462   5.683 -24.319
  130   2HG   ARG  18          2HG       ARG  18  -1.003   7.070 -23.352
  131   1HD   ARG  18          1HD       ARG  18   1.341   6.463 -23.408
  132   2HD   ARG  18          2HD       ARG  18   0.988   4.861 -24.024
  133    HE   ARG  18           HE       ARG  18   0.680   5.757 -26.192
  134   1HH1  ARG  18          2HH2      ARG  18   1.008   8.375 -23.828
  135   2HH1  ARG  18          1HH2      ARG  18   1.196   9.606 -25.031
  136   1HH2  ARG  18          1HH       ARG  18   1.147   8.998 -27.349
  137    H    ALA  19           H        ALA  19  -0.801   3.596 -20.007
  138    HA   ALA  19           HA       ALA  19   1.884   2.840 -19.815
  139   1HB   ALA  19          1HB       ALA  19   0.226   3.902 -18.094
  140   2HB   ALA  19          2HB       ALA  19  -0.204   2.216 -17.721
  141   3HB   ALA  19          3HB       ALA  19   1.472   2.775 -17.506
  142    H    GLN  20           H        GLN  20   0.928   0.631 -17.731
  143    HA   GLN  20           HA       GLN  20   0.972  -1.538 -17.656
  144   1HB   GLN  20          1HB       GLN  20  -1.182  -0.898 -19.302
  145   2HB   GLN  20          2HB       GLN  20  -0.337  -2.108 -20.247
  146   1HG   GLN  20          1HG       GLN  20  -1.818  -3.374 -18.882
  147   2HG   GLN  20          2HG       GLN  20  -0.265  -3.539 -18.089
  148   1HE2  GLN  20          1HE2      GLN  20  -2.379  -4.067 -16.614
  149   2HE2  GLN  20          2HE2      GLN  20  -2.728  -2.826 -15.457
  150    H    ASP  21           H        ASP  21   2.868  -2.637 -17.872
  151    HA   ASP  21           HA       ASP  21   4.427  -3.820 -18.869
  152   1HB   ASP  21          1HB       ASP  21   2.646  -3.673 -20.956
  153   2HB   ASP  21          2HB       ASP  21   3.995  -2.794 -21.648
  154    HD2  ASP  21           HD       ASP  21   3.064  -5.186 -22.577
  155    H    PHE  22           H        PHE  22   3.770  -0.656 -20.550
  156    HA   PHE  22           HA       PHE  22   6.502  -0.075 -20.969
  157   1HB   PHE  22          1HB       PHE  22   3.969   0.846 -21.762
  158   2HB   PHE  22          2HB       PHE  22   4.497   2.140 -20.705
  159    HD1  PHE  22           1HD      PHE  22   6.603   0.068 -22.959
  160    HD2  PHE  22           2HD      PHE  22   4.904   3.884 -22.209
  161    HE1  PHE  22           1HE      PHE  22   7.964   1.042 -24.829
  162    HE2  PHE  22           2HE      PHE  22   6.265   4.857 -24.080
  163    HZ   PHE  22           HZ       PHE  22   7.779   3.425 -25.368
  164    H    VAL  23           H        VAL  23   4.348   0.200 -18.222
  165    HA   VAL  23           HA       VAL  23   5.448   2.411 -16.949
  166    HB   VAL  23           HB       VAL  23   4.402  -0.069 -15.590
  167   1HG1  VAL  23          1HG1      VAL  23   3.927   2.823 -14.845
  168   2HG1  VAL  23          2HG1      VAL  23   3.729   1.365 -13.843
  169   3HG1  VAL  23          3HG1      VAL  23   5.359   1.926 -14.288
  170   1HG2  VAL  23          1HG2      VAL  23   2.268   1.738 -15.997
  171   2HG2  VAL  23          2HG2      VAL  23   3.067   1.546 -17.575
  172   3HG2  VAL  23          3HG2      VAL  23   2.475   0.115 -16.698
  173    H    GLN  24           H        GLN  24   6.774  -0.733 -17.644
  174    HA   GLN  24           HA       GLN  24   8.593  -0.696 -15.458
  175   1HB   GLN  24          1HB       GLN  24   7.740  -2.566 -17.487
  176   2HB   GLN  24          2HB       GLN  24   9.489  -2.461 -17.539
  177   1HG   GLN  24          1HG       GLN  24   9.057  -2.553 -14.812
  178   2HG   GLN  24          2HG       GLN  24   7.716  -3.523 -15.389
  179   1HE2  GLN  24          1HE2      GLN  24   8.076  -5.425 -16.510
  180   2HE2  GLN  24          2HE2      GLN  24   9.596  -6.254 -16.510
  181    H    TRP  25           H        TRP  25   8.376   1.463 -17.793
  182    HA   TRP  25           HA       TRP  25  11.283   1.573 -18.214
  183   1HB   TRP  25          1HB       TRP  25  10.195   0.894 -20.286
  184   2HB   TRP  25          2HB       TRP  25   9.115   2.271 -20.203
  185    HD1  TRP  25           HD       TRP  25  13.002   1.772 -20.329
  186    HE1  TRP  25           1HE      TRP  25  14.117   3.635 -21.829
  187    HE3  TRP  25           3HE      TRP  25   8.691   4.267 -21.355
  188    HZ2  TRP  25           2HZ      TRP  25  13.094   5.892 -23.244
  189    HZ3  TRP  25           3HZ      TRP  25   8.838   6.290 -22.804
  190    HH2  TRP  25           HH       TRP  25  10.942   7.111 -23.737
  191    H    LEU  26           H        LEU  26   8.118   3.350 -18.132
  192    HA   LEU  26           HA       LEU  26   9.352   5.871 -17.755
  193   1HB   LEU  26          1HB       LEU  26   6.514   5.007 -17.186
  194   2HB   LEU  26          2HB       LEU  26   7.091   6.655 -17.339
  195    HG   LEU  26           HG       LEU  26   6.069   6.243 -19.383
  196   1HD1  LEU  26          1HD1      LEU  26   7.890   6.064 -21.073
  197   2HD1  LEU  26          2HD1      LEU  26   8.222   7.233 -19.772
  198   3HD1  LEU  26          3HD1      LEU  26   9.013   5.639 -19.759
  199   1HD2  LEU  26          1HD2      LEU  26   6.058   3.670 -18.835
  200   2HD2  LEU  26          2HD2      LEU  26   5.888   4.252 -20.508
  201   3HD2  LEU  26          3HD2      LEU  26   7.460   3.649 -19.932
  202    H    MET  27           H        MET  27   8.458   3.178 -15.661
  203    HA   MET  27           HA       MET  27   9.944   4.149 -13.564
  204   1HB   MET  27          1HB       MET  27   8.073   4.695 -11.936
  205   2HB   MET  27          2HB       MET  27   8.180   5.846 -13.254
  206   1HG   MET  27          1HG       MET  27   6.109   5.293 -14.046
  207   2HG   MET  27          2HG       MET  27   6.436   3.575 -13.947
  208   1HE   MET  27          1HE       MET  27   3.548   5.747 -11.583
  209   2HE   MET  27          2HE       MET  27   4.370   6.136 -13.114
  210   3HE   MET  27          3HE       MET  27   3.374   4.666 -12.987
  211    H    ASN  28           H        ASN  28  10.525   1.864 -13.961
  212    HA   ASN  28           HA       ASN  28   8.595  -0.133 -13.529
  213   1HB   ASN  28          1HB       ASN  28  10.714  -1.620 -13.365
  214   2HB   ASN  28          2HB       ASN  28  10.501  -0.740 -14.866
  215   1HD2  ASN  28          1HD2      ASN  28  12.561  -1.447 -12.342
  216   2HD2  ASN  28          2HD2      ASN  28  13.769  -0.227 -12.566
  217    H    THR  29           H        THR  29  11.409   1.201 -11.640
  218    HA   THR  29           HA       THR  29  12.049   0.780  -9.508
  219    HB   THR  29           HB       THR  29   9.271   1.447  -8.606
  220    HG1  THR  29           1HG      THR  29   9.387   2.390 -10.761
  221   1HG2  THR  29          1HG2      THR  29  10.488   3.425  -7.652
  222   2HG2  THR  29          2HG2      THR  29  11.242   1.893  -7.148
  223   3HG2  THR  29          3HG2      THR  29  11.982   2.867  -8.441
  Start of MODEL   19
    1    H    HIS   1           H        HIS   1   4.397  18.505  -7.418
    2    HA   HIS   1           HA       HIS   1   2.678  19.986  -8.110
    3   1HB   HIS   1          1HB       HIS   1   4.405  20.954  -6.704
    4   2HB   HIS   1          2HB       HIS   1   5.418  21.279  -8.096
    5    HD1  HIS   1           1HD      HIS   1   4.878  23.698  -6.503
    6    HD2  HIS   1           2HD      HIS   1   2.170  22.377  -9.422
    7    HE1  HIS   1           1HE      HIS   1   3.468  25.727  -7.141
    8    H    SER   2           H        SER   2   5.581  20.631 -10.210
    9    HA   SER   2           HA       SER   2   3.713  20.722 -12.440
   10   1HB   SER   2          1HB       SER   2   4.284  23.044 -11.766
   11   2HB   SER   2          2HB       SER   2   5.992  22.681 -11.914
   12    HG   SER   2           HG       SER   2   4.898  21.947 -14.250
   13    H    GLN   3           H        GLN   3   7.271  20.925 -11.662
   14    HA   GLN   3           HA       GLN   3   7.676  18.553 -13.227
   15   1HB   GLN   3          1HB       GLN   3   8.279  21.234 -14.248
   16   2HB   GLN   3          2HB       GLN   3   9.725  20.247 -14.173
   17   1HG   GLN   3          1HG       GLN   3   7.990  18.417 -15.231
   18   2HG   GLN   3          2HG       GLN   3   7.262  19.889 -15.844
   19   1HE2  GLN   3          1HE2      GLN   3   7.807  19.330 -17.949
   20   2HE2  GLN   3          2HE2      GLN   3   9.413  19.482 -18.579
   21    H    GLY   4           H        GLY   4   9.666  17.467 -12.697
   22   1HA   GLY   4          1HA       GLY   4  11.892  17.818 -11.644
   23   2HA   GLY   4          2HA       GLY   4  11.039  18.630 -10.347
   24    H    THR   5           H        THR   5  11.121  17.310  -8.571
   25    HA   THR   5           HA       THR   5  11.533  14.650  -8.458
   26    HB   THR   5           HB       THR   5  10.228  14.850  -6.239
   27    HG1  THR   5           1HG      THR   5   9.675  17.268  -5.978
   28   1HG2  THR   5          1HG2      THR   5  12.519  15.491  -5.994
   29   2HG2  THR   5          2HG2      THR   5  12.331  16.886  -7.083
   30   3HG2  THR   5          3HG2      THR   5  11.626  16.930  -5.449
   31    H    PHE   6           H        PHE   6  10.104  12.794  -7.927
   32    HA   PHE   6           HA       PHE   6   7.641  12.995  -9.514
   33   1HB   PHE   6          1HB       PHE   6   8.264  10.348  -9.568
   34   2HB   PHE   6          2HB       PHE   6   8.969  11.463 -10.722
   35    HD1  PHE   6           1HD      PHE   6  11.286  12.303 -10.365
   36    HD2  PHE   6           2HD      PHE   6   9.604   9.274  -7.916
   37    HE1  PHE   6           1HE      PHE   6  13.583  11.665  -9.578
   38    HE2  PHE   6           2HE      PHE   6  11.901   8.635  -7.128
   39    HZ   PHE   6           HZ       PHE   6  13.862   9.838  -7.969
   40    H    THR   7           H        THR   7   9.286  11.633  -6.624
   41    HA   THR   7           HA       THR   7   7.268  10.039  -5.645
   42    HB   THR   7           HB       THR   7   9.751  10.601  -4.859
   43    HG1  THR   7           1HG      THR   7   8.871   9.857  -2.660
   44   1HG2  THR   7          1HG2      THR   7   8.121  12.192  -2.830
   45   2HG2  THR   7          2HG2      THR   7   9.892  12.050  -2.947
   46   3HG2  THR   7          3HG2      THR   7   8.993  13.002  -4.153
   47    H    SER   8           H        SER   8   5.165  10.461  -5.422
   48    HA   SER   8           HA       SER   8   4.296  12.342  -3.614
   49   1HB   SER   8          1HB       SER   8   4.975  13.983  -5.383
   50   2HB   SER   8          2HB       SER   8   3.873  13.213  -6.508
   51    HG   SER   8           HG       SER   8   2.637  13.890  -4.097
   52    H    ASP   9           H        ASP   9   2.175  11.798  -3.033
   53    HA   ASP   9           HA       ASP   9   0.223  10.842  -3.083
   54   1HB   ASP   9          1HB       ASP   9  -0.807  11.384  -5.033
   55   2HB   ASP   9          2HB       ASP   9   0.711  11.344  -5.907
   56    HD2  ASP   9           HD       ASP   9   0.096   9.248  -7.787
   57    H    TYR  10           H        TYR  10   2.276   9.143  -5.584
   58    HA   TYR  10           HA       TYR  10   1.510   6.615  -5.384
   59   1HB   TYR  10          1HB       TYR  10   4.415   7.597  -5.085
   60   2HB   TYR  10          2HB       TYR  10   3.920   6.104  -5.858
   61    HD1  TYR  10           1HD      TYR  10   5.368   8.975  -6.695
   62    HD2  TYR  10           2HD      TYR  10   1.758   6.884  -7.643
   63    HE1  TYR  10           1HE      TYR  10   5.259  10.166  -8.938
   64    HE2  TYR  10           2HE      TYR  10   1.661   8.082  -9.883
   65    HH   TYR  10           HH       TYR  10   2.458   9.827 -11.024
   66    H    SER  11           H        SER  11   2.194   4.692  -4.169
   67    HA   SER  11           HA       SER  11   2.980   3.619  -2.389
   68   1HB   SER  11          1HB       SER  11   4.441   5.772  -1.954
   69   2HB   SER  11          2HB       SER  11   3.232   6.150  -0.743
   70    HG   SER  11           HG       SER  11   5.235   4.188  -0.726
   71    H    LYS  12           H        LYS  12   0.909   2.682  -2.142
   72    HA   LYS  12           HA       LYS  12  -0.836   2.153  -0.841
   73   1HB   LYS  12          1HB       LYS  12   0.433   3.963   0.824
   74   2HB   LYS  12          2HB       LYS  12  -1.163   4.662   0.646
   75   1HG   LYS  12          1HG       LYS  12  -1.947   2.119   1.036
   76   2HG   LYS  12          2HG       LYS  12  -0.379   1.990   1.809
   77   1HD   LYS  12          1HD       LYS  12  -1.655   4.447   2.685
   78   2HD   LYS  12          2HD       LYS  12  -2.784   3.122   2.886
   79   1HE   LYS  12          1HE       LYS  12  -0.051   2.400   3.746
   80   2HE   LYS  12          2HE       LYS  12  -0.681   3.777   4.627
   81   1HZ   LYS  12          1HZ       LYS  12  -1.432   1.866   5.778
   82   2HZ   LYS  12          2HZ       LYS  12  -2.753   2.363   4.964
   83    H    TYR  13           H        TYR  13  -0.683   5.602  -1.923
   84    HA   TYR  13           HA       TYR  13  -3.491   5.493  -2.640
   85   1HB   TYR  13          1HB       TYR  13  -2.017   7.436  -1.574
   86   2HB   TYR  13          2HB       TYR  13  -1.367   7.643  -3.189
   87    HD1  TYR  13           1HD      TYR  13  -2.173   9.769  -3.802
   88    HD2  TYR  13           2HD      TYR  13  -4.896   6.858  -2.248
   89    HE1  TYR  13           1HE      TYR  13  -4.133  11.276  -4.394
   90    HE2  TYR  13           2HE      TYR  13  -6.847   8.375  -2.846
   91    HH   TYR  13           HH       TYR  13  -6.535  10.981  -4.913
   92    H    LEU  14           H        LEU  14  -1.594   3.676  -4.035
   93    HA   LEU  14           HA       LEU  14  -2.208   4.599  -6.725
   94   1HB   LEU  14          1HB       LEU  14  -0.077   4.460  -7.568
   95   2HB   LEU  14          2HB       LEU  14   0.157   5.275  -6.034
   96    HG   LEU  14           HG       LEU  14   0.816   2.413  -6.740
   97   1HD1  LEU  14          1HD1      LEU  14   2.745   3.416  -7.265
   98   2HD1  LEU  14          2HD1      LEU  14   2.321   4.910  -6.394
   99   3HD1  LEU  14          3HD1      LEU  14   2.997   3.524  -5.506
  100   1HD2  LEU  14          1HD2      LEU  14   0.018   1.995  -4.637
  101   2HD2  LEU  14          2HD2      LEU  14   1.689   2.469  -4.249
  102   3HD2  LEU  14          3HD2      LEU  14   0.364   3.641  -4.052
  103    H    ASP  15           H        ASP  15  -1.346   2.585  -8.258
  104    HA   ASP  15           HA       ASP  15  -1.441   0.067  -7.124
  105   1HB   ASP  15          1HB       ASP  15  -3.981   1.220  -7.157
  106   2HB   ASP  15          2HB       ASP  15  -3.968   0.321  -8.662
  107    HD2  ASP  15           HD       ASP  15  -5.359  -1.219  -5.819
  108    H    SER  16           H        SER  16  -2.437   2.190  -9.879
  109    HA   SER  16           HA       SER  16  -2.068   2.123 -12.016
  110   1HB   SER  16          1HB       SER  16   0.228   0.215 -11.385
  111   2HB   SER  16          2HB       SER  16   0.039   1.137 -12.863
  112    HG   SER  16           HG       SER  16   0.953   1.958 -10.338
  113    H    ARG  17           H        ARG  17  -3.518   1.137 -13.368
  114    HA   ARG  17           HA       ARG  17  -3.525  -1.773 -13.320
  115   1HB   ARG  17          1HB       ARG  17  -5.753   0.155 -12.937
  116   2HB   ARG  17          2HB       ARG  17  -6.102  -1.066 -14.145
  117   1HG   ARG  17          1HG       ARG  17  -4.873  -1.970 -11.542
  118   2HG   ARG  17          2HG       ARG  17  -6.560  -1.496 -11.529
  119   1HD   ARG  17          1HD       ARG  17  -7.050  -3.122 -13.355
  120   2HD   ARG  17          2HD       ARG  17  -5.358  -3.574 -13.423
  121    HE   ARG  17           HE       ARG  17  -6.274  -3.877 -10.724
  122   1HH1  ARG  17          2HH2      ARG  17  -6.670  -5.383 -13.907
  123   2HH1  ARG  17          1HH2      ARG  17  -7.032  -6.948 -13.258
  124   1HH2  ARG  17          1HH       ARG  17  -7.075  -7.253 -10.882
  125    H    ARG  18           H        ARG  18  -4.205   1.276 -15.131
  126    HA   ARG  18           HA       ARG  18  -4.835   0.208 -17.541
  127   1HB   ARG  18          1HB       ARG  18  -4.248   2.764 -16.509
  128   2HB   ARG  18          2HB       ARG  18  -3.060   2.559 -17.781
  129   1HG   ARG  18          1HG       ARG  18  -4.651   2.528 -19.467
  130   2HG   ARG  18          2HG       ARG  18  -5.850   1.725 -18.474
  131   1HD   ARG  18          1HD       ARG  18  -6.762   3.703 -17.764
  132   2HD   ARG  18          2HD       ARG  18  -5.193   4.427 -17.469
  133    HE   ARG  18           HE       ARG  18  -5.329   4.358 -20.231
  134   1HH1  ARG  18          2HH2      ARG  18  -7.481   5.636 -17.723
  135   2HH1  ARG  18          1HH2      ARG  18  -8.116   6.892 -18.732
  136   1HH2  ARG  18          1HH       ARG  18  -7.329   7.096 -20.987
  137    H    ALA  19           H        ALA  19  -1.556   1.585 -16.734
  138    HA   ALA  19           HA       ALA  19  -0.398  -0.139 -18.764
  139   1HB   ALA  19          1HB       ALA  19   0.037   2.432 -18.272
  140   2HB   ALA  19          2HB       ALA  19   1.171   1.783 -17.063
  141   3HB   ALA  19          3HB       ALA  19   1.368   1.366 -18.782
  142    H    GLN  20           H        GLN  20   0.817  -1.944 -18.335
  143    HA   GLN  20           HA       GLN  20   1.733  -2.303 -15.620
  144   1HB   GLN  20          1HB       GLN  20  -0.546  -3.381 -15.805
  145   2HB   GLN  20          2HB       GLN  20   0.087  -4.430 -17.058
  146   1HG   GLN  20          1HG       GLN  20   1.890  -4.491 -14.780
  147   2HG   GLN  20          2HG       GLN  20   0.256  -4.786 -14.220
  148   1HE2  GLN  20          1HE2      GLN  20   2.987  -6.176 -15.408
  149   2HE2  GLN  20          2HE2      GLN  20   2.364  -7.669 -16.029
  150    H    ASP  21           H        ASP  21   2.639  -1.902 -18.621
  151    HA   ASP  21           HA       ASP  21   4.655  -3.984 -18.441
  152   1HB   ASP  21          1HB       ASP  21   2.768  -3.401 -20.681
  153   2HB   ASP  21          2HB       ASP  21   4.439  -3.606 -21.166
  154    HD2  ASP  21           HD       ASP  21   1.954  -6.394 -20.254
  155    H    PHE  22           H        PHE  22   3.484  -0.849 -19.805
  156    HA   PHE  22           HA       PHE  22   6.058  -0.054 -20.723
  157   1HB   PHE  22          1HB       PHE  22   3.252   0.793 -20.725
  158   2HB   PHE  22          2HB       PHE  22   4.241   2.154 -20.234
  159    HD1  PHE  22           1HD      PHE  22   4.272  -0.522 -22.847
  160    HD2  PHE  22           2HD      PHE  22   4.988   3.552 -21.900
  161    HE1  PHE  22           1HE      PHE  22   4.834  -0.063 -25.250
  162    HE2  PHE  22           2HE      PHE  22   5.549   4.012 -24.303
  163    HZ   PHE  22           HZ       PHE  22   5.465   2.199 -25.949
  164    H    VAL  23           H        VAL  23   4.334   0.037 -17.663
  165    HA   VAL  23           HA       VAL  23   5.534   2.298 -16.546
  166    HB   VAL  23           HB       VAL  23   4.625  -0.229 -15.157
  167   1HG1  VAL  23          1HG1      VAL  23   5.110   0.856 -13.271
  168   2HG1  VAL  23          2HG1      VAL  23   5.672   2.266 -14.201
  169   3HG1  VAL  23          3HG1      VAL  23   3.961   2.138 -13.724
  170   1HG2  VAL  23          1HG2      VAL  23   2.491   1.396 -14.948
  171   2HG2  VAL  23          2HG2      VAL  23   3.101   1.928 -16.533
  172   3HG2  VAL  23          3HG2      VAL  23   2.687   0.217 -16.266
  173    H    GLN  24           H        GLN  24   6.829  -0.777 -17.483
  174    HA   GLN  24           HA       GLN  24   8.907  -0.748 -15.531
  175   1HB   GLN  24          1HB       GLN  24   7.848  -2.596 -17.503
  176   2HB   GLN  24          2HB       GLN  24   9.585  -2.477 -17.703
  177   1HG   GLN  24          1HG       GLN  24   9.980  -3.064 -15.373
  178   2HG   GLN  24          2HG       GLN  24   8.279  -2.909 -14.981
  179   1HE2  GLN  24          1HE2      GLN  24  10.744  -4.981 -15.857
  180   2HE2  GLN  24          2HE2      GLN  24   9.834  -6.385 -16.303
  181    H    TRP  25           H        TRP  25   8.373   1.476 -17.713
  182    HA   TRP  25           HA       TRP  25  11.192   1.643 -18.516
  183   1HB   TRP  25          1HB       TRP  25   9.949   0.959 -20.467
  184   2HB   TRP  25          2HB       TRP  25   8.769   2.231 -20.222
  185    HD1  TRP  25           HD       TRP  25  12.640   2.090 -20.823
  186    HE1  TRP  25           1HE      TRP  25  13.396   4.067 -22.398
  187    HE3  TRP  25           3HE      TRP  25   8.033   4.195 -21.267
  188    HZ2  TRP  25           2HZ      TRP  25  12.013   6.241 -23.626
  189    HZ3  TRP  25           3HZ      TRP  25   7.822   6.242 -22.673
  190    HH2  TRP  25           HH       TRP  25   9.717   7.264 -23.830
  191    H    LEU  26           H        LEU  26   8.014   3.326 -18.028
  192    HA   LEU  26           HA       LEU  26   9.225   5.878 -17.773
  193   1HB   LEU  26          1HB       LEU  26   6.481   4.824 -17.088
  194   2HB   LEU  26          2HB       LEU  26   6.946   6.506 -16.925
  195    HG   LEU  26           HG       LEU  26   5.933   6.563 -18.969
  196   1HD1  LEU  26          1HD1      LEU  26   7.600   6.661 -20.753
  197   2HD1  LEU  26          2HD1      LEU  26   8.215   7.393 -19.252
  198   3HD1  LEU  26          3HD1      LEU  26   8.755   5.767 -19.736
  199   1HD2  LEU  26          1HD2      LEU  26   5.379   4.185 -19.051
  200   2HD2  LEU  26          2HD2      LEU  26   5.941   4.772 -20.635
  201   3HD2  LEU  26          3HD2      LEU  26   7.028   3.810 -19.605
  202    H    MET  27           H        MET  27   8.366   3.216 -15.557
  203    HA   MET  27           HA       MET  27  10.168   4.040 -13.655
  204   1HB   MET  27          1HB       MET  27   8.627   4.870 -11.861
  205   2HB   MET  27          2HB       MET  27   8.578   5.926 -13.259
  206   1HG   MET  27          1HG       MET  27   6.600   3.993 -13.814
  207   2HG   MET  27          2HG       MET  27   6.431   4.278 -12.094
  208   1HE   MET  27          1HE       MET  27   4.530   6.079 -11.489
  209   2HE   MET  27          2HE       MET  27   3.687   6.667 -12.943
  210   3HE   MET  27          3HE       MET  27   4.095   4.941 -12.788
  211    H    ASN  28           H        ASN  28  10.511   1.725 -13.944
  212    HA   ASN  28           HA       ASN  28   8.508  -0.130 -13.506
  213   1HB   ASN  28          1HB       ASN  28  10.352  -1.763 -13.324
  214   2HB   ASN  28          2HB       ASN  28  10.726  -0.614 -14.593
  215   1HD2  ASN  28          1HD2      ASN  28  12.676  -2.121 -13.421
  216   2HD2  ASN  28          2HD2      ASN  28  13.741  -1.135 -12.476
  217    H    THR  29           H        THR  29   8.167  -1.533 -11.577
  218    HA   THR  29           HA       THR  29   7.596  -1.585  -9.392
  219    HB   THR  29           HB       THR  29   9.737  -1.914  -8.005
  220    HG1  THR  29           1HG      THR  29  11.673  -1.762  -9.468
  221   1HG2  THR  29          1HG2      THR  29   9.782  -3.222 -10.775
  222   2HG2  THR  29          2HG2      THR  29  10.584  -3.835  -9.309
  223   3HG2  THR  29          3HG2      THR  29   8.807  -3.808  -9.406
  Start of MODEL   20
    1    H    HIS   1           H        HIS   1   6.979  18.511 -15.693
    2    HA   HIS   1           HA       HIS   1   6.867  20.239 -17.544
    3   1HB   HIS   1          1HB       HIS   1   9.146  19.668 -18.345
    4   2HB   HIS   1          2HB       HIS   1   8.562  18.098 -18.858
    5    HD1  HIS   1           1HD      HIS   1   8.188  21.793 -19.670
    6    HD2  HIS   1           2HD      HIS   1   7.275  18.048 -21.325
    7    HE1  HIS   1           1HE      HIS   1   7.412  22.238 -22.060
    8    H    SER   2           H        SER   2   4.945  20.030 -18.688
    9    HA   SER   2           HA       SER   2   3.896  17.311 -18.795
   10   1HB   SER   2          1HB       SER   2   2.347  19.866 -18.174
   11   2HB   SER   2          2HB       SER   2   1.632  18.276 -18.352
   12    HG   SER   2           HG       SER   2   3.556  19.087 -16.343
   13    H    GLN   3           H        GLN   3   2.952  16.702 -20.763
   14    HA   GLN   3           HA       GLN   3   3.169  18.705 -22.846
   15   1HB   GLN   3          1HB       GLN   3   3.889  15.983 -22.704
   16   2HB   GLN   3          2HB       GLN   3   2.471  15.997 -23.733
   17   1HG   GLN   3          1HG       GLN   3   3.784  16.696 -25.444
   18   2HG   GLN   3          2HG       GLN   3   4.001  18.218 -24.602
   19   1HE2  GLN   3          1HE2      GLN   3   5.912  17.129 -26.275
   20   2HE2  GLN   3          2HE2      GLN   3   7.320  16.683 -25.371
   21    H    GLY   4           H        GLY   4   1.385  19.567 -23.863
   22   1HA   GLY   4          1HA       GLY   4  -0.790  20.103 -24.129
   23   2HA   GLY   4          2HA       GLY   4  -0.990  18.393 -24.456
   24    H    THR   5           H        THR   5  -0.793  20.777 -21.734
   25    HA   THR   5           HA       THR   5  -1.584  19.273 -19.636
   26    HB   THR   5           HB       THR   5  -2.686  21.464 -18.867
   27    HG1  THR   5           1HG      THR   5  -2.413  23.170 -20.542
   28   1HG2  THR   5          1HG2      THR   5   0.100  21.229 -19.973
   29   2HG2  THR   5          2HG2      THR   5  -0.492  22.878 -19.659
   30   3HG2  THR   5          3HG2      THR   5  -0.429  21.688 -18.337
   31    H    PHE   6           H        PHE   6  -3.671  18.970 -18.525
   32    HA   PHE   6           HA       PHE   6  -5.428  17.560 -20.101
   33   1HB   PHE   6          1HB       PHE   6  -6.952  18.049 -17.995
   34   2HB   PHE   6          2HB       PHE   6  -5.435  17.217 -17.720
   35    HD1  PHE   6           1HD      PHE   6  -7.148  20.469 -17.449
   36    HD2  PHE   6           2HD      PHE   6  -3.686  18.227 -16.450
   37    HE1  PHE   6           1HE      PHE   6  -6.467  22.249 -15.816
   38    HE2  PHE   6           2HE      PHE   6  -3.004  20.008 -14.818
   39    HZ   PHE   6           HZ       PHE   6  -4.403  21.998 -14.520
   40    H    THR   7           H        THR   7  -5.539  21.003 -19.022
   41    HA   THR   7           HA       THR   7  -8.079  21.681 -19.727
   42    HB   THR   7           HB       THR   7  -6.049  23.035 -18.719
   43    HG1  THR   7           1HG      THR   7  -7.496  24.717 -19.063
   44   1HG2  THR   7          1HG2      THR   7  -5.066  24.619 -20.358
   45   2HG2  THR   7          2HG2      THR   7  -4.619  22.952 -20.793
   46   3HG2  THR   7          3HG2      THR   7  -5.912  23.788 -21.686
   47    H    SER   8           H        SER   8  -8.937  22.875 -21.627
   48    HA   SER   8           HA       SER   8  -9.489  22.918 -23.725
   49   1HB   SER   8          1HB       SER   8  -7.117  23.884 -23.887
   50   2HB   SER   8          2HB       SER   8  -6.590  22.303 -24.429
   51    HG   SER   8           HG       SER   8  -8.604  23.948 -25.711
   52    H    ASP   9           H        ASP   9  -9.757  21.555 -25.781
   53    HA   ASP   9           HA       ASP   9 -10.513  19.053 -25.192
   54   1HB   ASP   9          1HB       ASP   9  -9.303  19.780 -27.891
   55   2HB   ASP   9          2HB       ASP   9 -10.600  18.643 -27.581
   56    HD2  ASP   9           HD       ASP   9 -12.947  20.120 -27.953
   57    H    TYR  10           H        TYR  10  -9.152  17.533 -24.190
   58    HA   TYR  10           HA       TYR  10  -6.625  16.954 -25.574
   59   1HB   TYR  10          1HB       TYR  10  -5.556  16.896 -23.411
   60   2HB   TYR  10          2HB       TYR  10  -6.629  18.274 -23.269
   61    HD1  TYR  10           1HD      TYR  10  -5.639  15.194 -21.810
   62    HD2  TYR  10           2HD      TYR  10  -9.008  17.792 -22.262
   63    HE1  TYR  10           1HE      TYR  10  -6.735  14.140 -19.771
   64    HE2  TYR  10           2HE      TYR  10 -10.092  16.730 -20.222
   65    HH   TYR  10           HH       TYR  10  -9.031  15.477 -18.069
   66    H    SER  11           H        SER  11  -5.747  14.720 -24.521
   67    HA   SER  11           HA       SER  11  -6.146  12.619 -23.928
   68   1HB   SER  11          1HB       SER  11  -8.451  13.541 -22.988
   69   2HB   SER  11          2HB       SER  11  -9.122  12.806 -24.430
   70    HG   SER  11           HG       SER  11  -7.803  10.821 -23.670
   71    H    LYS  12           H        LYS  12  -7.978  14.146 -26.606
   72    HA   LYS  12           HA       LYS  12  -8.605  12.148 -28.243
   73   1HB   LYS  12          1HB       LYS  12  -8.162  13.663 -30.118
   74   2HB   LYS  12          2HB       LYS  12  -8.946  14.490 -28.787
   75   1HG   LYS  12          1HG       LYS  12  -6.791  15.431 -28.039
   76   2HG   LYS  12          2HG       LYS  12  -5.926  14.505 -29.250
   77   1HD   LYS  12          1HD       LYS  12  -6.776  15.804 -31.047
   78   2HD   LYS  12          2HD       LYS  12  -8.142  16.384 -30.115
   79   1HE   LYS  12          1HE       LYS  12  -6.006  17.331 -28.612
   80   2HE   LYS  12          2HE       LYS  12  -5.359  17.428 -30.238
   81   1HZ   LYS  12          1HZ       LYS  12  -6.498  19.404 -30.139
   82   2HZ   LYS  12          2HZ       LYS  12  -7.733  18.490 -30.679
   83    H    TYR  13           H        TYR  13  -5.264  13.400 -27.695
   84    HA   TYR  13           HA       TYR  13  -4.099  11.607 -29.565
   85   1HB   TYR  13          1HB       TYR  13  -2.056  12.597 -28.639
   86   2HB   TYR  13          2HB       TYR  13  -3.255  13.874 -28.600
   87    HD1  TYR  13           1HD      TYR  13  -1.190  11.619 -26.594
   88    HD2  TYR  13           2HD      TYR  13  -4.272  14.583 -26.457
   89    HE1  TYR  13           1HE      TYR  13  -0.804  11.915 -24.099
   90    HE2  TYR  13           2HE      TYR  13  -3.876  14.869 -23.962
   91    HH   TYR  13           HH       TYR  13  -1.670  12.746 -22.232
   92    H    LEU  14           H        LEU  14  -4.481  11.648 -25.965
   93    HA   LEU  14           HA       LEU  14  -2.958   9.571 -25.228
   94   1HB   LEU  14          1HB       LEU  14  -5.467  10.776 -24.299
   95   2HB   LEU  14          2HB       LEU  14  -5.245   9.117 -23.779
   96    HG   LEU  14           HG       LEU  14  -3.088  11.194 -23.394
   97   1HD1  LEU  14          1HD1      LEU  14  -5.669  11.010 -22.036
   98   2HD1  LEU  14          2HD1      LEU  14  -4.286  10.896 -20.922
   99   3HD1  LEU  14          3HD1      LEU  14  -4.442  12.298 -22.008
  100   1HD2  LEU  14          1HD2      LEU  14  -1.957   9.421 -22.680
  101   2HD2  LEU  14          2HD2      LEU  14  -3.088   9.334 -21.308
  102   3HD2  LEU  14          3HD2      LEU  14  -3.397   8.380 -22.778
  103    H    ASP  15           H        ASP  15  -3.210   7.264 -24.998
  104    HA   ASP  15           HA       ASP  15  -5.396   5.951 -26.137
  105   1HB   ASP  15          1HB       ASP  15  -3.904   6.854 -28.150
  106   2HB   ASP  15          2HB       ASP  15  -2.854   5.516 -27.727
  107    HD2  ASP  15           HD       ASP  15  -6.185   4.819 -29.749
  108    H    SER  16           H        SER  16  -5.420   4.099 -24.854
  109    HA   SER  16           HA       SER  16  -3.305   3.413 -23.239
  110   1HB   SER  16          1HB       SER  16  -5.945   2.284 -23.963
  111   2HB   SER  16          2HB       SER  16  -4.787   1.067 -23.460
  112    HG   SER  16           HG       SER  16  -4.870   3.393 -21.852
  113    H    ARG  17           H        ARG  17  -1.312   2.753 -23.983
  114    HA   ARG  17           HA       ARG  17  -1.004   0.317 -25.180
  115   1HB   ARG  17          1HB       ARG  17  -1.761   2.242 -27.110
  116   2HB   ARG  17          2HB       ARG  17  -0.024   2.117 -27.299
  117   1HG   ARG  17          1HG       ARG  17  -0.107  -0.178 -27.859
  118   2HG   ARG  17          2HG       ARG  17  -1.650  -0.424 -27.067
  119   1HD   ARG  17          1HD       ARG  17  -2.000   1.560 -29.153
  120   2HD   ARG  17          2HD       ARG  17  -1.162   0.181 -29.836
  121    HE   ARG  17           HE       ARG  17  -3.143  -1.071 -28.450
  122   1HH1  ARG  17          2HH2      ARG  17  -3.270   1.715 -30.637
  123   2HH1  ARG  17          1HH2      ARG  17  -4.889   1.389 -31.157
  124   1HH2  ARG  17          1HH       ARG  17  -6.052  -0.506 -30.262
  125    H    ARG  18           H        ARG  18   0.306   3.706 -25.220
  126    HA   ARG  18           HA       ARG  18   2.931   3.148 -25.403
  127   1HB   ARG  18          1HB       ARG  18   1.307   5.330 -24.140
  128   2HB   ARG  18          2HB       ARG  18   2.986   5.259 -23.641
  129   1HG   ARG  18          1HG       ARG  18   3.753   5.974 -25.676
  130   2HG   ARG  18          2HG       ARG  18   2.653   4.937 -26.563
  131   1HD   ARG  18          1HD       ARG  18   0.990   6.557 -26.683
  132   2HD   ARG  18          2HD       ARG  18   1.391   7.246 -25.122
  133    HE   ARG  18           HE       ARG  18   3.601   7.795 -26.778
  134   1HH1  ARG  18          2HH2      ARG  18   0.147   8.583 -26.760
  135   2HH1  ARG  18          1HH2      ARG  18   0.358  10.085 -27.595
  136   1HH2  ARG  18          1HH       ARG  18   2.562  10.767 -28.244
  137    H    ALA  19           H        ALA  19   1.022   3.537 -22.321
  138    HA   ALA  19           HA       ALA  19   3.127   2.818 -20.628
  139   1HB   ALA  19          1HB       ALA  19   1.521   2.955 -18.938
  140   2HB   ALA  19          2HB       ALA  19   0.804   3.976 -20.207
  141   3HB   ALA  19          3HB       ALA  19   0.226   2.309 -19.974
  142    H    GLN  20           H        GLN  20   1.158   0.759 -19.251
  143    HA   GLN  20           HA       GLN  20   0.882  -1.397 -19.152
  144   1HB   GLN  20          1HB       GLN  20   0.177  -1.084 -21.637
  145   2HB   GLN  20          2HB       GLN  20   1.752  -1.737 -22.043
  146   1HG   GLN  20          1HG       GLN  20   0.987  -3.841 -21.701
  147   2HG   GLN  20          2HG       GLN  20   0.629  -3.453 -20.030
  148   1HE2  GLN  20          1HE2      GLN  20  -1.408  -2.328 -19.580
  149   2HE2  GLN  20          2HE2      GLN  20  -2.817  -2.715 -20.511
  150    H    ASP  21           H        ASP  21   2.733  -3.112 -21.195
  151    HA   ASP  21           HA       ASP  21   4.559  -3.884 -19.363
  152   1HB   ASP  21          1HB       ASP  21   3.936  -4.813 -21.748
  153   2HB   ASP  21          2HB       ASP  21   5.233  -3.786 -22.325
  154    HD2  ASP  21           HD       ASP  21   5.405  -7.205 -20.677
  155    H    PHE  22           H        PHE  22   4.435  -0.963 -21.283
  156    HA   PHE  22           HA       PHE  22   7.248  -0.454 -21.273
  157   1HB   PHE  22          1HB       PHE  22   4.947   0.423 -22.619
  158   2HB   PHE  22          2HB       PHE  22   5.246   1.768 -21.536
  159    HD1  PHE  22           1HD      PHE  22   6.275   3.505 -22.631
  160    HD2  PHE  22           2HD      PHE  22   7.464  -0.459 -23.566
  161    HE1  PHE  22           1HE      PHE  22   8.003   4.398 -24.216
  162    HE2  PHE  22           2HE      PHE  22   9.193   0.434 -25.152
  163    HZ   PHE  22           HZ       PHE  22   9.442   2.852 -25.458
  164    H    VAL  23           H        VAL  23   4.542   0.036 -19.078
  165    HA   VAL  23           HA       VAL  23   5.393   2.283 -17.712
  166    HB   VAL  23           HB       VAL  23   3.926  -0.183 -16.758
  167   1HG1  VAL  23          1HG1      VAL  23   4.005   0.663 -14.697
  168   2HG1  VAL  23          2HG1      VAL  23   4.908   2.085 -15.273
  169   3HG1  VAL  23          3HG1      VAL  23   3.128   2.096 -15.284
  170   1HG2  VAL  23          1HG2      VAL  23   2.577   2.426 -17.317
  171   2HG2  VAL  23          2HG2      VAL  23   3.085   1.433 -18.704
  172   3HG2  VAL  23          3HG2      VAL  23   1.971   0.761 -17.490
  173    H    GLN  24           H        GLN  24   6.832  -0.869 -17.972
  174    HA   GLN  24           HA       GLN  24   8.173  -0.683 -15.459
  175   1HB   GLN  24          1HB       GLN  24   8.125  -2.633 -17.757
  176   2HB   GLN  24          2HB       GLN  24   9.485  -2.692 -16.653
  177   1HG   GLN  24          1HG       GLN  24   8.236  -3.712 -15.055
  178   2HG   GLN  24          2HG       GLN  24   7.016  -2.456 -15.127
  179   1HE2  GLN  24          1HE2      GLN  24   5.213  -3.639 -15.089
  180   2HE2  GLN  24          2HE2      GLN  24   4.735  -4.795 -16.287
  181    H    TRP  25           H        TRP  25   8.460   1.412 -17.729
  182    HA   TRP  25           HA       TRP  25  11.394   1.397 -17.703
  183   1HB   TRP  25          1HB       TRP  25  10.882   0.700 -19.896
  184   2HB   TRP  25          2HB       TRP  25   9.569   1.850 -20.054
  185    HD1  TRP  25           HD       TRP  25  13.444   2.105 -19.516
  186    HE1  TRP  25           1HE      TRP  25  14.433   4.113 -20.914
  187    HE3  TRP  25           3HE      TRP  25   8.987   3.691 -21.379
  188    HZ2  TRP  25           2HZ      TRP  25  13.266   6.095 -22.603
  189    HZ3  TRP  25           3HZ      TRP  25   8.999   5.669 -22.895
  190    HH2  TRP  25           HH       TRP  25  11.042   6.861 -23.513
  191    H    LEU  26           H        LEU  26   8.293   3.217 -18.150
  192    HA   LEU  26           HA       LEU  26   9.426   5.757 -17.829
  193   1HB   LEU  26          1HB       LEU  26   6.611   4.778 -17.331
  194   2HB   LEU  26          2HB       LEU  26   7.095   6.460 -17.413
  195    HG   LEU  26           HG       LEU  26   6.240   6.110 -19.520
  196   1HD1  LEU  26          1HD1      LEU  26   8.438   7.070 -19.768
  197   2HD1  LEU  26          2HD1      LEU  26   9.186   5.454 -19.788
  198   3HD1  LEU  26          3HD1      LEU  26   8.124   5.960 -21.124
  199   1HD2  LEU  26          1HD2      LEU  26   7.624   3.474 -19.947
  200   2HD2  LEU  26          2HD2      LEU  26   6.088   3.566 -19.053
  201   3HD2  LEU  26          3HD2      LEU  26   6.173   4.135 -20.738
  202    H    MET  27           H        MET  27   8.125   3.334 -15.516
  203    HA   MET  27           HA       MET  27   9.694   4.436 -13.465
  204   1HB   MET  27          1HB       MET  27   6.759   5.131 -13.657
  205   2HB   MET  27          2HB       MET  27   7.365   4.734 -12.061
  206   1HG   MET  27          1HG       MET  27   9.333   6.437 -12.774
  207   2HG   MET  27          2HG       MET  27   8.092   7.056 -13.845
  208   1HE   MET  27          1HE       MET  27   6.444   8.960 -12.964
  209   2HE   MET  27          2HE       MET  27   5.647   7.371 -13.043
  210   3HE   MET  27          3HE       MET  27   5.377   8.433 -11.640
  211    H    ASN  28           H        ASN  28  10.342   2.150 -13.628
  212    HA   ASN  28           HA       ASN  28   9.464   0.597 -11.662
  213   1HB   ASN  28          1HB       ASN  28   7.581   0.469 -13.936
  214   2HB   ASN  28          2HB       ASN  28   8.230  -1.112 -13.551
  215   1HD2  ASN  28          1HD2      ASN  28   5.544  -0.007 -13.218
  216   2HD2  ASN  28          2HD2      ASN  28   5.121  -0.176 -11.547
  217    H    THR  29           H        THR  29  10.717  -1.400 -11.644
  218    HA   THR  29           HA       THR  29  12.656  -2.439 -12.169
  219    HB   THR  29           HB       THR  29  12.216  -3.770 -14.407
  220    HG1  THR  29           1HG      THR  29   9.646  -2.484 -13.842
  221   1HG2  THR  29          1HG2      THR  29  10.805  -3.853 -11.806
  222   2HG2  THR  29          2HG2      THR  29   9.819  -4.496 -13.141
  223   3HG2  THR  29          3HG2      THR  29  11.418  -5.199 -12.796