*HEADER    METAL BINDING PROTEIN                   13-JUN-02   1M0J              
*TITLE     SOLUTION STRUCTURE OF THE BETA DOMAIN OF MT_NC                        
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: METALLOTHIONEIN MT_NC;                                     
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: BETA DOMAIN;                                               
*COMPND   5 SYNONYM: METALLOTHIONEIN A;                                          
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: NOTOTHENIA CORIICEPS;                           
*SOURCE   3 ORGANISM_COMMON: BLACK ROCKCOD;                                      
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   8 EXPRESSION_SYSTEM_PLASMID: PGEM/MT                                   
*KEYWDS    CADMIUM THIOLATE-CLUSTER                                              
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    C.CAPASSO, V.CARGINALE, O.CRESCENZI, D.DI MARO, E.PARISI,             
*AUTHOR   2 R.SPADACCINI, P.A.TEMUSSI                                            
*REVDAT   2   27-MAY-03 1M0J    1      APPENDED CONSTRAINT FILE                 
*REVDAT   1   06-MAY-03 1M0J    0                                                

  3 PRO  HA      4 GLU- HN      3.17                
  3 PRO  QB      5 PHE  HN      5.64                
  3 PRO  QD      5 PHE  HE1     6.38                
  4 GLU- HN      5 PHE  HN      3.73                
  4 GLU- HA      4 GLU- QG      3.73                
  4 GLU- HA      5 PHE  HN      3.30                
  4 GLU- HA      5 PHE  HA      4.66                
  4 GLU- QG      5 PHE  HD1     6.38                
  5 PHE  HN      5 PHE  QB      3.66                
  5 PHE  HN      5 PHE  HD1     4.54                
  5 PHE  HA      5 PHE  HD1     3.39                
  5 PHE  HA      6 THR  HN      2.40                
  5 PHE  HA      6 THR  QG2     6.53                
  5 PHE  HB2     5 PHE  HD1     3.64                
  5 PHE  HB2     6 THR  HN      3.73                
  5 PHE  HB3     5 PHE  HD1     3.64                
  5 PHE  HB3     6 THR  HN      3.73                
  5 PHE  QB      5 PHE  HD1     3.30                
  5 PHE  QB      6 THR  HN      3.52                
  5 PHE  HD1     6 THR  HN      5.44                
  6 THR  HN      6 THR  HA      2.90                
  6 THR  HA      7 MET  HN      2.62                
  6 THR  HB      7 MET  HN      3.86                
  6 THR  QG2     7 MET  HN      5.38                
  6 THR  QG2     8 ASP- HN      6.53                
  6 THR  QG2     8 ASP- HA      6.06                
  6 THR  QG2     9 PRO  HD3     6.53                
  7 MET  HN      7 MET  HB2     3.08                
  7 MET  HA      7 MET  HB2     2.96                
  7 MET  HA      7 MET  HB3     2.52                
  7 MET  HA      8 ASP- HN      2.86                
  7 MET  HB2     8 ASP- HN      3.73                
  7 MET  HB3     8 ASP- HN      3.83                
  7 MET  HB3     8 ASP- HA      4.79                
  8 ASP- HN      8 ASP- HB2     2.90                
  8 ASP- HA      9 PRO  HG3     4.07                
  8 ASP- HA      9 PRO  HD3     2.43                
  8 ASP- HB2     9 PRO  HD2     5.50                
  8 ASP- HB2     9 PRO  HD3     5.38                
  8 ASP- HB3     9 PRO  HD2     4.23                
  9 PRO  HA     10 CYSS HN      2.43                
  9 PRO  HB2    10 CYSS HN      3.05                
  9 PRO  HB3    10 CYSS HN      3.76                
 10 CYSS HN     11 GLU- HN      4.57                
 10 CYSS HA     11 GLU- HN      2.40                
 10 CYSS QB     11 GLU- HN      3.87                
 10 CYSS QB     29 CYSM HA      5.02                
 11 GLU- HN     11 GLU- HB2     2.77                
 11 GLU- HN     11 GLU- QG      5.05                
 11 GLU- HA     11 GLU- QG      3.68                
 11 GLU- HB2    11 GLU- QG      2.69                
 11 GLU- QG     14 LYS+ QD      6.75                
 12 CYSM HN     12 CYSM HA      2.77                
 12 CYSM HN     12 CYSM HB2     2.96                
 12 CYSM HN     13 SER  HN      2.93                
 12 CYSM HN     14 LYS+ HN      3.70                
 12 CYSM HA     12 CYSM HB3     2.43                
 12 CYSM HB2    13 SER  HN      3.52                
 12 CYSM HB2    18 CYSS HA      5.50                
 12 CYSM HB3    13 SER  HN      3.33                
 13 SER  HN     13 SER  HB2     4.17                
 13 SER  HN     13 SER  HB3     4.17                
 13 SER  HN     13 SER  QB      3.77                
 13 SER  HN     14 LYS+ HN      2.74                
 13 SER  HA     14 LYS+ HN      3.52                
 13 SER  HA     14 LYS+ HA      5.50                
 14 LYS+ HN     14 LYS+ HA      2.74                
 14 LYS+ HN     14 LYS+ QG      5.17                
 14 LYS+ HN     14 LYS+ QD      5.98                
 14 LYS+ HN     15 SER  HN      3.64                
 14 LYS+ HN     16 GLY  HN      4.60                
 14 LYS+ HA     14 LYS+ QB      2.65                
 14 LYS+ HA     14 LYS+ QG      3.58                
 14 LYS+ HA     14 LYS+ QD      5.02                
 14 LYS+ HA     16 GLY  QA      5.64                
 14 LYS+ QB     15 SER  HN      4.27                
 15 SER  HN     15 SER  QB      3.44                
 15 SER  HN     16 GLY  HN      3.45                
 15 SER  HA     15 SER  QB      2.72                
 15 SER  QB     16 GLY  HN      4.52                
 16 GLY  HN     17 THR  HN      3.24                
 16 GLY  HA1    17 THR  HN      3.52                
 16 GLY  HA2    17 THR  HN      3.52                
 17 THR  HN     17 THR  HB      3.08                
 17 THR  HN     18 CYSS HN      4.23                
 17 THR  HA     17 THR  QG2     3.74                
 17 THR  HA     18 CYSS HN      2.40                
 17 THR  QG2    18 CYSS HN      4.92                
 17 THR  QG2    18 CYSS HA      6.53                
 17 THR  QG2    19 ASN  HA      6.53                
 17 THR  QG2    19 ASN  QB      7.41                
 17 THR  QG2    19 ASN  HD21    6.53                
 17 THR  QG2    19 ASN  HD22    6.53                
 18 CYSS HN     18 CYSS QB      3.40                
 18 CYSS HA     18 CYSS QB      2.60                
 18 CYSS HA     19 ASN  HN      2.83                
 19 ASN  HN     19 ASN  HB2     3.17                
 19 ASN  HN     19 ASN  HB3     3.17                
 19 ASN  HN     19 ASN  QB      2.86                
 19 ASN  HN     20 CYSM HN      2.68                
 19 ASN  HA     19 ASN  QB      2.65                
 19 ASN  HA     20 CYSM HN      3.30                
 19 ASN  HA     20 CYSM HA      4.57                
 20 CYSM HN     20 CYSM QB      3.46                
 20 CYSM HN     21 GLY  HN      3.05                
 20 CYSM HA     21 GLY  HN      3.17                
 20 CYSM HA     24 CYSS HA      4.38                
 20 CYSM QB     24 CYSS HA      4.72                
 23 SER  HN     23 SER  HB2     3.98                
 23 SER  HN     23 SER  HB3     3.98                
 23 SER  HN     23 SER  QB      3.71                
 23 SER  HA     23 SER  HB2     2.86                
 23 SER  HA     23 SER  HB3     2.86                
 23 SER  HA     24 CYSS HN      2.52                
 24 CYSS HN     24 CYSS HA      2.90                
 24 CYSS HN     24 CYSS HB2     3.58                
 24 CYSS HN     24 CYSS HB3     3.58                
 24 CYSS HN     24 CYSS QB      3.29                
 24 CYSS HN     25 THR  HN      4.66                
 24 CYSS HA     25 THR  HN      2.74                
 24 CYSS HA     25 THR  HA      4.54                
 24 CYSS HA     25 THR  QG2     5.50                
 24 CYSS HA     26 CYSS HN      3.89                
 24 CYSS QB     25 THR  HA      4.99                
 25 THR  HN     25 THR  QG2     4.61                
 25 THR  HN     26 CYSS HN      2.93                
 25 THR  HA     26 CYSS HN      3.61                
 25 THR  QG2    26 CYSS HN      6.03                
 26 CYSS HN     26 CYSS HB2     4.11                
 26 CYSS HN     26 CYSS HB3     3.05                
 26 CYSS HN     27 THR  HN      4.45                
 26 CYSS HA     26 CYSS HB3     2.77                
 26 CYSS HA     27 THR  HN      2.49                
 26 CYSS HB2    27 THR  HN      3.45                
 26 CYSS HB3    27 THR  HN      3.58                
 27 THR  HN     27 THR  HB      3.36                
 27 THR  HN     27 THR  QG2     4.85                
 27 THR  HA     27 THR  QG2     3.68                
 27 THR  QG2    28 ASN  HN      5.69                
 27 THR  QG2    28 ASN  HA      6.53                
 27 THR  QG2    28 ASN  HB2     4.92                
 27 THR  QG2    28 ASN  HB3     5.66                
 27 THR  QG2    28 ASN  HD21    5.38                
 27 THR  QG2    28 ASN  HD22    5.38                
 28 ASN  HN     28 ASN  HB2     3.83                
 28 ASN  HN     29 CYSM HN      3.45                
 28 ASN  HA     28 ASN  HB3     2.62                
 28 ASN  HA     29 CYSM HN      3.48                
 28 ASN  HB2    28 ASN  HD21    4.04                
 28 ASN  HB2    28 ASN  HD22    4.04                
 28 ASN  HB2    28 ASN  QD2     3.63                
 29 CYSM HN     29 CYSM HB2     2.83                
 29 CYSM HN     29 CYSM HB3     2.86                
 29 CYSM HN     30 SER  HN      4.54                
 29 CYSM HA     30 SER  HN      3.05                
 29 CYSM HB3    30 SER  HN      3.17                
 30 SER  HN     30 SER  HB2     3.61                
 30 SER  HN     30 SER  HB3     3.61                
 30 SER  HN     30 SER  QB      3.17                
 30 SER  HN     31 CYSS HN      3.08                
 30 SER  HA     31 CYSS HN      3.33                
 30 SER  HA     35 LYS+ QB      6.38                
 30 SER  HA     35 LYS+ QG      6.38                
 31 CYSS HN     31 CYSS HA      2.90                
 31 CYSS HN     31 CYSS QB      3.43                
 31 CYSS HA     31 CYSS QB      2.59                
 31 CYSS HA     32 LYS+ HN      3.64                
 31 CYSS HB2    32 LYS+ HN      4.23                
 31 CYSS HB3    32 LYS+ HN      4.23                
 31 CYSS QB     32 LYS+ HN      3.77                
 32 LYS+ HN     32 LYS+ QB      3.68                
 32 LYS+ HN     33 SER  HN      4.07                
 32 LYS+ HA     34 CYSS HN      3.52                
 32 LYS+ HA     36 LYS+ HA      4.66                
 32 LYS+ QB     33 SER  HN      4.52                
 33 SER  HN     34 CYSS HN      3.30                
 33 SER  HA     33 SER  QB      2.73                
 33 SER  HA     34 CYSS HN      3.21                
 33 SER  QB     34 CYSS HN      4.02                
 34 CYSS HN     34 CYSS QB      3.50                
 34 CYSS HN     35 LYS+ HN      2.74                
 34 CYSS QB     35 LYS+ HN      4.27          

10 CYSS
          SG          12 CYS SG          4.2      10.0
          SG          26 CYS SG          4.2      10.0
          SG          29 CYS SG          4.2      10.0
          SG          29 CYS Cd          2.6      10.0
          CB          29 CYS Cd          3.5      10.0
12 CYS
          SG          18 CYS SG          4.2      10.0
          SG          20 CYS SG          4.2      10.0
          SG          26 CYS SG          4.2      10.0
          SG          29 CYS SG          4.2      10.0
          SG          31 CYS SG          4.2      10.0
          SG          29 CYS Cd          2.6      10.0
          CB          29 CYS Cd          3.5      10.0
          Cd          18 CYS SG          2.6      10.0
          Cd          20 CYS SG          2.6      10.0
          Cd          31 CYS SG          2.6      10.0
          Cd          18 CYS CB          3.5      10.0
          Cd          20 CYS CB          3.5      10.0
          Cd          31 CYS CB          3.5      10.0
          Cd          20 CYS Cd          4.2      10.0
          Cd          29 CYS Cd          4.2      10.0
18 CYS
          SG          20 CYS SG          4.2      10.0
          SG          31 CYS SG          4.2      10.0
20 CYS
          SG          24 CYS SG          4.2      10.0
          SG          29 CYS SG          4.2      10.0
          SG          31 CYS SG          4.2      10.0
          SG          34 CYS SG          4.2      10.0
          Cd          24 CYS SG          2.6      10.0
          Cd          29 CYS SG          2.6      10.0
          Cd          34 CYS SG          2.6      10.0
          Cd          24 CYS CB          3.5      10.0
          Cd          29 CYS CB          3.5      10.0
          Cd          34 CYS CB          3.5      10.0
          Cd          29 CYS Cd          4.2      10.0
24 CYS
          SG          29 CYS SG          4.2      10.0
          SG          34 CYS SG          4.2      10.0
26 CYS
          SG          29 CYS SG          4.2      10.0
          SG          29 CYS Cd          2.6      10.0
          CB          29 CYS Cd          3.5      10.0
29 CYS
          SG          34 CYS SG          4.2      10.0



  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    ASP   8           H        ASP   8  -9.450  -7.290  -2.389
    2    HA   ASP   8           HA       ASP   8 -10.698  -4.912  -1.255
    3   1HB   ASP   8          2HB       ASP   8  -9.871  -7.271   0.019
    4   2HB   ASP   8          3HB       ASP   8  -8.533  -6.178   0.313
    5    HA   PRO   9           HA       PRO   9  -7.029  -3.019  -2.814
    6   1HB   PRO   9          2HB       PRO   9  -7.489  -0.472  -1.939
    7   2HB   PRO   9          3HB       PRO   9  -8.169  -1.112  -3.422
    8   1HG   PRO   9          2HG       PRO   9  -9.502  -0.627  -0.827
    9   2HG   PRO   9          3HG       PRO   9 -10.224  -0.856  -2.408
   10   1HD   PRO   9          2HD       PRO   9 -10.092  -2.783  -0.287
   11   2HD   PRO   9          3HD       PRO   9 -10.709  -3.046  -1.906
   12    H    CYS  10           H        CYS  10  -5.093  -1.711  -2.117
   13    HA   CYS  10           HA       CYS  10  -4.239  -2.897   0.322
   14   1HB   CYS  10          2HB       CYS  10  -2.891  -2.335  -1.838
   15   2HB   CYS  10          3HB       CYS  10  -2.734  -0.741  -1.127
   16    H    GLU  11           H        GLU  11  -3.699  -1.757   2.296
   17    HA   GLU  11           HA       GLU  11  -5.489   0.067   3.141
   18   1HB   GLU  11          2HB       GLU  11  -2.687  -0.627   4.038
   19   2HB   GLU  11          3HB       GLU  11  -3.537   0.681   4.836
   20   1HG   GLU  11          2HG       GLU  11  -5.457  -0.867   5.306
   21   2HG   GLU  11          3HG       GLU  11  -4.584  -2.174   4.530
   22    H    CYS  12           H        CYS  12  -2.663   0.543   1.185
   23    HA   CYS  12           HA       CYS  12  -2.155   3.297   1.636
   24   1HB   CYS  12          2HB       CYS  12  -1.791   1.583  -0.857
   25   2HB   CYS  12          3HB       CYS  12  -1.064   3.188  -0.597
   26    H    SER  13           H        SER  13  -4.019   1.757  -1.123
   27    HA   SER  13           HA       SER  13  -5.034   4.281  -1.844
   28   1HB   SER  13          2HB       SER  13  -6.449   2.961  -3.433
   29   2HB   SER  13          3HB       SER  13  -4.750   2.544  -3.528
   30    HG   SER  13           HG       SER  13  -5.659   0.877  -1.707
   31    H    LYS  14           H        LYS  14  -6.089   1.586   0.233
   32    HA   LYS  14           HA       LYS  14  -8.801   2.298   0.387
   33   1HB   LYS  14          2HB       LYS  14  -7.659   0.097   1.024
   34   2HB   LYS  14          3HB       LYS  14  -7.206   0.874   2.526
   35   1HG   LYS  14          2HG       LYS  14 -10.093   1.005   1.624
   36   2HG   LYS  14          3HG       LYS  14  -9.493  -0.479   2.336
   37   1HD   LYS  14          2HD       LYS  14  -9.983   0.488   4.344
   38   2HD   LYS  14          3HD       LYS  14  -8.507   1.405   4.112
   39   1HE   LYS  14          2HE       LYS  14  -9.637   3.357   3.734
   40   2HE   LYS  14          3HE       LYS  14 -10.792   2.588   2.660
   41   1HZ   LYS  14          1HZ       LYS  14 -11.547   1.582   4.967
   42   2HZ   LYS  14          2HZ       LYS  14 -10.952   3.006   5.502
   43   3HZ   LYS  14          3HZ       LYS  14 -12.140   2.987   4.381
   44    H    SER  15           H        SER  15  -6.350   2.622   3.046
   45    HA   SER  15           HA       SER  15  -7.715   4.307   4.589
   46   1HB   SER  15          2HB       SER  15  -5.368   3.284   4.920
   47   2HB   SER  15          3HB       SER  15  -4.740   4.678   4.064
   48    HG   SER  15           HG       SER  15  -5.608   4.470   6.683
   49    H    GLY  16           H        GLY  16  -5.496   5.267   1.873
   50   1HA   GLY  16          1HA       GLY  16  -6.398   7.016   0.401
   51   2HA   GLY  16          2HA       GLY  16  -6.849   7.901   1.846
   52    H    THR  17           H        THR  17  -4.344   7.008   3.318
   53    HA   THR  17           HA       THR  17  -2.407   8.661   1.838
   54    HB   THR  17           HB       THR  17  -3.294   8.677   4.751
   55    HG1  THR  17           1HG      THR  17  -4.099  10.081   2.874
   56   1HG2  THR  17          1HG2      THR  17  -1.396  10.274   5.151
   57   2HG2  THR  17          2HG2      THR  17  -0.804   8.630   4.808
   58   3HG2  THR  17          3HG2      THR  17  -0.747   9.880   3.541
   59    H    CYS  18           H        CYS  18  -1.024   7.211   0.972
   60    HA   CYS  18           HA       CYS  18  -0.466   4.732   2.003
   61   1HB   CYS  18          2HB       CYS  18   0.212   4.981  -0.167
   62   2HB   CYS  18          3HB       CYS  18   0.889   6.577   0.096
   63    H    ASN  19           H        ASN  19   1.448   3.933   3.193
   64    HA   ASN  19           HA       ASN  19   2.940   5.975   4.581
   65   1HB   ASN  19          2HB       ASN  19   0.898   5.324   6.000
   66   2HB   ASN  19          3HB       ASN  19   1.546   3.698   6.080
   67   1HD2  ASN  19          1HD2      ASN  19   1.213   6.342   7.817
   68   2HD2  ASN  19          2HD2      ASN  19   2.651   6.354   8.783
   69    H    CYS  20           H        CYS  20   4.020   4.574   2.626
   70    HA   CYS  20           HA       CYS  20   5.267   2.124   3.755
   71   1HB   CYS  20          2HB       CYS  20   4.894   3.193   0.938
   72   2HB   CYS  20          3HB       CYS  20   6.013   1.858   1.312
   73    H    GLY  21           H        GLY  21   6.088   4.723   4.797
   74   1HA   GLY  21          1HA       GLY  21   8.559   5.352   3.381
   75   2HA   GLY  21          2HA       GLY  21   7.864   6.198   4.749
   76    H    GLY  22           H        GLY  22   9.959   3.563   3.695
   77   1HA   GLY  22          1HA       GLY  22  11.828   3.241   5.307
   78   2HA   GLY  22          2HA       GLY  22  10.595   2.966   6.523
   79    H    SER  23           H        SER  23   9.083   1.099   6.229
   80    HA   SER  23           HA       SER  23  10.216  -0.911   4.456
   81   1HB   SER  23          2HB       SER  23   9.158  -2.184   6.821
   82   2HB   SER  23          3HB       SER  23  10.786  -2.261   6.174
   83    HG   SER  23           HG       SER  23   9.786  -0.108   7.839
   84    H    CYS  24           H        CYS  24   8.658  -2.454   3.627
   85    HA   CYS  24           HA       CYS  24   5.964  -1.410   3.723
   86   1HB   CYS  24          2HB       CYS  24   7.181  -2.024   1.584
   87   2HB   CYS  24          3HB       CYS  24   7.004  -3.702   2.055
   88    H    THR  25           H        THR  25   4.189  -2.588   4.577
   89    HA   THR  25           HA       THR  25   4.818  -5.194   5.772
   90    HB   THR  25           HB       THR  25   3.629  -4.435   7.840
   91    HG1  THR  25           1HG      THR  25   2.313  -2.793   6.833
   92   1HG2  THR  25          1HG2      THR  25   5.384  -3.174   8.755
   93   2HG2  THR  25          2HG2      THR  25   6.205  -3.834   7.321
   94   3HG2  THR  25          3HG2      THR  25   5.559  -2.175   7.292
   95    H    CYS  26           H        CYS  26   2.357  -2.827   4.649
   96    HA   CYS  26           HA       CYS  26   0.146  -4.420   4.885
   97   1HB   CYS  26          2HB       CYS  26  -0.599  -3.095   2.758
   98   2HB   CYS  26          3HB       CYS  26  -0.399  -2.293   4.304
   99    H    THR  27           H        THR  27  -1.077  -5.425   2.890
  100    HA   THR  27           HA       THR  27   0.883  -7.014   1.369
  101    HB   THR  27           HB       THR  27  -1.921  -7.637   2.431
  102    HG1  THR  27           1HG      THR  27   0.253  -7.677   3.698
  103   1HG2  THR  27          1HG2      THR  27   0.003  -9.470   0.909
  104   2HG2  THR  27          2HG2      THR  27  -1.624  -9.881   1.504
  105   3HG2  THR  27          3HG2      THR  27  -1.431  -8.725   0.163
  106    H    ASN  28           H        ASN  28   0.132  -7.757  -0.808
  107    HA   ASN  28           HA       ASN  28  -0.295  -7.130  -2.853
  108   1HB   ASN  28          2HB       ASN  28  -2.933  -6.359  -1.506
  109   2HB   ASN  28          3HB       ASN  28  -2.737  -6.382  -3.248
  110   1HD2  ASN  28          1HD2      ASN  28  -4.364  -7.987  -1.320
  111   2HD2  ASN  28          2HD2      ASN  28  -4.038  -9.649  -1.683
  112    H    CYS  29           H        CYS  29   1.331  -5.302  -2.104
  113    HA   CYS  29           HA       CYS  29   0.121  -2.606  -2.174
  114   1HB   CYS  29          2HB       CYS  29   2.064  -3.521  -0.601
  115   2HB   CYS  29          3HB       CYS  29   3.080  -3.111  -2.006
  116    H    SER  30           H        SER  30   1.626  -0.959  -3.561
  117    HA   SER  30           HA       SER  30   2.818  -2.060  -5.835
  118   1HB   SER  30          2HB       SER  30   0.347  -2.496  -6.319
  119   2HB   SER  30          3HB       SER  30   0.111  -0.759  -6.355
  120    HG   SER  30           HG       SER  30   1.986  -2.191  -8.040
  121    H    CYS  31           H        CYS  31   3.688  -0.233  -3.938
  122    HA   CYS  31           HA       CYS  31   3.357   2.364  -5.241
  123   1HB   CYS  31          2HB       CYS  31   4.679   2.046  -2.578
  124   2HB   CYS  31          3HB       CYS  31   3.800   3.411  -3.234
  125    H    LYS  32           H        LYS  32   5.316   3.603  -5.725
  126    HA   LYS  32           HA       LYS  32   7.519   1.865  -6.406
  127   1HB   LYS  32          2HB       LYS  32   8.266   3.630  -7.792
  128   2HB   LYS  32          3HB       LYS  32   6.524   3.577  -7.969
  129   1HG   LYS  32          2HG       LYS  32   6.992   5.313  -5.766
  130   2HG   LYS  32          3HG       LYS  32   8.206   5.742  -6.954
  131   1HD   LYS  32          2HD       LYS  32   6.544   6.182  -8.652
  132   2HD   LYS  32          3HD       LYS  32   5.278   5.405  -7.720
  133   1HE   LYS  32          2HE       LYS  32   4.953   7.781  -7.455
  134   2HE   LYS  32          3HE       LYS  32   5.595   7.201  -5.932
  135   1HZ   LYS  32          1HZ       LYS  32   7.517   8.270  -6.264
  136   2HZ   LYS  32          2HZ       LYS  32   7.548   8.028  -7.880
  137   3HZ   LYS  32          3HZ       LYS  32   6.627   9.220  -7.250
  138    H    SER  33           H        SER  33   6.530   3.527  -3.659
  139    HA   SER  33           HA       SER  33   9.173   4.418  -2.958
  140   1HB   SER  33          2HB       SER  33   6.498   5.111  -2.204
  141   2HB   SER  33          3HB       SER  33   7.291   4.523  -0.755
  142    HG   SER  33           HG       SER  33   8.894   6.104  -0.945
  143    H    CYS  34           H        CYS  34   7.866   1.459  -3.211
  144    HA   CYS  34           HA       CYS  34   9.393   0.477  -0.949
  145   1HB   CYS  34          2HB       CYS  34   7.584  -1.165  -0.409
  146   2HB   CYS  34          3HB       CYS  34   7.268   0.493   0.056
  147    H    LYS  35           H        LYS  35   7.349  -0.239  -3.860
  148    HA   LYS  35           HA       LYS  35   8.824  -2.658  -4.374
  149   1HB   LYS  35          2HB       LYS  35   6.338  -2.347  -4.756
  150   2HB   LYS  35          3HB       LYS  35   6.741  -1.311  -6.111
  151   1HG   LYS  35          2HG       LYS  35   8.359  -3.573  -6.522
  152   2HG   LYS  35          3HG       LYS  35   6.867  -4.252  -5.900
  153   1HD   LYS  35          2HD       LYS  35   5.803  -2.482  -7.667
  154   2HD   LYS  35          3HD       LYS  35   7.351  -2.736  -8.450
  155   1HE   LYS  35          2HE       LYS  35   6.963  -5.071  -8.746
  156   2HE   LYS  35          3HE       LYS  35   5.715  -5.117  -7.517
  157   1HZ   LYS  35          1HZ       LYS  35   5.037  -5.081  -9.949
  158   2HZ   LYS  35          2HZ       LYS  35   4.217  -4.115  -8.920
  159   3HZ   LYS  35          3HZ       LYS  35   5.355  -3.480  -9.906
  Start of MODEL    2
    1    H    ASP   8           H        ASP   8  -6.960  -7.493  -6.523
    2    HA   ASP   8           HA       ASP   8  -8.878  -5.982  -5.014
    3   1HB   ASP   8          2HB       ASP   8  -7.560  -8.408  -4.626
    4   2HB   ASP   8          3HB       ASP   8  -6.666  -7.335  -3.567
    5    HA   PRO   9           HA       PRO   9  -5.860  -2.794  -4.527
    6   1HB   PRO   9          2HB       PRO   9  -7.318  -1.111  -2.942
    7   2HB   PRO   9          3HB       PRO   9  -7.453  -1.139  -4.690
    8   1HG   PRO   9          2HG       PRO   9  -9.324  -2.215  -2.670
    9   2HG   PRO   9          3HG       PRO   9  -9.620  -1.852  -4.358
   10   1HD   PRO   9          2HD       PRO   9  -9.226  -4.448  -3.206
   11   2HD   PRO   9          3HD       PRO   9  -9.406  -4.074  -4.907
   12    H    CYS  10           H        CYS  10  -4.615  -1.580  -2.840
   13    HA   CYS  10           HA       CYS  10  -4.518  -3.313  -0.478
   14   1HB   CYS  10          2HB       CYS  10  -2.152  -2.998  -0.358
   15   2HB   CYS  10          3HB       CYS  10  -2.570  -3.607  -1.947
   16    H    GLU  11           H        GLU  11  -3.889  -2.161   1.550
   17    HA   GLU  11           HA       GLU  11  -4.660   0.646   1.373
   18   1HB   GLU  11          2HB       GLU  11  -5.317  -1.536   3.299
   19   2HB   GLU  11          3HB       GLU  11  -4.991   0.025   4.023
   20   1HG   GLU  11          2HG       GLU  11  -7.294   0.184   3.596
   21   2HG   GLU  11          3HG       GLU  11  -6.625   0.964   2.176
   22    H    CYS  12           H        CYS  12  -2.492   1.241   0.881
   23    HA   CYS  12           HA       CYS  12  -0.162   0.584   2.227
   24   1HB   CYS  12          2HB       CYS  12  -1.105   3.203   1.009
   25   2HB   CYS  12          3HB       CYS  12   0.554   2.957   1.611
   26    H    SER  13           H        SER  13  -2.396   3.369   3.059
   27    HA   SER  13           HA       SER  13  -1.358   3.058   5.765
   28   1HB   SER  13          2HB       SER  13  -0.504   5.122   4.478
   29   2HB   SER  13          3HB       SER  13  -2.148   5.727   4.534
   30    HG   SER  13           HG       SER  13  -1.570   6.521   6.438
   31    H    LYS  14           H        LYS  14  -3.957   2.646   3.767
   32    HA   LYS  14           HA       LYS  14  -6.109   2.303   4.146
   33   1HB   LYS  14          2HB       LYS  14  -5.341   1.401   6.350
   34   2HB   LYS  14          3HB       LYS  14  -5.589   2.985   7.054
   35   1HG   LYS  14          2HG       LYS  14  -8.007   2.590   5.761
   36   2HG   LYS  14          3HG       LYS  14  -7.595   0.950   6.218
   37   1HD   LYS  14          2HD       LYS  14  -8.291   1.390   8.329
   38   2HD   LYS  14          3HD       LYS  14  -6.985   2.546   8.497
   39   1HE   LYS  14          2HE       LYS  14  -8.378   4.352   8.242
   40   2HE   LYS  14          3HE       LYS  14  -9.271   3.603   6.933
   41   1HZ   LYS  14          1HZ       LYS  14 -10.637   3.856   8.865
   42   2HZ   LYS  14          2HZ       LYS  14 -10.417   2.263   8.580
   43   3HZ   LYS  14          3HZ       LYS  14  -9.601   2.997   9.790
   44    H    SER  15           H        SER  15  -5.081   5.113   6.218
   45    HA   SER  15           HA       SER  15  -7.234   6.623   6.110
   46   1HB   SER  15          2HB       SER  15  -5.579   8.632   5.886
   47   2HB   SER  15          3HB       SER  15  -5.398   7.545   7.250
   48    HG   SER  15           HG       SER  15  -3.826   7.659   4.834
   49    H    GLY  16           H        GLY  16  -5.015   5.949   3.391
   50   1HA   GLY  16          1HA       GLY  16  -6.083   5.946   1.199
   51   2HA   GLY  16          2HA       GLY  16  -6.831   7.473   1.619
   52    H    THR  17           H        THR  17  -3.465   6.548   2.467
   53    HA   THR  17           HA       THR  17  -2.389   8.124   0.289
   54    HB   THR  17           HB       THR  17  -2.411   9.003   3.203
   55    HG1  THR  17           1HG      THR  17  -2.549  10.343   0.600
   56   1HG2  THR  17          1HG2      THR  17  -0.779  10.799   1.818
   57   2HG2  THR  17          2HG2      THR  17  -0.197   9.594   2.990
   58   3HG2  THR  17          3HG2      THR  17  -0.185   9.220   1.251
   59    H    CYS  18           H        CYS  18  -0.789   6.942  -0.527
   60    HA   CYS  18           HA       CYS  18   0.210   4.698   0.699
   61   1HB   CYS  18          2HB       CYS  18   0.465   4.818  -1.608
   62   2HB   CYS  18          3HB       CYS  18   1.168   6.424  -1.559
   63    H    ASN  19           H        ASN  19   1.799   4.361   2.248
   64    HA   ASN  19           HA       ASN  19   3.635   6.537   2.746
   65   1HB   ASN  19          2HB       ASN  19   1.656   6.724   4.358
   66   2HB   ASN  19          3HB       ASN  19   2.077   5.143   4.984
   67   1HD2  ASN  19          1HD2      ASN  19   2.418   8.386   5.404
   68   2HD2  ASN  19          2HD2      ASN  19   3.849   8.452   6.379
   69    H    CYS  20           H        CYS  20   4.354   4.362   1.392
   70    HA   CYS  20           HA       CYS  20   5.243   2.206   3.180
   71   1HB   CYS  20          2HB       CYS  20   5.443   2.686   0.181
   72   2HB   CYS  20          3HB       CYS  20   6.132   1.263   1.005
   73    H    GLY  21           H        GLY  21   6.339   4.950   3.639
   74   1HA   GLY  21          1HA       GLY  21   9.052   4.773   2.577
   75   2HA   GLY  21          2HA       GLY  21   8.342   6.092   3.487
   76    H    GLY  22           H        GLY  22   7.191   4.338   5.614
   77   1HA   GLY  22          1HA       GLY  22   9.665   3.969   7.136
   78   2HA   GLY  22          2HA       GLY  22   8.035   4.096   7.767
   79    H    SER  23           H        SER  23   6.519   2.229   6.535
   80    HA   SER  23           HA       SER  23   7.920  -0.211   6.218
   81   1HB   SER  23          2HB       SER  23   7.049   0.505   8.870
   82   2HB   SER  23          3HB       SER  23   6.036  -0.811   8.312
   83    HG   SER  23           HG       SER  23   8.107  -1.920   7.694
   84    H    CYS  24           H        CYS  24   6.562  -1.816   5.226
   85    HA   CYS  24           HA       CYS  24   4.121  -0.700   4.180
   86   1HB   CYS  24          2HB       CYS  24   5.882  -1.931   2.816
   87   2HB   CYS  24          3HB       CYS  24   5.309  -3.406   3.571
   88    H    THR  25           H        THR  25   2.023  -1.610   4.555
   89    HA   THR  25           HA       THR  25   1.938  -3.610   6.719
   90    HB   THR  25           HB       THR  25  -0.094  -2.368   7.508
   91    HG1  THR  25           1HG      THR  25  -0.392  -1.541   5.197
   92   1HG2  THR  25          1HG2      THR  25   0.986  -0.384   8.374
   93   2HG2  THR  25          2HG2      THR  25   2.269  -1.614   8.264
   94   3HG2  THR  25          3HG2      THR  25   2.143  -0.344   7.021
   95    H    CYS  26           H        CYS  26   1.336  -2.966   3.457
   96    HA   CYS  26           HA       CYS  26  -0.991  -4.718   3.421
   97   1HB   CYS  26          2HB       CYS  26  -0.500  -3.991   0.812
   98   2HB   CYS  26          3HB       CYS  26  -1.675  -3.271   1.894
   99    H    THR  27           H        THR  27  -0.894  -6.771   2.395
  100    HA   THR  27           HA       THR  27   1.795  -7.808   2.052
  101    HB   THR  27           HB       THR  27  -0.123  -8.918   3.385
  102    HG1  THR  27           1HG      THR  27   1.880  -9.800   1.909
  103   1HG2  THR  27          1HG2      THR  27  -1.740  -8.519   1.281
  104   2HG2  THR  27          2HG2      THR  27  -0.982 -10.022   0.700
  105   3HG2  THR  27          3HG2      THR  27  -1.868 -10.010   2.245
  106    H    ASN  28           H        ASN  28  -1.010  -6.843   0.106
  107    HA   ASN  28           HA       ASN  28   0.494  -7.758  -2.218
  108   1HB   ASN  28          2HB       ASN  28  -2.504  -7.454  -1.732
  109   2HB   ASN  28          3HB       ASN  28  -1.858  -7.548  -3.359
  110   1HD2  ASN  28          1HD2      ASN  28  -3.158  -9.463  -3.520
  111   2HD2  ASN  28          2HD2      ASN  28  -2.565 -10.988  -2.951
  112    H    CYS  29           H        CYS  29   1.583  -5.589  -1.686
  113    HA   CYS  29           HA       CYS  29   0.132  -3.129  -2.084
  114   1HB   CYS  29          2HB       CYS  29   2.383  -3.593  -0.835
  115   2HB   CYS  29          3HB       CYS  29   3.116  -3.457  -2.454
  116    H    SER  30           H        SER  30   0.969  -1.525  -3.917
  117    HA   SER  30           HA       SER  30   1.865  -2.743  -6.277
  118   1HB   SER  30          2HB       SER  30  -0.703  -3.381  -5.999
  119   2HB   SER  30          3HB       SER  30  -0.973  -1.741  -6.553
  120    HG   SER  30           HG       SER  30   0.914  -3.125  -8.092
  121    H    CYS  31           H        CYS  31   2.993  -0.675  -5.005
  122    HA   CYS  31           HA       CYS  31   2.104   1.650  -6.549
  123   1HB   CYS  31          2HB       CYS  31   2.959   3.060  -4.664
  124   2HB   CYS  31          3HB       CYS  31   1.480   2.176  -4.347
  125    H    LYS  32           H        LYS  32   4.050   3.275  -6.756
  126    HA   LYS  32           HA       LYS  32   6.369   1.673  -7.484
  127   1HB   LYS  32          2HB       LYS  32   5.079   4.117  -8.480
  128   2HB   LYS  32          3HB       LYS  32   6.822   4.255  -8.365
  129   1HG   LYS  32          2HG       LYS  32   7.198   2.681 -10.008
  130   2HG   LYS  32          3HG       LYS  32   5.860   1.670  -9.498
  131   1HD   LYS  32          2HD       LYS  32   5.409   4.348 -10.881
  132   2HD   LYS  32          3HD       LYS  32   5.640   2.867 -11.791
  133   1HE   LYS  32          2HE       LYS  32   3.538   3.076  -9.595
  134   2HE   LYS  32          3HE       LYS  32   3.195   3.569 -11.241
  135   1HZ   LYS  32          1HZ       LYS  32   2.614   1.395 -11.285
  136   2HZ   LYS  32          2HZ       LYS  32   4.167   1.243 -11.764
  137   3HZ   LYS  32          3HZ       LYS  32   3.754   0.911 -10.220
  138    H    SER  33           H        SER  33   5.205   3.419  -4.838
  139    HA   SER  33           HA       SER  33   7.809   4.468  -4.162
  140   1HB   SER  33          2HB       SER  33   5.108   5.214  -3.586
  141   2HB   SER  33          3HB       SER  33   5.838   4.774  -2.055
  142    HG   SER  33           HG       SER  33   7.404   6.405  -3.773
  143    H    CYS  34           H        CYS  34   6.747   1.478  -4.240
  144    HA   CYS  34           HA       CYS  34   7.831   0.831  -1.600
  145   1HB   CYS  34          2HB       CYS  34   5.361   0.544  -1.639
  146   2HB   CYS  34          3HB       CYS  34   5.537  -0.617  -2.940
  147    H    LYS  35           H        LYS  35   6.991  -0.300  -4.949
  148    HA   LYS  35           HA       LYS  35   9.244  -2.157  -4.803
  149   1HB   LYS  35          2HB       LYS  35   6.873  -1.977  -6.681
  150   2HB   LYS  35          3HB       LYS  35   8.206  -3.092  -6.901
  151   1HG   LYS  35          2HG       LYS  35   7.672  -4.340  -4.972
  152   2HG   LYS  35          3HG       LYS  35   6.825  -3.007  -4.213
  153   1HD   LYS  35          2HD       LYS  35   5.155  -3.247  -6.260
  154   2HD   LYS  35          3HD       LYS  35   5.860  -4.843  -6.422
  155   1HE   LYS  35          2HE       LYS  35   5.373  -4.726  -3.688
  156   2HE   LYS  35          3HE       LYS  35   4.034  -3.790  -4.325
  157   1HZ   LYS  35          1HZ       LYS  35   4.700  -6.337  -5.570
  158   2HZ   LYS  35          2HZ       LYS  35   3.857  -6.329  -4.170
  159   3HZ   LYS  35          3HZ       LYS  35   3.257  -5.575  -5.489
  Start of MODEL    3
    1    H    ASP   8           H        ASP   8  -9.469  -0.657  -7.651
    2    HA   ASP   8           HA       ASP   8  -9.554   1.488  -5.760
    3   1HB   ASP   8          2HB       ASP   8 -10.677  -1.048  -5.892
    4   2HB   ASP   8          3HB       ASP   8  -9.357  -1.313  -4.770
    5    HA   PRO   9           HA       PRO   9  -5.261   0.999  -4.894
    6   1HB   PRO   9          2HB       PRO   9  -5.062   2.713  -2.774
    7   2HB   PRO   9          3HB       PRO   9  -5.013   3.244  -4.443
    8   1HG   PRO   9          2HG       PRO   9  -7.215   3.478  -2.485
    9   2HG   PRO   9          3HG       PRO   9  -6.982   4.356  -3.984
   10   1HD   PRO   9          2HD       PRO   9  -8.803   2.186  -3.531
   11   2HD   PRO   9          3HD       PRO   9  -8.484   2.986  -5.058
   12    H    CYS  10           H        CYS  10  -3.687   0.386  -3.147
   13    HA   CYS  10           HA       CYS  10  -4.878  -1.827  -1.808
   14   1HB   CYS  10          2HB       CYS  10  -2.713  -2.164  -2.685
   15   2HB   CYS  10          3HB       CYS  10  -2.083  -0.709  -1.938
   16    H    GLU  11           H        GLU  11  -4.974  -2.108   0.534
   17    HA   GLU  11           HA       GLU  11  -5.561   0.351   1.845
   18   1HB   GLU  11          2HB       GLU  11  -5.690  -2.565   2.705
   19   2HB   GLU  11          3HB       GLU  11  -6.093  -1.250   3.792
   20   1HG   GLU  11          2HG       GLU  11  -8.193  -1.315   2.931
   21   2HG   GLU  11          3HG       GLU  11  -7.530  -0.614   1.467
   22    H    CYS  12           H        CYS  12  -3.172   0.922   1.390
   23    HA   CYS  12           HA       CYS  12  -1.063  -0.218   2.894
   24   1HB   CYS  12          2HB       CYS  12  -1.392   2.679   2.015
   25   2HB   CYS  12          3HB       CYS  12   0.134   1.831   2.367
   26    H    SER  13           H        SER  13  -2.822   2.924   3.587
   27    HA   SER  13           HA       SER  13  -1.986   2.551   6.332
   28   1HB   SER  13          2HB       SER  13  -2.798   4.935   6.591
   29   2HB   SER  13          3HB       SER  13  -1.482   4.736   5.451
   30    HG   SER  13           HG       SER  13  -3.932   4.443   4.193
   31    H    LYS  14           H        LYS  14  -4.584   1.778   4.326
   32    HA   LYS  14           HA       LYS  14  -6.526   0.817   4.889
   33   1HB   LYS  14          2HB       LYS  14  -5.441   0.562   7.239
   34   2HB   LYS  14          3HB       LYS  14  -6.433   1.934   7.685
   35   1HG   LYS  14          2HG       LYS  14  -7.957  -0.086   6.168
   36   2HG   LYS  14          3HG       LYS  14  -7.248  -0.754   7.625
   37   1HD   LYS  14          2HD       LYS  14  -8.633   1.920   7.827
   38   2HD   LYS  14          3HD       LYS  14  -9.632   0.490   7.659
   39   1HE   LYS  14          2HE       LYS  14  -7.528   0.006   9.629
   40   2HE   LYS  14          3HE       LYS  14  -8.399   1.471  10.035
   41   1HZ   LYS  14          1HZ       LYS  14  -9.243  -1.126  10.368
   42   2HZ   LYS  14          2HZ       LYS  14 -10.078   0.238  10.693
   43   3HZ   LYS  14          3HZ       LYS  14 -10.222  -0.479   9.232
   44    H    SER  15           H        SER  15  -6.092   4.039   6.508
   45    HA   SER  15           HA       SER  15  -8.528   5.020   6.397
   46   1HB   SER  15          2HB       SER  15  -7.442   7.279   5.826
   47   2HB   SER  15          3HB       SER  15  -6.789   6.426   7.210
   48    HG   SER  15           HG       SER  15  -5.337   5.497   5.229
   49    H    GLY  16           H        GLY  16  -6.441   4.320   3.601
   50   1HA   GLY  16          1HA       GLY  16  -7.649   3.769   1.560
   51   2HA   GLY  16          2HA       GLY  16  -8.634   5.194   1.817
   52    H    THR  17           H        THR  17  -5.117   5.083   2.491
   53    HA   THR  17           HA       THR  17  -4.515   6.410  -0.019
   54    HB   THR  17           HB       THR  17  -5.335   8.092   1.865
   55    HG1  THR  17           1HG      THR  17  -3.449   9.463   1.029
   56   1HG2  THR  17          1HG2      THR  17  -3.328   8.938   3.155
   57   2HG2  THR  17          2HG2      THR  17  -3.866   7.332   3.702
   58   3HG2  THR  17          3HG2      THR  17  -2.437   7.482   2.650
   59    H    CYS  18           H        CYS  18  -2.548   5.856  -0.778
   60    HA   CYS  18           HA       CYS  18  -1.159   3.802   0.399
   61   1HB   CYS  18          2HB       CYS  18  -0.894   4.189  -1.912
   62   2HB   CYS  18          3HB       CYS  18  -0.381   5.847  -1.670
   63    H    ASN  19           H        ASN  19   0.643   3.706   1.809
   64    HA   ASN  19           HA       ASN  19   1.769   6.229   2.641
   65   1HB   ASN  19          2HB       ASN  19  -0.167   5.587   4.219
   66   2HB   ASN  19          3HB       ASN  19   0.762   4.173   4.672
   67   1HD2  ASN  19          1HD2      ASN  19   0.363   5.391   6.767
   68   2HD2  ASN  19          2HD2      ASN  19   1.603   6.476   7.301
   69    H    CYS  20           H        CYS  20   3.062   4.564   1.031
   70    HA   CYS  20           HA       CYS  20   4.708   2.726   2.694
   71   1HB   CYS  20          2HB       CYS  20   4.244   2.937  -0.308
   72   2HB   CYS  20          3HB       CYS  20   5.427   1.839   0.446
   73    H    GLY  21           H        GLY  21   5.060   5.641   2.905
   74   1HA   GLY  21          1HA       GLY  21   7.439   6.167   1.287
   75   2HA   GLY  21          2HA       GLY  21   6.558   7.303   2.291
   76    H    GLY  22           H        GLY  22   8.617   4.326   2.479
   77   1HA   GLY  22          1HA       GLY  22  10.620   5.030   4.004
   78   2HA   GLY  22          2HA       GLY  22   9.364   5.025   5.226
   79    H    SER  23           H        SER  23   7.885   2.939   5.174
   80    HA   SER  23           HA       SER  23   9.443   0.639   4.373
   81   1HB   SER  23          2HB       SER  23   9.220   1.546   7.097
   82   2HB   SER  23          3HB       SER  23   8.305   0.057   6.955
   83    HG   SER  23           HG       SER  23  10.700  -0.097   7.453
   84    H    CYS  24           H        CYS  24   8.132  -1.243   3.958
   85    HA   CYS  24           HA       CYS  24   5.301  -0.583   3.762
   86   1HB   CYS  24          2HB       CYS  24   6.643  -1.312   1.744
   87   2HB   CYS  24          3HB       CYS  24   6.754  -2.899   2.478
   88    H    THR  25           H        THR  25   3.724  -1.869   4.813
   89    HA   THR  25           HA       THR  25   4.782  -4.045   6.493
   90    HB   THR  25           HB       THR  25   4.327  -1.847   7.732
   91    HG1  THR  25           1HG      THR  25   2.556  -4.147   8.181
   92   1HG2  THR  25          1HG2      THR  25   1.406  -2.533   7.639
   93   2HG2  THR  25          2HG2      THR  25   2.187  -0.949   7.865
   94   3HG2  THR  25          3HG2      THR  25   2.044  -1.646   6.234
   95    H    CYS  26           H        CYS  26   2.095  -2.664   4.583
   96    HA   CYS  26           HA       CYS  26   0.337  -4.797   5.049
   97   1HB   CYS  26          2HB       CYS  26  -0.697  -3.935   2.848
   98   2HB   CYS  26          3HB       CYS  26  -0.726  -2.918   4.275
   99    H    THR  27           H        THR  27  -0.407  -6.258   3.094
  100    HA   THR  27           HA       THR  27   2.026  -7.265   1.769
  101    HB   THR  27           HB       THR  27  -0.489  -8.765   2.672
  102    HG1  THR  27           1HG      THR  27   2.279  -8.701   3.639
  103   1HG2  THR  27          1HG2      THR  27   0.487 -10.178   1.042
  104   2HG2  THR  27          2HG2      THR  27   2.125  -9.554   1.348
  105   3HG2  THR  27          3HG2      THR  27   1.365 -10.669   2.510
  106    H    ASN  28           H        ASN  28   1.318  -8.710  -0.235
  107    HA   ASN  28           HA       ASN  28   0.798  -8.478  -2.346
  108   1HB   ASN  28          2HB       ASN  28  -1.977  -7.822  -1.227
  109   2HB   ASN  28          3HB       ASN  28  -1.648  -8.478  -2.818
  110   1HD2  ASN  28          1HD2      ASN  28  -1.189 -10.602  -3.096
  111   2HD2  ASN  28          2HD2      ASN  28  -1.284 -11.801  -1.850
  112    H    CYS  29           H        CYS  29   1.953  -6.159  -1.480
  113    HA   CYS  29           HA       CYS  29   0.261  -3.886  -2.325
  114   1HB   CYS  29          2HB       CYS  29   1.837  -4.010  -0.217
  115   2HB   CYS  29          3HB       CYS  29   3.122  -3.666  -1.401
  116    H    SER  30           H        SER  30   1.561  -2.153  -3.727
  117    HA   SER  30           HA       SER  30   3.597  -3.089  -5.358
  118   1HB   SER  30          2HB       SER  30   1.536  -4.474  -6.169
  119   2HB   SER  30          3HB       SER  30   0.958  -2.971  -6.860
  120    HG   SER  30           HG       SER  30   3.247  -4.533  -7.569
  121    H    CYS  31           H        CYS  31   3.930  -0.856  -4.280
  122    HA   CYS  31           HA       CYS  31   2.801   1.194  -6.044
  123   1HB   CYS  31          2HB       CYS  31   3.767   1.972  -3.346
  124   2HB   CYS  31          3HB       CYS  31   2.483   2.651  -4.326
  125    H    LYS  32           H        LYS  32   5.451   0.967  -3.559
  126    HA   LYS  32           HA       LYS  32   7.557   0.829  -5.351
  127   1HB   LYS  32          2HB       LYS  32   6.360   3.433  -5.298
  128   2HB   LYS  32          3HB       LYS  32   7.938   3.538  -4.548
  129   1HG   LYS  32          2HG       LYS  32   8.848   2.203  -6.561
  130   2HG   LYS  32          3HG       LYS  32   7.288   2.451  -7.321
  131   1HD   LYS  32          2HD       LYS  32   8.579   4.906  -6.192
  132   2HD   LYS  32          3HD       LYS  32   9.394   4.188  -7.568
  133   1HE   LYS  32          2HE       LYS  32   6.407   4.496  -7.766
  134   2HE   LYS  32          3HE       LYS  32   7.362   5.963  -7.842
  135   1HZ   LYS  32          1HZ       LYS  32   7.176   5.162 -10.009
  136   2HZ   LYS  32          2HZ       LYS  32   8.703   4.788  -9.568
  137   3HZ   LYS  32          3HZ       LYS  32   7.555   3.627  -9.600
  138    H    SER  33           H        SER  33   9.435   0.400  -4.215
  139    HA   SER  33           HA       SER  33  10.822   0.301  -2.517
  140   1HB   SER  33          2HB       SER  33   9.545   2.560  -1.781
  141   2HB   SER  33          3HB       SER  33   8.969   1.523  -0.490
  142    HG   SER  33           HG       SER  33  10.986   1.335   0.343
  143    H    CYS  34           H        CYS  34   8.056  -1.237  -3.053
  144    HA   CYS  34           HA       CYS  34   8.191  -2.809  -0.583
  145   1HB   CYS  34          2HB       CYS  34   5.824  -3.269  -2.207
  146   2HB   CYS  34          3HB       CYS  34   5.974  -2.940  -0.493
  147    H    LYS  35           H        LYS  35   7.419  -2.985  -4.141
  148    HA   LYS  35           HA       LYS  35   8.947  -5.487  -4.210
  149   1HB   LYS  35          2HB       LYS  35   6.228  -4.977  -5.451
  150   2HB   LYS  35          3HB       LYS  35   7.252  -6.340  -5.859
  151   1HG   LYS  35          2HG       LYS  35   7.269  -7.025  -3.435
  152   2HG   LYS  35          3HG       LYS  35   6.197  -5.690  -3.064
  153   1HD   LYS  35          2HD       LYS  35   4.695  -7.489  -3.323
  154   2HD   LYS  35          3HD       LYS  35   4.615  -6.703  -4.887
  155   1HE   LYS  35          2HE       LYS  35   6.583  -8.968  -4.375
  156   2HE   LYS  35          3HE       LYS  35   4.922  -9.303  -4.820
  157   1HZ   LYS  35          1HZ       LYS  35   7.039  -8.366  -6.439
  158   2HZ   LYS  35          2HZ       LYS  35   5.606  -9.013  -6.883
  159   3HZ   LYS  35          3HZ       LYS  35   5.721  -7.412  -6.584
  Start of MODEL    4
    1    H    ASP   8           H        ASP   8  -9.968  -6.864  -3.913
    2    HA   ASP   8           HA       ASP   8 -10.882  -5.257  -1.658
    3   1HB   ASP   8          2HB       ASP   8  -9.628  -7.745  -1.632
    4   2HB   ASP   8          3HB       ASP   8  -8.272  -6.658  -1.413
    5    HA   PRO   9           HA       PRO   9  -8.002  -2.385  -3.373
    6   1HB   PRO   9          2HB       PRO   9  -8.271  -0.394  -1.519
    7   2HB   PRO   9          3HB       PRO   9  -9.362  -0.595  -2.876
    8   1HG   PRO   9          2HG       PRO   9  -9.810  -1.240  -0.025
    9   2HG   PRO   9          3HG       PRO   9 -10.991  -1.030  -1.302
   10   1HD   PRO   9          2HD       PRO   9 -10.096  -3.515  -0.187
   11   2HD   PRO   9          3HD       PRO   9 -11.189  -3.308  -1.540
   12    H    CYS  10           H        CYS  10  -6.034  -1.032  -2.750
   13    HA   CYS  10           HA       CYS  10  -4.369  -2.845  -1.312
   14   1HB   CYS  10          2HB       CYS  10  -3.935  -1.107  -3.348
   15   2HB   CYS  10          3HB       CYS  10  -3.342  -0.158  -2.000
   16    H    GLU  11           H        GLU  11  -2.908  -1.957   0.515
   17    HA   GLU  11           HA       GLU  11  -4.637  -0.546   2.343
   18   1HB   GLU  11          2HB       GLU  11  -2.216  -2.320   2.606
   19   2HB   GLU  11          3HB       GLU  11  -2.548  -1.185   3.901
   20   1HG   GLU  11          2HG       GLU  11  -5.038  -2.159   3.674
   21   2HG   GLU  11          3HG       GLU  11  -4.208  -3.526   2.956
   22    H    CYS  12           H        CYS  12  -3.153   0.674   0.027
   23    HA   CYS  12           HA       CYS  12  -0.985   2.254   1.036
   24   1HB   CYS  12          2HB       CYS  12  -2.786   2.334  -1.389
   25   2HB   CYS  12          3HB       CYS  12  -1.658   3.671  -1.059
   26    H    SER  13           H        SER  13  -4.257   3.472  -0.057
   27    HA   SER  13           HA       SER  13  -3.898   5.609   1.834
   28   1HB   SER  13          2HB       SER  13  -6.017   6.497   0.743
   29   2HB   SER  13          3HB       SER  13  -4.651   6.305  -0.339
   30    HG   SER  13           HG       SER  13  -7.066   4.792  -0.178
   31    H    LYS  14           H        LYS  14  -4.981   2.483   2.011
   32    HA   LYS  14           HA       LYS  14  -7.494   2.521   3.073
   33   1HB   LYS  14          2HB       LYS  14  -6.341   0.470   2.550
   34   2HB   LYS  14          3HB       LYS  14  -5.106   0.785   3.751
   35   1HG   LYS  14          2HG       LYS  14  -6.370  -0.202   5.347
   36   2HG   LYS  14          3HG       LYS  14  -7.650   0.965   5.084
   37   1HD   LYS  14          2HD       LYS  14  -8.888  -0.474   3.783
   38   2HD   LYS  14          3HD       LYS  14  -7.477  -1.146   2.991
   39   1HE   LYS  14          2HE       LYS  14  -7.015  -2.215   5.400
   40   2HE   LYS  14          3HE       LYS  14  -8.732  -1.942   5.626
   41   1HZ   LYS  14          1HZ       LYS  14  -7.491  -3.942   4.149
   42   2HZ   LYS  14          2HZ       LYS  14  -9.087  -3.736   4.431
   43   3HZ   LYS  14          3HZ       LYS  14  -8.393  -3.051   3.120
   44    H    SER  15           H        SER  15  -4.353   2.942   4.845
   45    HA   SER  15           HA       SER  15  -5.553   3.351   7.303
   46   1HB   SER  15          2HB       SER  15  -3.125   2.827   6.892
   47   2HB   SER  15          3HB       SER  15  -2.893   4.459   6.297
   48    HG   SER  15           HG       SER  15  -2.518   4.968   8.339
   49    H    GLY  16           H        GLY  16  -5.278   5.377   4.469
   50   1HA   GLY  16          1HA       GLY  16  -7.014   7.276   4.925
   51   2HA   GLY  16          2HA       GLY  16  -5.739   7.842   5.985
   52    H    THR  17           H        THR  17  -3.655   6.551   4.083
   53    HA   THR  17           HA       THR  17  -3.839   7.679   1.556
   54    HB   THR  17           HB       THR  17  -3.128   9.562   3.748
   55    HG1  THR  17           1HG      THR  17  -4.487  10.581   2.332
   56   1HG2  THR  17          1HG2      THR  17  -1.598  10.810   2.063
   57   2HG2  THR  17          2HG2      THR  17  -0.858   9.445   2.932
   58   3HG2  THR  17          3HG2      THR  17  -1.402   9.238   1.250
   59    H    CYS  18           H        CYS  18  -2.188   6.960   0.271
   60    HA   CYS  18           HA       CYS  18  -0.719   4.856   0.994
   61   1HB   CYS  18          2HB       CYS  18  -0.842   5.434  -1.284
   62   2HB   CYS  18          3HB       CYS  18  -0.135   7.016  -1.019
   63    H    ASN  19           H        ASN  19   1.082   4.455   2.270
   64    HA   ASN  19           HA       ASN  19   2.760   6.723   2.917
   65   1HB   ASN  19          2HB       ASN  19   0.918   6.192   4.738
   66   2HB   ASN  19          3HB       ASN  19   1.892   4.780   5.097
   67   1HD2  ASN  19          1HD2      ASN  19   1.240   7.622   6.263
   68   2HD2  ASN  19          2HD2      ASN  19   2.762   8.164   6.885
   69    H    CYS  20           H        CYS  20   3.494   4.921   1.104
   70    HA   CYS  20           HA       CYS  20   4.798   2.586   2.296
   71   1HB   CYS  20          2HB       CYS  20   4.653   3.723  -0.521
   72   2HB   CYS  20          3HB       CYS  20   5.564   2.253  -0.096
   73    H    GLY  21           H        GLY  21   5.546   5.676   2.758
   74   1HA   GLY  21          1HA       GLY  21   8.375   5.431   1.963
   75   2HA   GLY  21          2HA       GLY  21   7.526   6.918   2.334
   76    H    GLY  22           H        GLY  22   7.436   3.792   4.152
   77   1HA   GLY  22          1HA       GLY  22   9.184   4.778   6.222
   78   2HA   GLY  22          2HA       GLY  22   7.492   4.781   6.676
   79    H    SER  23           H        SER  23   6.432   2.522   5.463
   80    HA   SER  23           HA       SER  23   8.039   0.277   5.604
   81   1HB   SER  23          2HB       SER  23   8.204  -0.104   7.827
   82   2HB   SER  23          3HB       SER  23   7.153   1.249   8.191
   83    HG   SER  23           HG       SER  23   6.204  -0.688   8.980
   84    H    CYS  24           H        CYS  24   6.866  -0.351   3.755
   85    HA   CYS  24           HA       CYS  24   4.257  -0.063   3.232
   86   1HB   CYS  24          2HB       CYS  24   6.075  -1.090   1.794
   87   2HB   CYS  24          3HB       CYS  24   5.755  -2.609   2.605
   88    H    THR  25           H        THR  25   2.310  -1.314   3.614
   89    HA   THR  25           HA       THR  25   2.542  -3.206   5.861
   90    HB   THR  25           HB       THR  25   0.373  -2.242   6.656
   91    HG1  THR  25           1HG      THR  25   0.939  -0.297   4.540
   92   1HG2  THR  25          1HG2      THR  25   2.250   0.084   6.027
   93   2HG2  THR  25          2HG2      THR  25   1.163  -0.094   7.424
   94   3HG2  THR  25          3HG2      THR  25   2.623  -1.105   7.297
   95    H    CYS  26           H        CYS  26   1.092  -2.339   2.739
   96    HA   CYS  26           HA       CYS  26  -0.709  -4.541   2.774
   97   1HB   CYS  26          2HB       CYS  26  -0.187  -3.654   0.113
   98   2HB   CYS  26          3HB       CYS  26  -1.631  -3.457   1.088
   99    H    THR  27           H        THR  27  -0.427  -6.586   1.757
  100    HA   THR  27           HA       THR  27   2.329  -7.364   1.391
  101    HB   THR  27           HB       THR  27  -0.359  -8.646   1.778
  102    HG1  THR  27           1HG      THR  27   1.195  -9.914   3.142
  103   1HG2  THR  27          1HG2      THR  27   0.839  -9.660  -0.380
  104   2HG2  THR  27          2HG2      THR  27   1.967 -10.341   0.817
  105   3HG2  THR  27          3HG2      THR  27   0.238 -10.755   0.888
  106    H    ASN  28           H        ASN  28  -0.679  -7.519  -0.637
  107    HA   ASN  28           HA       ASN  28   0.955  -8.029  -2.916
  108   1HB   ASN  28          2HB       ASN  28  -2.036  -7.663  -2.448
  109   2HB   ASN  28          3HB       ASN  28  -1.396  -7.756  -4.077
  110   1HD2  ASN  28          1HD2      ASN  28  -2.774  -9.485  -1.706
  111   2HD2  ASN  28          2HD2      ASN  28  -2.184 -11.080  -2.035
  112    H    CYS  29           H        CYS  29   1.928  -5.751  -2.068
  113    HA   CYS  29           HA       CYS  29   0.470  -3.463  -3.243
  114   1HB   CYS  29          2HB       CYS  29   1.579  -3.454  -0.916
  115   2HB   CYS  29          3HB       CYS  29   3.132  -3.409  -1.788
  116    H    SER  30           H        SER  30   2.002  -1.824  -4.490
  117    HA   SER  30           HA       SER  30   4.202  -3.002  -5.792
  118   1HB   SER  30          2HB       SER  30   2.015  -3.966  -6.929
  119   2HB   SER  30          3HB       SER  30   1.918  -2.385  -7.678
  120    HG   SER  30           HG       SER  30   3.969  -4.382  -7.952
  121    H    CYS  31           H        CYS  31   4.122  -0.736  -4.287
  122    HA   CYS  31           HA       CYS  31   3.599   1.512  -6.024
  123   1HB   CYS  31          2HB       CYS  31   3.932   1.076  -3.146
  124   2HB   CYS  31          3HB       CYS  31   4.763   2.506  -3.727
  125    H    LYS  32           H        LYS  32   6.316   1.331  -3.702
  126    HA   LYS  32           HA       LYS  32   8.347   0.644  -5.449
  127   1HB   LYS  32          2HB       LYS  32   7.386   3.388  -5.800
  128   2HB   LYS  32          3HB       LYS  32   9.091   3.323  -5.395
  129   1HG   LYS  32          2HG       LYS  32   8.246   1.284  -7.391
  130   2HG   LYS  32          3HG       LYS  32   8.046   2.937  -7.935
  131   1HD   LYS  32          2HD       LYS  32  10.561   3.032  -6.753
  132   2HD   LYS  32          3HD       LYS  32  10.540   1.410  -7.415
  133   1HE   LYS  32          2HE       LYS  32  10.263   2.173  -9.643
  134   2HE   LYS  32          3HE       LYS  32   9.614   3.722  -9.142
  135   1HZ   LYS  32          1HZ       LYS  32  12.397   2.839  -8.819
  136   2HZ   LYS  32          2HZ       LYS  32  11.854   3.967  -9.867
  137   3HZ   LYS  32          3HZ       LYS  32  11.808   4.256  -8.260
  138    H    SER  33           H        SER  33  10.271   0.422  -4.303
  139    HA   SER  33           HA       SER  33  11.664   0.496  -2.627
  140   1HB   SER  33          2HB       SER  33  11.077   2.998  -2.553
  141   2HB   SER  33          3HB       SER  33   9.957   2.616  -1.262
  142    HG   SER  33           HG       SER  33  12.804   2.576  -1.266
  143    H    CYS  34           H        CYS  34   8.633  -0.643  -2.645
  144    HA   CYS  34           HA       CYS  34   8.838  -1.656   0.097
  145   1HB   CYS  34          2HB       CYS  34   6.321  -1.892  -0.009
  146   2HB   CYS  34          3HB       CYS  34   6.965  -0.275   0.199
  147    H    LYS  35           H        LYS  35   7.588  -2.166  -3.275
  148    HA   LYS  35           HA       LYS  35   8.374  -4.967  -3.019
  149   1HB   LYS  35          2HB       LYS  35   5.634  -3.953  -3.263
  150   2HB   LYS  35          3HB       LYS  35   6.052  -5.088  -4.530
  151   1HG   LYS  35          2HG       LYS  35   7.106  -6.457  -2.461
  152   2HG   LYS  35          3HG       LYS  35   5.936  -5.524  -1.550
  153   1HD   LYS  35          2HD       LYS  35   4.666  -7.408  -2.125
  154   2HD   LYS  35          3HD       LYS  35   4.228  -6.299  -3.409
  155   1HE   LYS  35          2HE       LYS  35   5.754  -7.355  -4.973
  156   2HE   LYS  35          3HE       LYS  35   6.532  -8.274  -3.701
  157   1HZ   LYS  35          1HZ       LYS  35   4.232  -9.244  -3.339
  158   2HZ   LYS  35          2HZ       LYS  35   3.859  -8.646  -4.812
  159   3HZ   LYS  35          3HZ       LYS  35   5.060  -9.741  -4.656
  Start of MODEL    5
    1    H    ASP   8           H        ASP   8 -10.591  -6.774  -3.521
    2    HA   ASP   8           HA       ASP   8 -11.186  -4.015  -2.786
    3   1HB   ASP   8          2HB       ASP   8 -11.683  -6.246  -1.259
    4   2HB   ASP   8          3HB       ASP   8 -10.051  -5.879  -0.737
    5    HA   PRO   9           HA       PRO   9  -6.831  -3.698  -3.461
    6   1HB   PRO   9          2HB       PRO   9  -6.555  -1.026  -2.954
    7   2HB   PRO   9          3HB       PRO   9  -7.052  -1.659  -4.511
    8   1HG   PRO   9          2HG       PRO   9  -8.694  -0.342  -2.436
    9   2HG   PRO   9          3HG       PRO   9  -9.061  -0.593  -4.130
   10   1HD   PRO   9          2HD       PRO   9 -10.113  -2.073  -1.911
   11   2HD   PRO   9          3HD       PRO   9 -10.389  -2.397  -3.611
   12    H    CYS  10           H        CYS  10  -4.782  -2.901  -2.353
   13    HA   CYS  10           HA       CYS  10  -4.952  -3.932   0.286
   14   1HB   CYS  10          2HB       CYS  10  -2.493  -3.161   0.318
   15   2HB   CYS  10          3HB       CYS  10  -2.968  -4.485  -0.728
   16    H    GLU  11           H        GLU  11  -4.258  -2.684   2.249
   17    HA   GLU  11           HA       GLU  11  -5.591  -0.212   2.319
   18   1HB   GLU  11          2HB       GLU  11  -4.343  -2.076   4.210
   19   2HB   GLU  11          3HB       GLU  11  -4.020  -0.412   4.654
   20   1HG   GLU  11          2HG       GLU  11  -6.685  -0.225   4.021
   21   2HG   GLU  11          3HG       GLU  11  -6.622  -1.888   4.572
   22    H    CYS  12           H        CYS  12  -4.132   0.490   0.408
   23    HA   CYS  12           HA       CYS  12  -1.445   1.347   0.982
   24   1HB   CYS  12          2HB       CYS  12  -3.309   1.321  -1.259
   25   2HB   CYS  12          3HB       CYS  12  -2.454   2.879  -1.151
   26    H    SER  13           H        SER  13  -4.297   3.461   0.107
   27    HA   SER  13           HA       SER  13  -3.228   5.293   2.110
   28   1HB   SER  13          2HB       SER  13  -4.145   7.132   0.751
   29   2HB   SER  13          3HB       SER  13  -3.042   6.157  -0.200
   30    HG   SER  13           HG       SER  13  -5.513   6.792  -0.862
   31    H    LYS  14           H        LYS  14  -5.345   2.976   2.118
   32    HA   LYS  14           HA       LYS  14  -7.895   3.868   2.277
   33   1HB   LYS  14          2HB       LYS  14  -6.334   1.660   3.434
   34   2HB   LYS  14          3HB       LYS  14  -7.744   2.089   4.380
   35   1HG   LYS  14          2HG       LYS  14  -7.900   1.698   1.363
   36   2HG   LYS  14          3HG       LYS  14  -8.072   0.355   2.475
   37   1HD   LYS  14          2HD       LYS  14  -9.745   2.641   3.277
   38   2HD   LYS  14          3HD       LYS  14 -10.112   2.116   1.645
   39   1HE   LYS  14          2HE       LYS  14 -11.181   0.266   2.412
   40   2HE   LYS  14          3HE       LYS  14  -9.777  -0.224   3.341
   41   1HZ   LYS  14          1HZ       LYS  14 -11.685   1.818   4.245
   42   2HZ   LYS  14          2HZ       LYS  14 -11.760   0.246   4.680
   43   3HZ   LYS  14          3HZ       LYS  14 -10.475   1.155   5.119
   44    H    SER  15           H        SER  15  -5.563   3.774   5.068
   45    HA   SER  15           HA       SER  15  -7.177   5.028   6.853
   46   1HB   SER  15          2HB       SER  15  -4.537   4.139   6.782
   47   2HB   SER  15          3HB       SER  15  -4.342   5.861   7.037
   48    HG   SER  15           HG       SER  15  -6.307   4.528   8.613
   49    H    GLY  16           H        GLY  16  -5.563   6.323   4.021
   50   1HA   GLY  16          1HA       GLY  16  -6.508   8.423   3.220
   51   2HA   GLY  16          2HA       GLY  16  -6.344   9.056   4.846
   52    H    THR  17           H        THR  17  -3.885   6.893   3.435
   53    HA   THR  17           HA       THR  17  -2.226   8.758   2.244
   54    HB   THR  17           HB       THR  17  -2.184   8.746   5.233
   55    HG1  THR  17           1HG      THR  17  -1.252  10.368   2.970
   56   1HG2  THR  17          1HG2      THR  17   0.353   9.532   4.876
   57   2HG2  THR  17          2HG2      THR  17  -0.016   7.820   5.197
   58   3HG2  THR  17          3HG2      THR  17   0.293   8.368   3.531
   59    H    CYS  18           H        CYS  18  -0.865   7.612   1.019
   60    HA   CYS  18           HA       CYS  18  -0.842   4.906   0.984
   61   1HB   CYS  18          2HB       CYS  18   0.569   7.019  -0.304
   62   2HB   CYS  18          3HB       CYS  18   1.744   5.803   0.159
   63    H    ASN  19           H        ASN  19   0.234   3.269   2.113
   64    HA   ASN  19           HA       ASN  19   1.670   4.157   4.439
   65   1HB   ASN  19          2HB       ASN  19  -0.027   1.944   3.792
   66   2HB   ASN  19          3HB       ASN  19   1.553   1.249   4.099
   67   1HD2  ASN  19          1HD2      ASN  19  -1.032   3.238   5.386
   68   2HD2  ASN  19          2HD2      ASN  19  -0.653   3.073   7.067
   69    H    CYS  20           H        CYS  20   2.598   4.102   1.485
   70    HA   CYS  20           HA       CYS  20   4.957   2.311   1.719
   71   1HB   CYS  20          2HB       CYS  20   4.032   3.852  -0.728
   72   2HB   CYS  20          3HB       CYS  20   5.107   2.434  -0.655
   73    H    GLY  21           H        GLY  21   4.886   4.695   3.384
   74   1HA   GLY  21          1HA       GLY  21   6.872   6.370   1.963
   75   2HA   GLY  21          2HA       GLY  21   5.728   6.975   3.146
   76    H    GLY  22           H        GLY  22   8.092   4.210   2.927
   77   1HA   GLY  22          1HA       GLY  22  10.084   4.760   4.471
   78   2HA   GLY  22          2HA       GLY  22   8.852   4.748   5.718
   79    H    SER  23           H        SER  23   7.175   2.670   5.133
   80    HA   SER  23           HA       SER  23   8.673   0.383   4.361
   81   1HB   SER  23          2HB       SER  23   9.401  -0.256   6.400
   82   2HB   SER  23          3HB       SER  23   8.633   1.132   7.143
   83    HG   SER  23           HG       SER  23   6.742  -0.047   7.489
   84    H    CYS  24           H        CYS  24   7.040  -0.156   2.890
   85    HA   CYS  24           HA       CYS  24   4.408   0.247   3.055
   86   1HB   CYS  24          2HB       CYS  24   5.687  -0.786   1.165
   87   2HB   CYS  24          3HB       CYS  24   5.629  -2.316   2.015
   88    H    THR  25           H        THR  25   2.553  -0.961   3.864
   89    HA   THR  25           HA       THR  25   3.252  -2.874   5.995
   90    HB   THR  25           HB       THR  25   2.421  -0.427   6.582
   91    HG1  THR  25           1HG      THR  25   1.485  -1.494   8.412
   92   1HG2  THR  25          1HG2      THR  25  -0.293  -1.729   6.414
   93   2HG2  THR  25          2HG2      THR  25   0.126   0.000   6.434
   94   3HG2  THR  25          3HG2      THR  25   0.329  -0.948   4.940
   95    H    CYS  26           H        CYS  26   1.749  -2.382   2.989
   96    HA   CYS  26           HA       CYS  26  -0.194  -4.488   3.527
   97   1HB   CYS  26          2HB       CYS  26  -0.824  -3.812   1.051
   98   2HB   CYS  26          3HB       CYS  26  -1.423  -2.936   2.445
   99    H    THR  27           H        THR  27  -0.322  -6.275   1.856
  100    HA   THR  27           HA       THR  27   2.383  -6.913   0.900
  101    HB   THR  27           HB       THR  27  -0.019  -8.720   1.493
  102    HG1  THR  27           1HG      THR  27   2.447  -7.946   2.885
  103   1HG2  THR  27          1HG2      THR  27   2.083 -10.328   1.793
  104   2HG2  THR  27          2HG2      THR  27   1.414 -10.057   0.166
  105   3HG2  THR  27          3HG2      THR  27   2.870  -9.178   0.690
  106    H    ASN  28           H        ASN  28   2.269  -8.511  -1.086
  107    HA   ASN  28           HA       ASN  28   2.061  -8.509  -3.256
  108   1HB   ASN  28          2HB       ASN  28  -0.912  -8.158  -2.597
  109   2HB   ASN  28          3HB       ASN  28  -0.290  -8.767  -4.119
  110   1HD2  ASN  28          1HD2      ASN  28  -1.744  -9.718  -1.453
  111   2HD2  ASN  28          2HD2      ASN  28  -1.097 -11.304  -1.205
  112    H    CYS  29           H        CYS  29   2.524  -5.919  -2.079
  113    HA   CYS  29           HA       CYS  29   0.875  -4.000  -3.588
  114   1HB   CYS  29          2HB       CYS  29   1.679  -3.734  -1.140
  115   2HB   CYS  29          3HB       CYS  29   3.273  -3.371  -1.847
  116    H    SER  30           H        SER  30   2.213  -2.137  -4.731
  117    HA   SER  30           HA       SER  30   4.718  -3.024  -5.749
  118   1HB   SER  30          2HB       SER  30   2.714  -4.101  -7.139
  119   2HB   SER  30          3HB       SER  30   2.633  -2.512  -7.871
  120    HG   SER  30           HG       SER  30   5.073  -2.815  -8.191
  121    H    CYS  31           H        CYS  31   3.731  -0.782  -4.173
  122    HA   CYS  31           HA       CYS  31   3.410   1.441  -5.929
  123   1HB   CYS  31          2HB       CYS  31   3.331   0.938  -3.039
  124   2HB   CYS  31          3HB       CYS  31   4.042   2.483  -3.459
  125    H    LYS  32           H        LYS  32   5.723   1.426  -3.187
  126    HA   LYS  32           HA       LYS  32   8.033   1.260  -4.834
  127   1HB   LYS  32          2HB       LYS  32   8.805   3.506  -4.747
  128   2HB   LYS  32          3HB       LYS  32   7.185   3.548  -5.410
  129   1HG   LYS  32          2HG       LYS  32   6.499   3.864  -2.833
  130   2HG   LYS  32          3HG       LYS  32   8.148   4.442  -2.693
  131   1HD   LYS  32          2HD       LYS  32   6.152   5.499  -4.750
  132   2HD   LYS  32          3HD       LYS  32   6.432   6.252  -3.192
  133   1HE   LYS  32          2HE       LYS  32   8.216   7.363  -4.044
  134   2HE   LYS  32          3HE       LYS  32   9.014   5.837  -4.367
  135   1HZ   LYS  32          1HZ       LYS  32   7.070   6.197  -6.303
  136   2HZ   LYS  32          2HZ       LYS  32   7.897   7.602  -6.193
  137   3HZ   LYS  32          3HZ       LYS  32   8.691   6.207  -6.497
  138    H    SER  33           H        SER  33   9.886   0.888  -3.581
  139    HA   SER  33           HA       SER  33  11.093   0.538  -1.800
  140   1HB   SER  33          2HB       SER  33   8.945   1.843  -0.078
  141   2HB   SER  33          3HB       SER  33  10.621   1.580   0.358
  142    HG   SER  33           HG       SER  33  10.237   3.779  -0.325
  143    H    CYS  34           H        CYS  34   8.278  -0.852  -2.617
  144    HA   CYS  34           HA       CYS  34   8.338  -2.702  -0.342
  145   1HB   CYS  34          2HB       CYS  34   5.914  -3.138  -1.568
  146   2HB   CYS  34          3HB       CYS  34   6.186  -2.254  -0.080
  147    H    LYS  35           H        LYS  35   7.720  -2.273  -3.896
  148    HA   LYS  35           HA       LYS  35   8.850  -4.954  -4.276
  149   1HB   LYS  35          2HB       LYS  35   6.329  -4.859  -4.524
  150   2HB   LYS  35          3HB       LYS  35   6.570  -3.808  -5.905
  151   1HG   LYS  35          2HG       LYS  35   8.058  -5.593  -6.933
  152   2HG   LYS  35          3HG       LYS  35   7.651  -6.647  -5.593
  153   1HD   LYS  35          2HD       LYS  35   5.630  -7.177  -6.494
  154   2HD   LYS  35          3HD       LYS  35   5.228  -5.495  -6.774
  155   1HE   LYS  35          2HE       LYS  35   6.455  -5.472  -8.887
  156   2HE   LYS  35          3HE       LYS  35   7.140  -7.054  -8.572
  157   1HZ   LYS  35          1HZ       LYS  35   5.345  -7.972  -9.418
  158   2HZ   LYS  35          2HZ       LYS  35   4.349  -7.176  -8.398
  159   3HZ   LYS  35          3HZ       LYS  35   4.769  -6.499  -9.823
  Start of MODEL    6
    1    H    ASP   8           H        ASP   8 -10.437  -4.286   2.571
    2    HA   ASP   8           HA       ASP   8  -9.715  -5.333  -0.034
    3   1HB   ASP   8          2HB       ASP   8 -10.929  -2.816   0.345
    4   2HB   ASP   8          3HB       ASP   8  -9.222  -2.438   0.228
    5    HA   PRO   9           HA       PRO   9  -5.860  -5.098   2.093
    6   1HB   PRO   9          2HB       PRO   9  -4.233  -6.042   0.109
    7   2HB   PRO   9          3HB       PRO   9  -5.144  -7.088   1.183
    8   1HG   PRO   9          2HG       PRO   9  -5.676  -6.421  -1.648
    9   2HG   PRO   9          3HG       PRO   9  -6.298  -7.757  -0.699
   10   1HD   PRO   9          2HD       PRO   9  -7.705  -5.364  -1.419
   11   2HD   PRO   9          3HD       PRO   9  -8.285  -6.647  -0.375
   12    H    CYS  10           H        CYS  10  -3.720  -4.054   2.090
   13    HA   CYS  10           HA       CYS  10  -2.473  -2.283   1.757
   14   1HB   CYS  10          2HB       CYS  10  -2.169  -3.026  -0.500
   15   2HB   CYS  10          3HB       CYS  10  -3.707  -2.349  -0.999
   16    H    GLU  11           H        GLU  11  -2.629  -0.033   2.238
   17    HA   GLU  11           HA       GLU  11  -5.365   0.980   2.156
   18   1HB   GLU  11          2HB       GLU  11  -3.208   1.196   4.266
   19   2HB   GLU  11          3HB       GLU  11  -4.424   2.453   4.147
   20   1HG   GLU  11          2HG       GLU  11  -6.223   0.911   4.569
   21   2HG   GLU  11          3HG       GLU  11  -5.206  -0.486   4.269
   22    H    CYS  12           H        CYS  12  -2.282   1.215   0.920
   23    HA   CYS  12           HA       CYS  12  -1.780   3.993   0.763
   24   1HB   CYS  12          2HB       CYS  12  -1.095   1.749  -1.181
   25   2HB   CYS  12          3HB       CYS  12  -0.357   3.372  -1.173
   26    H    SER  13           H        SER  13  -3.244   1.830  -1.812
   27    HA   SER  13           HA       SER  13  -4.160   4.183  -3.137
   28   1HB   SER  13          2HB       SER  13  -3.465   2.437  -4.592
   29   2HB   SER  13          3HB       SER  13  -4.320   1.207  -3.683
   30    HG   SER  13           HG       SER  13  -5.256   2.104  -5.828
   31    H    LYS  14           H        LYS  14  -5.431   1.638  -0.990
   32    HA   LYS  14           HA       LYS  14  -8.169   2.256  -1.476
   33   1HB   LYS  14          2HB       LYS  14  -7.529   0.036  -0.771
   34   2HB   LYS  14          3HB       LYS  14  -6.765   0.653   0.678
   35   1HG   LYS  14          2HG       LYS  14  -9.476   1.662   0.589
   36   2HG   LYS  14          3HG       LYS  14  -9.525  -0.064   0.293
   37   1HD   LYS  14          2HD       LYS  14  -8.942  -0.567   2.442
   38   2HD   LYS  14          3HD       LYS  14  -7.652   0.619   2.463
   39   1HE   LYS  14          2HE       LYS  14  -8.957   2.202   3.480
   40   2HE   LYS  14          3HE       LYS  14 -10.330   1.872   2.441
   41   1HZ   LYS  14          1HZ       LYS  14  -9.547   0.454   4.876
   42   2HZ   LYS  14          2HZ       LYS  14 -10.967   1.186   4.541
   43   3HZ   LYS  14          3HZ       LYS  14 -10.579  -0.217   3.802
   44    H    SER  15           H        SER  15  -6.849   2.279   1.838
   45    HA   SER  15           HA       SER  15  -8.408   4.167   2.825
   46   1HB   SER  15          2HB       SER  15  -6.437   2.777   3.889
   47   2HB   SER  15          3HB       SER  15  -5.471   4.203   3.570
   48    HG   SER  15           HG       SER  15  -7.738   5.088   4.713
   49    H    GLY  16           H        GLY  16  -5.226   4.765   1.182
   50   1HA   GLY  16          1HA       GLY  16  -4.913   6.567  -0.295
   51   2HA   GLY  16          2HA       GLY  16  -6.160   7.477   0.534
   52    H    THR  17           H        THR  17  -3.654   5.615   2.280
   53    HA   THR  17           HA       THR  17  -2.131   8.049   2.783
   54    HB   THR  17           HB       THR  17  -3.934   6.623   4.721
   55    HG1  THR  17           1HG      THR  17  -2.672   9.240   4.308
   56   1HG2  THR  17          1HG2      THR  17  -2.114   6.165   6.104
   57   2HG2  THR  17          2HG2      THR  17  -1.063   7.334   5.269
   58   3HG2  THR  17          3HG2      THR  17  -2.264   7.905   6.452
   59    H    CYS  18           H        CYS  18  -0.594   6.948   1.407
   60    HA   CYS  18           HA       CYS  18   0.340   4.413   1.847
   61   1HB   CYS  18          2HB       CYS  18   1.009   5.473  -0.121
   62   2HB   CYS  18          3HB       CYS  18   1.598   6.894   0.717
   63    H    ASN  19           H        ASN  19   1.850   3.495   3.287
   64    HA   ASN  19           HA       ASN  19   3.132   5.336   5.124
   65   1HB   ASN  19          2HB       ASN  19   0.887   3.861   5.875
   66   2HB   ASN  19          3HB       ASN  19   2.185   2.789   6.360
   67   1HD2  ASN  19          1HD2      ASN  19   4.166   4.688   6.930
   68   2HD2  ASN  19          2HD2      ASN  19   3.732   5.570   8.356
   69    H    CYS  20           H        CYS  20   4.363   4.207   2.977
   70    HA   CYS  20           HA       CYS  20   5.777   1.787   3.980
   71   1HB   CYS  20          2HB       CYS  20   5.584   2.944   1.166
   72   2HB   CYS  20          3HB       CYS  20   6.403   1.431   1.627
   73    H    GLY  21           H        GLY  21   6.447   4.301   5.190
   74   1HA   GLY  21          1HA       GLY  21   8.879   5.141   3.772
   75   2HA   GLY  21          2HA       GLY  21   8.070   5.991   5.073
   76    H    GLY  22           H        GLY  22   9.184   2.548   4.700
   77   1HA   GLY  22          1HA       GLY  22  11.453   2.506   6.135
   78   2HA   GLY  22          2HA       GLY  22  10.240   2.589   7.398
   79    H    SER  23           H        SER  23   8.150   1.044   6.612
   80    HA   SER  23           HA       SER  23   9.238  -1.435   5.618
   81   1HB   SER  23          2HB       SER  23   9.336  -2.440   7.635
   82   2HB   SER  23          3HB       SER  23   8.832  -0.954   8.414
   83    HG   SER  23           HG       SER  23   7.463  -3.069   8.583
   84    H    CYS  24           H        CYS  24   7.572  -2.868   4.772
   85    HA   CYS  24           HA       CYS  24   5.056  -1.447   4.353
   86   1HB   CYS  24          2HB       CYS  24   6.494  -2.126   2.387
   87   2HB   CYS  24          3HB       CYS  24   6.130  -3.795   2.784
   88    H    THR  25           H        THR  25   3.064  -2.492   4.862
   89    HA   THR  25           HA       THR  25   3.356  -5.042   6.310
   90    HB   THR  25           HB       THR  25   1.523  -4.162   7.786
   91    HG1  THR  25           1HG      THR  25   0.731  -2.082   7.268
   92   1HG2  THR  25          1HG2      THR  25   2.817  -1.984   8.580
   93   2HG2  THR  25          2HG2      THR  25   3.591  -3.574   8.794
   94   3HG2  THR  25          3HG2      THR  25   4.061  -2.530   7.430
   95    H    CYS  26           H        CYS  26   1.865  -3.256   3.731
   96    HA   CYS  26           HA       CYS  26  -0.309  -5.163   3.552
   97   1HB   CYS  26          2HB       CYS  26  -0.723  -3.675   1.411
   98   2HB   CYS  26          3HB       CYS  26  -1.227  -3.175   3.013
   99    H    THR  27           H        THR  27  -0.642  -6.334   1.437
  100    HA   THR  27           HA       THR  27   1.964  -7.028   0.260
  101    HB   THR  27           HB       THR  27  -0.230  -8.559   1.382
  102    HG1  THR  27           1HG      THR  27   2.236  -8.755   1.356
  103   1HG2  THR  27          1HG2      THR  27  -1.171  -8.719  -0.906
  104   2HG2  THR  27          2HG2      THR  27   0.442  -9.091  -1.560
  105   3HG2  THR  27          3HG2      THR  27  -0.370 -10.253  -0.484
  106    H    ASN  28           H        ASN  28  -1.439  -6.135  -0.442
  107    HA   ASN  28           HA       ASN  28  -0.929  -6.271  -3.243
  108   1HB   ASN  28          2HB       ASN  28  -3.279  -5.396  -1.514
  109   2HB   ASN  28          3HB       ASN  28  -3.290  -5.074  -3.237
  110   1HD2  ASN  28          1HD2      ASN  28  -3.137  -7.553  -0.759
  111   2HD2  ASN  28          2HD2      ASN  28  -3.679  -8.890  -1.718
  112    H    CYS  29           H        CYS  29   0.990  -4.691  -2.536
  113    HA   CYS  29           HA       CYS  29   0.126  -1.868  -2.427
  114   1HB   CYS  29          2HB       CYS  29   2.128  -3.194  -1.140
  115   2HB   CYS  29          3HB       CYS  29   3.011  -2.577  -2.560
  116    H    SER  30           H        SER  30   1.947  -0.447  -3.847
  117    HA   SER  30           HA       SER  30   2.714  -1.566  -6.254
  118   1HB   SER  30          2HB       SER  30   0.072  -1.489  -6.403
  119   2HB   SER  30          3HB       SER  30   0.312   0.222  -6.695
  120    HG   SER  30           HG       SER  30   0.246  -0.986  -8.687
  121    H    CYS  31           H        CYS  31   1.787   1.164  -4.209
  122    HA   CYS  31           HA       CYS  31   2.428   3.370  -5.489
  123   1HB   CYS  31          2HB       CYS  31   3.655   4.078  -3.313
  124   2HB   CYS  31          3HB       CYS  31   1.939   3.727  -3.287
  125    H    LYS  32           H        LYS  32   4.230   4.344  -6.458
  126    HA   LYS  32           HA       LYS  32   6.413   2.663  -7.089
  127   1HB   LYS  32          2HB       LYS  32   5.497   4.367  -8.618
  128   2HB   LYS  32          3HB       LYS  32   6.018   5.638  -7.530
  129   1HG   LYS  32          2HG       LYS  32   8.129   5.573  -8.360
  130   2HG   LYS  32          3HG       LYS  32   8.255   3.854  -8.042
  131   1HD   LYS  32          2HD       LYS  32   7.819   3.295 -10.218
  132   2HD   LYS  32          3HD       LYS  32   6.509   4.450 -10.352
  133   1HE   LYS  32          2HE       LYS  32   8.440   4.987 -11.870
  134   2HE   LYS  32          3HE       LYS  32   8.072   6.288 -10.754
  135   1HZ   LYS  32          1HZ       LYS  32   9.813   5.159  -9.298
  136   2HZ   LYS  32          2HZ       LYS  32  10.296   4.406 -10.665
  137   3HZ   LYS  32          3HZ       LYS  32  10.328   6.036 -10.576
  138    H    SER  33           H        SER  33   5.626   4.503  -4.314
  139    HA   SER  33           HA       SER  33   8.354   5.138  -3.705
  140   1HB   SER  33          2HB       SER  33   5.761   6.024  -2.844
  141   2HB   SER  33          3HB       SER  33   6.591   5.412  -1.427
  142    HG   SER  33           HG       SER  33   7.672   7.360  -3.283
  143    H    CYS  34           H        CYS  34   6.993   2.272  -3.963
  144    HA   CYS  34           HA       CYS  34   7.848   1.300  -1.339
  145   1HB   CYS  34          2HB       CYS  34   5.467   0.878  -2.279
  146   2HB   CYS  34          3HB       CYS  34   6.243  -0.302  -3.314
  147    H    LYS  35           H        LYS  35   7.700   0.224  -4.823
  148    HA   LYS  35           HA       LYS  35  10.380  -0.914  -4.432
  149   1HB   LYS  35          2HB       LYS  35   8.190  -1.778  -6.346
  150   2HB   LYS  35          3HB       LYS  35   9.788  -2.489  -6.235
  151   1HG   LYS  35          2HG       LYS  35   9.356  -3.108  -3.853
  152   2HG   LYS  35          3HG       LYS  35   7.767  -2.375  -3.946
  153   1HD   LYS  35          2HD       LYS  35   6.965  -4.370  -4.669
  154   2HD   LYS  35          3HD       LYS  35   7.844  -4.119  -6.165
  155   1HE   LYS  35          2HE       LYS  35   9.844  -5.014  -4.424
  156   2HE   LYS  35          3HE       LYS  35   8.449  -5.944  -3.916
  157   1HZ   LYS  35          1HZ       LYS  35   9.553  -7.074  -5.662
  158   2HZ   LYS  35          2HZ       LYS  35   8.128  -6.540  -6.257
  159   3HZ   LYS  35          3HZ       LYS  35   9.515  -5.771  -6.646
  Start of MODEL    7
    1    H    ASP   8           H        ASP   8  -9.266  -5.123  -6.304
    2    HA   ASP   8           HA       ASP   8  -9.927  -3.523  -4.290
    3   1HB   ASP   8          2HB       ASP   8  -9.095  -6.146  -4.545
    4   2HB   ASP   8          3HB       ASP   8  -7.789  -5.483  -3.583
    5    HA   PRO   9           HA       PRO   9  -6.324  -0.988  -3.893
    6   1HB   PRO   9          2HB       PRO   9  -7.231   0.647  -1.899
    7   2HB   PRO   9          3HB       PRO   9  -7.583   0.918  -3.592
    8   1HG   PRO   9          2HG       PRO   9  -9.357  -0.132  -1.475
    9   2HG   PRO   9          3HG       PRO   9  -9.789   0.537  -3.036
   10   1HD   PRO   9          2HD       PRO   9  -9.752  -2.237  -2.310
   11   2HD   PRO   9          3HD       PRO   9 -10.070  -1.574  -3.901
   12    H    CYS  10           H        CYS  10  -4.675  -0.280  -2.265
   13    HA   CYS  10           HA       CYS  10  -4.433  -2.515  -0.409
   14   1HB   CYS  10          2HB       CYS  10  -2.613  -2.169  -2.030
   15   2HB   CYS  10          3HB       CYS  10  -2.341  -0.562  -1.388
   16    H    GLU  11           H        GLU  11  -3.598  -1.980   1.822
   17    HA   GLU  11           HA       GLU  11  -5.152  -0.225   3.119
   18   1HB   GLU  11          2HB       GLU  11  -2.428  -1.382   3.739
   19   2HB   GLU  11          3HB       GLU  11  -3.133  -0.220   4.846
   20   1HG   GLU  11          2HG       GLU  11  -4.056  -2.138   5.750
   21   2HG   GLU  11          3HG       GLU  11  -5.298  -1.804   4.561
   22    H    CYS  12           H        CYS  12  -2.325   0.418   1.220
   23    HA   CYS  12           HA       CYS  12  -1.442   2.878   2.260
   24   1HB   CYS  12          2HB       CYS  12  -1.498   1.729  -0.553
   25   2HB   CYS  12          3HB       CYS  12  -0.702   3.272  -0.154
   26    H    SER  13           H        SER  13  -3.809   2.331  -0.487
   27    HA   SER  13           HA       SER  13  -4.517   5.088  -0.318
   28   1HB   SER  13          2HB       SER  13  -4.418   3.552  -2.435
   29   2HB   SER  13          3HB       SER  13  -5.991   2.973  -1.923
   30    HG   SER  13           HG       SER  13  -6.131   4.767  -3.433
   31    H    LYS  14           H        LYS  14  -5.692   1.947   0.841
   32    HA   LYS  14           HA       LYS  14  -8.347   2.610   1.327
   33   1HB   LYS  14          2HB       LYS  14  -6.547   0.448   1.865
   34   2HB   LYS  14          3HB       LYS  14  -7.396   0.828   3.348
   35   1HG   LYS  14          2HG       LYS  14  -9.167   0.865   0.976
   36   2HG   LYS  14          3HG       LYS  14  -8.406  -0.693   1.229
   37   1HD   LYS  14          2HD       LYS  14  -9.727  -1.137   3.026
   38   2HD   LYS  14          3HD       LYS  14  -9.328   0.393   3.780
   39   1HE   LYS  14          2HE       LYS  14 -10.989   1.343   1.870
   40   2HE   LYS  14          3HE       LYS  14 -11.629  -0.286   1.957
   41   1HZ   LYS  14          1HZ       LYS  14 -11.343   1.581   4.207
   42   2HZ   LYS  14          2HZ       LYS  14 -12.740   1.095   3.516
   43   3HZ   LYS  14          3HZ       LYS  14 -11.834   0.031   4.360
   44    H    SER  15           H        SER  15  -5.535   2.657   3.636
   45    HA   SER  15           HA       SER  15  -6.868   3.761   5.721
   46   1HB   SER  15          2HB       SER  15  -4.477   2.875   5.643
   47   2HB   SER  15          3HB       SER  15  -3.990   4.412   4.957
   48    HG   SER  15           HG       SER  15  -4.084   5.327   6.894
   49    H    GLY  16           H        GLY  16  -5.231   5.397   2.943
   50   1HA   GLY  16          1HA       GLY  16  -6.600   7.379   2.201
   51   2HA   GLY  16          2HA       GLY  16  -6.402   7.957   3.844
   52    H    THR  17           H        THR  17  -3.642   6.875   4.172
   53    HA   THR  17           HA       THR  17  -2.175   8.442   2.177
   54    HB   THR  17           HB       THR  17  -2.251   8.819   5.200
   55    HG1  THR  17           1HG      THR  17  -3.539  10.073   3.548
   56   1HG2  THR  17          1HG2      THR  17   0.138   8.806   3.617
   57   2HG2  THR  17          2HG2      THR  17  -0.317  10.514   3.832
   58   3HG2  THR  17          3HG2      THR  17  -0.063   9.473   5.255
   59    H    CYS  18           H        CYS  18  -0.821   7.077   1.208
   60    HA   CYS  18           HA       CYS  18  -0.221   4.575   2.021
   61   1HB   CYS  18          2HB       CYS  18   0.442   4.905  -0.112
   62   2HB   CYS  18          3HB       CYS  18   1.022   6.531   0.188
   63    H    ASN  19           H        ASN  19   0.369   4.176   4.165
   64    HA   ASN  19           HA       ASN  19   2.414   5.856   5.309
   65   1HB   ASN  19          2HB       ASN  19   0.251   5.062   6.531
   66   2HB   ASN  19          3HB       ASN  19   1.006   3.482   6.624
   67   1HD2  ASN  19          1HD2      ASN  19   0.474   6.255   8.247
   68   2HD2  ASN  19          2HD2      ASN  19   1.805   6.274   9.357
   69    H    CYS  20           H        CYS  20   2.765   3.794   3.110
   70    HA   CYS  20           HA       CYS  20   4.642   1.917   4.461
   71   1HB   CYS  20          2HB       CYS  20   3.746   0.319   3.158
   72   2HB   CYS  20          3HB       CYS  20   2.580   1.514   2.535
   73    H    GLY  21           H        GLY  21   4.499   4.837   2.675
   74   1HA   GLY  21          1HA       GLY  21   6.356   4.744   0.725
   75   2HA   GLY  21          2HA       GLY  21   6.205   6.076   1.853
   76    H    GLY  22           H        GLY  22   7.029   4.901   4.289
   77   1HA   GLY  22          1HA       GLY  22   9.892   4.634   3.765
   78   2HA   GLY  22          2HA       GLY  22   9.115   4.980   5.297
   79    H    SER  23           H        SER  23   7.833   3.180   6.351
   80    HA   SER  23           HA       SER  23   9.276   0.714   5.909
   81   1HB   SER  23          2HB       SER  23   7.462   0.565   8.149
   82   2HB   SER  23          3HB       SER  23   9.214   0.533   8.157
   83    HG   SER  23           HG       SER  23   8.003   2.358   9.331
   84    H    CYS  24           H        CYS  24   8.319  -0.696   4.482
   85    HA   CYS  24           HA       CYS  24   5.464  -0.573   4.120
   86   1HB   CYS  24          2HB       CYS  24   6.984  -0.733   2.190
   87   2HB   CYS  24          3HB       CYS  24   7.551  -2.289   2.761
   88    H    THR  25           H        THR  25   4.202  -2.709   4.143
   89    HA   THR  25           HA       THR  25   5.290  -4.887   5.636
   90    HB   THR  25           HB       THR  25   4.792  -3.023   7.374
   91    HG1  THR  25           1HG      THR  25   3.301  -5.555   7.340
   92   1HG2  THR  25          1HG2      THR  25   1.946  -3.890   6.638
   93   2HG2  THR  25          2HG2      THR  25   2.388  -2.966   8.094
   94   3HG2  THR  25          3HG2      THR  25   2.602  -2.242   6.482
   95    H    CYS  26           H        CYS  26   2.408  -3.146   4.374
   96    HA   CYS  26           HA       CYS  26   0.622  -5.179   4.343
   97   1HB   CYS  26          2HB       CYS  26   0.211  -3.929   1.897
   98   2HB   CYS  26          3HB       CYS  26  -0.521  -3.522   3.436
   99    H    THR  27           H        THR  27   0.303  -7.060   3.110
  100    HA   THR  27           HA       THR  27   2.582  -7.943   1.567
  101    HB   THR  27           HB       THR  27   0.277  -9.085   3.022
  102    HG1  THR  27           1HG      THR  27   2.859  -9.960   1.929
  103   1HG2  THR  27          1HG2      THR  27   0.159 -11.145   1.641
  104   2HG2  THR  27          2HG2      THR  27  -0.410  -9.752   0.691
  105   3HG2  THR  27          3HG2      THR  27   1.224 -10.403   0.422
  106    H    ASN  28           H        ASN  28  -0.924  -7.268   0.985
  107    HA   ASN  28           HA       ASN  28  -0.533  -7.747  -1.797
  108   1HB   ASN  28          2HB       ASN  28  -2.872  -6.821  -0.077
  109   2HB   ASN  28          3HB       ASN  28  -2.987  -6.774  -1.825
  110   1HD2  ASN  28          1HD2      ASN  28  -2.633  -8.784   1.005
  111   2HD2  ASN  28          2HD2      ASN  28  -3.051 -10.305   0.286
  112    H    CYS  29           H        CYS  29   1.267  -5.916  -1.351
  113    HA   CYS  29           HA       CYS  29   0.135  -3.199  -1.651
  114   1HB   CYS  29          2HB       CYS  29   2.119  -3.954  -0.077
  115   2HB   CYS  29          3HB       CYS  29   3.080  -3.833  -1.572
  116    H    SER  30           H        SER  30   1.495  -1.767  -3.330
  117    HA   SER  30           HA       SER  30   2.641  -3.078  -5.485
  118   1HB   SER  30          2HB       SER  30   0.123  -3.724  -5.707
  119   2HB   SER  30          3HB       SER  30  -0.135  -2.055  -6.172
  120    HG   SER  30           HG       SER  30   1.528  -2.403  -7.871
  121    H    CYS  31           H        CYS  31   3.060  -0.797  -3.720
  122    HA   CYS  31           HA       CYS  31   2.338   1.589  -5.022
  123   1HB   CYS  31          2HB       CYS  31   4.110   0.807  -2.770
  124   2HB   CYS  31          3HB       CYS  31   4.461   2.339  -3.549
  125    H    LYS  32           H        LYS  32   5.778   1.141  -4.312
  126    HA   LYS  32           HA       LYS  32   6.854   0.245  -6.603
  127   1HB   LYS  32          2HB       LYS  32   5.500   2.751  -7.137
  128   2HB   LYS  32          3HB       LYS  32   7.219   2.913  -7.432
  129   1HG   LYS  32          2HG       LYS  32   7.185   0.891  -8.880
  130   2HG   LYS  32          3HG       LYS  32   5.481   0.662  -8.547
  131   1HD   LYS  32          2HD       LYS  32   6.428   3.311  -9.675
  132   2HD   LYS  32          3HD       LYS  32   6.253   1.936 -10.747
  133   1HE   LYS  32          2HE       LYS  32   3.922   1.823 -10.462
  134   2HE   LYS  32          3HE       LYS  32   3.971   2.558  -8.871
  135   1HZ   LYS  32          1HZ       LYS  32   3.176   4.198 -10.262
  136   2HZ   LYS  32          2HZ       LYS  32   4.748   4.608 -10.101
  137   3HZ   LYS  32          3HZ       LYS  32   4.229   3.875 -11.466
  138    H    SER  33           H        SER  33   6.805   2.696  -4.039
  139    HA   SER  33           HA       SER  33   9.658   2.941  -4.112
  140   1HB   SER  33          2HB       SER  33   7.466   4.462  -3.069
  141   2HB   SER  33          3HB       SER  33   8.470   4.024  -1.701
  142    HG   SER  33           HG       SER  33  10.328   4.792  -3.171
  143    H    CYS  34           H        CYS  34   7.999   0.350  -3.437
  144    HA   CYS  34           HA       CYS  34   9.563  -0.263  -1.048
  145   1HB   CYS  34          2HB       CYS  34   7.692  -1.644  -0.201
  146   2HB   CYS  34          3HB       CYS  34   7.375   0.080  -0.186
  147    H    LYS  35           H        LYS  35   7.490  -1.521  -3.758
  148    HA   LYS  35           HA       LYS  35   9.121  -3.932  -3.821
  149   1HB   LYS  35          2HB       LYS  35   6.379  -3.193  -4.608
  150   2HB   LYS  35          3HB       LYS  35   7.204  -4.209  -5.773
  151   1HG   LYS  35          2HG       LYS  35   7.845  -5.762  -3.850
  152   2HG   LYS  35          3HG       LYS  35   6.826  -4.796  -2.801
  153   1HD   LYS  35          2HD       LYS  35   4.833  -5.358  -4.050
  154   2HD   LYS  35          3HD       LYS  35   5.763  -6.026  -5.376
  155   1HE   LYS  35          2HE       LYS  35   6.709  -7.675  -3.511
  156   2HE   LYS  35          3HE       LYS  35   5.268  -7.207  -2.631
  157   1HZ   LYS  35          1HZ       LYS  35   4.655  -7.799  -5.312
  158   2HZ   LYS  35          2HZ       LYS  35   5.430  -9.059  -4.619
  159   3HZ   LYS  35          3HZ       LYS  35   4.061  -8.472  -3.948
  Start of MODEL    8
    1    H    ASP   8           H        ASP   8  -6.704   2.950  -5.422
    2    HA   ASP   8           HA       ASP   8  -3.847   3.124  -5.982
    3   1HB   ASP   8          2HB       ASP   8  -4.918   4.522  -4.017
    4   2HB   ASP   8          3HB       ASP   8  -5.029   2.982  -3.188
    5    HA   PRO   9           HA       PRO   9  -4.183  -1.235  -5.456
    6   1HB   PRO   9          2HB       PRO   9  -1.534  -1.891  -5.594
    7   2HB   PRO   9          3HB       PRO   9  -2.531  -1.629  -7.012
    8   1HG   PRO   9          2HG       PRO   9  -0.477   0.144  -5.838
    9   2HG   PRO   9          3HG       PRO   9  -1.169   0.179  -7.448
   10   1HD   PRO   9          2HD       PRO   9  -1.796   1.940  -5.272
   11   2HD   PRO   9          3HD       PRO   9  -2.569   1.901  -6.845
   12    H    CYS  10           H        CYS  10  -3.923  -2.974  -3.977
   13    HA   CYS  10           HA       CYS  10  -3.799  -3.754  -1.930
   14   1HB   CYS  10          2HB       CYS  10  -1.373  -3.526  -2.383
   15   2HB   CYS  10          3HB       CYS  10  -1.393  -1.947  -1.623
   16    H    GLU  11           H        GLU  11  -3.997  -3.123   0.493
   17    HA   GLU  11           HA       GLU  11  -5.136  -0.441   0.646
   18   1HB   GLU  11          2HB       GLU  11  -6.173  -3.092   1.636
   19   2HB   GLU  11          3HB       GLU  11  -6.542  -1.658   2.574
   20   1HG   GLU  11          2HG       GLU  11  -7.096  -0.774   0.008
   21   2HG   GLU  11          3HG       GLU  11  -7.532  -2.466  -0.115
   22    H    CYS  12           H        CYS  12  -3.113   0.353   1.354
   23    HA   CYS  12           HA       CYS  12  -2.008  -0.708   3.872
   24   1HB   CYS  12          2HB       CYS  12  -0.906   1.751   2.592
   25   2HB   CYS  12          3HB       CYS  12  -0.063   0.330   3.254
   26    H    SER  13           H        SER  13  -2.494   2.735   2.764
   27    HA   SER  13           HA       SER  13  -3.751   3.137   5.367
   28   1HB   SER  13          2HB       SER  13  -1.501   4.514   4.057
   29   2HB   SER  13          3HB       SER  13  -2.754   5.632   4.556
   30    HG   SER  13           HG       SER  13  -2.602   4.851   6.712
   31    H    LYS  14           H        LYS  14  -4.802   2.514   2.531
   32    HA   LYS  14           HA       LYS  14  -5.822   4.420   1.072
   33   1HB   LYS  14          2HB       LYS  14  -6.379   1.924   1.099
   34   2HB   LYS  14          3HB       LYS  14  -7.665   2.315   2.222
   35   1HG   LYS  14          2HG       LYS  14  -8.851   2.538   0.244
   36   2HG   LYS  14          3HG       LYS  14  -8.251   4.180   0.378
   37   1HD   LYS  14          2HD       LYS  14  -6.313   2.383  -0.942
   38   2HD   LYS  14          3HD       LYS  14  -7.845   2.447  -1.790
   39   1HE   LYS  14          2HE       LYS  14  -7.007   5.127  -0.927
   40   2HE   LYS  14          3HE       LYS  14  -5.769   4.365  -1.904
   41   1HZ   LYS  14          1HZ       LYS  14  -7.496   3.885  -3.545
   42   2HZ   LYS  14          2HZ       LYS  14  -8.591   4.697  -2.647
   43   3HZ   LYS  14          3HZ       LYS  14  -7.317   5.487  -3.293
   44    H    SER  15           H        SER  15  -6.934   3.717   4.427
   45    HA   SER  15           HA       SER  15  -9.081   5.188   4.700
   46   1HB   SER  15          2HB       SER  15  -7.094   4.222   6.427
   47   2HB   SER  15          3HB       SER  15  -7.152   5.933   6.800
   48    HG   SER  15           HG       SER  15  -8.676   4.489   8.016
   49    H    GLY  16           H        GLY  16  -5.814   6.432   4.036
   50   1HA   GLY  16          1HA       GLY  16  -6.921   9.025   3.368
   51   2HA   GLY  16          2HA       GLY  16  -5.836   9.024   4.744
   52    H    THR  17           H        THR  17  -5.777   7.023   1.717
   53    HA   THR  17           HA       THR  17  -4.333   7.043  -0.007
   54    HB   THR  17           HB       THR  17  -4.119   9.663   0.919
   55    HG1  THR  17           1HG      THR  17  -2.903   9.782  -1.158
   56   1HG2  THR  17          1HG2      THR  17  -1.779  10.227   1.024
   57   2HG2  THR  17          2HG2      THR  17  -1.974   8.874   2.164
   58   3HG2  THR  17          3HG2      THR  17  -1.288   8.583   0.548
   59    H    CYS  18           H        CYS  18  -2.663   5.664  -0.432
   60    HA   CYS  18           HA       CYS  18  -1.787   3.956   1.412
   61   1HB   CYS  18          2HB       CYS  18  -1.256   3.312  -0.707
   62   2HB   CYS  18          3HB       CYS  18  -0.670   4.895  -1.177
   63    H    ASN  19           H        ASN  19   0.278   3.707   2.624
   64    HA   ASN  19           HA       ASN  19   1.748   6.160   2.992
   65   1HB   ASN  19          2HB       ASN  19  -0.177   5.996   4.728
   66   2HB   ASN  19          3HB       ASN  19   0.663   4.608   5.393
   67   1HD2  ASN  19          1HD2      ASN  19   0.395   7.972   5.310
   68   2HD2  ASN  19          2HD2      ASN  19   1.784   8.407   6.248
   69    H    CYS  20           H        CYS  20   2.815   4.205   1.638
   70    HA   CYS  20           HA       CYS  20   4.061   2.165   3.343
   71   1HB   CYS  20          2HB       CYS  20   3.819   2.733   0.407
   72   2HB   CYS  20          3HB       CYS  20   5.210   1.770   0.963
   73    H    GLY  21           H        GLY  21   4.679   5.052   3.890
   74   1HA   GLY  21          1HA       GLY  21   6.893   6.134   2.876
   75   2HA   GLY  21          2HA       GLY  21   6.588   6.062   4.600
   76    H    GLY  22           H        GLY  22   7.435   4.186   5.850
   77   1HA   GLY  22          1HA       GLY  22  10.105   3.586   5.139
   78   2HA   GLY  22          2HA       GLY  22   9.186   2.915   6.472
   79    H    SER  23           H        SER  23   9.656   0.725   6.285
   80    HA   SER  23           HA       SER  23   9.614  -0.495   3.716
   81   1HB   SER  23          2HB       SER  23  10.620  -1.115   6.333
   82   2HB   SER  23          3HB       SER  23   9.557  -2.429   5.865
   83    HG   SER  23           HG       SER  23  11.362  -3.088   4.863
   84    H    CYS  24           H        CYS  24   8.109  -2.176   3.020
   85    HA   CYS  24           HA       CYS  24   5.460  -1.588   3.562
   86   1HB   CYS  24          2HB       CYS  24   6.726  -4.042   2.333
   87   2HB   CYS  24          3HB       CYS  24   4.996  -3.763   2.386
   88    H    THR  25           H        THR  25   4.027  -2.324   5.135
   89    HA   THR  25           HA       THR  25   5.082  -4.371   6.976
   90    HB   THR  25           HB       THR  25   4.814  -1.949   7.810
   91    HG1  THR  25           1HG      THR  25   3.089  -4.091   8.847
   92   1HG2  THR  25          1HG2      THR  25   2.399  -1.457   8.519
   93   2HG2  THR  25          2HG2      THR  25   2.704  -1.274   6.775
   94   3HG2  THR  25          3HG2      THR  25   1.884  -2.731   7.386
   95    H    CYS  26           H        CYS  26   2.439  -3.343   4.871
   96    HA   CYS  26           HA       CYS  26   0.587  -5.214   5.925
   97   1HB   CYS  26          2HB       CYS  26  -0.418  -4.705   3.497
   98   2HB   CYS  26          3HB       CYS  26  -0.622  -3.646   4.880
   99    H    THR  27           H        THR  27  -0.361  -6.947   4.282
  100    HA   THR  27           HA       THR  27   1.949  -8.402   3.198
  101    HB   THR  27           HB       THR  27  -0.783  -9.233   4.289
  102    HG1  THR  27           1HG      THR  27   2.017  -9.915   4.849
  103   1HG2  THR  27          1HG2      THR  27   1.063 -10.656   2.441
  104   2HG2  THR  27          2HG2      THR  27   0.738 -11.540   3.952
  105   3HG2  THR  27          3HG2      THR  27  -0.611 -11.059   2.894
  106    H    ASN  28           H        ASN  28   2.031  -9.127   1.098
  107    HA   ASN  28           HA       ASN  28   1.646  -9.100  -1.035
  108   1HB   ASN  28          2HB       ASN  28  -1.326  -8.961  -0.299
  109   2HB   ASN  28          3HB       ASN  28  -0.685  -9.475  -1.846
  110   1HD2  ASN  28          1HD2      ASN  28  -2.367 -11.043  -0.321
  111   2HD2  ASN  28          2HD2      ASN  28  -1.533 -12.451   0.244
  112    H    CYS  29           H        CYS  29   2.550  -6.859  -0.873
  113    HA   CYS  29           HA       CYS  29   0.593  -4.668  -1.212
  114   1HB   CYS  29          2HB       CYS  29   2.740  -4.676   0.319
  115   2HB   CYS  29          3HB       CYS  29   3.587  -4.324  -1.209
  116    H    SER  30           H        SER  30   1.299  -2.952  -2.986
  117    HA   SER  30           HA       SER  30   2.805  -3.839  -5.130
  118   1HB   SER  30          2HB       SER  30   0.681  -5.374  -5.230
  119   2HB   SER  30          3HB       SER  30  -0.154  -3.942  -5.798
  120    HG   SER  30           HG       SER  30   0.622  -4.401  -7.732
  121    H    CYS  31           H        CYS  31   3.172  -1.521  -4.111
  122    HA   CYS  31           HA       CYS  31   1.486   0.357  -5.603
  123   1HB   CYS  31          2HB       CYS  31   3.014   1.377  -3.286
  124   2HB   CYS  31          3HB       CYS  31   1.424   1.814  -3.877
  125    H    LYS  32           H        LYS  32   2.623   2.064  -6.721
  126    HA   LYS  32           HA       LYS  32   5.335   1.339  -7.384
  127   1HB   LYS  32          2HB       LYS  32   3.172   2.442  -8.771
  128   2HB   LYS  32          3HB       LYS  32   4.302   3.773  -8.613
  129   1HG   LYS  32          2HG       LYS  32   5.555   2.880 -10.273
  130   2HG   LYS  32          3HG       LYS  32   5.890   1.494  -9.254
  131   1HD   LYS  32          2HD       LYS  32   4.696   0.204 -10.685
  132   2HD   LYS  32          3HD       LYS  32   3.250   1.075 -10.214
  133   1HE   LYS  32          2HE       LYS  32   3.267   2.423 -12.105
  134   2HE   LYS  32          3HE       LYS  32   5.017   2.457 -12.202
  135   1HZ   LYS  32          1HZ       LYS  32   3.174   0.508 -13.260
  136   2HZ   LYS  32          2HZ       LYS  32   4.577   1.062 -13.884
  137   3HZ   LYS  32          3HZ       LYS  32   4.598  -0.071 -12.708
  138    H    SER  33           H        SER  33   3.729   3.296  -5.072
  139    HA   SER  33           HA       SER  33   5.914   5.183  -4.973
  140   1HB   SER  33          2HB       SER  33   3.132   5.279  -4.336
  141   2HB   SER  33          3HB       SER  33   3.984   5.477  -2.817
  142    HG   SER  33           HG       SER  33   3.619   7.307  -4.776
  143    H    CYS  34           H        CYS  34   5.870   2.130  -4.198
  144    HA   CYS  34           HA       CYS  34   7.318   2.555  -1.720
  145   1HB   CYS  34          2HB       CYS  34   6.226   0.813  -0.523
  146   2HB   CYS  34          3HB       CYS  34   5.016   1.965  -1.053
  147    H    LYS  35           H        LYS  35   6.150   0.251  -4.271
  148    HA   LYS  35           HA       LYS  35   8.612  -1.264  -4.013
  149   1HB   LYS  35          2HB       LYS  35   6.025  -1.696  -5.517
  150   2HB   LYS  35          3HB       LYS  35   7.436  -2.699  -5.782
  151   1HG   LYS  35          2HG       LYS  35   7.309  -3.694  -3.686
  152   2HG   LYS  35          3HG       LYS  35   6.657  -2.259  -2.920
  153   1HD   LYS  35          2HD       LYS  35   4.719  -3.511  -2.930
  154   2HD   LYS  35          3HD       LYS  35   4.556  -2.815  -4.529
  155   1HE   LYS  35          2HE       LYS  35   6.092  -5.408  -4.182
  156   2HE   LYS  35          3HE       LYS  35   4.340  -5.440  -4.198
  157   1HZ   LYS  35          1HZ       LYS  35   4.573  -4.092  -6.310
  158   2HZ   LYS  35          2HZ       LYS  35   6.140  -4.552  -6.322
  159   3HZ   LYS  35          3HZ       LYS  35   4.958  -5.675  -6.392
  Start of MODEL    9
    1    H    ASP   8           H        ASP   8  -4.102  -4.024  -7.752
    2    HA   ASP   8           HA       ASP   8  -6.754  -4.003  -6.730
    3   1HB   ASP   8          2HB       ASP   8  -4.585  -5.769  -6.678
    4   2HB   ASP   8          3HB       ASP   8  -4.630  -5.178  -5.030
    5    HA   PRO   9           HA       PRO   9  -5.840  -0.809  -3.836
    6   1HB   PRO   9          2HB       PRO   9  -8.171  -0.852  -2.410
    7   2HB   PRO   9          3HB       PRO   9  -7.993   0.001  -3.929
    8   1HG   PRO   9          2HG       PRO   9  -9.381  -2.552  -3.389
    9   2HG   PRO   9          3HG       PRO   9  -9.546  -1.483  -4.768
   10   1HD   PRO   9          2HD       PRO   9  -8.108  -3.964  -4.682
   11   2HD   PRO   9          3HD       PRO   9  -8.177  -2.838  -6.023
   12    H    CYS  10           H        CYS  10  -5.307  -0.353  -1.622
   13    HA   CYS  10           HA       CYS  10  -5.420  -2.704   0.064
   14   1HB   CYS  10          2HB       CYS  10  -2.967  -2.343   0.661
   15   2HB   CYS  10          3HB       CYS  10  -3.339  -3.188  -0.828
   16    H    GLU  11           H        GLU  11  -4.592  -2.022   2.367
   17    HA   GLU  11           HA       GLU  11  -6.070  -0.115   3.400
   18   1HB   GLU  11          2HB       GLU  11  -3.532  -1.405   4.166
   19   2HB   GLU  11          3HB       GLU  11  -3.736   0.165   4.917
   20   1HG   GLU  11          2HG       GLU  11  -4.819  -1.260   6.447
   21   2HG   GLU  11          3HG       GLU  11  -6.158  -0.649   5.497
   22    H    CYS  12           H        CYS  12  -3.118   0.345   1.579
   23    HA   CYS  12           HA       CYS  12  -2.354   2.937   2.237
   24   1HB   CYS  12          2HB       CYS  12  -2.352   1.397  -0.377
   25   2HB   CYS  12          3HB       CYS  12  -1.661   3.034  -0.245
   26    H    SER  13           H        SER  13  -4.823   1.936  -0.274
   27    HA   SER  13           HA       SER  13  -5.645   4.719  -0.280
   28   1HB   SER  13          2HB       SER  13  -5.148   3.726  -2.480
   29   2HB   SER  13          3HB       SER  13  -6.283   2.422  -2.183
   30    HG   SER  13           HG       SER  13  -7.017   5.225  -2.267
   31    H    LYS  14           H        LYS  14  -6.223   2.390   1.751
   32    HA   LYS  14           HA       LYS  14  -9.144   2.694   1.667
   33   1HB   LYS  14          2HB       LYS  14  -7.456   0.295   1.952
   34   2HB   LYS  14          3HB       LYS  14  -8.708   0.432   3.170
   35   1HG   LYS  14          2HG       LYS  14  -9.416   0.950   0.272
   36   2HG   LYS  14          3HG       LYS  14  -9.233  -0.704   0.821
   37   1HD   LYS  14          2HD       LYS  14 -11.011  -0.502   2.415
   38   2HD   LYS  14          3HD       LYS  14 -10.981   1.250   2.358
   39   1HE   LYS  14          2HE       LYS  14 -11.474   0.569  -0.310
   40   2HE   LYS  14          3HE       LYS  14 -12.358  -0.666   0.565
   41   1HZ   LYS  14          1HZ       LYS  14 -12.775   2.193   0.533
   42   2HZ   LYS  14          2HZ       LYS  14 -13.869   0.981   0.578
   43   3HZ   LYS  14          3HZ       LYS  14 -13.084   1.424   1.941
   44    H    SER  15           H        SER  15  -6.611   1.636   4.050
   45    HA   SER  15           HA       SER  15  -7.819   2.455   6.272
   46   1HB   SER  15          2HB       SER  15  -5.388   1.451   5.747
   47   2HB   SER  15          3HB       SER  15  -4.888   3.110   6.008
   48    HG   SER  15           HG       SER  15  -6.637   1.890   7.918
   49    H    GLY  16           H        GLY  16  -5.759   4.509   4.105
   50   1HA   GLY  16          1HA       GLY  16  -6.873   6.774   3.821
   51   2HA   GLY  16          2HA       GLY  16  -6.717   6.891   5.563
   52    H    THR  17           H        THR  17  -5.129   7.274   2.500
   53    HA   THR  17           HA       THR  17  -3.177   8.214   1.971
   54    HB   THR  17           HB       THR  17  -3.730   9.242   4.502
   55    HG1  THR  17           1HG      THR  17  -1.341   9.560   2.824
   56   1HG2  THR  17          1HG2      THR  17  -1.902   7.430   5.253
   57   2HG2  THR  17          2HG2      THR  17  -0.772   8.595   4.526
   58   3HG2  THR  17          3HG2      THR  17  -1.819   9.095   5.874
   59    H    CYS  18           H        CYS  18  -1.017   7.583   1.555
   60    HA   CYS  18           HA       CYS  18  -0.498   4.883   2.547
   61   1HB   CYS  18          2HB       CYS  18  -0.508   4.588   0.305
   62   2HB   CYS  18          3HB       CYS  18  -0.067   6.248  -0.042
   63    H    ASN  19           H        ASN  19   1.711   4.372   3.245
   64    HA   ASN  19           HA       ASN  19   3.448   6.651   3.570
   65   1HB   ASN  19          2HB       ASN  19   1.961   6.357   5.672
   66   2HB   ASN  19          3HB       ASN  19   2.775   4.827   5.932
   67   1HD2  ASN  19          1HD2      ASN  19   2.693   7.751   7.083
   68   2HD2  ASN  19          2HD2      ASN  19   4.349   8.080   7.470
   69    H    CYS  20           H        CYS  20   3.938   4.799   1.759
   70    HA   CYS  20           HA       CYS  20   5.502   2.580   2.932
   71   1HB   CYS  20          2HB       CYS  20   4.526   3.241   0.130
   72   2HB   CYS  20          3HB       CYS  20   5.657   1.907   0.474
   73    H    GLY  21           H        GLY  21   6.454   5.393   3.236
   74   1HA   GLY  21          1HA       GLY  21   8.598   5.613   1.276
   75   2HA   GLY  21          2HA       GLY  21   8.174   6.757   2.534
   76    H    GLY  22           H        GLY  22   9.196   3.264   2.345
   77   1HA   GLY  22          1HA       GLY  22  11.662   3.330   3.357
   78   2HA   GLY  22          2HA       GLY  22  10.708   3.563   4.808
   79    H    SER  23           H        SER  23   8.690   1.959   4.950
   80    HA   SER  23           HA       SER  23   9.512  -0.625   3.910
   81   1HB   SER  23          2HB       SER  23   9.644   0.198   6.668
   82   2HB   SER  23          3HB       SER  23   8.372  -0.998   6.530
   83    HG   SER  23           HG       SER  23   9.818  -2.544   6.142
   84    H    CYS  24           H        CYS  24   7.648  -2.282   4.137
   85    HA   CYS  24           HA       CYS  24   5.176  -0.861   3.551
   86   1HB   CYS  24          2HB       CYS  24   6.319  -2.651   2.026
   87   2HB   CYS  24          3HB       CYS  24   5.586  -3.802   3.125
   88    H    THR  25           H        THR  25   3.234  -1.339   4.720
   89    HA   THR  25           HA       THR  25   3.636  -3.012   7.113
   90    HB   THR  25           HB       THR  25   2.249  -1.348   8.319
   91    HG1  THR  25           1HG      THR  25   1.620   0.551   6.991
   92   1HG2  THR  25          1HG2      THR  25   4.810  -0.857   7.801
   93   2HG2  THR  25          2HG2      THR  25   4.153   0.367   6.689
   94   3HG2  THR  25          3HG2      THR  25   3.784   0.455   8.428
   95    H    CYS  26           H        CYS  26   1.521  -1.960   4.447
   96    HA   CYS  26           HA       CYS  26  -0.628  -3.607   5.384
   97   1HB   CYS  26          2HB       CYS  26  -1.901  -2.520   3.906
   98   2HB   CYS  26          3HB       CYS  26  -0.563  -1.389   3.860
   99    H    THR  27           H        THR  27  -1.557  -4.988   3.207
  100    HA   THR  27           HA       THR  27   0.715  -6.709   2.455
  101    HB   THR  27           HB       THR  27  -1.197  -7.464   4.176
  102    HG1  THR  27           1HG      THR  27  -0.564  -9.044   1.796
  103   1HG2  THR  27          1HG2      THR  27  -3.147  -7.012   2.720
  104   2HG2  THR  27          2HG2      THR  27  -2.404  -7.953   1.403
  105   3HG2  THR  27          3HG2      THR  27  -2.937  -8.772   2.892
  106    H    ASN  28           H        ASN  28   0.320  -7.990   0.416
  107    HA   ASN  28           HA       ASN  28   0.239  -7.782  -1.764
  108   1HB   ASN  28          2HB       ASN  28  -2.670  -7.130  -1.056
  109   2HB   ASN  28          3HB       ASN  28  -2.142  -7.564  -2.669
  110   1HD2  ASN  28          1HD2      ASN  28  -3.922  -9.173  -1.975
  111   2HD2  ASN  28          2HD2      ASN  28  -3.377 -10.693  -1.350
  112    H    CYS  29           H        CYS  29   1.498  -5.637  -1.238
  113    HA   CYS  29           HA       CYS  29   0.005  -3.206  -2.011
  114   1HB   CYS  29          2HB       CYS  29   1.758  -3.498  -0.043
  115   2HB   CYS  29          3HB       CYS  29   2.940  -3.257  -1.353
  116    H    SER  30           H        SER  30   1.493  -1.650  -3.511
  117    HA   SER  30           HA       SER  30   3.183  -2.912  -5.312
  118   1HB   SER  30          2HB       SER  30   0.818  -3.868  -5.926
  119   2HB   SER  30          3HB       SER  30   0.509  -2.278  -6.598
  120    HG   SER  30           HG       SER  30   1.336  -3.674  -8.234
  121    H    CYS  31           H        CYS  31   2.976  -0.504  -3.673
  122    HA   CYS  31           HA       CYS  31   2.305   1.672  -5.373
  123   1HB   CYS  31          2HB       CYS  31   3.962   1.774  -2.850
  124   2HB   CYS  31          3HB       CYS  31   3.059   3.078  -3.597
  125    H    LYS  32           H        LYS  32   5.458   1.002  -3.695
  126    HA   LYS  32           HA       LYS  32   7.115   0.436  -5.683
  127   1HB   LYS  32          2HB       LYS  32   6.094   3.163  -6.108
  128   2HB   LYS  32          3HB       LYS  32   7.842   3.061  -6.107
  129   1HG   LYS  32          2HG       LYS  32   7.909   1.848  -8.058
  130   2HG   LYS  32          3HG       LYS  32   6.527   0.866  -7.615
  131   1HD   LYS  32          2HD       LYS  32   5.206   2.106  -8.973
  132   2HD   LYS  32          3HD       LYS  32   5.540   3.528  -8.005
  133   1HE   LYS  32          2HE       LYS  32   6.389   4.276 -10.030
  134   2HE   LYS  32          3HE       LYS  32   7.839   3.522  -9.399
  135   1HZ   LYS  32          1HZ       LYS  32   6.380   2.819 -11.660
  136   2HZ   LYS  32          2HZ       LYS  32   7.787   2.184 -11.124
  137   3HZ   LYS  32          3HZ       LYS  32   6.365   1.546 -10.635
  138    H    SER  33           H        SER  33   9.314   0.538  -5.016
  139    HA   SER  33           HA       SER  33  10.977   0.773  -3.635
  140   1HB   SER  33          2HB       SER  33   9.641   3.258  -3.376
  141   2HB   SER  33          3HB       SER  33   9.969   2.752  -1.731
  142    HG   SER  33           HG       SER  33  11.964   3.430  -2.063
  143    H    CYS  34           H        CYS  34   8.084  -0.498  -2.958
  144    HA   CYS  34           HA       CYS  34   8.900  -1.274  -0.256
  145   1HB   CYS  34          2HB       CYS  34   6.570  -1.409   0.414
  146   2HB   CYS  34          3HB       CYS  34   7.012   0.223  -0.050
  147    H    LYS  35           H        LYS  35   7.036  -2.023  -3.271
  148    HA   LYS  35           HA       LYS  35   7.596  -4.861  -2.754
  149   1HB   LYS  35          2HB       LYS  35   5.167  -4.123  -2.578
  150   2HB   LYS  35          3HB       LYS  35   5.224  -3.786  -4.297
  151   1HG   LYS  35          2HG       LYS  35   6.193  -6.247  -4.483
  152   2HG   LYS  35          3HG       LYS  35   5.501  -6.456  -2.887
  153   1HD   LYS  35          2HD       LYS  35   3.315  -6.308  -3.649
  154   2HD   LYS  35          3HD       LYS  35   3.716  -5.177  -4.925
  155   1HE   LYS  35          2HE       LYS  35   3.947  -6.850  -6.451
  156   2HE   LYS  35          3HE       LYS  35   5.038  -7.740  -5.407
  157   1HZ   LYS  35          1HZ       LYS  35   2.103  -7.772  -5.256
  158   2HZ   LYS  35          2HZ       LYS  35   3.062  -8.988  -5.778
  159   3HZ   LYS  35          3HZ       LYS  35   3.089  -8.544  -4.207
  Start of MODEL   10
    1    H    ASP   8           H        ASP   8  -9.165  -3.075  -7.792
    2    HA   ASP   8           HA       ASP   8  -9.998  -1.120  -5.799
    3   1HB   ASP   8          2HB       ASP   8 -10.851  -3.628  -5.843
    4   2HB   ASP   8          3HB       ASP   8  -9.267  -4.002  -5.192
    5    HA   PRO   9           HA       PRO   9  -5.626  -0.780  -5.236
    6   1HB   PRO   9          2HB       PRO   9  -5.637   1.166  -3.319
    7   2HB   PRO   9          3HB       PRO   9  -5.734   1.510  -5.035
    8   1HG   PRO   9          2HG       PRO   9  -7.879   1.608  -3.002
    9   2HG   PRO   9          3HG       PRO   9  -7.841   2.339  -4.595
   10   1HD   PRO   9          2HD       PRO   9  -9.267  -0.028  -3.826
   11   2HD   PRO   9          3HD       PRO   9  -9.134   0.638  -5.442
   12    H    CYS  10           H        CYS  10  -3.927  -0.869  -3.466
   13    HA   CYS  10           HA       CYS  10  -4.725  -3.084  -1.830
   14   1HB   CYS  10          2HB       CYS  10  -2.588  -3.246  -2.843
   15   2HB   CYS  10          3HB       CYS  10  -2.110  -1.655  -2.287
   16    H    GLU  11           H        GLU  11  -4.512  -3.069   0.553
   17    HA   GLU  11           HA       GLU  11  -5.277  -0.493   1.585
   18   1HB   GLU  11          2HB       GLU  11  -5.873  -3.246   2.207
   19   2HB   GLU  11          3HB       GLU  11  -5.192  -2.502   3.640
   20   1HG   GLU  11          2HG       GLU  11  -6.837  -0.647   3.492
   21   2HG   GLU  11          3HG       GLU  11  -7.487  -1.316   2.009
   22    H    CYS  12           H        CYS  12  -3.228   0.531   1.392
   23    HA   CYS  12           HA       CYS  12  -0.892  -0.503   2.754
   24   1HB   CYS  12          2HB       CYS  12  -1.503   2.303   1.734
   25   2HB   CYS  12          3HB       CYS  12   0.103   1.640   2.133
   26    H    SER  13           H        SER  13  -2.644   2.656   3.335
   27    HA   SER  13           HA       SER  13  -2.167   2.105   6.160
   28   1HB   SER  13          2HB       SER  13  -0.853   4.016   5.452
   29   2HB   SER  13          3HB       SER  13  -2.221   4.733   4.625
   30    HG   SER  13           HG       SER  13  -2.853   4.259   7.267
   31    H    LYS  14           H        LYS  14  -4.420   3.321   3.646
   32    HA   LYS  14           HA       LYS  14  -6.645   3.273   3.601
   33   1HB   LYS  14          2HB       LYS  14  -6.352   1.284   5.233
   34   2HB   LYS  14          3HB       LYS  14  -6.792   2.419   6.492
   35   1HG   LYS  14          2HG       LYS  14  -8.978   2.672   5.708
   36   2HG   LYS  14          3HG       LYS  14  -8.537   2.358   4.042
   37   1HD   LYS  14          2HD       LYS  14  -7.933  -0.076   5.133
   38   2HD   LYS  14          3HD       LYS  14  -9.206   0.423   6.230
   39   1HE   LYS  14          2HE       LYS  14 -10.025   1.040   3.515
   40   2HE   LYS  14          3HE       LYS  14  -9.481  -0.625   3.570
   41   1HZ   LYS  14          1HZ       LYS  14 -11.778  -0.478   4.145
   42   2HZ   LYS  14          2HZ       LYS  14 -10.946  -0.956   5.467
   43   3HZ   LYS  14          3HZ       LYS  14 -11.482   0.583   5.351
   44    H    SER  15           H        SER  15  -5.281   4.502   6.724
   45    HA   SER  15           HA       SER  15  -7.002   6.238   7.562
   46   1HB   SER  15          2HB       SER  15  -4.429   5.945   8.086
   47   2HB   SER  15          3HB       SER  15  -4.224   7.314   7.013
   48    HG   SER  15           HG       SER  15  -4.530   8.356   8.902
   49    H    GLY  16           H        GLY  16  -5.030   6.707   4.575
   50   1HA   GLY  16          1HA       GLY  16  -6.889   8.028   3.085
   51   2HA   GLY  16          2HA       GLY  16  -6.133   9.304   4.020
   52    H    THR  17           H        THR  17  -5.785   7.053   1.362
   53    HA   THR  17           HA       THR  17  -4.339   7.063  -0.345
   54    HB   THR  17           HB       THR  17  -4.073   9.641   0.695
   55    HG1  THR  17           1HG      THR  17  -2.886   9.827  -1.407
   56   1HG2  THR  17          1HG2      THR  17  -1.755  10.178   0.847
   57   2HG2  THR  17          2HG2      THR  17  -1.878   8.684   1.806
   58   3HG2  THR  17          3HG2      THR  17  -1.260   8.623   0.137
   59    H    CYS  18           H        CYS  18  -2.396   5.988  -0.921
   60    HA   CYS  18           HA       CYS  18  -1.592   4.077   0.850
   61   1HB   CYS  18          2HB       CYS  18  -0.922   3.407  -1.165
   62   2HB   CYS  18          3HB       CYS  18  -0.744   5.044  -1.766
   63    H    ASN  19           H        ASN  19   0.665   3.789   1.829
   64    HA   ASN  19           HA       ASN  19   2.051   6.239   2.353
   65   1HB   ASN  19          2HB       ASN  19   0.135   5.892   4.130
   66   2HB   ASN  19          3HB       ASN  19   1.128   4.586   4.745
   67   1HD2  ASN  19          1HD2      ASN  19   0.986   8.031   4.063
   68   2HD2  ASN  19          2HD2      ASN  19   2.214   8.546   5.171
   69    H    CYS  20           H        CYS  20   3.143   4.407   0.898
   70    HA   CYS  20           HA       CYS  20   4.485   2.340   2.531
   71   1HB   CYS  20          2HB       CYS  20   4.239   2.891  -0.445
   72   2HB   CYS  20          3HB       CYS  20   5.377   1.687   0.210
   73    H    GLY  21           H        GLY  21   5.106   5.245   2.960
   74   1HA   GLY  21          1HA       GLY  21   7.629   5.699   1.635
   75   2HA   GLY  21          2HA       GLY  21   6.861   6.693   2.856
   76    H    GLY  22           H        GLY  22   6.715   5.570   5.152
   77   1HA   GLY  22          1HA       GLY  22   9.239   5.270   6.181
   78   2HA   GLY  22          2HA       GLY  22   7.769   4.672   6.926
   79    H    SER  23           H        SER  23   6.916   2.491   6.103
   80    HA   SER  23           HA       SER  23   8.834   0.855   4.788
   81   1HB   SER  23          2HB       SER  23   9.843  -0.035   6.597
   82   2HB   SER  23          3HB       SER  23   8.885   0.985   7.653
   83    HG   SER  23           HG       SER  23   8.344  -1.075   8.278
   84    H    CYS  24           H        CYS  24   7.694  -0.635   3.579
   85    HA   CYS  24           HA       CYS  24   4.913  -0.629   3.643
   86   1HB   CYS  24          2HB       CYS  24   6.466  -1.215   1.718
   87   2HB   CYS  24          3HB       CYS  24   6.634  -2.800   2.447
   88    H    THR  25           H        THR  25   3.412  -2.012   4.653
   89    HA   THR  25           HA       THR  25   4.555  -4.154   6.319
   90    HB   THR  25           HB       THR  25   3.945  -1.990   7.579
   91    HG1  THR  25           1HG      THR  25   2.397  -4.456   7.968
   92   1HG2  THR  25          1HG2      THR  25   1.562  -1.608   8.017
   93   2HG2  THR  25          2HG2      THR  25   1.815  -1.519   6.256
   94   3HG2  THR  25          3HG2      THR  25   1.112  -2.984   6.982
   95    H    CYS  26           H        CYS  26   1.754  -2.848   4.491
   96    HA   CYS  26           HA       CYS  26   0.024  -4.930   4.849
   97   1HB   CYS  26          2HB       CYS  26  -0.678  -4.312   2.406
   98   2HB   CYS  26          3HB       CYS  26  -0.943  -3.202   3.737
   99    H    THR  27           H        THR  27  -0.573  -6.541   2.912
  100    HA   THR  27           HA       THR  27   1.949  -7.761   1.993
  101    HB   THR  27           HB       THR  27   0.590  -8.907   3.900
  102    HG1  THR  27           1HG      THR  27   2.168  -9.905   2.367
  103   1HG2  THR  27          1HG2      THR  27  -1.695  -8.733   3.049
  104   2HG2  THR  27          2HG2      THR  27  -1.205  -9.386   1.467
  105   3HG2  THR  27          3HG2      THR  27  -1.207 -10.438   2.902
  106    H    ASN  28           H        ASN  28   1.961  -8.777  -0.069
  107    HA   ASN  28           HA       ASN  28   1.520  -8.878  -2.189
  108   1HB   ASN  28          2HB       ASN  28  -1.302  -8.853  -1.066
  109   2HB   ASN  28          3HB       ASN  28  -1.081  -8.798  -2.804
  110   1HD2  ASN  28          1HD2      ASN  28  -0.533 -10.624   0.129
  111   2HD2  ASN  28          2HD2      ASN  28  -0.250 -12.172  -0.593
  112    H    CYS  29           H        CYS  29   2.383  -6.467  -1.527
  113    HA   CYS  29           HA       CYS  29   0.501  -4.395  -2.482
  114   1HB   CYS  29          2HB       CYS  29   2.030  -4.243  -0.366
  115   2HB   CYS  29          3HB       CYS  29   3.333  -3.920  -1.538
  116    H    SER  30           H        SER  30   1.627  -2.636  -3.980
  117    HA   SER  30           HA       SER  30   3.746  -3.495  -5.567
  118   1HB   SER  30          2HB       SER  30   1.982  -5.098  -6.393
  119   2HB   SER  30          3HB       SER  30   1.010  -3.730  -6.896
  120    HG   SER  30           HG       SER  30   2.119  -4.244  -8.735
  121    H    CYS  31           H        CYS  31   3.705  -1.177  -4.401
  122    HA   CYS  31           HA       CYS  31   2.303   0.756  -6.048
  123   1HB   CYS  31          2HB       CYS  31   3.829   0.993  -3.453
  124   2HB   CYS  31          3HB       CYS  31   3.248   2.384  -4.347
  125    H    LYS  32           H        LYS  32   5.427   1.406  -4.462
  126    HA   LYS  32           HA       LYS  32   7.117   0.870  -6.603
  127   1HB   LYS  32          2HB       LYS  32   5.562   2.749  -7.544
  128   2HB   LYS  32          3HB       LYS  32   6.516   3.818  -6.534
  129   1HG   LYS  32          2HG       LYS  32   8.252   3.762  -7.996
  130   2HG   LYS  32          3HG       LYS  32   8.297   2.011  -7.955
  131   1HD   LYS  32          2HD       LYS  32   7.775   2.366 -10.204
  132   2HD   LYS  32          3HD       LYS  32   6.166   2.189  -9.532
  133   1HE   LYS  32          2HE       LYS  32   5.614   4.313 -10.119
  134   2HE   LYS  32          3HE       LYS  32   7.007   4.964  -9.277
  135   1HZ   LYS  32          1HZ       LYS  32   8.166   3.930 -11.403
  136   2HZ   LYS  32          2HZ       LYS  32   6.715   4.295 -12.057
  137   3HZ   LYS  32          3HZ       LYS  32   7.611   5.466 -11.354
  138    H    SER  33           H        SER  33   6.240   2.937  -3.811
  139    HA   SER  33           HA       SER  33   8.922   3.533  -3.192
  140   1HB   SER  33          2HB       SER  33   6.238   3.951  -1.950
  141   2HB   SER  33          3HB       SER  33   7.588   3.933  -0.833
  142    HG   SER  33           HG       SER  33   7.877   5.480  -3.210
  143    H    CYS  34           H        CYS  34   7.357   0.619  -3.223
  144    HA   CYS  34           HA       CYS  34   8.952  -0.350  -0.968
  145   1HB   CYS  34          2HB       CYS  34   7.164  -2.119  -0.682
  146   2HB   CYS  34          3HB       CYS  34   6.796  -0.505  -0.109
  147    H    LYS  35           H        LYS  35   7.220  -1.082  -4.070
  148    HA   LYS  35           HA       LYS  35   8.830  -3.430  -4.490
  149   1HB   LYS  35          2HB       LYS  35   6.342  -3.025  -5.135
  150   2HB   LYS  35          3HB       LYS  35   6.992  -2.169  -6.518
  151   1HG   LYS  35          2HG       LYS  35   8.162  -4.128  -7.312
  152   2HG   LYS  35          3HG       LYS  35   7.923  -4.978  -5.799
  153   1HD   LYS  35          2HD       LYS  35   6.218  -5.948  -7.045
  154   2HD   LYS  35          3HD       LYS  35   5.333  -4.601  -6.356
  155   1HE   LYS  35          2HE       LYS  35   4.871  -4.683  -8.755
  156   2HE   LYS  35          3HE       LYS  35   5.822  -3.248  -8.424
  157   1HZ   LYS  35          1HZ       LYS  35   7.613  -5.274  -8.891
  158   2HZ   LYS  35          2HZ       LYS  35   6.472  -5.426 -10.049
  159   3HZ   LYS  35          3HZ       LYS  35   7.271  -4.012  -9.869
  Start of MODEL   11
    1    H    ASP   8           H        ASP   8  -8.052  -8.698  -0.264
    2    HA   ASP   8           HA       ASP   8  -9.657  -6.293  -0.637
    3   1HB   ASP   8          2HB       ASP   8  -9.239  -7.851   1.668
    4   2HB   ASP   8          3HB       ASP   8  -8.137  -6.506   1.888
    5    HA   PRO   9           HA       PRO   9  -5.746  -4.505  -1.595
    6   1HB   PRO   9          2HB       PRO   9  -6.519  -1.893  -1.827
    7   2HB   PRO   9          3HB       PRO   9  -6.690  -3.062  -3.122
    8   1HG   PRO   9          2HG       PRO   9  -8.773  -1.944  -1.345
    9   2HG   PRO   9          3HG       PRO   9  -8.965  -2.763  -2.884
   10   1HD   PRO   9          2HD       PRO   9  -9.444  -3.868  -0.282
   11   2HD   PRO   9          3HD       PRO   9  -9.524  -4.718  -1.812
   12    H    CYS  10           H        CYS  10  -4.103  -2.917  -0.856
   13    HA   CYS  10           HA       CYS  10  -4.120  -3.041   1.993
   14   1HB   CYS  10          2HB       CYS  10  -1.915  -1.839   1.739
   15   2HB   CYS  10          3HB       CYS  10  -2.034  -3.434   1.023
   16    H    GLU  11           H        GLU  11  -3.698  -1.008   3.332
   17    HA   GLU  11           HA       GLU  11  -5.523   1.019   2.423
   18   1HB   GLU  11          2HB       GLU  11  -4.401   0.123   5.032
   19   2HB   GLU  11          3HB       GLU  11  -4.677   1.850   4.907
   20   1HG   GLU  11          2HG       GLU  11  -7.019   1.550   4.411
   21   2HG   GLU  11          3HG       GLU  11  -6.813  -0.161   4.091
   22    H    CYS  12           H        CYS  12  -3.435   1.083   0.782
   23    HA   CYS  12           HA       CYS  12  -1.408   2.980   1.742
   24   1HB   CYS  12          2HB       CYS  12  -1.816   1.193  -0.604
   25   2HB   CYS  12          3HB       CYS  12  -0.946   2.714  -0.925
   26    H    SER  13           H        SER  13  -3.994   2.868  -0.847
   27    HA   SER  13           HA       SER  13  -3.761   5.764  -0.905
   28   1HB   SER  13          2HB       SER  13  -3.735   4.042  -2.995
   29   2HB   SER  13          3HB       SER  13  -5.468   4.284  -2.883
   30    HG   SER  13           HG       SER  13  -4.350   5.821  -4.315
   31    H    LYS  14           H        LYS  14  -5.933   3.012  -0.256
   32    HA   LYS  14           HA       LYS  14  -8.365   4.316  -0.254
   33   1HB   LYS  14          2HB       LYS  14  -7.902   1.838  -0.082
   34   2HB   LYS  14          3HB       LYS  14  -7.533   2.082   1.614
   35   1HG   LYS  14          2HG       LYS  14 -10.013   3.434   1.110
   36   2HG   LYS  14          3HG       LYS  14 -10.131   1.865   0.336
   37   1HD   LYS  14          2HD       LYS  14 -10.791   1.238   2.463
   38   2HD   LYS  14          3HD       LYS  14  -9.062   1.030   2.662
   39   1HE   LYS  14          2HE       LYS  14  -9.517   2.358   4.523
   40   2HE   LYS  14          3HE       LYS  14  -9.128   3.606   3.356
   41   1HZ   LYS  14          1HZ       LYS  14 -11.882   2.697   3.552
   42   2HZ   LYS  14          2HZ       LYS  14 -11.307   3.711   4.697
   43   3HZ   LYS  14          3HZ       LYS  14 -11.306   4.165   3.128
   44    H    SER  15           H        SER  15  -6.269   3.624   2.640
   45    HA   SER  15           HA       SER  15  -7.633   4.978   4.475
   46   1HB   SER  15          2HB       SER  15  -5.685   3.840   5.191
   47   2HB   SER  15          3HB       SER  15  -4.657   4.656   4.028
   48    HG   SER  15           HG       SER  15  -4.943   6.642   5.253
   49    H    GLY  16           H        GLY  16  -5.107   6.414   2.284
   50   1HA   GLY  16          1HA       GLY  16  -6.091   8.616   1.363
   51   2HA   GLY  16          2HA       GLY  16  -6.039   9.098   3.047
   52    H    THR  17           H        THR  17  -3.653   7.885   3.954
   53    HA   THR  17           HA       THR  17  -1.631   9.104   2.192
   54    HB   THR  17           HB       THR  17  -2.112   9.359   5.193
   55    HG1  THR  17           1HG      THR  17  -1.829  11.624   4.428
   56   1HG2  THR  17          1HG2      THR  17   0.124  10.829   4.820
   57   2HG2  THR  17          2HG2      THR  17   0.215   9.126   5.334
   58   3HG2  THR  17          3HG2      THR  17   0.461   9.554   3.624
   59    H    CYS  18           H        CYS  18  -0.723   7.354   1.237
   60    HA   CYS  18           HA       CYS  18  -0.549   4.845   2.197
   61   1HB   CYS  18          2HB       CYS  18   0.230   4.802   0.109
   62   2HB   CYS  18          3HB       CYS  18   0.869   6.430   0.199
   63    H    ASN  19           H        ASN  19   0.176   4.167   4.188
   64    HA   ASN  19           HA       ASN  19   2.338   5.676   5.382
   65   1HB   ASN  19          2HB       ASN  19   0.245   5.221   6.717
   66   2HB   ASN  19          3HB       ASN  19   0.531   3.500   6.563
   67   1HD2  ASN  19          1HD2      ASN  19   1.850   6.533   7.786
   68   2HD2  ASN  19          2HD2      ASN  19   2.813   5.872   9.065
   69    H    CYS  20           H        CYS  20   2.620   3.760   3.131
   70    HA   CYS  20           HA       CYS  20   4.145   1.546   4.408
   71   1HB   CYS  20          2HB       CYS  20   3.222   0.244   2.824
   72   2HB   CYS  20          3HB       CYS  20   2.285   1.644   2.247
   73    H    GLY  21           H        GLY  21   4.548   4.652   3.021
   74   1HA   GLY  21          1HA       GLY  21   6.555   4.617   1.261
   75   2HA   GLY  21          2HA       GLY  21   6.502   5.735   2.608
   76    H    GLY  22           H        GLY  22   6.944   4.055   4.829
   77   1HA   GLY  22          1HA       GLY  22   9.739   3.271   4.340
   78   2HA   GLY  22          2HA       GLY  22   9.034   3.736   5.875
   79    H    SER  23           H        SER  23   7.683   2.231   7.059
   80    HA   SER  23           HA       SER  23   8.502  -0.431   6.669
   81   1HB   SER  23          2HB       SER  23   7.233   1.143   8.724
   82   2HB   SER  23          3HB       SER  23   6.245  -0.280   8.454
   83    HG   SER  23           HG       SER  23   9.039  -0.733   8.585
   84    H    CYS  24           H        CYS  24   7.685  -1.693   5.033
   85    HA   CYS  24           HA       CYS  24   4.876  -1.290   4.335
   86   1HB   CYS  24          2HB       CYS  24   6.556  -0.984   2.540
   87   2HB   CYS  24          3HB       CYS  24   7.067  -2.647   2.750
   88    H    THR  25           H        THR  25   3.436  -3.087   4.394
   89    HA   THR  25           HA       THR  25   4.571  -5.634   5.299
   90    HB   THR  25           HB       THR  25   2.671  -5.709   7.001
   91    HG1  THR  25           1HG      THR  25   1.384  -4.036   5.965
   92   1HG2  THR  25          1HG2      THR  25   4.147  -4.868   8.526
   93   2HG2  THR  25          2HG2      THR  25   5.125  -4.230   7.182
   94   3HG2  THR  25          3HG2      THR  25   3.858  -3.219   7.921
   95    H    CYS  26           H        CYS  26   1.808  -3.781   3.941
   96    HA   CYS  26           HA       CYS  26   0.151  -5.830   3.309
   97   1HB   CYS  26          2HB       CYS  26  -0.232  -4.312   1.149
   98   2HB   CYS  26          3HB       CYS  26  -0.833  -3.895   2.741
   99    H    THR  27           H        THR  27  -0.111  -7.162   1.358
  100    HA   THR  27           HA       THR  27   2.478  -7.752   0.110
  101    HB   THR  27           HB       THR  27   0.248  -9.304   1.197
  102    HG1  THR  27           1HG      THR  27   2.440  -9.792   1.649
  103   1HG2  THR  27          1HG2      THR  27   0.235 -11.044  -0.590
  104   2HG2  THR  27          2HG2      THR  27  -0.457  -9.522  -1.202
  105   3HG2  THR  27          3HG2      THR  27   1.207  -9.979  -1.635
  106    H    ASN  28           H        ASN  28  -0.976  -7.044  -0.621
  107    HA   ASN  28           HA       ASN  28  -0.402  -7.110  -3.414
  108   1HB   ASN  28          2HB       ASN  28  -2.852  -6.452  -1.728
  109   2HB   ASN  28          3HB       ASN  28  -2.854  -6.120  -3.448
  110   1HD2  ASN  28          1HD2      ASN  28  -4.261  -8.084  -1.631
  111   2HD2  ASN  28          2HD2      ASN  28  -4.071  -9.632  -2.384
  112    H    CYS  29           H        CYS  29   1.361  -5.382  -2.627
  113    HA   CYS  29           HA       CYS  29   0.260  -2.643  -2.506
  114   1HB   CYS  29          2HB       CYS  29   2.272  -3.728  -1.121
  115   2HB   CYS  29          3HB       CYS  29   3.202  -3.245  -2.562
  116    H    SER  30           H        SER  30   1.800  -1.000  -3.896
  117    HA   SER  30           HA       SER  30   2.686  -2.088  -6.335
  118   1HB   SER  30          2HB       SER  30   0.068  -2.024  -6.484
  119   2HB   SER  30          3HB       SER  30   0.259  -0.288  -6.622
  120    HG   SER  30           HG       SER  30   1.118  -2.351  -8.420
  121    H    CYS  31           H        CYS  31   3.605  -0.374  -4.113
  122    HA   CYS  31           HA       CYS  31   3.720   2.253  -5.349
  123   1HB   CYS  31          2HB       CYS  31   4.642   1.287  -2.635
  124   2HB   CYS  31          3HB       CYS  31   4.806   2.930  -3.221
  125    H    LYS  32           H        LYS  32   5.730   3.176  -6.031
  126    HA   LYS  32           HA       LYS  32   7.745   1.195  -6.646
  127   1HB   LYS  32          2HB       LYS  32   7.392   4.092  -7.463
  128   2HB   LYS  32          3HB       LYS  32   8.727   3.082  -7.980
  129   1HG   LYS  32          2HG       LYS  32   6.352   1.555  -8.438
  130   2HG   LYS  32          3HG       LYS  32   6.008   3.176  -9.011
  131   1HD   LYS  32          2HD       LYS  32   7.158   2.667 -10.898
  132   2HD   LYS  32          3HD       LYS  32   8.624   2.682  -9.937
  133   1HE   LYS  32          2HE       LYS  32   8.041   0.212  -9.327
  134   2HE   LYS  32          3HE       LYS  32   6.880   0.287 -10.637
  135   1HZ   LYS  32          1HZ       LYS  32   9.308  -0.436 -11.061
  136   2HZ   LYS  32          2HZ       LYS  32   8.522   0.468 -12.171
  137   3HZ   LYS  32          3HZ       LYS  32   9.595   1.168 -11.160
  138    H    SER  33           H        SER  33   7.312   4.183  -4.688
  139    HA   SER  33           HA       SER  33   9.963   4.417  -3.939
  140   1HB   SER  33          2HB       SER  33   7.434   5.641  -3.294
  141   2HB   SER  33          3HB       SER  33   8.258   5.292  -1.788
  142    HG   SER  33           HG       SER  33   9.018   7.036  -3.913
  143    H    CYS  34           H        CYS  34   7.682   1.964  -3.244
  144    HA   CYS  34           HA       CYS  34   9.025   1.297  -0.736
  145   1HB   CYS  34          2HB       CYS  34   7.132   0.317   0.012
  146   2HB   CYS  34          3HB       CYS  34   6.416   1.510  -1.053
  147    H    LYS  35           H        LYS  35   8.700   0.574  -4.124
  148    HA   LYS  35           HA       LYS  35  10.262  -1.870  -3.707
  149   1HB   LYS  35          2HB       LYS  35   7.861  -1.524  -5.520
  150   2HB   LYS  35          3HB       LYS  35   9.023  -2.821  -5.709
  151   1HG   LYS  35          2HG       LYS  35   8.386  -3.886  -3.733
  152   2HG   LYS  35          3HG       LYS  35   7.910  -2.393  -2.949
  153   1HD   LYS  35          2HD       LYS  35   5.798  -3.240  -3.371
  154   2HD   LYS  35          3HD       LYS  35   6.035  -2.384  -4.882
  155   1HE   LYS  35          2HE       LYS  35   7.126  -5.168  -4.818
  156   2HE   LYS  35          3HE       LYS  35   5.381  -5.050  -4.711
  157   1HZ   LYS  35          1HZ       LYS  35   7.112  -4.020  -6.835
  158   2HZ   LYS  35          2HZ       LYS  35   5.886  -5.091  -6.962
  159   3HZ   LYS  35          3HZ       LYS  35   5.567  -3.517  -6.672
  Start of MODEL   12
    1    H    ASP   8           H        ASP   8  -9.123  -6.220  -4.886
    2    HA   ASP   8           HA       ASP   8 -10.277  -3.950  -3.498
    3   1HB   ASP   8          2HB       ASP   8  -9.954  -6.573  -2.720
    4   2HB   ASP   8          3HB       ASP   8  -8.496  -5.868  -2.053
    5    HA   PRO   9           HA       PRO   9  -6.285  -2.107  -3.900
    6   1HB   PRO   9          2HB       PRO   9  -6.775   0.206  -2.529
    7   2HB   PRO   9          3HB       PRO   9  -7.189  -0.014  -4.218
    8   1HG   PRO   9          2HG       PRO   9  -8.971  -0.009  -1.858
    9   2HG   PRO   9          3HG       PRO   9  -9.385   0.200  -3.548
   10   1HD   PRO   9          2HD       PRO   9  -9.761  -2.164  -1.968
   11   2HD   PRO   9          3HD       PRO   9 -10.068  -1.991  -3.685
   12    H    CYS  10           H        CYS  10  -4.451  -1.194  -2.586
   13    HA   CYS  10           HA       CYS  10  -4.151  -2.975  -0.388
   14   1HB   CYS  10          2HB       CYS  10  -2.344  -2.261  -2.006
   15   2HB   CYS  10          3HB       CYS  10  -2.323  -0.708  -1.192
   16    H    GLU  11           H        GLU  11  -3.631  -2.221   1.857
   17    HA   GLU  11           HA       GLU  11  -5.550  -0.546   2.832
   18   1HB   GLU  11          2HB       GLU  11  -3.042  -1.782   3.879
   19   2HB   GLU  11          3HB       GLU  11  -3.643  -0.416   4.796
   20   1HG   GLU  11          2HG       GLU  11  -4.711  -2.327   5.761
   21   2HG   GLU  11          3HG       GLU  11  -5.947  -1.561   4.783
   22    H    CYS  12           H        CYS  12  -2.610   0.179   1.239
   23    HA   CYS  12           HA       CYS  12  -1.735   2.580   2.326
   24   1HB   CYS  12          2HB       CYS  12  -1.850   1.474  -0.483
   25   2HB   CYS  12          3HB       CYS  12  -1.221   3.114  -0.187
   26    H    SER  13           H        SER  13  -4.367   2.116  -0.174
   27    HA   SER  13           HA       SER  13  -4.957   4.903   0.021
   28   1HB   SER  13          2HB       SER  13  -5.153   3.328  -2.064
   29   2HB   SER  13          3HB       SER  13  -6.678   2.824  -1.364
   30    HG   SER  13           HG       SER  13  -5.932   5.534  -2.068
   31    H    LYS  14           H        LYS  14  -5.922   1.902   1.547
   32    HA   LYS  14           HA       LYS  14  -8.536   2.367   2.216
   33   1HB   LYS  14          2HB       LYS  14  -7.358   0.268   2.628
   34   2HB   LYS  14          3HB       LYS  14  -6.351   1.032   3.840
   35   1HG   LYS  14          2HG       LYS  14  -8.104  -0.074   5.053
   36   2HG   LYS  14          3HG       LYS  14  -8.492   1.635   5.110
   37   1HD   LYS  14          2HD       LYS  14  -9.708   0.693   2.726
   38   2HD   LYS  14          3HD       LYS  14 -10.007  -0.566   3.906
   39   1HE   LYS  14          2HE       LYS  14 -11.254   0.844   5.313
   40   2HE   LYS  14          3HE       LYS  14 -10.450   2.297   4.754
   41   1HZ   LYS  14          1HZ       LYS  14 -12.698   0.923   3.627
   42   2HZ   LYS  14          2HZ       LYS  14 -12.306   2.508   3.567
   43   3HZ   LYS  14          3HZ       LYS  14 -11.613   1.456   2.529
   44    H    SER  15           H        SER  15  -5.615   3.258   4.194
   45    HA   SER  15           HA       SER  15  -7.060   4.676   6.060
   46   1HB   SER  15          2HB       SER  15  -4.841   5.730   6.619
   47   2HB   SER  15          3HB       SER  15  -4.785   3.983   6.517
   48    HG   SER  15           HG       SER  15  -3.580   4.064   4.693
   49    H    GLY  16           H        GLY  16  -5.731   5.572   2.865
   50   1HA   GLY  16          1HA       GLY  16  -7.040   7.323   1.738
   51   2HA   GLY  16          2HA       GLY  16  -6.898   8.273   3.204
   52    H    THR  17           H        THR  17  -4.052   7.209   3.661
   53    HA   THR  17           HA       THR  17  -2.692   8.584   1.452
   54    HB   THR  17           HB       THR  17  -2.489   9.146   4.452
   55    HG1  THR  17           1HG      THR  17  -3.069  11.264   3.554
   56   1HG2  THR  17          1HG2      THR  17  -0.191   9.212   3.608
   57   2HG2  THR  17          2HG2      THR  17  -0.715  10.037   2.122
   58   3HG2  THR  17          3HG2      THR  17  -0.783  10.889   3.682
   59    H    CYS  18           H        CYS  18  -1.178   7.330   0.576
   60    HA   CYS  18           HA       CYS  18  -0.550   4.850   1.677
   61   1HB   CYS  18          2HB       CYS  18  -0.215   4.785  -0.550
   62   2HB   CYS  18          3HB       CYS  18   0.299   6.458  -0.646
   63    H    ASN  19           H        ASN  19   0.216   5.096   3.841
   64    HA   ASN  19           HA       ASN  19   2.480   6.832   4.224
   65   1HB   ASN  19          2HB       ASN  19   0.504   6.604   5.879
   66   2HB   ASN  19          3HB       ASN  19   1.120   5.011   6.273
   67   1HD2  ASN  19          1HD2      ASN  19   1.285   8.313   6.882
   68   2HD2  ASN  19          2HD2      ASN  19   2.690   8.368   7.892
   69    H    CYS  20           H        CYS  20   2.461   4.268   2.623
   70    HA   CYS  20           HA       CYS  20   4.152   2.451   4.216
   71   1HB   CYS  20          2HB       CYS  20   3.269   0.873   2.877
   72   2HB   CYS  20          3HB       CYS  20   2.257   2.137   2.134
   73    H    GLY  21           H        GLY  21   4.597   5.286   2.406
   74   1HA   GLY  21          1HA       GLY  21   6.710   4.716   0.707
   75   2HA   GLY  21          2HA       GLY  21   6.427   6.242   1.520
   76    H    GLY  22           H        GLY  22   8.021   3.041   1.777
   77   1HA   GLY  22          1HA       GLY  22  10.409   3.580   2.646
   78   2HA   GLY  22          2HA       GLY  22   9.537   3.957   4.118
   79    H    SER  23           H        SER  23   9.005   2.313   5.525
   80    HA   SER  23           HA       SER  23   9.519  -0.369   4.514
   81   1HB   SER  23          2HB       SER  23  10.343   1.028   6.902
   82   2HB   SER  23          3HB       SER  23   9.342  -0.327   7.383
   83    HG   SER  23           HG       SER  23  11.697  -0.780   7.124
   84    H    CYS  24           H        CYS  24   7.460  -0.958   3.725
   85    HA   CYS  24           HA       CYS  24   5.231  -0.613   5.573
   86   1HB   CYS  24          2HB       CYS  24   3.776  -0.807   3.760
   87   2HB   CYS  24          3HB       CYS  24   5.087   0.204   3.189
   88    H    THR  25           H        THR  25   3.687  -2.565   5.694
   89    HA   THR  25           HA       THR  25   5.262  -5.056   5.609
   90    HB   THR  25           HB       THR  25   3.835  -5.699   7.601
   91    HG1  THR  25           1HG      THR  25   2.307  -4.164   8.239
   92   1HG2  THR  25          1HG2      THR  25   5.623  -4.822   8.743
   93   2HG2  THR  25          2HG2      THR  25   5.811  -3.500   7.566
   94   3HG2  THR  25          3HG2      THR  25   4.647  -3.343   8.902
   95    H    CYS  26           H        CYS  26   2.426  -3.322   4.552
   96    HA   CYS  26           HA       CYS  26   0.621  -5.308   4.156
   97   1HB   CYS  26          2HB       CYS  26   0.227  -3.882   1.911
   98   2HB   CYS  26          3HB       CYS  26  -0.321  -3.391   3.502
   99    H    THR  27           H        THR  27   0.253  -6.878   2.482
  100    HA   THR  27           HA       THR  27   2.690  -7.584   1.015
  101    HB   THR  27           HB       THR  27   0.566  -9.006   2.450
  102    HG1  THR  27           1HG      THR  27   2.340 -10.666   2.001
  103   1HG2  THR  27          1HG2      THR  27   0.577 -10.952   0.788
  104   2HG2  THR  27          2HG2      THR  27  -0.412  -9.563   0.277
  105   3HG2  THR  27          3HG2      THR  27   1.199  -9.816  -0.433
  106    H    ASN  28           H        ASN  28  -0.826  -6.940   0.564
  107    HA   ASN  28           HA       ASN  28  -0.528  -7.264  -2.253
  108   1HB   ASN  28          2HB       ASN  28  -2.800  -6.447  -0.398
  109   2HB   ASN  28          3HB       ASN  28  -2.976  -6.258  -2.131
  110   1HD2  ASN  28          1HD2      ASN  28  -4.411  -7.980  -0.292
  111   2HD2  ASN  28          2HD2      ASN  28  -4.216  -9.613  -0.838
  112    H    CYS  29           H        CYS  29   1.298  -5.477  -1.797
  113    HA   CYS  29           HA       CYS  29   0.188  -2.738  -1.869
  114   1HB   CYS  29          2HB       CYS  29   2.300  -3.689  -0.515
  115   2HB   CYS  29          3HB       CYS  29   3.124  -3.309  -2.047
  116    H    SER  30           H        SER  30   1.506  -1.223  -3.529
  117    HA   SER  30           HA       SER  30   2.334  -2.549  -5.877
  118   1HB   SER  30          2HB       SER  30  -0.289  -2.603  -5.882
  119   2HB   SER  30          3HB       SER  30  -0.182  -0.888  -6.224
  120    HG   SER  30           HG       SER  30   1.326  -1.577  -8.045
  121    H    CYS  31           H        CYS  31   3.461  -0.656  -4.031
  122    HA   CYS  31           HA       CYS  31   3.524   1.743  -5.715
  123   1HB   CYS  31          2HB       CYS  31   4.415   1.962  -2.901
  124   2HB   CYS  31          3HB       CYS  31   3.572   3.115  -3.918
  125    H    LYS  32           H        LYS  32   5.864   2.672  -3.985
  126    HA   LYS  32           HA       LYS  32   7.862   0.740  -4.936
  127   1HB   LYS  32          2HB       LYS  32   9.297   2.569  -5.606
  128   2HB   LYS  32          3HB       LYS  32   7.762   2.681  -6.442
  129   1HG   LYS  32          2HG       LYS  32   7.923   4.139  -3.830
  130   2HG   LYS  32          3HG       LYS  32   8.924   4.779  -5.120
  131   1HD   LYS  32          2HD       LYS  32   6.141   4.080  -5.938
  132   2HD   LYS  32          3HD       LYS  32   6.253   5.382  -4.770
  133   1HE   LYS  32          2HE       LYS  32   8.301   5.892  -6.692
  134   2HE   LYS  32          3HE       LYS  32   6.890   5.417  -7.618
  135   1HZ   LYS  32          1HZ       LYS  32   7.057   7.575  -5.638
  136   2HZ   LYS  32          2HZ       LYS  32   6.757   7.713  -7.237
  137   3HZ   LYS  32          3HZ       LYS  32   5.639   7.046  -6.252
  138    H    SER  33           H        SER  33  10.067   2.310  -3.822
  139    HA   SER  33           HA       SER  33  11.235   2.256  -1.982
  140   1HB   SER  33          2HB       SER  33   8.787   3.810  -1.359
  141   2HB   SER  33          3HB       SER  33   9.642   3.247   0.064
  142    HG   SER  33           HG       SER  33  10.716   5.106  -0.341
  143    H    CYS  34           H        CYS  34   9.392  -0.120  -2.580
  144    HA   CYS  34           HA       CYS  34   9.876  -1.451  -0.092
  145   1HB   CYS  34          2HB       CYS  34   7.591  -2.251   0.229
  146   2HB   CYS  34          3HB       CYS  34   7.727  -0.519   0.449
  147    H    LYS  35           H        LYS  35   8.248  -1.448  -3.333
  148    HA   LYS  35           HA       LYS  35   9.449  -4.092  -3.786
  149   1HB   LYS  35          2HB       LYS  35   6.948  -4.115  -3.469
  150   2HB   LYS  35          3HB       LYS  35   6.806  -3.128  -4.909
  151   1HG   LYS  35          2HG       LYS  35   7.943  -4.865  -6.258
  152   2HG   LYS  35          3HG       LYS  35   8.216  -5.836  -4.826
  153   1HD   LYS  35          2HD       LYS  35   5.425  -5.269  -4.836
  154   2HD   LYS  35          3HD       LYS  35   5.826  -5.658  -6.496
  155   1HE   LYS  35          2HE       LYS  35   5.820  -7.855  -5.936
  156   2HE   LYS  35          3HE       LYS  35   7.235  -7.571  -4.941
  157   1HZ   LYS  35          1HZ       LYS  35   4.489  -7.838  -4.153
  158   2HZ   LYS  35          2HZ       LYS  35   5.850  -8.234  -3.342
  159   3HZ   LYS  35          3HZ       LYS  35   5.325  -6.688  -3.352
  Start of MODEL   13
    1    H    ASP   8           H        ASP   8  -7.905   3.562  -2.643
    2    HA   ASP   8           HA       ASP   8  -5.417   3.949  -4.105
    3   1HB   ASP   8          2HB       ASP   8  -5.751   4.857  -1.685
    4   2HB   ASP   8          3HB       ASP   8  -5.698   3.182  -1.172
    5    HA   PRO   9           HA       PRO   9  -5.461  -0.435  -4.472
    6   1HB   PRO   9          2HB       PRO   9  -2.943  -0.827  -5.459
    7   2HB   PRO   9          3HB       PRO   9  -4.303  -0.357  -6.460
    8   1HG   PRO   9          2HG       PRO   9  -2.040   1.294  -5.514
    9   2HG   PRO   9          3HG       PRO   9  -3.154   1.608  -6.830
   10   1HD   PRO   9          2HD       PRO   9  -3.185   2.816  -4.230
   11   2HD   PRO   9          3HD       PRO   9  -4.366   3.044  -5.504
   12    H    CYS  10           H        CYS  10  -4.736  -2.424  -3.561
   13    HA   CYS  10           HA       CYS  10  -3.997  -3.614  -1.872
   14   1HB   CYS  10          2HB       CYS  10  -1.803  -3.111  -2.790
   15   2HB   CYS  10          3HB       CYS  10  -1.717  -1.626  -1.862
   16    H    GLU  11           H        GLU  11  -3.655  -3.582   0.592
   17    HA   GLU  11           HA       GLU  11  -5.209  -1.379   1.635
   18   1HB   GLU  11          2HB       GLU  11  -4.596  -4.187   2.554
   19   2HB   GLU  11          3HB       GLU  11  -5.081  -3.000   3.749
   20   1HG   GLU  11          2HG       GLU  11  -7.017  -2.479   1.963
   21   2HG   GLU  11          3HG       GLU  11  -6.660  -4.108   1.426
   22    H    CYS  12           H        CYS  12  -3.028  -0.215   1.092
   23    HA   CYS  12           HA       CYS  12  -0.775  -0.539   2.798
   24   1HB   CYS  12          2HB       CYS  12  -1.838   1.870   1.269
   25   2HB   CYS  12          3HB       CYS  12  -0.235   1.791   2.042
   26    H    SER  13           H        SER  13  -3.169   2.233   2.887
   27    HA   SER  13           HA       SER  13  -2.793   2.126   5.779
   28   1HB   SER  13          2HB       SER  13  -3.442   4.634   5.632
   29   2HB   SER  13          3HB       SER  13  -1.831   4.177   5.117
   30    HG   SER  13           HG       SER  13  -3.815   4.103   3.101
   31    H    LYS  14           H        LYS  14  -4.941   1.708   3.148
   32    HA   LYS  14           HA       LYS  14  -7.100   1.240   3.056
   33   1HB   LYS  14          2HB       LYS  14  -6.553   0.977   5.934
   34   2HB   LYS  14          3HB       LYS  14  -8.223   1.364   5.573
   35   1HG   LYS  14          2HG       LYS  14  -7.320  -0.621   3.668
   36   2HG   LYS  14          3HG       LYS  14  -6.880  -1.164   5.275
   37   1HD   LYS  14          2HD       LYS  14  -9.662  -0.070   4.799
   38   2HD   LYS  14          3HD       LYS  14  -9.291  -1.705   4.290
   39   1HE   LYS  14          2HE       LYS  14  -8.603  -2.314   6.582
   40   2HE   LYS  14          3HE       LYS  14  -8.804  -0.659   7.119
   41   1HZ   LYS  14          1HZ       LYS  14 -10.802  -1.499   7.671
   42   2HZ   LYS  14          2HZ       LYS  14 -11.181  -1.065   6.144
   43   3HZ   LYS  14          3HZ       LYS  14 -10.827  -2.622   6.486
   44    H    SER  15           H        SER  15  -6.636   3.757   5.640
   45    HA   SER  15           HA       SER  15  -8.814   5.188   5.386
   46   1HB   SER  15          2HB       SER  15  -6.959   5.835   6.849
   47   2HB   SER  15          3HB       SER  15  -5.964   6.266   5.473
   48    HG   SER  15           HG       SER  15  -6.785   8.227   5.696
   49    H    GLY  16           H        GLY  16  -5.919   5.657   3.223
   50   1HA   GLY  16          1HA       GLY  16  -7.160   5.764   0.813
   51   2HA   GLY  16          2HA       GLY  16  -7.393   7.382   1.445
   52    H    THR  17           H        THR  17  -5.031   7.855   2.888
   53    HA   THR  17           HA       THR  17  -3.176   8.192   0.695
   54    HB   THR  17           HB       THR  17  -3.453   9.187   3.559
   55    HG1  THR  17           1HG      THR  17  -4.522  10.499   2.077
   56   1HG2  THR  17          1HG2      THR  17  -1.120   9.610   1.619
   57   2HG2  THR  17          2HG2      THR  17  -1.425  10.612   3.058
   58   3HG2  THR  17          3HG2      THR  17  -1.017   8.891   3.245
   59    H    CYS  18           H        CYS  18  -2.291   6.226   0.132
   60    HA   CYS  18           HA       CYS  18  -1.595   4.200   1.778
   61   1HB   CYS  18          2HB       CYS  18  -1.087   3.400  -0.216
   62   2HB   CYS  18          3HB       CYS  18  -1.009   5.011  -0.904
   63    H    ASN  19           H        ASN  19  -0.466   4.376   3.693
   64    HA   ASN  19           HA       ASN  19   1.652   6.333   3.811
   65   1HB   ASN  19          2HB       ASN  19  -0.235   5.838   5.634
   66   2HB   ASN  19          3HB       ASN  19   0.829   4.530   6.115
   67   1HD2  ASN  19          1HD2      ASN  19  -0.029   7.299   7.172
   68   2HD2  ASN  19          2HD2      ASN  19   1.444   8.033   7.712
   69    H    CYS  20           H        CYS  20   1.748   3.750   2.294
   70    HA   CYS  20           HA       CYS  20   3.632   2.071   3.807
   71   1HB   CYS  20          2HB       CYS  20   2.809   0.453   2.481
   72   2HB   CYS  20          3HB       CYS  20   1.721   1.656   1.746
   73    H    GLY  21           H        GLY  21   3.831   4.952   2.035
   74   1HA   GLY  21          1HA       GLY  21   5.704   4.880   0.175
   75   2HA   GLY  21          2HA       GLY  21   5.755   6.053   1.476
   76    H    GLY  22           H        GLY  22   6.446   4.541   3.720
   77   1HA   GLY  22          1HA       GLY  22   9.214   3.863   3.071
   78   2HA   GLY  22          2HA       GLY  22   8.535   4.181   4.655
   79    H    SER  23           H        SER  23   9.283   2.274   5.663
   80    HA   SER  23           HA       SER  23   9.104  -0.228   4.510
   81   1HB   SER  23          2HB       SER  23   9.919   0.919   7.019
   82   2HB   SER  23          3HB       SER  23   8.869  -0.437   7.380
   83    HG   SER  23           HG       SER  23  10.642  -1.602   7.052
   84    H    CYS  24           H        CYS  24   7.063  -0.738   3.632
   85    HA   CYS  24           HA       CYS  24   4.710  -0.321   5.208
   86   1HB   CYS  24          2HB       CYS  24   3.505  -1.199   3.326
   87   2HB   CYS  24          3HB       CYS  24   4.682  -0.020   2.782
   88    H    THR  25           H        THR  25   3.255  -2.138   5.847
   89    HA   THR  25           HA       THR  25   4.688  -4.688   6.155
   90    HB   THR  25           HB       THR  25   4.763  -3.259   8.257
   91    HG1  THR  25           1HG      THR  25   3.671  -5.102   9.483
   92   1HG2  THR  25          1HG2      THR  25   1.745  -3.789   8.232
   93   2HG2  THR  25          2HG2      THR  25   2.670  -3.034   9.552
   94   3HG2  THR  25          3HG2      THR  25   2.484  -2.187   7.998
   95    H    CYS  26           H        CYS  26   2.503  -3.443   4.318
   96    HA   CYS  26           HA       CYS  26   0.246  -5.080   5.052
   97   1HB   CYS  26          2HB       CYS  26  -0.594  -4.137   2.777
   98   2HB   CYS  26          3HB       CYS  26  -0.537  -3.116   4.201
   99    H    THR  27           H        THR  27  -0.707  -6.517   3.204
  100    HA   THR  27           HA       THR  27   1.528  -8.014   2.020
  101    HB   THR  27           HB       THR  27  -1.350  -8.817   2.703
  102    HG1  THR  27           1HG      THR  27  -0.306  -9.625   4.556
  103   1HG2  THR  27          1HG2      THR  27  -0.859 -10.594   1.320
  104   2HG2  THR  27          2HG2      THR  27   0.865 -10.157   1.237
  105   3HG2  THR  27          3HG2      THR  27   0.250 -11.093   2.621
  106    H    ASN  28           H        ASN  28   1.321  -8.872  -0.145
  107    HA   ASN  28           HA       ASN  28   1.093  -8.488  -2.275
  108   1HB   ASN  28          2HB       ASN  28  -1.842  -7.931  -1.600
  109   2HB   ASN  28          3HB       ASN  28  -1.228  -8.481  -3.146
  110   1HD2  ASN  28          1HD2      ASN  28  -3.007  -9.531  -0.829
  111   2HD2  ASN  28          2HD2      ASN  28  -2.504 -11.176  -0.619
  112    H    CYS  29           H        CYS  29   2.310  -6.410  -1.792
  113    HA   CYS  29           HA       CYS  29   0.696  -3.944  -2.048
  114   1HB   CYS  29          2HB       CYS  29   2.697  -4.399  -0.382
  115   2HB   CYS  29          3HB       CYS  29   3.697  -4.010  -1.804
  116    H    SER  30           H        SER  30   1.821  -2.193  -3.577
  117    HA   SER  30           HA       SER  30   3.249  -3.264  -5.752
  118   1HB   SER  30          2HB       SER  30   0.582  -3.811  -5.975
  119   2HB   SER  30          3HB       SER  30   0.613  -2.220  -6.708
  120    HG   SER  30           HG       SER  30   2.598  -4.113  -7.517
  121    H    CYS  31           H        CYS  31   4.154  -1.295  -4.274
  122    HA   CYS  31           HA       CYS  31   3.418   1.146  -5.719
  123   1HB   CYS  31          2HB       CYS  31   4.233   0.879  -2.818
  124   2HB   CYS  31          3HB       CYS  31   4.077   2.402  -3.672
  125    H    LYS  32           H        LYS  32   5.174   2.308  -6.587
  126    HA   LYS  32           HA       LYS  32   7.648   0.886  -6.720
  127   1HB   LYS  32          2HB       LYS  32   6.531   3.392  -7.955
  128   2HB   LYS  32          3HB       LYS  32   8.246   3.055  -8.060
  129   1HG   LYS  32          2HG       LYS  32   7.783   1.724  -9.839
  130   2HG   LYS  32          3HG       LYS  32   7.064   0.590  -8.713
  131   1HD   LYS  32          2HD       LYS  32   4.866   1.362  -9.119
  132   2HD   LYS  32          3HD       LYS  32   5.407   2.928  -9.688
  133   1HE   LYS  32          2HE       LYS  32   6.516   0.829 -11.385
  134   2HE   LYS  32          3HE       LYS  32   4.779   0.633 -11.263
  135   1HZ   LYS  32          1HZ       LYS  32   4.846   2.173 -12.868
  136   2HZ   LYS  32          2HZ       LYS  32   4.927   3.227 -11.625
  137   3HZ   LYS  32          3HZ       LYS  32   6.287   2.796 -12.418
  138    H    SER  33           H        SER  33   6.259   2.835  -4.370
  139    HA   SER  33           HA       SER  33   8.710   4.201  -3.724
  140   1HB   SER  33          2HB       SER  33   5.888   4.567  -3.164
  141   2HB   SER  33          3HB       SER  33   6.765   4.512  -1.647
  142    HG   SER  33           HG       SER  33   7.984   6.289  -2.224
  143    H    CYS  34           H        CYS  34   7.956   1.100  -3.539
  144    HA   CYS  34           HA       CYS  34   9.369   0.758  -1.041
  145   1HB   CYS  34          2HB       CYS  34   7.829  -0.746  -0.052
  146   2HB   CYS  34          3HB       CYS  34   6.963   0.731  -0.430
  147    H    LYS  35           H        LYS  35   7.662  -0.736  -3.874
  148    HA   LYS  35           HA       LYS  35   9.655  -2.862  -3.904
  149   1HB   LYS  35          2HB       LYS  35   7.002  -2.467  -5.304
  150   2HB   LYS  35          3HB       LYS  35   8.115  -3.749  -5.741
  151   1HG   LYS  35          2HG       LYS  35   8.081  -4.594  -3.393
  152   2HG   LYS  35          3HG       LYS  35   6.999  -3.297  -2.933
  153   1HD   LYS  35          2HD       LYS  35   5.602  -5.216  -3.311
  154   2HD   LYS  35          3HD       LYS  35   5.353  -4.162  -4.689
  155   1HE   LYS  35          2HE       LYS  35   5.935  -5.883  -6.047
  156   2HE   LYS  35          3HE       LYS  35   7.566  -5.783  -5.413
  157   1HZ   LYS  35          1HZ       LYS  35   6.092  -7.102  -3.519
  158   2HZ   LYS  35          2HZ       LYS  35   5.630  -7.749  -4.945
  159   3HZ   LYS  35          3HZ       LYS  35   7.207  -7.748  -4.522
  Start of MODEL   14
    1    H    ASP   8           H        ASP   8  -9.794   2.415   0.930
    2    HA   ASP   8           HA       ASP   8  -8.925   2.697  -1.768
    3   1HB   ASP   8          2HB       ASP   8  -7.980   4.065   0.094
    4   2HB   ASP   8          3HB       ASP   8  -7.382   2.609   0.867
    5    HA   PRO   9           HA       PRO   9  -7.799  -1.555  -2.029
    6   1HB   PRO   9          2HB       PRO   9  -6.504  -1.507  -4.435
    7   2HB   PRO   9          3HB       PRO   9  -8.247  -1.617  -4.286
    8   1HG   PRO   9          2HG       PRO   9  -6.597   0.710  -5.063
    9   2HG   PRO   9          3HG       PRO   9  -8.312   0.448  -5.313
   10   1HD   PRO   9          2HD       PRO   9  -7.105   2.138  -3.334
   11   2HD   PRO   9          3HD       PRO   9  -8.812   1.784  -3.511
   12    H    CYS  10           H        CYS  10  -5.937  -3.067  -2.195
   13    HA   CYS  10           HA       CYS  10  -3.904  -3.642  -1.603
   14   1HB   CYS  10          2HB       CYS  10  -3.353  -1.795  -3.357
   15   2HB   CYS  10          3HB       CYS  10  -2.858  -0.849  -1.967
   16    H    GLU  11           H        GLU  11  -2.486  -3.587   0.321
   17    HA   GLU  11           HA       GLU  11  -3.813  -2.220   2.478
   18   1HB   GLU  11          2HB       GLU  11  -2.280  -4.668   2.157
   19   2HB   GLU  11          3HB       GLU  11  -1.581  -3.709   3.447
   20   1HG   GLU  11          2HG       GLU  11  -4.285  -3.450   3.988
   21   2HG   GLU  11          3HG       GLU  11  -4.228  -5.068   3.319
   22    H    CYS  12           H        CYS  12  -2.624  -0.434   0.801
   23    HA   CYS  12           HA       CYS  12   0.077   0.236   1.516
   24   1HB   CYS  12          2HB       CYS  12  -2.192   1.543   0.031
   25   2HB   CYS  12          3HB       CYS  12  -0.795   2.533   0.523
   26    H    SER  13           H        SER  13  -2.831   2.361   2.082
   27    HA   SER  13           HA       SER  13  -1.727   2.753   4.754
   28   1HB   SER  13          2HB       SER  13  -2.041   5.065   4.621
   29   2HB   SER  13          3HB       SER  13  -1.545   4.688   2.983
   30    HG   SER  13           HG       SER  13  -3.577   6.078   3.400
   31    H    LYS  14           H        LYS  14  -4.505   2.200   2.644
   32    HA   LYS  14           HA       LYS  14  -6.518   1.391   3.136
   33   1HB   LYS  14          2HB       LYS  14  -5.355   0.364   5.167
   34   2HB   LYS  14          3HB       LYS  14  -5.961   1.724   6.091
   35   1HG   LYS  14          2HG       LYS  14  -8.087   0.895   6.133
   36   2HG   LYS  14          3HG       LYS  14  -8.067   0.516   4.422
   37   1HD   LYS  14          2HD       LYS  14  -6.423  -1.208   6.277
   38   2HD   LYS  14          3HD       LYS  14  -8.164  -1.417   6.286
   39   1HE   LYS  14          2HE       LYS  14  -7.511  -1.305   3.543
   40   2HE   LYS  14          3HE       LYS  14  -6.202  -2.231   4.248
   41   1HZ   LYS  14          1HZ       LYS  14  -9.035  -2.803   4.761
   42   2HZ   LYS  14          2HZ       LYS  14  -8.154  -3.550   3.607
   43   3HZ   LYS  14          3HZ       LYS  14  -7.756  -3.727   5.182
   44    H    SER  15           H        SER  15  -5.613   4.026   5.471
   45    HA   SER  15           HA       SER  15  -7.942   5.208   5.824
   46   1HB   SER  15          2HB       SER  15  -5.867   6.073   6.780
   47   2HB   SER  15          3HB       SER  15  -5.279   6.552   5.199
   48    HG   SER  15           HG       SER  15  -7.005   8.112   5.065
   49    H    GLY  16           H        GLY  16  -5.778   5.825   2.964
   50   1HA   GLY  16          1HA       GLY  16  -7.630   5.810   0.985
   51   2HA   GLY  16          2HA       GLY  16  -7.779   7.426   1.646
   52    H    THR  17           H        THR  17  -4.851   7.435   2.509
   53    HA   THR  17           HA       THR  17  -3.697   7.798  -0.179
   54    HB   THR  17           HB       THR  17  -4.259   9.889   1.239
   55    HG1  THR  17           1HG      THR  17  -2.564   9.633  -0.488
   56   1HG2  THR  17          1HG2      THR  17  -1.704   9.116   2.705
   57   2HG2  THR  17          2HG2      THR  17  -2.832  10.442   3.078
   58   3HG2  THR  17          3HG2      THR  17  -3.299   8.757   3.408
   59    H    CYS  18           H        CYS  18  -2.249   6.282  -0.664
   60    HA   CYS  18           HA       CYS  18  -1.286   4.370   0.913
   61   1HB   CYS  18          2HB       CYS  18  -0.626   3.990  -1.200
   62   2HB   CYS  18          3HB       CYS  18  -0.333   5.683  -1.542
   63    H    ASN  19           H        ASN  19   0.562   4.060   2.306
   64    HA   ASN  19           HA       ASN  19   2.031   6.468   2.954
   65   1HB   ASN  19          2HB       ASN  19   0.033   6.090   4.573
   66   2HB   ASN  19          3HB       ASN  19   0.870   4.652   5.123
   67   1HD2  ASN  19          1HD2      ASN  19   0.340   6.498   6.943
   68   2HD2  ASN  19          2HD2      ASN  19   1.749   7.373   7.442
   69    H    CYS  20           H        CYS  20   3.101   4.587   1.423
   70    HA   CYS  20           HA       CYS  20   4.344   2.437   2.984
   71   1HB   CYS  20          2HB       CYS  20   4.333   3.291   0.078
   72   2HB   CYS  20          3HB       CYS  20   5.495   2.081   0.680
   73    H    GLY  21           H        GLY  21   4.930   5.286   3.761
   74   1HA   GLY  21          1HA       GLY  21   7.655   5.688   2.808
   75   2HA   GLY  21          2HA       GLY  21   6.710   6.749   3.836
   76    H    GLY  22           H        GLY  22   5.884   5.131   5.937
   77   1HA   GLY  22          1HA       GLY  22   8.216   4.979   7.522
   78   2HA   GLY  22          2HA       GLY  22   6.609   4.420   7.945
   79    H    SER  23           H        SER  23   5.929   2.349   6.455
   80    HA   SER  23           HA       SER  23   8.090   0.656   5.810
   81   1HB   SER  23          2HB       SER  23   7.189   0.630   8.546
   82   2HB   SER  23          3HB       SER  23   6.680  -0.875   7.806
   83    HG   SER  23           HG       SER  23   8.944  -1.112   7.036
   84    H    CYS  24           H        CYS  24   7.359  -1.020   4.443
   85    HA   CYS  24           HA       CYS  24   4.629  -0.793   3.631
   86   1HB   CYS  24          2HB       CYS  24   6.590  -1.104   2.084
   87   2HB   CYS  24          3HB       CYS  24   6.718  -2.753   2.665
   88    H    THR  25           H        THR  25   2.998  -2.410   3.880
   89    HA   THR  25           HA       THR  25   3.726  -4.641   5.660
   90    HB   THR  25           HB       THR  25   1.623  -4.242   6.868
   91    HG1  THR  25           1HG      THR  25   0.296  -2.440   6.043
   92   1HG2  THR  25          1HG2      THR  25   2.008  -2.071   7.856
   93   2HG2  THR  25          2HG2      THR  25   3.621  -2.667   7.396
   94   3HG2  THR  25          3HG2      THR  25   2.794  -1.464   6.379
   95    H    CYS  26           H        CYS  26   1.585  -3.363   3.075
   96    HA   CYS  26           HA       CYS  26   0.048  -5.554   2.640
   97   1HB   CYS  26          2HB       CYS  26   0.737  -4.594   0.083
   98   2HB   CYS  26          3HB       CYS  26  -0.689  -4.236   1.034
   99    H    THR  27           H        THR  27   0.382  -7.618   1.793
  100    HA   THR  27           HA       THR  27   3.096  -8.475   1.482
  101    HB   THR  27           HB       THR  27   1.208  -9.790   2.567
  102    HG1  THR  27           1HG      THR  27   1.941 -11.739   1.373
  103   1HG2  THR  27          1HG2      THR  27  -0.579  -9.286   0.852
  104   2HG2  THR  27          2HG2      THR  27   0.370 -10.188  -0.353
  105   3HG2  THR  27          3HG2      THR  27  -0.312 -11.034   1.057
  106    H    ASN  28           H        ASN  28   0.387  -7.634  -0.685
  107    HA   ASN  28           HA       ASN  28   2.256  -8.100  -2.876
  108   1HB   ASN  28          2HB       ASN  28  -0.772  -8.496  -2.748
  109   2HB   ASN  28          3HB       ASN  28   0.075  -8.373  -4.278
  110   1HD2  ASN  28          1HD2      ASN  28  -1.101 -10.448  -2.034
  111   2HD2  ASN  28          2HD2      ASN  28  -0.140 -11.857  -2.330
  112    H    CYS  29           H        CYS  29   2.856  -5.830  -2.374
  113    HA   CYS  29           HA       CYS  29   0.947  -3.685  -2.599
  114   1HB   CYS  29          2HB       CYS  29   3.294  -3.759  -1.450
  115   2HB   CYS  29          3HB       CYS  29   3.919  -3.411  -3.079
  116    H    SER  30           H        SER  30   1.146  -1.932  -4.369
  117    HA   SER  30           HA       SER  30   1.863  -3.206  -6.886
  118   1HB   SER  30          2HB       SER  30  -0.170  -1.817  -7.818
  119   2HB   SER  30          3HB       SER  30  -0.462  -3.364  -7.049
  120    HG   SER  30           HG       SER  30  -1.906  -1.692  -6.265
  121    H    CYS  31           H        CYS  31   2.563  -0.836  -4.712
  122    HA   CYS  31           HA       CYS  31   3.039   1.189  -6.768
  123   1HB   CYS  31          2HB       CYS  31   3.007   2.836  -5.127
  124   2HB   CYS  31          3HB       CYS  31   1.678   1.772  -4.713
  125    H    LYS  32           H        LYS  32   5.191   2.533  -6.030
  126    HA   LYS  32           HA       LYS  32   7.249   0.474  -5.705
  127   1HB   LYS  32          2HB       LYS  32   7.566   3.252  -6.868
  128   2HB   LYS  32          3HB       LYS  32   8.722   1.937  -6.918
  129   1HG   LYS  32          2HG       LYS  32   7.495   0.723  -8.516
  130   2HG   LYS  32          3HG       LYS  32   5.968   1.451  -8.056
  131   1HD   LYS  32          2HD       LYS  32   8.162   3.156  -9.281
  132   2HD   LYS  32          3HD       LYS  32   7.121   2.191 -10.309
  133   1HE   LYS  32          2HE       LYS  32   6.051   4.163  -8.238
  134   2HE   LYS  32          3HE       LYS  32   6.340   4.597  -9.912
  135   1HZ   LYS  32          1HZ       LYS  32   4.407   3.705 -10.407
  136   2HZ   LYS  32          2HZ       LYS  32   4.880   2.239  -9.869
  137   3HZ   LYS  32          3HZ       LYS  32   4.146   3.282  -8.851
  138    H    SER  33           H        SER  33   9.284   2.594  -5.146
  139    HA   SER  33           HA       SER  33  10.258   3.461  -3.411
  140   1HB   SER  33          2HB       SER  33   7.852   4.811  -3.631
  141   2HB   SER  33          3HB       SER  33   7.816   4.311  -1.951
  142    HG   SER  33           HG       SER  33   9.009   6.436  -2.791
  143    H    CYS  34           H        CYS  34   8.836   0.663  -3.293
  144    HA   CYS  34           HA       CYS  34   9.685   0.104  -0.635
  145   1HB   CYS  34          2HB       CYS  34   7.483  -0.939   0.033
  146   2HB   CYS  34          3HB       CYS  34   7.591   0.808   0.110
  147    H    LYS  35           H        LYS  35   7.596  -0.999  -3.404
  148    HA   LYS  35           HA       LYS  35   8.829  -3.633  -3.205
  149   1HB   LYS  35          2HB       LYS  35   6.333  -3.360  -3.313
  150   2HB   LYS  35          3HB       LYS  35   6.513  -2.725  -4.937
  151   1HG   LYS  35          2HG       LYS  35   7.992  -4.992  -5.212
  152   2HG   LYS  35          3HG       LYS  35   6.921  -5.527  -3.934
  153   1HD   LYS  35          2HD       LYS  35   5.651  -6.105  -5.803
  154   2HD   LYS  35          3HD       LYS  35   5.015  -4.504  -5.480
  155   1HE   LYS  35          2HE       LYS  35   5.755  -3.732  -7.483
  156   2HE   LYS  35          3HE       LYS  35   7.390  -4.266  -7.144
  157   1HZ   LYS  35          1HZ       LYS  35   5.297  -6.119  -8.028
  158   2HZ   LYS  35          2HZ       LYS  35   6.266  -5.326  -9.077
  159   3HZ   LYS  35          3HZ       LYS  35   6.910  -6.373  -8.001
  Start of MODEL   15
    1    H    ASP   8           H        ASP   8  -7.817  -9.844  -1.051
    2    HA   ASP   8           HA       ASP   8  -9.208  -7.462  -1.645
    3   1HB   ASP   8          2HB       ASP   8  -8.114  -8.767   0.650
    4   2HB   ASP   8          3HB       ASP   8  -7.319  -7.208   0.566
    5    HA   PRO   9           HA       PRO   9  -5.693  -5.499  -3.451
    6   1HB   PRO   9          2HB       PRO   9  -6.780  -3.027  -3.871
    7   2HB   PRO   9          3HB       PRO   9  -7.000  -4.373  -4.974
    8   1HG   PRO   9          2HG       PRO   9  -8.923  -3.225  -3.044
    9   2HG   PRO   9          3HG       PRO   9  -9.237  -4.257  -4.425
   10   1HD   PRO   9          2HD       PRO   9  -9.216  -5.039  -1.665
   11   2HD   PRO   9          3HD       PRO   9  -9.416  -6.093  -3.051
   12    H    CYS  10           H        CYS  10  -4.222  -3.569  -3.203
   13    HA   CYS  10           HA       CYS  10  -3.716  -3.385  -0.407
   14   1HB   CYS  10          2HB       CYS  10  -1.658  -2.752  -0.994
   15   2HB   CYS  10          3HB       CYS  10  -2.126  -3.339  -2.577
   16    H    GLU  11           H        GLU  11  -3.657  -1.330   0.814
   17    HA   GLU  11           HA       GLU  11  -5.339   0.716  -0.402
   18   1HB   GLU  11          2HB       GLU  11  -5.549  -0.535   2.355
   19   2HB   GLU  11          3HB       GLU  11  -6.167   1.077   2.057
   20   1HG   GLU  11          2HG       GLU  11  -7.740   0.292   0.410
   21   2HG   GLU  11          3HG       GLU  11  -6.943  -1.263   0.273
   22    H    CYS  12           H        CYS  12  -3.362   1.761  -0.957
   23    HA   CYS  12           HA       CYS  12  -1.310   2.441   0.876
   24   1HB   CYS  12          2HB       CYS  12  -2.258   3.411  -1.802
   25   2HB   CYS  12          3HB       CYS  12  -1.115   4.431  -0.894
   26    H    SER  13           H        SER  13  -3.986   4.597  -0.408
   27    HA   SER  13           HA       SER  13  -3.522   6.232   1.932
   28   1HB   SER  13          2HB       SER  13  -4.618   6.657  -0.796
   29   2HB   SER  13          3HB       SER  13  -5.490   7.512   0.461
   30    HG   SER  13           HG       SER  13  -2.683   7.671   0.669
   31    H    LYS  14           H        LYS  14  -5.867   4.034   0.419
   32    HA   LYS  14           HA       LYS  14  -8.206   4.689   1.612
   33   1HB   LYS  14          2HB       LYS  14  -6.956   2.198   0.620
   34   2HB   LYS  14          3HB       LYS  14  -8.281   1.963   1.742
   35   1HG   LYS  14          2HG       LYS  14  -9.352   2.080  -0.373
   36   2HG   LYS  14          3HG       LYS  14  -9.601   3.676   0.305
   37   1HD   LYS  14          2HD       LYS  14  -8.106   4.699  -1.165
   38   2HD   LYS  14          3HD       LYS  14  -7.103   3.270  -1.318
   39   1HE   LYS  14          2HE       LYS  14  -8.231   3.520  -3.431
   40   2HE   LYS  14          3HE       LYS  14  -9.008   2.172  -2.624
   41   1HZ   LYS  14          1HZ       LYS  14 -10.515   3.866  -3.594
   42   2HZ   LYS  14          2HZ       LYS  14 -10.799   3.534  -2.020
   43   3HZ   LYS  14          3HZ       LYS  14 -10.032   4.914  -2.439
   44    H    SER  15           H        SER  15  -5.576   2.638   3.048
   45    HA   SER  15           HA       SER  15  -6.872   2.252   5.451
   46   1HB   SER  15          2HB       SER  15  -4.598   1.673   6.321
   47   2HB   SER  15          3HB       SER  15  -4.958   0.896   4.794
   48    HG   SER  15           HG       SER  15  -2.914   2.613   5.408
   49    H    GLY  16           H        GLY  16  -5.005   4.979   4.156
   50   1HA   GLY  16          1HA       GLY  16  -5.825   7.046   5.458
   51   2HA   GLY  16          2HA       GLY  16  -4.978   6.287   6.791
   52    H    THR  17           H        THR  17  -4.595   7.643   3.484
   53    HA   THR  17           HA       THR  17  -2.857   8.557   2.442
   54    HB   THR  17           HB       THR  17  -2.857   9.515   5.094
   55    HG1  THR  17           1HG      THR  17  -1.595  11.199   3.926
   56   1HG2  THR  17          1HG2      THR  17  -0.006   8.926   4.140
   57   2HG2  THR  17          2HG2      THR  17  -0.459   9.899   5.561
   58   3HG2  THR  17          3HG2      THR  17  -0.777   8.147   5.544
   59    H    CYS  18           H        CYS  18  -0.924   8.013   1.430
   60    HA   CYS  18           HA       CYS  18  -0.122   5.332   1.897
   61   1HB   CYS  18          2HB       CYS  18  -0.163   5.997  -0.346
   62   2HB   CYS  18          3HB       CYS  18   0.709   7.483  -0.029
   63    H    ASN  19           H        ASN  19   1.447   4.668   3.328
   64    HA   ASN  19           HA       ASN  19   3.426   6.673   4.074
   65   1HB   ASN  19          2HB       ASN  19   1.734   6.247   5.913
   66   2HB   ASN  19          3HB       ASN  19   2.180   4.551   5.902
   67   1HD2  ASN  19          1HD2      ASN  19   3.627   7.795   6.106
   68   2HD2  ASN  19          2HD2      ASN  19   4.840   7.424   7.286
   69    H    CYS  20           H        CYS  20   3.835   4.949   1.986
   70    HA   CYS  20           HA       CYS  20   5.157   2.501   2.929
   71   1HB   CYS  20          2HB       CYS  20   4.664   3.728   0.190
   72   2HB   CYS  20          3HB       CYS  20   5.583   2.223   0.441
   73    H    GLY  21           H        GLY  21   6.243   5.152   3.829
   74   1HA   GLY  21          1HA       GLY  21   8.630   5.539   2.228
   75   2HA   GLY  21          2HA       GLY  21   8.150   6.413   3.669
   76    H    GLY  22           H        GLY  22   8.815   2.921   2.862
   77   1HA   GLY  22          1HA       GLY  22  10.616   1.684   3.643
   78   2HA   GLY  22          2HA       GLY  22  10.958   2.905   4.851
   79    H    SER  23           H        SER  23   7.608   1.872   4.364
   80    HA   SER  23           HA       SER  23   7.722  -0.194   6.286
   81   1HB   SER  23          2HB       SER  23   5.874   1.681   7.466
   82   2HB   SER  23          3HB       SER  23   7.272   0.918   8.197
   83    HG   SER  23           HG       SER  23   7.803   3.054   8.288
   84    H    CYS  24           H        CYS  24   6.625  -1.324   4.574
   85    HA   CYS  24           HA       CYS  24   4.214  -0.225   3.509
   86   1HB   CYS  24          2HB       CYS  24   5.909  -1.747   2.327
   87   2HB   CYS  24          3HB       CYS  24   5.165  -3.068   3.205
   88    H    THR  25           H        THR  25   2.075  -0.844   4.055
   89    HA   THR  25           HA       THR  25   1.845  -2.716   6.318
   90    HB   THR  25           HB       THR  25   1.642  -0.301   7.021
   91    HG1  THR  25           1HG      THR  25   0.309  -2.218   7.832
   92   1HG2  THR  25          1HG2      THR  25  -0.467   0.887   6.334
   93   2HG2  THR  25          2HG2      THR  25   0.647   0.677   4.962
   94   3HG2  THR  25          3HG2      THR  25  -0.769  -0.388   5.130
   95    H    CYS  26           H        CYS  26   0.454  -1.319   3.335
   96    HA   CYS  26           HA       CYS  26  -1.820  -3.028   3.445
   97   1HB   CYS  26          2HB       CYS  26  -1.873  -2.244   0.919
   98   2HB   CYS  26          3HB       CYS  26  -2.381  -1.207   2.238
   99    H    THR  27           H        THR  27  -2.216  -4.848   1.957
  100    HA   THR  27           HA       THR  27   0.243  -6.305   1.409
  101    HB   THR  27           HB       THR  27  -2.491  -6.893   2.219
  102    HG1  THR  27           1HG      THR  27  -0.431  -7.701   3.095
  103   1HG2  THR  27          1HG2      THR  27  -2.939  -8.826   0.815
  104   2HG2  THR  27          2HG2      THR  27  -2.708  -7.450  -0.289
  105   3HG2  THR  27          3HG2      THR  27  -1.396  -8.629  -0.050
  106    H    ASN  28           H        ASN  28   0.181  -7.713  -0.675
  107    HA   ASN  28           HA       ASN  28   0.693  -7.467  -2.810
  108   1HB   ASN  28          2HB       ASN  28  -1.283  -7.611  -4.225
  109   2HB   ASN  28          3HB       ASN  28  -1.694  -8.372  -2.701
  110   1HD2  ASN  28          1HD2      ASN  28  -2.735  -6.306  -5.010
  111   2HD2  ASN  28          2HD2      ASN  28  -3.888  -5.356  -4.133
  112    H    CYS  29           H        CYS  29   1.617  -5.217  -1.802
  113    HA   CYS  29           HA       CYS  29   0.356  -2.846  -2.993
  114   1HB   CYS  29          2HB       CYS  29   1.432  -2.930  -0.676
  115   2HB   CYS  29          3HB       CYS  29   3.002  -3.038  -1.510
  116    H    SER  30           H        SER  30   1.885  -1.277  -4.259
  117    HA   SER  30           HA       SER  30   4.138  -2.304  -5.487
  118   1HB   SER  30          2HB       SER  30   2.437  -3.811  -6.590
  119   2HB   SER  30          3HB       SER  30   1.662  -2.395  -7.269
  120    HG   SER  30           HG       SER  30   3.036  -2.674  -8.889
  121    H    CYS  31           H        CYS  31   3.144   0.110  -4.199
  122    HA   CYS  31           HA       CYS  31   2.607   2.014  -6.261
  123   1HB   CYS  31          2HB       CYS  31   2.332   3.580  -4.571
  124   2HB   CYS  31          3HB       CYS  31   1.739   2.085  -3.875
  125    H    LYS  32           H        LYS  32   5.325   1.185  -4.000
  126    HA   LYS  32           HA       LYS  32   7.355   1.479  -5.776
  127   1HB   LYS  32          2HB       LYS  32   6.977   3.711  -6.297
  128   2HB   LYS  32          3HB       LYS  32   6.487   4.132  -4.668
  129   1HG   LYS  32          2HG       LYS  32   9.255   3.085  -4.811
  130   2HG   LYS  32          3HG       LYS  32   9.025   4.541  -5.757
  131   1HD   LYS  32          2HD       LYS  32   7.845   5.515  -3.643
  132   2HD   LYS  32          3HD       LYS  32   8.533   4.155  -2.779
  133   1HE   LYS  32          2HE       LYS  32  10.806   4.930  -3.918
  134   2HE   LYS  32          3HE       LYS  32   9.968   6.454  -4.134
  135   1HZ   LYS  32          1HZ       LYS  32   9.497   5.626  -1.547
  136   2HZ   LYS  32          2HZ       LYS  32  11.096   5.424  -1.808
  137   3HZ   LYS  32          3HZ       LYS  32  10.409   6.888  -2.039
  138    H    SER  33           H        SER  33   9.309   0.917  -4.792
  139    HA   SER  33           HA       SER  33  10.673   0.271  -3.229
  140   1HB   SER  33          2HB       SER  33   9.333   2.505  -1.987
  141   2HB   SER  33          3HB       SER  33   9.580   1.276  -0.764
  142    HG   SER  33           HG       SER  33  11.681   1.691  -0.760
  143    H    CYS  34           H        CYS  34   7.826  -0.922  -3.785
  144    HA   CYS  34           HA       CYS  34   7.931  -2.780  -1.528
  145   1HB   CYS  34          2HB       CYS  34   5.303  -2.173  -2.816
  146   2HB   CYS  34          3HB       CYS  34   5.648  -2.809  -1.220
  147    H    LYS  35           H        LYS  35   6.557  -2.149  -4.843
  148    HA   LYS  35           HA       LYS  35   7.518  -4.803  -5.610
  149   1HB   LYS  35          2HB       LYS  35   4.973  -4.639  -5.020
  150   2HB   LYS  35          3HB       LYS  35   4.839  -3.825  -6.567
  151   1HG   LYS  35          2HG       LYS  35   5.988  -5.776  -7.669
  152   2HG   LYS  35          3HG       LYS  35   6.059  -6.592  -6.119
  153   1HD   LYS  35          2HD       LYS  35   3.351  -5.598  -6.892
  154   2HD   LYS  35          3HD       LYS  35   3.992  -6.859  -7.925
  155   1HE   LYS  35          2HE       LYS  35   4.545  -7.603  -5.190
  156   2HE   LYS  35          3HE       LYS  35   2.864  -7.116  -5.280
  157   1HZ   LYS  35          1HZ       LYS  35   2.376  -8.864  -6.544
  158   2HZ   LYS  35          2HZ       LYS  35   3.731  -8.768  -7.449
  159   3HZ   LYS  35          3HZ       LYS  35   3.773  -9.505  -5.993
  Start of MODEL   16
    1    H    ASP   8           H        ASP   8  -8.770  -6.245  -6.649
    2    HA   ASP   8           HA       ASP   8  -9.534  -3.518  -6.027
    3   1HB   ASP   8          2HB       ASP   8 -10.465  -5.834  -4.985
    4   2HB   ASP   8          3HB       ASP   8  -9.095  -5.621  -3.914
    5    HA   PRO   9           HA       PRO   9  -5.354  -2.822  -4.850
    6   1HB   PRO   9          2HB       PRO   9  -5.632  -0.422  -3.576
    7   2HB   PRO   9          3HB       PRO   9  -5.515  -0.574  -5.317
    8   1HG   PRO   9          2HG       PRO   9  -7.899  -0.016  -3.659
    9   2HG   PRO   9          3HG       PRO   9  -7.671   0.243  -5.377
   10   1HD   PRO   9          2HD       PRO   9  -9.152  -1.881  -4.145
   11   2HD   PRO   9          3HD       PRO   9  -8.827  -1.685  -5.856
   12    H    CYS  10           H        CYS  10  -3.936  -2.185  -2.885
   13    HA   CYS  10           HA       CYS  10  -4.721  -4.041  -0.882
   14   1HB   CYS  10          2HB       CYS  10  -2.445  -4.039  -1.257
   15   2HB   CYS  10          3HB       CYS  10  -2.344  -2.294  -1.377
   16    H    GLU  11           H        GLU  11  -5.128  -3.505   1.396
   17    HA   GLU  11           HA       GLU  11  -6.566  -1.038   1.607
   18   1HB   GLU  11          2HB       GLU  11  -6.312  -3.550   3.250
   19   2HB   GLU  11          3HB       GLU  11  -6.874  -2.098   4.053
   20   1HG   GLU  11          2HG       GLU  11  -8.888  -3.048   3.287
   21   2HG   GLU  11          3HG       GLU  11  -8.538  -1.875   2.034
   22    H    CYS  12           H        CYS  12  -4.538   0.211   1.310
   23    HA   CYS  12           HA       CYS  12  -2.621   0.238   3.510
   24   1HB   CYS  12          2HB       CYS  12  -2.840   1.290   0.798
   25   2HB   CYS  12          3HB       CYS  12  -2.290   2.544   1.938
   26    H    SER  13           H        SER  13  -5.472   2.166   2.400
   27    HA   SER  13           HA       SER  13  -6.229   2.982   4.813
   28   1HB   SER  13          2HB       SER  13  -3.771   4.361   4.113
   29   2HB   SER  13          3HB       SER  13  -5.073   5.528   4.214
   30    HG   SER  13           HG       SER  13  -3.791   4.825   6.259
   31    H    LYS  14           H        LYS  14  -5.612   3.805   1.414
   32    HA   LYS  14           HA       LYS  14  -6.963   4.542  -0.176
   33   1HB   LYS  14          2HB       LYS  14  -9.212   4.498   1.858
   34   2HB   LYS  14          3HB       LYS  14  -9.374   4.572   0.115
   35   1HG   LYS  14          2HG       LYS  14  -7.936   2.353   0.133
   36   2HG   LYS  14          3HG       LYS  14  -8.398   2.260   1.820
   37   1HD   LYS  14          2HD       LYS  14 -10.758   2.193   1.272
   38   2HD   LYS  14          3HD       LYS  14 -10.456   2.646  -0.393
   39   1HE   LYS  14          2HE       LYS  14  -9.225   0.111   0.739
   40   2HE   LYS  14          3HE       LYS  14 -10.892   0.110   0.198
   41   1HZ   LYS  14          1HZ       LYS  14  -9.855   1.211  -1.881
   42   2HZ   LYS  14          2HZ       LYS  14  -8.476   0.505  -1.364
   43   3HZ   LYS  14          3HZ       LYS  14  -9.787  -0.410  -1.698
   44    H    SER  15           H        SER  15  -7.905   6.161   2.942
   45    HA   SER  15           HA       SER  15  -8.637   8.532   2.134
   46   1HB   SER  15          2HB       SER  15  -8.433   8.080   4.486
   47   2HB   SER  15          3HB       SER  15  -6.701   7.841   4.372
   48    HG   SER  15           HG       SER  15  -6.974   9.905   5.206
   49    H    GLY  16           H        GLY  16  -5.130   7.647   2.574
   50   1HA   GLY  16          1HA       GLY  16  -4.040   8.546   0.311
   51   2HA   GLY  16          2HA       GLY  16  -4.303  10.053   1.166
   52    H    THR  17           H        THR  17  -4.008   8.440   3.833
   53    HA   THR  17           HA       THR  17  -1.206   8.945   4.103
   54    HB   THR  17           HB       THR  17  -3.459   7.928   5.889
   55    HG1  THR  17           1HG      THR  17  -3.320  10.211   5.434
   56   1HG2  THR  17          1HG2      THR  17  -0.579   8.546   6.721
   57   2HG2  THR  17          2HG2      THR  17  -1.912   8.043   7.787
   58   3HG2  THR  17          3HG2      THR  17  -1.234   6.896   6.608
   59    H    CYS  18           H        CYS  18  -0.013   7.612   2.757
   60    HA   CYS  18           HA       CYS  18  -0.481   4.767   2.972
   61   1HB   CYS  18          2HB       CYS  18   0.547   6.512   0.977
   62   2HB   CYS  18          3HB       CYS  18   1.835   5.407   1.414
   63    H    ASN  19           H        ASN  19   0.950   3.332   4.028
   64    HA   ASN  19           HA       ASN  19   2.825   4.655   5.776
   65   1HB   ASN  19          2HB       ASN  19   1.061   2.797   6.438
   66   2HB   ASN  19          3HB       ASN  19   2.213   1.671   5.749
   67   1HD2  ASN  19          1HD2      ASN  19   1.302   3.446   8.451
   68   2HD2  ASN  19          2HD2      ASN  19   2.696   3.216   9.452
   69    H    CYS  20           H        CYS  20   3.183   4.195   2.822
   70    HA   CYS  20           HA       CYS  20   5.526   2.357   2.836
   71   1HB   CYS  20          2HB       CYS  20   4.017   3.428   0.425
   72   2HB   CYS  20          3HB       CYS  20   5.163   2.064   0.489
   73    H    GLY  21           H        GLY  21   5.768   5.009   4.004
   74   1HA   GLY  21          1HA       GLY  21   7.232   6.443   1.877
   75   2HA   GLY  21          2HA       GLY  21   6.527   7.173   3.305
   76    H    GLY  22           H        GLY  22   8.184   4.027   3.489
   77   1HA   GLY  22          1HA       GLY  22  10.785   4.922   4.032
   78   2HA   GLY  22          2HA       GLY  22   9.907   4.857   5.547
   79    H    SER  23           H        SER  23   8.128   2.653   4.964
   80    HA   SER  23           HA       SER  23   9.713   0.478   4.075
   81   1HB   SER  23          2HB       SER  23   9.824   1.183   6.870
   82   2HB   SER  23          3HB       SER  23   8.940  -0.323   6.731
   83    HG   SER  23           HG       SER  23  11.138  -0.846   6.890
   84    H    CYS  24           H        CYS  24   8.344  -1.167   3.358
   85    HA   CYS  24           HA       CYS  24   5.526  -0.652   3.687
   86   1HB   CYS  24          2HB       CYS  24   6.612  -1.186   1.476
   87   2HB   CYS  24          3HB       CYS  24   6.864  -2.820   2.059
   88    H    THR  25           H        THR  25   4.056  -2.164   4.667
   89    HA   THR  25           HA       THR  25   5.379  -4.291   6.220
   90    HB   THR  25           HB       THR  25   4.647  -2.263   7.565
   91    HG1  THR  25           1HG      THR  25   4.643  -4.390   8.525
   92   1HG2  THR  25          1HG2      THR  25   2.613  -1.364   6.967
   93   2HG2  THR  25          2HG2      THR  25   2.120  -2.845   6.109
   94   3HG2  THR  25          3HG2      THR  25   1.919  -2.730   7.874
   95    H    CYS  26           H        CYS  26   3.031  -3.416   3.846
   96    HA   CYS  26           HA       CYS  26   1.482  -5.815   4.341
   97   1HB   CYS  26          2HB       CYS  26   0.675  -4.525   1.944
   98   2HB   CYS  26          3HB       CYS  26  -0.184  -4.664   3.464
   99    H    THR  27           H        THR  27   1.528  -7.626   2.932
  100    HA   THR  27           HA       THR  27   3.875  -7.747   1.218
  101    HB   THR  27           HB       THR  27   2.845  -9.483   3.040
  102    HG1  THR  27           1HG      THR  27   3.881 -10.285   0.423
  103   1HG2  THR  27          1HG2      THR  27   1.724 -10.321   0.314
  104   2HG2  THR  27          2HG2      THR  27   1.830 -11.380   1.741
  105   3HG2  THR  27          3HG2      THR  27   0.760  -9.959   1.766
  106    H    ASN  28           H        ASN  28   0.290  -8.013   0.994
  107    HA   ASN  28           HA       ASN  28   0.531  -8.345  -1.842
  108   1HB   ASN  28          2HB       ASN  28  -1.957  -8.492  -1.778
  109   2HB   ASN  28          3HB       ASN  28  -1.248  -9.557  -0.580
  110   1HD2  ASN  28          1HD2      ASN  28  -1.520  -9.196   1.563
  111   2HD2  ASN  28          2HD2      ASN  28  -2.565  -7.989   2.234
  112    H    CYS  29           H        CYS  29   1.711  -6.001  -1.122
  113    HA   CYS  29           HA       CYS  29  -0.253  -3.810  -1.419
  114   1HB   CYS  29          2HB       CYS  29   1.743  -3.909   0.280
  115   2HB   CYS  29          3HB       CYS  29   2.734  -3.468  -1.134
  116    H    SER  30           H        SER  30   0.595  -1.927  -2.965
  117    HA   SER  30           HA       SER  30   2.247  -2.659  -5.073
  118   1HB   SER  30          2HB       SER  30   0.087  -4.091  -5.467
  119   2HB   SER  30          3HB       SER  30  -0.658  -2.578  -5.944
  120    HG   SER  30           HG       SER  30   0.722  -4.152  -7.518
  121    H    CYS  31           H        CYS  31   2.374  -0.456  -3.564
  122    HA   CYS  31           HA       CYS  31   0.875   1.621  -4.965
  123   1HB   CYS  31          2HB       CYS  31   2.532   2.102  -2.510
  124   2HB   CYS  31          3HB       CYS  31   1.163   3.008  -3.120
  125    H    LYS  32           H        LYS  32   4.134   1.410  -3.353
  126    HA   LYS  32           HA       LYS  32   5.650   1.539  -5.663
  127   1HB   LYS  32          2HB       LYS  32   4.317   3.890  -5.505
  128   2HB   LYS  32          3HB       LYS  32   5.725   4.291  -4.542
  129   1HG   LYS  32          2HG       LYS  32   7.220   3.984  -6.331
  130   2HG   LYS  32          3HG       LYS  32   6.167   2.856  -7.161
  131   1HD   LYS  32          2HD       LYS  32   5.283   5.734  -6.803
  132   2HD   LYS  32          3HD       LYS  32   6.433   5.337  -8.065
  133   1HE   LYS  32          2HE       LYS  32   4.822   4.393  -9.375
  134   2HE   LYS  32          3HE       LYS  32   4.193   3.436  -8.049
  135   1HZ   LYS  32          1HZ       LYS  32   3.584   6.159  -7.693
  136   2HZ   LYS  32          2HZ       LYS  32   3.044   5.645  -9.147
  137   3HZ   LYS  32          3HZ       LYS  32   2.572   4.880  -7.782
  138    H    SER  33           H        SER  33   7.795   1.190  -5.130
  139    HA   SER  33           HA       SER  33   9.604   1.056  -3.902
  140   1HB   SER  33          2HB       SER  33   8.298   3.152  -2.582
  141   2HB   SER  33          3HB       SER  33   8.608   2.007  -1.292
  142    HG   SER  33           HG       SER  33  10.526   3.219  -3.082
  143    H    CYS  34           H        CYS  34   6.836  -0.571  -3.687
  144    HA   CYS  34           HA       CYS  34   7.615  -2.155  -1.357
  145   1HB   CYS  34          2HB       CYS  34   5.054  -2.741  -2.700
  146   2HB   CYS  34          3HB       CYS  34   5.451  -2.674  -0.995
  147    H    LYS  35           H        LYS  35   6.412  -2.407  -4.784
  148    HA   LYS  35           HA       LYS  35   8.177  -4.708  -5.116
  149   1HB   LYS  35          2HB       LYS  35   5.216  -4.670  -5.761
  150   2HB   LYS  35          3HB       LYS  35   6.334  -5.868  -6.380
  151   1HG   LYS  35          2HG       LYS  35   6.567  -6.920  -4.336
  152   2HG   LYS  35          3HG       LYS  35   6.472  -5.423  -3.429
  153   1HD   LYS  35          2HD       LYS  35   4.304  -5.867  -2.948
  154   2HD   LYS  35          3HD       LYS  35   3.912  -5.761  -4.653
  155   1HE   LYS  35          2HE       LYS  35   4.849  -8.243  -4.751
  156   2HE   LYS  35          3HE       LYS  35   4.585  -8.226  -3.018
  157   1HZ   LYS  35          1HZ       LYS  35   2.532  -8.789  -3.601
  158   2HZ   LYS  35          2HZ       LYS  35   2.305  -7.205  -3.934
  159   3HZ   LYS  35          3HZ       LYS  35   2.668  -8.249  -5.136
  Start of MODEL   17
    1    H    ASP   8           H        ASP   8 -10.718  -4.489  -4.573
    2    HA   ASP   8           HA       ASP   8 -11.085  -2.215  -2.826
    3   1HB   ASP   8          2HB       ASP   8 -11.869  -4.777  -2.046
    4   2HB   ASP   8          3HB       ASP   8 -10.236  -4.688  -1.420
    5    HA   PRO   9           HA       PRO   9  -6.738  -2.398  -3.587
    6   1HB   PRO   9          2HB       PRO   9  -6.014  -0.113  -2.275
    7   2HB   PRO   9          3HB       PRO   9  -6.612  -0.123  -3.923
    8   1HG   PRO   9          2HG       PRO   9  -8.007   0.700  -1.449
    9   2HG   PRO   9          3HG       PRO   9  -8.412   1.071  -3.113
   10   1HD   PRO   9          2HD       PRO   9  -9.697  -0.858  -1.423
   11   2HD   PRO   9          3HD       PRO   9 -10.024  -0.567  -3.120
   12    H    CYS  10           H        CYS  10  -4.590  -2.394  -2.427
   13    HA   CYS  10           HA       CYS  10  -4.958  -4.125  -0.199
   14   1HB   CYS  10          2HB       CYS  10  -2.411  -3.982  -0.126
   15   2HB   CYS  10          3HB       CYS  10  -3.161  -4.720  -1.527
   16    H    GLU  11           H        GLU  11  -3.953  -3.684   1.976
   17    HA   GLU  11           HA       GLU  11  -4.762  -1.172   2.895
   18   1HB   GLU  11          2HB       GLU  11  -3.373  -3.565   4.099
   19   2HB   GLU  11          3HB       GLU  11  -3.407  -2.071   5.013
   20   1HG   GLU  11          2HG       GLU  11  -5.378  -3.148   5.732
   21   2HG   GLU  11          3HG       GLU  11  -5.978  -2.047   4.507
   22    H    CYS  12           H        CYS  12  -3.521   0.184   1.436
   23    HA   CYS  12           HA       CYS  12  -0.639   0.288   1.598
   24   1HB   CYS  12          2HB       CYS  12  -2.844   1.750   0.239
   25   2HB   CYS  12          3HB       CYS  12  -1.382   2.710   0.583
   26    H    SER  13           H        SER  13  -3.046   2.900   2.479
   27    HA   SER  13           HA       SER  13  -1.283   3.404   4.748
   28   1HB   SER  13          2HB       SER  13  -1.204   5.200   3.026
   29   2HB   SER  13          3HB       SER  13  -2.941   5.403   3.149
   30    HG   SER  13           HG       SER  13  -1.022   5.832   5.277
   31    H    LYS  14           H        LYS  14  -4.600   3.103   3.471
   32    HA   LYS  14           HA       LYS  14  -6.444   2.459   4.561
   33   1HB   LYS  14          2HB       LYS  14  -4.784   1.545   6.332
   34   2HB   LYS  14          3HB       LYS  14  -5.189   2.980   7.251
   35   1HG   LYS  14          2HG       LYS  14  -7.187   2.105   7.881
   36   2HG   LYS  14          3HG       LYS  14  -7.629   1.769   6.219
   37   1HD   LYS  14          2HD       LYS  14  -5.864  -0.243   6.526
   38   2HD   LYS  14          3HD       LYS  14  -6.256  -0.022   8.219
   39   1HE   LYS  14          2HE       LYS  14  -8.011  -1.425   7.768
   40   2HE   LYS  14          3HE       LYS  14  -8.782   0.016   7.135
   41   1HZ   LYS  14          1HZ       LYS  14  -7.644  -2.207   5.715
   42   2HZ   LYS  14          2HZ       LYS  14  -8.899  -1.244   5.311
   43   3HZ   LYS  14          3HZ       LYS  14  -7.367  -0.743   5.045
   44    H    SER  15           H        SER  15  -4.742   5.167   6.287
   45    HA   SER  15           HA       SER  15  -6.805   6.593   7.119
   46   1HB   SER  15          2HB       SER  15  -5.400   8.663   6.588
   47   2HB   SER  15          3HB       SER  15  -4.595   7.411   7.511
   48    HG   SER  15           HG       SER  15  -3.945   6.646   5.170
   49    H    GLY  16           H        GLY  16  -5.519   6.560   3.733
   50   1HA   GLY  16          1HA       GLY  16  -7.786   6.656   2.321
   51   2HA   GLY  16          2HA       GLY  16  -7.634   8.330   2.818
   52    H    THR  17           H        THR  17  -4.556   7.990   2.896
   53    HA   THR  17           HA       THR  17  -4.116   7.950  -0.015
   54    HB   THR  17           HB       THR  17  -4.281  10.284   1.153
   55    HG1  THR  17           1HG      THR  17  -2.226  10.814  -0.097
   56   1HG2  THR  17          1HG2      THR  17  -2.587   9.301   3.028
   57   2HG2  THR  17          2HG2      THR  17  -1.380   9.826   1.829
   58   3HG2  THR  17          3HG2      THR  17  -2.524  11.005   2.514
   59    H    CYS  18           H        CYS  18  -2.773   6.373  -0.590
   60    HA   CYS  18           HA       CYS  18  -1.538   4.644   1.006
   61   1HB   CYS  18          2HB       CYS  18  -1.292   3.956  -1.113
   62   2HB   CYS  18          3HB       CYS  18  -1.103   5.581  -1.742
   63    H    ASN  19           H        ASN  19   0.596   4.427   1.975
   64    HA   ASN  19           HA       ASN  19   2.269   6.753   1.939
   65   1HB   ASN  19          2HB       ASN  19   0.502   6.949   3.873
   66   2HB   ASN  19          3HB       ASN  19   1.383   5.643   4.639
   67   1HD2  ASN  19          1HD2      ASN  19   1.228   7.910   5.983
   68   2HD2  ASN  19          2HD2      ASN  19   2.723   8.787   6.001
   69    H    CYS  20           H        CYS  20   3.060   4.605   0.758
   70    HA   CYS  20           HA       CYS  20   4.156   2.543   2.501
   71   1HB   CYS  20          2HB       CYS  20   4.203   3.140  -0.467
   72   2HB   CYS  20          3HB       CYS  20   5.243   1.874   0.234
   73    H    GLY  21           H        GLY  21   5.013   5.685   2.311
   74   1HA   GLY  21          1HA       GLY  21   7.730   5.641   1.560
   75   2HA   GLY  21          2HA       GLY  21   6.930   6.835   2.561
   76    H    GLY  22           H        GLY  22   5.993   4.968   4.642
   77   1HA   GLY  22          1HA       GLY  22   8.585   4.517   5.969
   78   2HA   GLY  22          2HA       GLY  22   7.048   4.812   6.757
   79    H    SER  23           H        SER  23   8.651   2.457   4.503
   80    HA   SER  23           HA       SER  23   8.642   0.286   4.443
   81   1HB   SER  23          2HB       SER  23   8.263   0.824   7.221
   82   2HB   SER  23          3HB       SER  23   7.157  -0.477   6.824
   83    HG   SER  23           HG       SER  23   9.010  -1.579   7.240
   84    H    CYS  24           H        CYS  24   7.123  -1.669   4.175
   85    HA   CYS  24           HA       CYS  24   4.477  -0.650   3.458
   86   1HB   CYS  24          2HB       CYS  24   6.038  -1.592   1.674
   87   2HB   CYS  24          3HB       CYS  24   5.773  -3.163   2.405
   88    H    THR  25           H        THR  25   2.617  -1.797   4.207
   89    HA   THR  25           HA       THR  25   3.202  -3.913   6.173
   90    HB   THR  25           HB       THR  25   1.242  -2.970   7.434
   91    HG1  THR  25           1HG      THR  25   0.070  -1.925   5.791
   92   1HG2  THR  25          1HG2      THR  25   3.104  -0.664   6.698
   93   2HG2  THR  25          2HG2      THR  25   2.276  -0.949   8.247
   94   3HG2  THR  25          3HG2      THR  25   3.632  -1.992   7.759
   95    H    CYS  26           H        CYS  26   1.591  -2.976   3.256
   96    HA   CYS  26           HA       CYS  26  -0.304  -5.166   3.532
   97   1HB   CYS  26          2HB       CYS  26  -1.017  -4.230   1.207
   98   2HB   CYS  26          3HB       CYS  26  -1.487  -3.413   2.685
   99    H    THR  27           H        THR  27  -0.504  -6.625   1.502
  100    HA   THR  27           HA       THR  27   2.209  -7.205   0.515
  101    HB   THR  27           HB       THR  27   0.662  -8.811   2.055
  102    HG1  THR  27           1HG      THR  27   2.819  -9.183   1.056
  103   1HG2  THR  27          1HG2      THR  27  -1.128  -8.795   0.138
  104   2HG2  THR  27          2HG2      THR  27   0.052  -9.767  -0.774
  105   3HG2  THR  27          3HG2      THR  27  -0.608 -10.378   0.762
  106    H    ASN  28           H        ASN  28   1.835  -8.746  -1.621
  107    HA   ASN  28           HA       ASN  28   1.659  -8.440  -3.785
  108   1HB   ASN  28          2HB       ASN  28  -0.665  -8.574  -4.627
  109   2HB   ASN  28          3HB       ASN  28  -0.501  -9.574  -3.197
  110   1HD2  ASN  28          1HD2      ASN  28  -2.203  -9.472  -1.964
  111   2HD2  ASN  28          2HD2      ASN  28  -3.153  -8.074  -1.587
  112    H    CYS  29           H        CYS  29   2.229  -6.008  -2.286
  113    HA   CYS  29           HA       CYS  29   0.671  -3.838  -3.476
  114   1HB   CYS  29          2HB       CYS  29   1.775  -3.942  -1.115
  115   2HB   CYS  29          3HB       CYS  29   3.281  -3.539  -1.977
  116    H    SER  30           H        SER  30   2.059  -1.941  -4.527
  117    HA   SER  30           HA       SER  30   4.418  -2.711  -5.817
  118   1HB   SER  30          2HB       SER  30   2.604  -4.020  -7.112
  119   2HB   SER  30          3HB       SER  30   2.033  -2.468  -7.691
  120    HG   SER  30           HG       SER  30   4.335  -3.918  -8.400
  121    H    CYS  31           H        CYS  31   4.368  -0.584  -4.390
  122    HA   CYS  31           HA       CYS  31   3.440   1.645  -6.036
  123   1HB   CYS  31          2HB       CYS  31   4.143   1.500  -3.099
  124   2HB   CYS  31          3HB       CYS  31   3.791   2.992  -3.950
  125    H    LYS  32           H        LYS  32   6.001   1.608  -3.507
  126    HA   LYS  32           HA       LYS  32   8.196   1.384  -5.202
  127   1HB   LYS  32          2HB       LYS  32   8.896   3.589  -5.625
  128   2HB   LYS  32          3HB       LYS  32   7.212   3.538  -6.105
  129   1HG   LYS  32          2HG       LYS  32   6.809   5.278  -4.711
  130   2HG   LYS  32          3HG       LYS  32   7.152   4.224  -3.355
  131   1HD   LYS  32          2HD       LYS  32   9.251   5.108  -3.016
  132   2HD   LYS  32          3HD       LYS  32   9.579   5.259  -4.731
  133   1HE   LYS  32          2HE       LYS  32   7.656   7.162  -4.532
  134   2HE   LYS  32          3HE       LYS  32   8.229   7.204  -2.875
  135   1HZ   LYS  32          1HZ       LYS  32  10.003   8.287  -3.551
  136   2HZ   LYS  32          2HZ       LYS  32  10.414   7.118  -4.614
  137   3HZ   LYS  32          3HZ       LYS  32   9.421   8.330  -5.078
  138    H    SER  33           H        SER  33  10.079   1.213  -3.976
  139    HA   SER  33           HA       SER  33  11.366   1.185  -2.217
  140   1HB   SER  33          2HB       SER  33   9.667   3.437  -1.628
  141   2HB   SER  33          3HB       SER  33   9.902   2.543  -0.139
  142    HG   SER  33           HG       SER  33  12.255   2.607  -0.623
  143    H    CYS  34           H        CYS  34   8.560  -0.327  -2.635
  144    HA   CYS  34           HA       CYS  34   8.777  -1.750  -0.089
  145   1HB   CYS  34          2HB       CYS  34   6.317  -2.168  -0.221
  146   2HB   CYS  34          3HB       CYS  34   6.785  -0.525   0.170
  147    H    LYS  35           H        LYS  35   7.611  -1.737  -3.527
  148    HA   LYS  35           HA       LYS  35   8.621  -4.470  -3.755
  149   1HB   LYS  35          2HB       LYS  35   6.060  -4.311  -3.350
  150   2HB   LYS  35          3HB       LYS  35   5.980  -3.704  -4.990
  151   1HG   LYS  35          2HG       LYS  35   7.692  -5.947  -5.165
  152   2HG   LYS  35          3HG       LYS  35   6.439  -6.448  -4.046
  153   1HD   LYS  35          2HD       LYS  35   4.740  -6.281  -5.640
  154   2HD   LYS  35          3HD       LYS  35   5.549  -5.010  -6.535
  155   1HE   LYS  35          2HE       LYS  35   6.605  -7.871  -6.446
  156   2HE   LYS  35          3HE       LYS  35   5.467  -7.328  -7.663
  157   1HZ   LYS  35          1HZ       LYS  35   7.082  -5.566  -8.203
  158   2HZ   LYS  35          2HZ       LYS  35   8.155  -6.252  -7.181
  159   3HZ   LYS  35          3HZ       LYS  35   7.643  -7.072  -8.497
  Start of MODEL   18
    1    H    ASP   8           H        ASP   8  -9.492   0.792  -5.002
    2    HA   ASP   8           HA       ASP   8  -7.845  -1.259  -5.588
    3   1HB   ASP   8          2HB       ASP   8  -7.422   1.280  -5.692
    4   2HB   ASP   8          3HB       ASP   8  -7.002   1.202  -3.993
    5    HA   PRO   9           HA       PRO   9  -7.272  -3.157  -1.658
    6   1HB   PRO   9          2HB       PRO   9  -5.281  -4.913  -2.305
    7   2HB   PRO   9          3HB       PRO   9  -6.977  -5.230  -2.615
    8   1HG   PRO   9          2HG       PRO   9  -4.856  -4.464  -4.525
    9   2HG   PRO   9          3HG       PRO   9  -6.417  -5.187  -4.852
   10   1HD   PRO   9          2HD       PRO   9  -5.684  -2.439  -5.231
   11   2HD   PRO   9          3HD       PRO   9  -7.277  -3.140  -5.448
   12    H    CYS  10           H        CYS  10  -5.608  -3.655   0.058
   13    HA   CYS  10           HA       CYS  10  -3.746  -3.117   1.152
   14   1HB   CYS  10          2HB       CYS  10  -2.913  -2.513  -1.404
   15   2HB   CYS  10          3HB       CYS  10  -2.716  -0.980  -0.575
   16    H    GLU  11           H        GLU  11  -3.443  -1.525   2.810
   17    HA   GLU  11           HA       GLU  11  -5.590   0.250   3.086
   18   1HB   GLU  11          2HB       GLU  11  -3.051  -0.290   4.646
   19   2HB   GLU  11          3HB       GLU  11  -4.074   1.064   5.086
   20   1HG   GLU  11          2HG       GLU  11  -5.375  -1.629   4.669
   21   2HG   GLU  11          3HG       GLU  11  -4.454  -1.375   6.138
   22    H    CYS  12           H        CYS  12  -2.741   0.411   1.324
   23    HA   CYS  12           HA       CYS  12  -1.887   3.092   1.648
   24   1HB   CYS  12          2HB       CYS  12  -1.768   1.127  -0.665
   25   2HB   CYS  12          3HB       CYS  12  -1.016   2.742  -0.732
   26    H    SER  13           H        SER  13  -4.101   1.670  -0.906
   27    HA   SER  13           HA       SER  13  -4.854   4.354  -1.577
   28   1HB   SER  13          2HB       SER  13  -5.395   1.607  -2.711
   29   2HB   SER  13          3HB       SER  13  -6.453   2.930  -3.164
   30    HG   SER  13           HG       SER  13  -3.600   2.723  -3.573
   31    H    LYS  14           H        LYS  14  -6.102   1.502   0.163
   32    HA   LYS  14           HA       LYS  14  -8.788   2.340   0.276
   33   1HB   LYS  14          2HB       LYS  14  -8.394   0.058   0.639
   34   2HB   LYS  14          3HB       LYS  14  -7.104   0.353   1.787
   35   1HG   LYS  14          2HG       LYS  14  -8.551   0.571   3.545
   36   2HG   LYS  14          3HG       LYS  14  -9.659   1.575   2.630
   37   1HD   LYS  14          2HD       LYS  14 -10.923  -0.386   3.028
   38   2HD   LYS  14          3HD       LYS  14 -10.341  -0.618   1.391
   39   1HE   LYS  14          2HE       LYS  14  -9.508  -2.612   2.103
   40   2HE   LYS  14          3HE       LYS  14  -8.265  -1.691   2.926
   41   1HZ   LYS  14          1HZ       LYS  14  -9.232  -2.958   4.568
   42   2HZ   LYS  14          2HZ       LYS  14  -9.971  -1.516   4.775
   43   3HZ   LYS  14          3HZ       LYS  14 -10.759  -2.736   4.030
   44    H    SER  15           H        SER  15  -6.466   2.162   3.060
   45    HA   SER  15           HA       SER  15  -7.823   3.736   4.735
   46   1HB   SER  15          2HB       SER  15  -5.909   3.733   6.021
   47   2HB   SER  15          3HB       SER  15  -5.435   2.516   4.853
   48    HG   SER  15           HG       SER  15  -3.787   3.784   4.376
   49    H    GLY  16           H        GLY  16  -5.390   4.832   2.269
   50   1HA   GLY  16          1HA       GLY  16  -6.079   6.830   1.010
   51   2HA   GLY  16          2HA       GLY  16  -6.499   7.562   2.545
   52    H    THR  17           H        THR  17  -4.503   7.197   4.275
   53    HA   THR  17           HA       THR  17  -2.275   8.552   2.979
   54    HB   THR  17           HB       THR  17  -3.196   8.097   5.857
   55    HG1  THR  17           1HG      THR  17  -4.080   9.753   4.240
   56   1HG2  THR  17          1HG2      THR  17  -0.694   9.525   4.809
   57   2HG2  THR  17          2HG2      THR  17  -1.340   9.703   6.458
   58   3HG2  THR  17          3HG2      THR  17  -0.717   8.127   5.910
   59    H    CYS  18           H        CYS  18  -1.307   6.878   1.771
   60    HA   CYS  18           HA       CYS  18  -0.736   4.373   2.660
   61   1HB   CYS  18          2HB       CYS  18  -0.147   4.459   0.510
   62   2HB   CYS  18          3HB       CYS  18   0.259   6.163   0.577
   63    H    ASN  19           H        ASN  19   0.091   3.974   4.707
   64    HA   ASN  19           HA       ASN  19   2.215   5.699   5.632
   65   1HB   ASN  19          2HB       ASN  19   0.302   5.166   7.166
   66   2HB   ASN  19          3HB       ASN  19   0.672   3.457   7.041
   67   1HD2  ASN  19          1HD2      ASN  19   1.811   6.588   8.147
   68   2HD2  ASN  19          2HD2      ASN  19   2.949   6.028   9.327
   69    H    CYS  20           H        CYS  20   2.405   3.600   3.475
   70    HA   CYS  20           HA       CYS  20   4.179   1.575   4.714
   71   1HB   CYS  20          2HB       CYS  20   3.312   0.214   3.148
   72   2HB   CYS  20          3HB       CYS  20   2.271   1.551   2.597
   73    H    GLY  21           H        GLY  21   4.359   4.693   3.297
   74   1HA   GLY  21          1HA       GLY  21   6.433   4.627   1.528
   75   2HA   GLY  21          2HA       GLY  21   6.153   5.910   2.686
   76    H    GLY  22           H        GLY  22   8.159   3.199   1.800
   77   1HA   GLY  22          1HA       GLY  22  10.415   3.199   2.579
   78   2HA   GLY  22          2HA       GLY  22   9.860   3.730   4.154
   79    H    SER  23           H        SER  23   9.839   2.169   5.705
   80    HA   SER  23           HA       SER  23  10.343  -0.466   5.124
   81   1HB   SER  23          2HB       SER  23   9.897   1.164   7.456
   82   2HB   SER  23          3HB       SER  23   8.940  -0.292   7.637
   83    HG   SER  23           HG       SER  23  11.548  -0.039   8.084
   84    H    CYS  24           H        CYS  24   8.845  -1.197   3.488
   85    HA   CYS  24           HA       CYS  24   6.099  -0.948   3.676
   86   1HB   CYS  24          2HB       CYS  24   7.528  -1.649   1.688
   87   2HB   CYS  24          3HB       CYS  24   7.533  -3.263   2.374
   88    H    THR  25           H        THR  25   4.488  -2.215   4.680
   89    HA   THR  25           HA       THR  25   5.385  -4.590   6.141
   90    HB   THR  25           HB       THR  25   4.029  -3.681   8.125
   91    HG1  THR  25           1HG      THR  25   2.861  -2.029   7.018
   92   1HG2  THR  25          1HG2      THR  25   5.735  -1.712   8.581
   93   2HG2  THR  25          2HG2      THR  25   6.361  -3.375   8.496
   94   3HG2  THR  25          3HG2      THR  25   6.531  -2.288   7.096
   95    H    CYS  26           H        CYS  26   2.689  -2.552   4.906
   96    HA   CYS  26           HA       CYS  26   0.616  -4.238   5.367
   97   1HB   CYS  26          2HB       CYS  26  -0.217  -3.292   3.062
   98   2HB   CYS  26          3HB       CYS  26  -0.098  -2.278   4.487
   99    H    THR  27           H        THR  27  -0.557  -5.647   3.634
  100    HA   THR  27           HA       THR  27   1.470  -7.366   2.385
  101    HB   THR  27           HB       THR  27  -1.398  -7.835   3.350
  102    HG1  THR  27           1HG      THR  27   1.297  -8.784   4.031
  103   1HG2  THR  27          1HG2      THR  27  -1.424  -9.741   2.091
  104   2HG2  THR  27          2HG2      THR  27   0.152  -9.311   1.388
  105   3HG2  THR  27          3HG2      THR  27   0.079 -10.261   2.891
  106    H    ASN  28           H        ASN  28   1.208  -8.149   0.244
  107    HA   ASN  28           HA       ASN  28   0.947  -7.729  -1.882
  108   1HB   ASN  28          2HB       ASN  28  -1.934  -7.532  -0.883
  109   2HB   ASN  28          3HB       ASN  28  -1.553  -7.500  -2.593
  110   1HD2  ASN  28          1HD2      ASN  28  -2.345  -9.413  -0.020
  111   2HD2  ASN  28          2HD2      ASN  28  -1.839 -10.966  -0.593
  112    H    CYS  29           H        CYS  29   2.109  -5.651  -1.628
  113    HA   CYS  29           HA       CYS  29   0.437  -3.211  -1.663
  114   1HB   CYS  29          2HB       CYS  29   2.628  -3.615  -0.262
  115   2HB   CYS  29          3HB       CYS  29   3.451  -3.258  -1.802
  116    H    SER  30           H        SER  30   1.299  -1.441  -3.323
  117    HA   SER  30           HA       SER  30   2.197  -2.716  -5.748
  118   1HB   SER  30          2HB       SER  30  -0.183  -2.892  -6.058
  119   2HB   SER  30          3HB       SER  30  -0.462  -1.272  -5.451
  120    HG   SER  30           HG       SER  30   1.273  -1.388  -7.664
  121    H    CYS  31           H        CYS  31   2.989  -0.640  -3.558
  122    HA   CYS  31           HA       CYS  31   3.041   1.834  -4.972
  123   1HB   CYS  31          2HB       CYS  31   4.162   0.850  -2.366
  124   2HB   CYS  31          3HB       CYS  31   4.704   2.375  -3.037
  125    H    LYS  32           H        LYS  32   4.912   2.808  -5.960
  126    HA   LYS  32           HA       LYS  32   6.882   0.835  -6.806
  127   1HB   LYS  32          2HB       LYS  32   7.279   2.207  -8.667
  128   2HB   LYS  32          3HB       LYS  32   5.543   2.260  -8.436
  129   1HG   LYS  32          2HG       LYS  32   5.724   4.433  -7.271
  130   2HG   LYS  32          3HG       LYS  32   7.473   4.365  -7.350
  131   1HD   LYS  32          2HD       LYS  32   7.446   4.523  -9.786
  132   2HD   LYS  32          3HD       LYS  32   5.707   4.321  -9.838
  133   1HE   LYS  32          2HE       LYS  32   6.519   6.565  -8.094
  134   2HE   LYS  32          3HE       LYS  32   7.083   6.766  -9.742
  135   1HZ   LYS  32          1HZ       LYS  32   4.393   6.726  -8.738
  136   2HZ   LYS  32          2HZ       LYS  32   5.019   7.533 -10.012
  137   3HZ   LYS  32          3HZ       LYS  32   4.608   5.961 -10.163
  138    H    SER  33           H        SER  33   6.443   3.054  -4.323
  139    HA   SER  33           HA       SER  33   9.207   3.899  -4.350
  140   1HB   SER  33          2HB       SER  33   6.723   4.981  -3.332
  141   2HB   SER  33          3HB       SER  33   7.840   4.802  -1.994
  142    HG   SER  33           HG       SER  33   9.343   6.140  -3.022
  143    H    CYS  34           H        CYS  34   7.971   1.069  -3.742
  144    HA   CYS  34           HA       CYS  34   9.617   0.656  -1.385
  145   1HB   CYS  34          2HB       CYS  34   7.985  -0.652  -0.232
  146   2HB   CYS  34          3HB       CYS  34   7.325   0.943  -0.543
  147    H    LYS  35           H        LYS  35   7.510  -0.745  -3.986
  148    HA   LYS  35           HA       LYS  35   9.258  -3.079  -4.073
  149   1HB   LYS  35          2HB       LYS  35   6.457  -2.649  -4.418
  150   2HB   LYS  35          3HB       LYS  35   7.096  -3.216  -5.947
  151   1HG   LYS  35          2HG       LYS  35   6.393  -5.070  -4.365
  152   2HG   LYS  35          3HG       LYS  35   8.048  -5.197  -4.926
  153   1HD   LYS  35          2HD       LYS  35   8.886  -4.969  -2.821
  154   2HD   LYS  35          3HD       LYS  35   7.893  -3.563  -2.494
  155   1HE   LYS  35          2HE       LYS  35   6.178  -4.812  -1.540
  156   2HE   LYS  35          3HE       LYS  35   6.463  -6.200  -2.570
  157   1HZ   LYS  35          1HZ       LYS  35   8.500  -5.474  -0.629
  158   2HZ   LYS  35          2HZ       LYS  35   7.155  -6.239  -0.103
  159   3HZ   LYS  35          3HZ       LYS  35   8.112  -6.947  -1.220
  Start of MODEL   19
    1    H    ASP   8           H        ASP   8  -9.093  -8.716  -3.270
    2    HA   ASP   8           HA       ASP   8 -10.187  -6.021  -3.484
    3   1HB   ASP   8          2HB       ASP   8 -10.661  -7.454  -1.349
    4   2HB   ASP   8          3HB       ASP   8  -8.965  -7.225  -0.971
    5    HA   PRO   9           HA       PRO   9  -5.947  -5.033  -4.133
    6   1HB   PRO   9          2HB       PRO   9  -6.107  -2.306  -4.056
    7   2HB   PRO   9          3HB       PRO   9  -6.489  -3.249  -5.483
    8   1HG   PRO   9          2HG       PRO   9  -8.332  -1.901  -3.605
    9   2HG   PRO   9          3HG       PRO   9  -8.646  -2.471  -5.233
   10   1HD   PRO   9          2HD       PRO   9  -9.454  -3.731  -2.786
   11   2HD   PRO   9          3HD       PRO   9  -9.667  -4.360  -4.409
   12    H    CYS  10           H        CYS  10  -4.125  -3.533  -3.214
   13    HA   CYS  10           HA       CYS  10  -4.034  -4.271  -0.471
   14   1HB   CYS  10          2HB       CYS  10  -1.825  -3.898  -0.604
   15   2HB   CYS  10          3HB       CYS  10  -2.141  -4.001  -2.325
   16    H    GLU  11           H        GLU  11  -3.420  -2.542   1.241
   17    HA   GLU  11           HA       GLU  11  -4.311   0.099   0.661
   18   1HB   GLU  11          2HB       GLU  11  -6.115  -1.851   1.949
   19   2HB   GLU  11          3HB       GLU  11  -5.886  -0.404   2.913
   20   1HG   GLU  11          2HG       GLU  11  -6.537   1.024   1.006
   21   2HG   GLU  11          3HG       GLU  11  -6.636  -0.373  -0.048
   22    H    CYS  12           H        CYS  12  -2.480   0.983   1.409
   23    HA   CYS  12           HA       CYS  12  -1.334   0.082   3.974
   24   1HB   CYS  12          2HB       CYS  12   0.016   2.337   2.763
   25   2HB   CYS  12          3HB       CYS  12   0.603   0.671   2.997
   26    H    SER  13           H        SER  13  -1.514   3.462   2.656
   27    HA   SER  13           HA       SER  13  -2.824   4.128   5.176
   28   1HB   SER  13          2HB       SER  13  -0.384   5.183   3.921
   29   2HB   SER  13          3HB       SER  13  -1.533   6.459   4.273
   30    HG   SER  13           HG       SER  13  -0.097   6.031   6.075
   31    H    LYS  14           H        LYS  14  -3.755   3.492   2.272
   32    HA   LYS  14           HA       LYS  14  -4.527   5.534   0.776
   33   1HB   LYS  14          2HB       LYS  14  -6.125   3.123   1.653
   34   2HB   LYS  14          3HB       LYS  14  -6.719   4.244   0.445
   35   1HG   LYS  14          2HG       LYS  14  -4.354   3.886  -0.688
   36   2HG   LYS  14          3HG       LYS  14  -4.277   2.449   0.312
   37   1HD   LYS  14          2HD       LYS  14  -5.612   1.339  -1.143
   38   2HD   LYS  14          3HD       LYS  14  -6.894   2.505  -0.881
   39   1HE   LYS  14          2HE       LYS  14  -5.892   4.006  -2.614
   40   2HE   LYS  14          3HE       LYS  14  -4.596   2.854  -2.869
   41   1HZ   LYS  14          1HZ       LYS  14  -5.940   1.934  -4.336
   42   2HZ   LYS  14          2HZ       LYS  14  -6.864   1.389  -3.104
   43   3HZ   LYS  14          3HZ       LYS  14  -7.242   2.793  -3.849
   44    H    SER  15           H        SER  15  -5.882   4.719   4.001
   45    HA   SER  15           HA       SER  15  -8.056   6.187   4.157
   46   1HB   SER  15          2HB       SER  15  -7.265   5.037   6.106
   47   2HB   SER  15          3HB       SER  15  -5.771   5.952   6.143
   48    HG   SER  15           HG       SER  15  -8.115   6.518   7.382
   49    H    GLY  16           H        GLY  16  -4.749   7.419   3.766
   50   1HA   GLY  16          1HA       GLY  16  -5.710  10.004   3.011
   51   2HA   GLY  16          2HA       GLY  16  -4.948  10.029   4.588
   52    H    THR  17           H        THR  17  -4.428   8.898   1.185
   53    HA   THR  17           HA       THR  17  -2.609   8.867  -0.093
   54    HB   THR  17           HB       THR  17  -2.236  11.127   1.746
   55    HG1  THR  17           1HG      THR  17  -1.731  11.988  -0.341
   56   1HG2  THR  17          1HG2      THR  17  -0.042  10.083   2.261
   57   2HG2  THR  17          2HG2      THR  17   0.236   9.786   0.528
   58   3HG2  THR  17          3HG2      THR  17   0.191  11.453   1.149
   59    H    CYS  18           H        CYS  18  -1.539   7.017  -0.335
   60    HA   CYS  18           HA       CYS  18  -0.939   5.238   1.544
   61   1HB   CYS  18          2HB       CYS  18  -0.548   4.377  -0.503
   62   2HB   CYS  18          3HB       CYS  18   0.172   5.850  -1.122
   63    H    ASN  19           H        ASN  19   1.153   4.610   2.633
   64    HA   ASN  19           HA       ASN  19   3.024   6.777   2.924
   65   1HB   ASN  19          2HB       ASN  19   1.156   6.963   4.731
   66   2HB   ASN  19          3HB       ASN  19   1.790   5.472   5.399
   67   1HD2  ASN  19          1HD2      ASN  19   2.080   8.837   5.206
   68   2HD2  ASN  19          2HD2      ASN  19   3.553   9.059   6.089
   69    H    CYS  20           H        CYS  20   3.729   4.685   1.577
   70    HA   CYS  20           HA       CYS  20   4.597   2.429   3.233
   71   1HB   CYS  20          2HB       CYS  20   4.496   3.119   0.317
   72   2HB   CYS  20          3HB       CYS  20   5.709   1.928   0.848
   73    H    GLY  21           H        GLY  21   5.695   5.160   3.865
   74   1HA   GLY  21          1HA       GLY  21   8.363   5.233   2.811
   75   2HA   GLY  21          2HA       GLY  21   7.684   6.225   4.087
   76    H    GLY  22           H        GLY  22   6.807   4.275   5.947
   77   1HA   GLY  22          1HA       GLY  22   9.242   3.653   7.255
   78   2HA   GLY  22          2HA       GLY  22   7.626   3.179   7.736
   79    H    SER  23           H        SER  23   6.578   1.383   6.277
   80    HA   SER  23           HA       SER  23   8.347  -0.302   4.895
   81   1HB   SER  23          2HB       SER  23   9.142  -1.598   6.562
   82   2HB   SER  23          3HB       SER  23   8.247  -0.666   7.745
   83    HG   SER  23           HG       SER  23   7.508  -2.784   7.923
   84    H    CYS  24           H        CYS  24   7.168  -1.960   3.751
   85    HA   CYS  24           HA       CYS  24   4.475  -1.365   3.336
   86   1HB   CYS  24          2HB       CYS  24   6.159  -3.741   2.534
   87   2HB   CYS  24          3HB       CYS  24   4.492  -3.530   2.030
   88    H    THR  25           H        THR  25   2.653  -2.057   4.429
   89    HA   THR  25           HA       THR  25   3.069  -4.066   6.525
   90    HB   THR  25           HB       THR  25   2.224  -1.898   7.293
   91    HG1  THR  25           1HG      THR  25  -0.022  -3.733   6.885
   92   1HG2  THR  25          1HG2      THR  25  -0.278  -1.461   6.398
   93   2HG2  THR  25          2HG2      THR  25   1.125  -0.755   5.561
   94   3HG2  THR  25          3HG2      THR  25   0.368  -2.239   4.932
   95    H    CYS  26           H        CYS  26   1.444  -3.460   3.456
   96    HA   CYS  26           HA       CYS  26  -0.285  -5.741   3.854
   97   1HB   CYS  26          2HB       CYS  26  -0.342  -4.768   1.168
   98   2HB   CYS  26          3HB       CYS  26  -1.599  -4.744   2.387
   99    H    THR  27           H        THR  27  -0.273  -7.492   2.100
  100    HA   THR  27           HA       THR  27   2.503  -8.206   1.546
  101    HB   THR  27           HB       THR  27  -0.090  -9.587   2.064
  102    HG1  THR  27           1HG      THR  27   1.699 -11.100   2.827
  103   1HG2  THR  27          1HG2      THR  27   1.034 -11.692   0.943
  104   2HG2  THR  27          2HG2      THR  27   0.094 -10.591  -0.093
  105   3HG2  THR  27          3HG2      THR  27   1.872 -10.498  -0.078
  106    H    ASN  28           H        ASN  28  -0.672  -8.039  -0.202
  107    HA   ASN  28           HA       ASN  28   0.751  -8.241  -2.672
  108   1HB   ASN  28          2HB       ASN  28  -2.199  -7.878  -1.953
  109   2HB   ASN  28          3HB       ASN  28  -1.646  -7.897  -3.616
  110   1HD2  ASN  28          1HD2      ASN  28  -1.038  -9.760  -4.585
  111   2HD2  ASN  28          2HD2      ASN  28  -1.186 -11.336  -3.880
  112    H    CYS  29           H        CYS  29   1.726  -6.073  -1.430
  113    HA   CYS  29           HA       CYS  29   0.284  -3.624  -1.786
  114   1HB   CYS  29          2HB       CYS  29   2.359  -4.196  -0.300
  115   2HB   CYS  29          3HB       CYS  29   3.299  -3.838  -1.769
  116    H    SER  30           H        SER  30   1.302  -1.788  -3.277
  117    HA   SER  30           HA       SER  30   2.626  -2.587  -5.577
  118   1HB   SER  30          2HB       SER  30   0.248  -3.644  -5.869
  119   2HB   SER  30          3HB       SER  30  -0.296  -2.004  -6.153
  120    HG   SER  30           HG       SER  30   0.582  -3.550  -8.007
  121    H    CYS  31           H        CYS  31   3.701  -0.631  -4.712
  122    HA   CYS  31           HA       CYS  31   2.354   1.768  -5.683
  123   1HB   CYS  31          2HB       CYS  31   4.010   2.186  -3.289
  124   2HB   CYS  31          3HB       CYS  31   2.495   2.928  -3.766
  125    H    LYS  32           H        LYS  32   3.944   3.484  -6.285
  126    HA   LYS  32           HA       LYS  32   6.377   2.266  -7.263
  127   1HB   LYS  32          2HB       LYS  32   4.965   4.887  -7.769
  128   2HB   LYS  32          3HB       LYS  32   6.592   4.595  -8.346
  129   1HG   LYS  32          2HG       LYS  32   5.580   3.666 -10.170
  130   2HG   LYS  32          3HG       LYS  32   5.336   2.268  -9.143
  131   1HD   LYS  32          2HD       LYS  32   3.090   2.948  -8.570
  132   2HD   LYS  32          3HD       LYS  32   3.332   4.559  -9.214
  133   1HE   LYS  32          2HE       LYS  32   3.848   2.466 -11.232
  134   2HE   LYS  32          3HE       LYS  32   2.219   2.379 -10.592
  135   1HZ   LYS  32          1HZ       LYS  32   1.689   4.239 -11.632
  136   2HZ   LYS  32          2HZ       LYS  32   3.018   5.044 -11.134
  137   3HZ   LYS  32          3HZ       LYS  32   3.085   4.107 -12.470
  138    H    SER  33           H        SER  33   5.371   3.658  -4.384
  139    HA   SER  33           HA       SER  33   7.895   5.018  -3.973
  140   1HB   SER  33          2HB       SER  33   5.174   5.259  -2.891
  141   2HB   SER  33          3HB       SER  33   6.371   5.202  -1.612
  142    HG   SER  33           HG       SER  33   6.009   7.139  -3.675
  143    H    CYS  34           H        CYS  34   7.004   1.920  -3.991
  144    HA   CYS  34           HA       CYS  34   8.746   1.282  -1.762
  145   1HB   CYS  34          2HB       CYS  34   7.183  -0.579  -1.084
  146   2HB   CYS  34          3HB       CYS  34   6.721   1.048  -0.622
  147    H    LYS  35           H        LYS  35   6.718   0.182  -4.558
  148    HA   LYS  35           HA       LYS  35   8.464  -2.066  -5.012
  149   1HB   LYS  35          2HB       LYS  35   5.930  -2.054  -5.304
  150   2HB   LYS  35          3HB       LYS  35   6.185  -1.099  -6.750
  151   1HG   LYS  35          2HG       LYS  35   8.028  -3.168  -7.077
  152   2HG   LYS  35          3HG       LYS  35   6.694  -3.982  -6.282
  153   1HD   LYS  35          2HD       LYS  35   5.371  -3.856  -8.136
  154   2HD   LYS  35          3HD       LYS  35   5.737  -2.161  -8.386
  155   1HE   LYS  35          2HE       LYS  35   7.894  -4.177  -9.017
  156   2HE   LYS  35          3HE       LYS  35   6.545  -4.046 -10.127
  157   1HZ   LYS  35          1HZ       LYS  35   7.029  -1.814 -10.509
  158   2HZ   LYS  35          2HZ       LYS  35   8.030  -1.686  -9.225
  159   3HZ   LYS  35          3HZ       LYS  35   8.486  -2.550 -10.533
  Start of MODEL   20
    1    H    ASP   8           H        ASP   8  -9.221  -7.841  -0.306
    2    HA   ASP   8           HA       ASP   8 -10.499  -5.354   0.349
    3   1HB   ASP   8          2HB       ASP   8  -9.102  -7.282   1.806
    4   2HB   ASP   8          3HB       ASP   8  -7.912  -6.007   1.647
    5    HA   PRO   9           HA       PRO   9  -7.531  -3.166  -2.057
    6   1HB   PRO   9          2HB       PRO   9  -8.122  -0.616  -1.271
    7   2HB   PRO   9          3HB       PRO   9  -9.027  -1.473  -2.503
    8   1HG   PRO   9          2HG       PRO   9  -9.793  -0.898   0.294
    9   2HG   PRO   9          3HG       PRO   9 -10.816  -1.360  -1.051
   10   1HD   PRO   9          2HD       PRO   9  -9.947  -3.045   1.100
   11   2HD   PRO   9          3HD       PRO   9 -10.873  -3.533  -0.305
   12    H    CYS  10           H        CYS  10  -5.714  -1.514  -1.905
   13    HA   CYS  10           HA       CYS  10  -4.149  -2.383   0.308
   14   1HB   CYS  10          2HB       CYS  10  -3.602  -1.513  -2.238
   15   2HB   CYS  10          3HB       CYS  10  -3.137  -0.124  -1.276
   16    H    GLU  11           H        GLU  11  -3.514  -1.137   2.135
   17    HA   GLU  11           HA       GLU  11  -5.350   0.722   3.022
   18   1HB   GLU  11          2HB       GLU  11  -2.819  -0.459   3.957
   19   2HB   GLU  11          3HB       GLU  11  -3.017   1.191   4.509
   20   1HG   GLU  11          2HG       GLU  11  -5.548   0.221   4.969
   21   2HG   GLU  11          3HG       GLU  11  -4.610  -1.243   5.192
   22    H    CYS  12           H        CYS  12  -2.790   1.003   0.812
   23    HA   CYS  12           HA       CYS  12  -1.900   3.671   1.275
   24   1HB   CYS  12          2HB       CYS  12  -2.019   1.989  -1.260
   25   2HB   CYS  12          3HB       CYS  12  -1.123   3.518  -1.093
   26    H    SER  13           H        SER  13  -4.173   2.457  -1.335
   27    HA   SER  13           HA       SER  13  -5.049   5.120  -1.733
   28   1HB   SER  13          2HB       SER  13  -6.499   4.165  -3.447
   29   2HB   SER  13          3HB       SER  13  -4.915   3.427  -3.564
   30    HG   SER  13           HG       SER  13  -6.077   1.609  -3.529
   31    H    LYS  14           H        LYS  14  -6.202   2.193  -0.021
   32    HA   LYS  14           HA       LYS  14  -8.828   2.985   0.415
   33   1HB   LYS  14          2HB       LYS  14  -8.203   0.723   0.789
   34   2HB   LYS  14          3HB       LYS  14  -6.943   1.166   1.921
   35   1HG   LYS  14          2HG       LYS  14  -8.568   1.908   3.575
   36   2HG   LYS  14          3HG       LYS  14  -9.883   1.801   2.422
   37   1HD   LYS  14          2HD       LYS  14 -10.056  -0.178   3.762
   38   2HD   LYS  14          3HD       LYS  14  -9.376  -0.712   2.236
   39   1HE   LYS  14          2HE       LYS  14  -7.894  -1.753   3.695
   40   2HE   LYS  14          3HE       LYS  14  -7.046  -0.237   3.465
   41   1HZ   LYS  14          1HZ       LYS  14  -7.302  -0.846   5.791
   42   2HZ   LYS  14          2HZ       LYS  14  -8.020   0.585   5.469
   43   3HZ   LYS  14          3HZ       LYS  14  -8.927  -0.759   5.660
   44    H    SER  15           H        SER  15  -6.654   2.764   3.247
   45    HA   SER  15           HA       SER  15  -7.888   4.589   4.736
   46   1HB   SER  15          2HB       SER  15  -6.039   3.174   5.538
   47   2HB   SER  15          3HB       SER  15  -4.886   4.081   4.579
   48    HG   SER  15           HG       SER  15  -6.533   5.385   6.555
   49    H    GLY  16           H        GLY  16  -5.322   5.211   2.269
   50   1HA   GLY  16          1HA       GLY  16  -5.340   7.136   0.927
   51   2HA   GLY  16          2HA       GLY  16  -6.187   8.018   2.183
   52    H    THR  17           H        THR  17  -3.356   5.871   2.732
   53    HA   THR  17           HA       THR  17  -1.535   8.099   2.866
   54    HB   THR  17           HB       THR  17  -2.667   6.718   5.333
   55    HG1  THR  17           1HG      THR  17  -3.224   8.858   5.649
   56   1HG2  THR  17          1HG2      THR  17  -0.660   6.840   6.414
   57   2HG2  THR  17          2HG2      THR  17   0.125   7.284   4.879
   58   3HG2  THR  17          3HG2      THR  17  -0.515   8.552   5.952
   59    H    CYS  18           H        CYS  18   0.075   7.300   1.666
   60    HA   CYS  18           HA       CYS  18   0.534   4.604   1.295
   61   1HB   CYS  18          2HB       CYS  18   1.640   7.060   0.408
   62   2HB   CYS  18          3HB       CYS  18   2.975   6.085   0.988
   63    H    ASN  19           H        ASN  19   1.183   3.120   2.813
   64    HA   ASN  19           HA       ASN  19   2.578   4.113   5.129
   65   1HB   ASN  19          2HB       ASN  19   0.592   2.423   5.159
   66   2HB   ASN  19          3HB       ASN  19   1.731   1.232   4.563
   67   1HD2  ASN  19          1HD2      ASN  19   0.257   2.241   7.228
   68   2HD2  ASN  19          2HD2      ASN  19   1.421   1.882   8.459
   69    H    CYS  20           H        CYS  20   3.741   3.864   2.363
   70    HA   CYS  20           HA       CYS  20   5.820   1.781   2.792
   71   1HB   CYS  20          2HB       CYS  20   5.336   3.366   0.254
   72   2HB   CYS  20          3HB       CYS  20   6.144   1.790   0.448
   73    H    GLY  21           H        GLY  21   5.899   4.213   4.405
   74   1HA   GLY  21          1HA       GLY  21   8.045   5.742   3.082
   75   2HA   GLY  21          2HA       GLY  21   7.045   6.293   4.411
   76    H    GLY  22           H        GLY  22   7.109   4.113   6.192
   77   1HA   GLY  22          1HA       GLY  22   9.887   4.282   7.101
   78   2HA   GLY  22          2HA       GLY  22   8.484   3.821   8.044
   79    H    SER  23           H        SER  23   7.256   1.807   6.640
   80    HA   SER  23           HA       SER  23   9.145  -0.031   5.621
   81   1HB   SER  23          2HB       SER  23   9.726  -1.123   7.506
   82   2HB   SER  23          3HB       SER  23   8.758  -0.018   8.462
   83    HG   SER  23           HG       SER  23   7.280  -1.542   8.730
   84    H    CYS  24           H        CYS  24   7.877  -0.659   3.900
   85    HA   CYS  24           HA       CYS  24   5.125  -0.566   3.872
   86   1HB   CYS  24          2HB       CYS  24   6.554  -0.627   1.875
   87   2HB   CYS  24          3HB       CYS  24   6.967  -2.298   2.208
   88    H    THR  25           H        THR  25   3.493  -2.141   4.273
   89    HA   THR  25           HA       THR  25   4.449  -4.656   5.469
   90    HB   THR  25           HB       THR  25   3.747  -3.112   7.263
   91    HG1  THR  25           1HG      THR  25   3.014  -5.468   7.077
   92   1HG2  THR  25          1HG2      THR  25   1.354  -2.354   7.344
   93   2HG2  THR  25          2HG2      THR  25   2.228  -1.606   5.986
   94   3HG2  THR  25          3HG2      THR  25   1.121  -2.967   5.689
   95    H    CYS  26           H        CYS  26   1.880  -2.892   3.688
   96    HA   CYS  26           HA       CYS  26   0.161  -4.991   3.306
   97   1HB   CYS  26          2HB       CYS  26  -0.017  -3.629   0.936
   98   2HB   CYS  26          3HB       CYS  26  -0.877  -3.247   2.414
   99    H    THR  27           H        THR  27   0.060  -6.719   1.796
  100    HA   THR  27           HA       THR  27   2.615  -7.344   0.530
  101    HB   THR  27           HB       THR  27   1.633  -9.061   1.979
  102    HG1  THR  27           1HG      THR  27   2.486  -9.492  -0.328
  103   1HG2  THR  27          1HG2      THR  27  -0.756  -8.467   1.941
  104   2HG2  THR  27          2HG2      THR  27  -0.825  -8.726   0.182
  105   3HG2  THR  27          3HG2      THR  27  -0.576 -10.108   1.275
  106    H    ASN  28           H        ASN  28  -0.860  -6.843  -0.274
  107    HA   ASN  28           HA       ASN  28  -0.275  -7.262  -3.037
  108   1HB   ASN  28          2HB       ASN  28  -2.805  -6.237  -1.644
  109   2HB   ASN  28          3HB       ASN  28  -2.710  -6.674  -3.338
  110   1HD2  ASN  28          1HD2      ASN  28  -2.453  -8.816  -3.957
  111   2HD2  ASN  28          2HD2      ASN  28  -2.785 -10.150  -2.902
  112    H    CYS  29           H        CYS  29   1.392  -5.331  -2.311
  113    HA   CYS  29           HA       CYS  29   0.142  -2.683  -2.736
  114   1HB   CYS  29          2HB       CYS  29   1.964  -3.360  -0.929
  115   2HB   CYS  29          3HB       CYS  29   3.086  -3.116  -2.290
  116    H    SER  30           H        SER  30   1.681  -1.153  -4.192
  117    HA   SER  30           HA       SER  30   3.021  -2.512  -6.264
  118   1HB   SER  30          2HB       SER  30   0.474  -2.789  -6.776
  119   2HB   SER  30          3HB       SER  30   0.497  -1.079  -7.161
  120    HG   SER  30           HG       SER  30   2.430  -1.725  -8.604
  121    H    CYS  31           H        CYS  31   3.378  -0.342  -4.256
  122    HA   CYS  31           HA       CYS  31   3.467   2.033  -5.924
  123   1HB   CYS  31          2HB       CYS  31   4.376   1.969  -3.071
  124   2HB   CYS  31          3HB       CYS  31   3.681   3.288  -3.992
  125    H    LYS  32           H        LYS  32   5.515   3.191  -6.234
  126    HA   LYS  32           HA       LYS  32   7.729   1.362  -6.458
  127   1HB   LYS  32          2HB       LYS  32   8.759   3.065  -7.779
  128   2HB   LYS  32          3HB       LYS  32   7.080   2.949  -8.267
  129   1HG   LYS  32          2HG       LYS  32   6.485   4.938  -6.983
  130   2HG   LYS  32          3HG       LYS  32   8.057   4.981  -6.211
  131   1HD   LYS  32          2HD       LYS  32   8.180   6.628  -7.937
  132   2HD   LYS  32          3HD       LYS  32   9.075   5.258  -8.563
  133   1HE   LYS  32          2HE       LYS  32   7.728   5.330 -10.390
  134   2HE   LYS  32          3HE       LYS  32   6.433   4.734  -9.373
  135   1HZ   LYS  32          1HZ       LYS  32   6.880   7.375 -10.362
  136   2HZ   LYS  32          2HZ       LYS  32   5.484   6.652  -9.915
  137   3HZ   LYS  32          3HZ       LYS  32   6.450   7.332  -8.786
  138    H    SER  33           H        SER  33   6.427   3.186  -3.969
  139    HA   SER  33           HA       SER  33   8.912   4.175  -2.965
  140   1HB   SER  33          2HB       SER  33   6.168   4.734  -2.541
  141   2HB   SER  33          3HB       SER  33   6.732   4.081  -1.016
  142    HG   SER  33           HG       SER  33   6.969   6.509  -1.482
  143    H    CYS  34           H        CYS  34   7.949   1.130  -3.373
  144    HA   CYS  34           HA       CYS  34   9.188   0.273  -0.886
  145   1HB   CYS  34          2HB       CYS  34   7.514  -1.654  -0.841
  146   2HB   CYS  34          3HB       CYS  34   7.000  -0.092  -0.237
  147    H    LYS  35           H        LYS  35   7.838  -0.612  -4.138
  148    HA   LYS  35           HA       LYS  35   9.732  -2.773  -4.380
  149   1HB   LYS  35          2HB       LYS  35   7.203  -2.067  -5.525
  150   2HB   LYS  35          3HB       LYS  35   8.361  -2.244  -6.827
  151   1HG   LYS  35          2HG       LYS  35   8.704  -4.501  -6.416
  152   2HG   LYS  35          3HG       LYS  35   8.486  -4.335  -4.685
  153   1HD   LYS  35          2HD       LYS  35   6.349  -5.058  -4.884
  154   2HD   LYS  35          3HD       LYS  35   5.970  -3.665  -5.878
  155   1HE   LYS  35          2HE       LYS  35   5.425  -5.538  -7.251
  156   2HE   LYS  35          3HE       LYS  35   6.967  -4.981  -7.869
  157   1HZ   LYS  35          1HZ       LYS  35   6.490  -7.471  -7.137
  158   2HZ   LYS  35          2HZ       LYS  35   7.984  -6.810  -7.139
  159   3HZ   LYS  35          3HZ       LYS  35   7.136  -6.905  -5.749