*HEADER    ANTIMICROBIAL PROTEIN                   27-DEC-18   6J12              
*TITLE     THREE-DIMENSIONAL SOLUTION NMR STRUCTURE OF KYE28-PEG48 IN MICROGEL   
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: HEPARIN COFACTOR 2;                                        
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 SYNONYM: KYE28-PEG48;                                                
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   4 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   5 ORGANISM_TAXID: 9606                                                 
*KEYWDS    ANTIMICROBIAL PEPTIDE, DRUG DELIVERY, MICROGEL, PEGYLATION,           
*KEYWDS   2 ANTIMICROBIAL PROTEIN                                                
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    H.ILYAS,A.BHUNIA                                                      
*REVDAT   1   16-JAN-19 6J12    0                                                
# Restraints file 1: KYE28_PEG4800.seq
LYS
TYR
GLU
ILE
THR
THR
ILE
HIS
ASN
LEU
PHE
ARG
LYS
LEU
THR
HIS
ARG
LEU
PHE
ARG
ARG
ASN
PHE
GLY
TYR
THR
LEU
ARG
# Restraints file 2: KYE28_PEG4800.aco
# Torsion angle constraints 
# generated from HA secondary chemical shifts			
   
   2 TYR  PHI  -120   -30
   2 TYR  PSI  -120   120
   3 GLU  PHI  -120   -30
   3 GLU  PSI  -120   120
   4 ILE  PHI  -120   -30
   4 ILE  PSI  -120   120
   5 THR  PHI  -120   -30
   5 THR  PSI  -120   120
   6 THR  PHI  -120   -30
   6 THR  PSI  -120   120
   7 ILE  PHI  -120   -30
   7 ILE  PSI  -120   120
   8 HIS  PHI  -120   -30
   8 HIS  PSI  -120   120
   9 ASN  PHI  -120   -30
   9 ASN  PSI  -120   120
  10 LEU  PHI  -120   -30
  10 LEU  PSI  -120   120
  11 PHE  PHI  -120   -30
  11 PHE  PSI  -120   120
  12 ARG  PHI  -120   -30
  12 ARG  PSI  -120   120
  13 LYS  PHI  -120   -30
  13 LYS  PSI  -120   120
  14 LEU  PHI  -120   -30
  14 LEU  PSI  -120   120
  15 THR  PHI  -120   -30
  15 THR  PSI  -120   120
  16 HIS  PHI  -120   -30
  16 HIS  PSI  -120   120
  17 ARG  PHI  -120   -30
  17 ARG  PSI  -120   120
  18 LEU  PHI  -120   -30
  18 LEU  PSI  -120   120
  19 PHE  PHI  -120   -30
  19 PHE  PSI  -120   120
  20 ARG  PHI  -120   -30
  20 ARG  PSI  -120   120
  21 ARG  PHI  -120   -30
  21 ARG  PSI  -120   120
  22 ASN  PHI  -120   -30
  22 ASN  PSI  -120   120
  23 PHE  PHI  -120   -30
  23 PHE  PSI  -120   120
  24 GLY  PHI  -120   -30
  24 GLY  PSI  -120   120
  25 TYR  PHI  -120   -30
  25 TYR  PSI  -120   120
  26 THR  PHI  -120   -30
  26 THR  PSI  -120   120
  27 LEU  PHI  -120   -30
  27 LEU  PSI  -120   120
  28 ARG  PHI  -120   -30
  28 ARG  PSI  -120   120
# Restraints file 3: KYE28_PEG4800.upl
2 TYR HB2	2 TYR H		3.5	2.0
2 TYR HB3	2 TYR H		3.5	2.0
3 GLU HB2	3 GLU H		3.8	2.0
3 GLU HB3	3 GLU H		3.8	2.0
3 GLU QG	3 GLU H		3.8	2.0
4 ILE QB	4 ILE H		3.5	2.0
4 ILE HG21	4 ILE H		3.5	2.0
4 ILE HD1	4 ILE H		3.5	2.0
5 THR HB	5 THR H		3.5	2.0
5 THR QG1	5 THR H		4.1	2.0
6 THR HB	6 THR H		3.5	2.0
6 THR QG1	6 THR H		3.8	2.0
7 ILE QB	7 ILE H		3.5	2.0
7 ILE HG1	7 ILE H		3.5	2.0
7 ILE HD1	7 ILE H		3.5	2.0
8 HIS HB2	8 HIS H		3.5	2.0
8 HIS HB3	8 HIS H		3.5	2.0
9 ASN QB	9 ASN H		3.5	2.0
10 LEU QB	10 LEU H	3.5	2.0
10 LEU QG	10 LEU H	3.5	2.0
10 LEU QQD	10 LEU H	3.5	2.0
11 PHE HB2	11 PHE H	3.5	2.0
11 PHE HB3	11 PHE H	3.5	2.0
12 ARG QB	12 ARG H	3.5	2.0
12 ARG QG	12 ARG H	3.8	2.0
13 LYS QB	13 LYS H	3.5	2.0
13 LYS QG	13 LYS H	4.2	2.0
13 LYS QD	13 LYS H	4.2	2.0
14 LEU QB	14 LEU H	3.5	2.0
14 LEU HG 	14 LEU H	4.5	2.0
14 LEU QQD	14 LEU H	3.8	2.0
15 THR HB	15 THR H	3.8	2.0
15 THR QG1	15 THR H	3.8	2.0
16 HIS HB2	16 HIS H	3.8	2.0
16 HIS HB3	16 HIS H	3.5	2.0
17 ARG HB2	17 ARG H	3.5	2.0
17 ARG HB3	17 ARG H	3.5	2.0
17 ARG QG	17 ARG H	4.0	2.0
18 LEU QB	18 LEU H	3.5	2.0
18 LEU HG 	18 LEU H	4.0	2.0
18 LEU QQD	18 LEU H	3.8	2.0
19 PHE HB2	19 PHE H	3.5	2.0
19 PHE HB3	19 PHE H	3.5	2.0
20 ARG QB	20 ARG H	3.5	2.0
20 ARG QG	20 ARG H	4.0	2.0
21 ARG QB	21 ARG H	3.5	2.0
21 ARG QG	21 ARG H	4.3	2.0
22 ASN HB2	22 ASN H	3.5	2.0
23 PHE HB2	23 PHE H	3.5	2.0
23 PHE HB3	23 PHE H	3.5	2.0
25 TYR HB2	25 TYR H	3.5	2.0
25 TYR HB3	25 TYR H	3.5	2.0
26 THR HB	26 THR H	3.5	2.0
26 THR QG1	26 THR H	3.8	2.0
27 LEU QB	27 LEU H	3.5	2.0
27 LEU HG 	27 LEU H	4.0	2.0
27 LEU QQD	27 LEU H	3.8	2.0
28 ARG QB	28 ARG H	3.5	2.0
28 ARG QG	28 ARG H	4.0	2.0
1 LYS HA	2 TYR H		3.3	2.0
1 LYS QB	2 TYR H		3.3	2.0
2 TYR HA	3 GLU H		3.5	2.0
2 TYR HB3	3 GLU H		3.5	2.0
2 TYR HB2	3 GLU H		3.5	2.0
3 GLU HA	4 ILE H		3.5	2.0
3 GLU HB2	4 ILE H		3.8	2.0
4 ILE HA	5 THR H		3.5	2.0
4 ILE HD1	5 THR H		3.5	2.0
5 THR HA	6 THR H		3.5	2.0
5 THR QG1	6 THR H		3.8	2.0
6 THR HA	7 ILE H		3.5	2.0
7 ILE QB	8 HIS H		3.5	2.0
7 ILE HD1	8 HIS H		3.5	2.0
8 HIS HA	9 ASN H		3.5	2.0
8 HIS HB2	9 ASN H		3.8	2.0
8 HIS HB3	9 ASN H		4.3	2.0
9 ASN HA	10 LEU H	3.5	2.0
10 LEU HA	11 PHE H	3.5	2.0
10 LEU QQD	11 PHE H	3.5	2.0
11 PHE HA	12 ARG H	3.5	2.0
12 ARG HA	13 LYS H	3.5	2.0
13 LYS HA	14 LEU H	3.5	2.0
14 LEU HG	15 THR H	4.5	2.0
14 LEU QQD 	15 THR H	4.5	2.0
14 LEU HG	15 THR H	3.9	2.0
15 THR HA	16 HIS H	3.5	2.0
15 THR HB	16 HIS H	4.2	2.0
15 THR QG1	16 HIS H	4.2	2.0
16 HIS HA	17 ARG H	3.5	2.0
16 HIS HB2	17 ARG H	4.2	2.0
17 ARG HA	18 LEU H	3.5	2.0
18 LEU HA	19 PHE H	3.5	2.0
18 LEU QB	19 PHE H	4.5	2.0
18 LEU HG	19 PHE H	5.0	2.0
18 LEU QQD 	19 PHE H	4.5	2.0
19 PHE HA	20 ARG H	3.5	2.0
19 PHE HB2	20 ARG H	3.8	2.0
20 ARG HA	21 ARG H	3.5	2.0
20 ARG QB	21 ARG H	4.5	2.0
21 ARG HA	22  ASN H	3.5	2.0
21 ARG QB	22  ASN H	4.5	2.0
21 ARG QG	22  ASN H	4.5	2.0
22 ASN HA	23 PHE H	3.5	2.0
22 ASN HB2	23 PHE H	3.5	2.0
22 ASN HB3	23 PHE H	3.5	2.0
23 PHE HA	24 GLY H	3.5	2.0
23 PHE HB2	24 GLY H	3.8	2.0
23 PHE HB3	24 GLY H	3.8	2.0
24 GLY HA2	25 TYR H	3.5	2.0
24 GLY HA3	25 TYR H	3.5	2.0
24 GLY HA3	25 TYR QD	3.5	2.0
25 TYR HA	26 THR H	3.5	2.0
25 TYR HB2   	26 THR H	3.8	2.0
25 TYR HB3   	26 THR H	3.8	2.0
26 THR HA	27 LEU H	3.5	2.0
26 THR HB	27 LEU H	3.8	2.0
26 THR QG1	27 LEU H	4.2	2.0
27 LEU HA	28 ARG H	3.5	2.0
27 LEU QQD 	28 ARG H	4.5	2.0
2 TYR H		3 GLU H		3.5	2.0
3 GLU H		4 ILE H		3.5	2.0
4 ILE H		5 THR H		3.5	2.0
5 THR H		6 THR H		5.0	2.0
6 THR H		7 ILE H		5.0	2.0
7 ILE H		8 HIS H		3.5	2.0
8 HIS H		9 ASN H		3.5	2.0
9 ASN H		10 LEU H	3.5	2.0
10 LEU H	11 PHE H	3.5	2.0
11 PHE H	12 ARG H	5.5	2.0
12 ARG H	13 LYS H	5.5	2.0
14 LEU H	15 THR H	3.5	2.0
15 THR H	16 HIS H	3.5	2.0
17 ARG H	18 LEU H	3.5	2.0
20 ARG H	21 ARG H	3.5	2.0
21 ARG H	22 ASN H	3.5	2.0
24 GLY H	25 TYR H	3.5	2.0
25 TYR H	26 THR H	3.5	2.0
26 THR H	27 LEU H	3.5	2.0
27 LEU H	28 ARG H	3.5	2.0
2 TYR HB3	4 ILE H		4.0	2.0
7 ILE QB	9 ASN H		4.0	2.0
22 ASN HA	24 GLY H	3.8	2.0
23 PHE HA	25 TYR H	3.8	2.0
13 LYS QG	15 THR H	4.2	2.0
15 THR QG1	17 ARG H	4.0	2.0
19 PHE HB3	11 PHE QD	5.0	2.0
26 THR QG1	28 ARG H	4.8	2.0
7 ILE HD1	11 PHE QE	5.0	2.0
19 PHE HA	23 PHE H	4.2	2.0
16 HIS HA	20 ARG H	4.0	2.0
11 PHE QE	19 PHE QE	3.8	2.0
11 PHE QD	19 PHE QD	5.0	2.0
18 LEU HA	20 ARG H	4.0	2.0
2 TRP HA	5 THR H		4.5	2.0
23 PHE HA	27 LEU H	4.2	2.0
23 PHE QB	27 LEU H	4.2	2.0
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   LYS   1           H        LYS   1   1.806   0.000   0.856
    2    HA   LYS   1           HA       LYS   1   1.480   0.440  -2.010
    3    HB2  LYS   1          2HB       LYS   1   3.920   0.462  -0.229
    4    HB3  LYS   1          3HB       LYS   1   3.972   0.719  -1.968
    5    HG2  LYS   1          2HG       LYS   1   2.669   2.723  -1.770
    6    HG3  LYS   1          3HG       LYS   1   2.410   2.432  -0.048
    7    HD2  LYS   1          2HD       LYS   1   4.152   3.880   0.123
    8    HD3  LYS   1          3HD       LYS   1   5.081   2.393  -0.080
    9    HE2  LYS   1          2HE       LYS   1   6.020   3.967  -1.573
   10    HE3  LYS   1          3HE       LYS   1   5.059   2.866  -2.560
   11    HZ1  LYS   1          1HZ       LYS   1   4.675   5.131  -3.232
   12    HZ2  LYS   1          2HZ       LYS   1   4.247   5.576  -1.657
   13    HZ3  LYS   1          3HZ       LYS   1   3.263   4.514  -2.532
   14    H    TYR   2           H        TYR   2   1.676  -2.149   0.037
   15    HA   TYR   2           HA       TYR   2   2.885  -3.843  -2.051
   16    HB2  TYR   2          2HB       TYR   2   4.304  -3.801  -0.073
   17    HB3  TYR   2          3HB       TYR   2   2.937  -4.231   0.949
   18    HD1  TYR   2           HD1      TYR   2   4.285  -5.597  -2.264
   19    HD2  TYR   2           HD2      TYR   2   3.175  -6.370   1.770
   20    HE1  TYR   2           HE1      TYR   2   4.804  -7.980  -2.584
   21    HE2  TYR   2           HE2      TYR   2   3.692  -8.755   1.462
   22    HH   TYR   2           HH       TYR   2   4.601 -10.044  -1.694
   23    H    GLU   3           H        GLU   3   1.026  -4.563   0.891
   24    HA   GLU   3           HA       GLU   3  -0.538  -6.537  -0.452
   25    HB2  GLU   3          2HB       GLU   3  -0.324  -5.463   2.295
   26    HB3  GLU   3          3HB       GLU   3  -1.888  -6.137   1.859
   27    HG2  GLU   3          2HG       GLU   3  -1.088  -8.259   1.687
   28    HG3  GLU   3          3HG       GLU   3   0.530  -7.732   1.228
   29    H    ILE   4           H        ILE   4  -0.727  -3.205  -0.363
   30    HA   ILE   4           HA       ILE   4  -3.478  -2.707  -0.176
   31    HB   ILE   4           HB       ILE   4  -3.018  -0.630  -1.442
   32   HG12  ILE   4          2HG1      ILE   4  -0.409  -0.309  -1.776
   33   HG13  ILE   4          3HG1      ILE   4  -0.445  -2.060  -1.949
   34   HG21  ILE   4          1HG2      ILE   4  -1.172  -1.383   0.807
   35   HG22  ILE   4          2HG2      ILE   4  -1.281   0.258   0.171
   36   HG23  ILE   4          3HG2      ILE   4  -2.698  -0.504   0.893
   37   HD11  ILE   4          1HD1      ILE   4  -1.278  -1.931  -4.002
   38   HD12  ILE   4          2HD1      ILE   4  -2.495  -0.746  -3.524
   39   HD13  ILE   4          3HD1      ILE   4  -0.864  -0.218  -3.941
   40    H    THR   5           H        THR   5  -1.561  -4.034  -2.736
   41    HA   THR   5           HA       THR   5  -3.575  -3.603  -4.770
   42    HB   THR   5           HB       THR   5  -1.671  -5.556  -5.601
   43    HG1  THR   5           HG1      THR   5  -0.097  -4.967  -4.262
   44   HG21  THR   5          1HG2      THR   5  -1.053  -3.833  -7.215
   45   HG22  THR   5          2HG2      THR   5  -1.901  -2.617  -6.259
   46   HG23  THR   5          3HG2      THR   5  -2.805  -3.916  -7.037
   47    H    THR   6           H        THR   6  -2.495  -6.180  -2.657
   48    HA   THR   6           HA       THR   6  -4.251  -8.119  -3.939
   49    HB   THR   6           HB       THR   6  -2.730  -8.666  -1.412
   50    HG1  THR   6           HG1      THR   6  -0.966  -8.164  -2.476
   51   HG21  THR   6          1HG2      THR   6  -2.557 -10.735  -3.330
   52   HG22  THR   6          2HG2      THR   6  -4.231 -10.180  -3.318
   53   HG23  THR   6          3HG2      THR   6  -3.472 -10.725  -1.823
   54    H    ILE   7           H        ILE   7  -6.323  -8.187  -3.396
   55    HA   ILE   7           HA       ILE   7  -7.104  -7.378  -0.676
   56    HB   ILE   7           HB       ILE   7  -8.782  -7.497  -3.185
   57   HG12  ILE   7          2HG1      ILE   7  -8.882  -4.938  -2.521
   58   HG13  ILE   7          3HG1      ILE   7  -7.350  -5.308  -1.738
   59   HG21  ILE   7          1HG2      ILE   7 -10.145  -6.015  -1.306
   60   HG22  ILE   7          2HG2      ILE   7 -10.496  -7.679  -1.769
   61   HG23  ILE   7          3HG2      ILE   7  -9.480  -7.351  -0.366
   62   HD11  ILE   7          1HD1      ILE   7  -7.925  -4.853  -4.513
   63   HD12  ILE   7          2HD1      ILE   7  -6.370  -4.962  -3.688
   64   HD13  ILE   7          3HD1      ILE   7  -7.157  -6.424  -4.282
   65    H    HIS   8           H        HIS   8  -8.704  -9.406  -3.117
   66    HA   HIS   8           HA       HIS   8  -8.880 -11.545  -1.097
   67    HB2  HIS   8          2HB       HIS   8 -10.975 -10.161  -2.471
   68    HB3  HIS   8          3HB       HIS   8 -10.976 -11.844  -2.989
   69    HD1  HIS   8           HD1      HIS   8 -13.024 -12.609  -1.732
   70    HD2  HIS   8           HD2      HIS   8 -10.227 -10.753   0.716
   71    HE1  HIS   8           HE1      HIS   8 -13.825 -12.999   0.619
   72    H    ASN   9           H        ASN   9  -9.487 -11.199  -4.597
   73    HA   ASN   9           HA       ASN   9  -7.763 -13.552  -5.022
   74    HB2  ASN   9          2HB       ASN   9  -9.211 -14.370  -6.683
   75    HB3  ASN   9          3HB       ASN   9 -10.295 -13.823  -5.407
   76   HD21  ASN   9          1HD2      ASN   9 -11.424 -11.856  -5.688
   77   HD22  ASN   9          2HD2      ASN   9 -11.712 -11.218  -7.267
   78    H    LEU  10           H        LEU  10  -8.011 -10.304  -5.487
   79    HA   LEU  10           HA       LEU  10  -7.340  -9.784  -8.109
   80    HB2  LEU  10          2HB       LEU  10  -6.661  -8.456  -5.522
   81    HB3  LEU  10          3HB       LEU  10  -5.930  -7.874  -7.017
   82    HG   LEU  10           HG       LEU  10  -8.467  -7.819  -7.795
   83   HD11  LEU  10          1HD1      LEU  10  -9.961  -8.115  -6.189
   84   HD12  LEU  10          2HD1      LEU  10  -9.268  -6.763  -5.294
   85   HD13  LEU  10          3HD1      LEU  10  -8.670  -8.399  -5.021
   86   HD21  LEU  10          1HD2      LEU  10  -8.414  -5.437  -6.549
   87   HD22  LEU  10          2HD2      LEU  10  -7.497  -5.793  -8.013
   88   HD23  LEU  10          3HD2      LEU  10  -6.710  -5.879  -6.436
   89    H    PHE  11           H        PHE  11  -4.856  -9.677  -5.569
   90    HA   PHE  11           HA       PHE  11  -2.915 -10.677  -7.521
   91    HB2  PHE  11          2HB       PHE  11  -2.746  -8.999  -5.066
   92    HB3  PHE  11          3HB       PHE  11  -1.353  -9.997  -5.469
   93    HD1  PHE  11           HD1      PHE  11   0.127  -9.383  -7.188
   94    HD2  PHE  11           HD2      PHE  11  -3.568  -7.321  -6.729
   95    HE1  PHE  11           HE1      PHE  11   0.880  -7.683  -8.800
   96    HE2  PHE  11           HE2      PHE  11  -2.822  -5.618  -8.341
   97    HZ   PHE  11           HZ       PHE  11  -0.596  -5.799  -9.379
   98    H    ARG  12           H        ARG  12  -4.900 -12.335  -6.008
   99    HA   ARG  12           HA       ARG  12  -3.142 -13.963  -4.331
  100    HB2  ARG  12          2HB       ARG  12  -5.841 -13.270  -4.154
  101    HB3  ARG  12          3HB       ARG  12  -5.847 -14.963  -4.629
  102    HG2  ARG  12          2HG       ARG  12  -3.957 -14.898  -2.639
  103    HG3  ARG  12          3HG       ARG  12  -5.166 -13.739  -2.082
  104    HD2  ARG  12          2HD       ARG  12  -6.665 -15.866  -3.022
  105    HD3  ARG  12          3HD       ARG  12  -5.291 -16.636  -2.231
  106    HE   ARG  12           HE       ARG  12  -6.148 -14.740  -0.456
  107   HH11  ARG  12          1HH1      ARG  12  -7.600 -17.456  -2.080
  108   HH12  ARG  12          2HH1      ARG  12  -8.725 -17.785  -0.804
  109   HH21  ARG  12          1HH2      ARG  12  -7.625 -15.163   1.231
  110   HH22  ARG  12          2HH2      ARG  12  -8.739 -16.479   1.079
  111    H    LYS  13           H        LYS  13  -2.834 -13.855  -7.238
  112    HA   LYS  13           HA       LYS  13  -3.921 -16.041  -8.570
  113    HB2  LYS  13          2HB       LYS  13  -2.439 -14.099  -9.445
  114    HB3  LYS  13          3HB       LYS  13  -1.090 -15.151  -9.040
  115    HG2  LYS  13          2HG       LYS  13  -1.526 -15.500 -11.323
  116    HG3  LYS  13          3HG       LYS  13  -2.184 -16.907 -10.485
  117    HD2  LYS  13          2HD       LYS  13  -4.053 -16.500 -11.651
  118    HD3  LYS  13          3HD       LYS  13  -4.316 -15.185 -10.504
  119    HE2  LYS  13          2HE       LYS  13  -2.597 -14.082 -12.355
  120    HE3  LYS  13          3HE       LYS  13  -3.653 -15.094 -13.339
  121    HZ1  LYS  13          1HZ       LYS  13  -4.709 -13.183 -11.341
  122    HZ2  LYS  13          2HZ       LYS  13  -5.542 -13.941 -12.603
  123    HZ3  LYS  13          3HZ       LYS  13  -4.405 -12.736 -12.944
  124    H    LEU  14           H        LEU  14  -3.859 -18.106  -7.996
  125    HA   LEU  14           HA       LEU  14  -2.034 -19.199  -6.150
  126    HB2  LEU  14          2HB       LEU  14  -2.991 -21.359  -6.765
  127    HB3  LEU  14          3HB       LEU  14  -4.236 -20.143  -6.487
  128    HG   LEU  14           HG       LEU  14  -3.472 -20.359  -9.291
  129   HD11  LEU  14          1HD1      LEU  14  -4.054 -22.515  -9.776
  130   HD12  LEU  14          2HD1      LEU  14  -5.017 -22.705  -8.312
  131   HD13  LEU  14          3HD1      LEU  14  -3.257 -22.753  -8.221
  132   HD21  LEU  14          1HD2      LEU  14  -5.552 -19.353  -7.953
  133   HD22  LEU  14          2HD2      LEU  14  -6.195 -20.959  -8.298
  134   HD23  LEU  14          3HD2      LEU  14  -5.670 -19.915  -9.620
  135    H    THR  15           H        THR  15  -1.934 -18.815  -9.592
  136    HA   THR  15           HA       THR  15   0.597 -20.327  -9.666
  137    HB   THR  15           HB       THR  15   0.180 -20.729 -12.068
  138    HG1  THR  15           HG1      THR  15  -1.558 -18.844 -11.872
  139   HG21  THR  15          1HG2      THR  15  -0.923 -22.637 -11.613
  140   HG22  THR  15          2HG2      THR  15  -2.312 -21.785 -10.939
  141   HG23  THR  15          3HG2      THR  15  -0.886 -22.074  -9.942
  142    H    HIS  16           H        HIS  16   1.442 -18.176  -8.932
  143    HA   HIS  16           HA       HIS  16   1.417 -15.984 -10.770
  144    HB2  HIS  16          2HB       HIS  16   3.259 -15.110  -9.242
  145    HB3  HIS  16          3HB       HIS  16   1.695 -15.409  -8.488
  146    HD1  HIS  16           HD1      HIS  16   1.560 -17.291  -6.747
  147    HD2  HIS  16           HD2      HIS  16   5.327 -16.843  -8.441
  148    HE1  HIS  16           HE1      HIS  16   3.107 -18.668  -5.320
  149    H    ARG  17           H        ARG  17   2.087 -17.363 -12.633
  150    HA   ARG  17           HA       ARG  17   4.960 -17.925 -12.705
  151    HB2  ARG  17          2HB       ARG  17   2.750 -19.291 -13.713
  152    HB3  ARG  17          3HB       ARG  17   3.497 -18.565 -15.130
  153    HG2  ARG  17          2HG       ARG  17   5.554 -19.672 -14.719
  154    HG3  ARG  17          3HG       ARG  17   5.024 -20.196 -13.120
  155    HD2  ARG  17          2HD       ARG  17   3.356 -21.640 -14.105
  156    HD3  ARG  17          3HD       ARG  17   3.751 -21.046 -15.717
  157    HE   ARG  17           HE       ARG  17   6.038 -22.146 -14.448
  158   HH11  ARG  17          1HH1      ARG  17   3.077 -23.024 -16.054
  159   HH12  ARG  17          2HH1      ARG  17   3.676 -24.555 -16.603
  160   HH21  ARG  17          1HH2      ARG  17   6.838 -24.158 -15.164
  161   HH22  ARG  17          2HH2      ARG  17   5.815 -25.199 -16.095
  162    H    LEU  18           H        LEU  18   2.543 -15.796 -14.004
  163    HA   LEU  18           HA       LEU  18   4.552 -14.570 -15.770
  164    HB2  LEU  18          2HB       LEU  18   1.577 -14.758 -15.877
  165    HB3  LEU  18          3HB       LEU  18   2.381 -13.389 -16.642
  166    HG   LEU  18           HG       LEU  18   3.345 -16.110 -17.340
  167   HD11  LEU  18          1HD1      LEU  18   1.373 -15.642 -19.203
  168   HD12  LEU  18          2HD1      LEU  18   0.589 -15.251 -17.673
  169   HD13  LEU  18          3HD1      LEU  18   1.319 -16.839 -17.909
  170   HD21  LEU  18          1HD2      LEU  18   4.133 -13.757 -18.172
  171   HD22  LEU  18          2HD2      LEU  18   2.733 -13.890 -19.236
  172   HD23  LEU  18          3HD2      LEU  18   4.007 -15.109 -19.299
  173    H    PHE  19           H        PHE  19   2.489 -14.065 -13.037
  174    HA   PHE  19           HA       PHE  19   2.692 -11.201 -13.038
  175    HB2  PHE  19          2HB       PHE  19   1.385 -13.258 -11.415
  176    HB3  PHE  19          3HB       PHE  19   2.004 -11.911 -10.465
  177    HD1  PHE  19           HD1      PHE  19   1.426  -9.530 -11.433
  178    HD2  PHE  19           HD2      PHE  19  -0.725 -13.099 -12.303
  179    HE1  PHE  19           HE1      PHE  19  -0.542  -8.189 -12.051
  180    HE2  PHE  19           HE2      PHE  19  -2.696 -11.764 -12.923
  181    HZ   PHE  19           HZ       PHE  19  -2.606  -9.306 -12.798
  182    H    ARG  20           H        ARG  20   4.579 -13.834 -11.838
  183    HA   ARG  20           HA       ARG  20   5.945 -12.676  -9.723
  184    HB2  ARG  20          2HB       ARG  20   6.101 -15.054 -11.080
  185    HB3  ARG  20          3HB       ARG  20   7.633 -14.297 -11.496
  186    HG2  ARG  20          2HG       ARG  20   6.716 -14.455  -8.651
  187    HG3  ARG  20          3HG       ARG  20   7.528 -15.815  -9.430
  188    HD2  ARG  20          2HD       ARG  20   8.946 -13.372  -9.956
  189    HD3  ARG  20          3HD       ARG  20   8.704 -13.572  -8.221
  190    HE   ARG  20           HE       ARG  20   9.620 -15.989  -9.357
  191   HH11  ARG  20          1HH1      ARG  20  10.707 -12.793  -8.508
  192   HH12  ARG  20          2HH1      ARG  20  12.352 -13.277  -8.258
  193   HH21  ARG  20          1HH2      ARG  20  11.782 -16.639  -9.031
  194   HH22  ARG  20          2HH2      ARG  20  12.962 -15.465  -8.557
  195    H    ARG  21           H        ARG  21   6.351 -12.226 -13.170
  196    HA   ARG  21           HA       ARG  21   8.844 -10.827 -12.962
  197    HB2  ARG  21          2HB       ARG  21   8.668 -10.470 -15.301
  198    HB3  ARG  21          3HB       ARG  21   8.013 -12.075 -15.001
  199    HG2  ARG  21          2HG       ARG  21   6.311 -11.391 -16.272
  200    HG3  ARG  21          3HG       ARG  21   5.778 -10.533 -14.825
  201    HD2  ARG  21          2HD       ARG  21   5.770  -9.045 -16.743
  202    HD3  ARG  21          3HD       ARG  21   6.990  -8.538 -15.576
  203    HE   ARG  21           HE       ARG  21   8.395 -10.088 -17.279
  204   HH11  ARG  21          1HH1      ARG  21   6.223  -7.409 -17.747
  205   HH12  ARG  21          2HH1      ARG  21   7.010  -6.853 -19.187
  206   HH21  ARG  21          1HH2      ARG  21   9.441  -9.367 -19.174
  207   HH22  ARG  21          2HH2      ARG  21   8.840  -7.968 -19.998
  208    H    ASN  22           H        ASN  22   5.492  -9.977 -12.766
  209    HA   ASN  22           HA       ASN  22   5.965  -7.148 -13.166
  210    HB2  ASN  22          2HB       ASN  22   3.676  -8.898 -13.128
  211    HB3  ASN  22          3HB       ASN  22   3.406  -7.534 -12.047
  212   HD21  ASN  22          1HD2      ASN  22   3.964  -5.373 -12.996
  213   HD22  ASN  22          2HD2      ASN  22   3.515  -5.102 -14.642
  214    H    PHE  23           H        PHE  23   5.515  -9.387 -10.513
  215    HA   PHE  23           HA       PHE  23   4.947  -7.658  -8.429
  216    HB2  PHE  23          2HB       PHE  23   6.108 -10.339  -8.695
  217    HB3  PHE  23          3HB       PHE  23   6.632  -9.482  -7.250
  218    HD1  PHE  23           HD1      PHE  23   4.715  -8.353  -5.869
  219    HD2  PHE  23           HD2      PHE  23   4.147 -11.538  -8.634
  220    HE1  PHE  23           HE1      PHE  23   2.602  -8.941  -4.753
  221    HE2  PHE  23           HE2      PHE  23   2.033 -12.131  -7.523
  222    HZ   PHE  23           HZ       PHE  23   1.258 -10.831  -5.581
  223    H    GLY  24           H        GLY  24   7.948  -8.181 -10.122
  224    HA2  GLY  24          2HA       GLY  24   9.769  -7.143  -8.277
  225    HA3  GLY  24          3HA       GLY  24   9.967  -7.096 -10.023
  226    H    TYR  25           H        TYR  25   7.350  -5.528 -10.124
  227    HA   TYR  25           HA       TYR  25   8.608  -2.929  -9.927
  228    HB2  TYR  25          2HB       TYR  25   6.114  -4.011 -11.148
  229    HB3  TYR  25          3HB       TYR  25   6.150  -2.299 -10.738
  230    HD1  TYR  25           HD1      TYR  25   8.829  -4.527 -12.074
  231    HD2  TYR  25           HD2      TYR  25   6.336  -1.145 -12.743
  232    HE1  TYR  25           HE1      TYR  25  10.037  -4.058 -14.164
  233    HE2  TYR  25           HE2      TYR  25   7.536  -0.667 -14.836
  234    HH   TYR  25           HH       TYR  25   9.482  -1.129 -15.988
  235    H    THR  26           H        THR  26   6.293  -4.832  -8.176
  236    HA   THR  26           HA       THR  26   5.393  -2.566  -6.586
  237    HB   THR  26           HB       THR  26   4.263  -4.653  -5.331
  238    HG1  THR  26           HG1      THR  26   5.353  -6.117  -6.834
  239   HG21  THR  26          1HG2      THR  26   3.491  -2.777  -7.360
  240   HG22  THR  26          2HG2      THR  26   2.518  -3.481  -6.068
  241   HG23  THR  26          3HG2      THR  26   2.658  -4.309  -7.618
  242    H    LEU  27           H        LEU  27   7.503  -5.347  -6.333
  243    HA   LEU  27           HA       LEU  27   7.892  -5.100  -3.498
  244    HB2  LEU  27          2HB       LEU  27   8.994  -6.782  -5.681
  245    HB3  LEU  27          3HB       LEU  27   9.959  -6.608  -4.217
  246    HG   LEU  27           HG       LEU  27   7.114  -7.608  -4.264
  247   HD11  LEU  27          1HD1      LEU  27   8.328  -9.806  -3.694
  248   HD12  LEU  27          2HD1      LEU  27   9.737  -9.043  -4.430
  249   HD13  LEU  27          3HD1      LEU  27   8.269  -9.286  -5.378
  250   HD21  LEU  27          1HD2      LEU  27   7.860  -8.479  -1.990
  251   HD22  LEU  27          2HD2      LEU  27   7.570  -6.745  -2.128
  252   HD23  LEU  27          3HD2      LEU  27   9.221  -7.367  -2.136
  253    H    ARG  28           H        ARG  28   9.451  -3.910  -6.388
  254    HA   ARG  28           HA       ARG  28  11.425  -2.519  -4.698
  255    HB2  ARG  28          2HB       ARG  28  11.870  -4.238  -6.885
  256    HB3  ARG  28          3HB       ARG  28  12.208  -2.613  -7.467
  257    HG2  ARG  28          2HG       ARG  28  13.512  -2.563  -5.107
  258    HG3  ARG  28          3HG       ARG  28  13.662  -4.271  -5.526
  259    HD2  ARG  28          2HD       ARG  28  14.253  -2.179  -7.575
  260    HD3  ARG  28          3HD       ARG  28  15.453  -2.557  -6.340
  261    HE   ARG  28           HE       ARG  28  14.799  -4.129  -8.617
  262   HH11  ARG  28          1HH1      ARG  28  15.786  -4.341  -5.285
  263   HH12  ARG  28          2HH1      ARG  28  16.563  -5.877  -5.477
  264   HH21  ARG  28          1HH2      ARG  28  15.820  -6.151  -8.882
  265   HH22  ARG  28          2HH2      ARG  28  16.583  -6.906  -7.524
  Start of MODEL    2
    1    H1   LYS   1           H        LYS   1  -9.190   1.850  -2.351
    2    HA   LYS   1           HA       LYS   1  -9.463   1.392   0.497
    3    HB2  LYS   1          2HB       LYS   1 -11.227   2.804  -1.509
    4    HB3  LYS   1          3HB       LYS   1 -11.599   2.678   0.206
    5    HG2  LYS   1          2HG       LYS   1  -9.074   3.925  -0.847
    6    HG3  LYS   1          3HG       LYS   1 -10.550   4.835  -0.520
    7    HD2  LYS   1          2HD       LYS   1 -10.465   3.932   1.825
    8    HD3  LYS   1          3HD       LYS   1  -8.866   3.289   1.444
    9    HE2  LYS   1          2HE       LYS   1  -9.633   6.194   1.194
   10    HE3  LYS   1          3HE       LYS   1  -8.839   5.498   2.605
   11    HZ1  LYS   1          1HZ       LYS   1  -7.616   5.066  -0.019
   12    HZ2  LYS   1          2HZ       LYS   1  -6.885   5.239   1.496
   13    HZ3  LYS   1          3HZ       LYS   1  -7.471   6.600   0.679
   14    H    TYR   2           H        TYR   2 -10.100  -0.384  -2.218
   15    HA   TYR   2           HA       TYR   2 -12.301  -1.825  -0.889
   16    HB2  TYR   2          2HB       TYR   2 -13.094  -0.779  -2.940
   17    HB3  TYR   2          3HB       TYR   2 -11.779  -1.512  -3.852
   18    HD1  TYR   2           HD1      TYR   2 -13.988  -3.053  -1.280
   19    HD2  TYR   2           HD2      TYR   2 -12.848  -2.918  -5.377
   20    HE1  TYR   2           HE1      TYR   2 -15.403  -5.013  -1.732
   21    HE2  TYR   2           HE2      TYR   2 -14.261  -4.877  -5.840
   22    HH   TYR   2           HH       TYR   2 -15.610  -6.798  -3.359
   23    H    GLU   3           H        GLU   3 -10.192  -2.608  -3.639
   24    HA   GLU   3           HA       GLU   3  -9.824  -5.288  -2.733
   25    HB2  GLU   3          2HB       GLU   3  -9.154  -3.712  -5.089
   26    HB3  GLU   3          3HB       GLU   3  -7.860  -4.814  -4.638
   27    HG2  GLU   3          2HG       GLU   3  -8.949  -6.498  -5.557
   28    HG3  GLU   3          3HG       GLU   3 -10.316  -6.225  -4.479
   29    H    ILE   4           H        ILE   4  -8.417  -2.400  -1.823
   30    HA   ILE   4           HA       ILE   4  -5.715  -3.061  -1.489
   31    HB   ILE   4           HB       ILE   4  -5.674  -1.304   0.256
   32   HG12  ILE   4          2HG1      ILE   4  -7.986  -0.009   0.316
   33   HG13  ILE   4          3HG1      ILE   4  -8.632  -1.611  -0.024
   34   HG21  ILE   4          1HG2      ILE   4  -6.928  -0.838  -2.412
   35   HG22  ILE   4          2HG2      ILE   4  -6.717   0.513  -1.299
   36   HG23  ILE   4          3HG2      ILE   4  -5.316  -0.412  -1.838
   37   HD11  ILE   4          1HD1      ILE   4  -8.325  -2.277   2.071
   38   HD12  ILE   4          2HD1      ILE   4  -6.684  -1.632   2.124
   39   HD13  ILE   4          3HD1      ILE   4  -8.058  -0.576   2.454
   40    H    THR   5           H        THR   5  -8.534  -3.989   0.293
   41    HA   THR   5           HA       THR   5  -7.184  -4.765   2.691
   42    HB   THR   5           HB       THR   5  -9.629  -6.234   2.301
   43    HG1  THR   5           HG1      THR   5 -10.321  -4.703   0.862
   44   HG21  THR   5          1HG2      THR   5  -8.529  -5.436   4.439
   45   HG22  THR   5          2HG2      THR   5 -10.269  -5.173   4.325
   46   HG23  THR   5          3HG2      THR   5  -9.154  -3.833   4.057
   47    H    THR   6           H        THR   6  -7.970  -6.321  -0.336
   48    HA   THR   6           HA       THR   6  -7.193  -8.945   0.656
   49    HB   THR   6           HB       THR   6  -7.508  -9.354  -1.991
   50    HG1  THR   6           HG1      THR   6  -9.497  -7.418  -1.507
   51   HG21  THR   6          1HG2      THR   6  -9.002 -10.692  -1.013
   52   HG22  THR   6          2HG2      THR   6 -10.135  -9.340  -1.039
   53   HG23  THR   6          3HG2      THR   6  -9.130  -9.621   0.382
   54    H    ILE   7           H        ILE   7  -5.121  -9.487   0.733
   55    HA   ILE   7           HA       ILE   7  -3.316  -8.437  -1.348
   56    HB   ILE   7           HB       ILE   7  -2.616  -9.111   1.512
   57   HG12  ILE   7          2HG1      ILE   7  -2.119  -6.396   0.538
   58   HG13  ILE   7          3HG1      ILE   7  -3.826  -6.826   0.544
   59   HG21  ILE   7          1HG2      ILE   7  -0.900  -7.998  -0.704
   60   HG22  ILE   7          2HG2      ILE   7  -0.400  -8.241   0.969
   61   HG23  ILE   7          3HG2      ILE   7  -0.805  -9.629  -0.040
   62   HD11  ILE   7          1HD1      ILE   7  -2.976  -7.712   2.991
   63   HD12  ILE   7          2HD1      ILE   7  -2.037  -6.237   2.756
   64   HD13  ILE   7          3HD1      ILE   7  -3.798  -6.185   2.671
   65    H    HIS   8           H        HIS   8  -2.929 -10.935   1.147
   66    HA   HIS   8           HA       HIS   8  -1.577 -12.702  -0.606
   67    HB2  HIS   8          2HB       HIS   8  -2.929 -13.513   1.964
   68    HB3  HIS   8          3HB       HIS   8  -1.501 -14.222   1.216
   69    HD1  HIS   8           HD1      HIS   8  -2.322 -12.245   3.981
   70    HD2  HIS   8           HD2      HIS   8   0.619 -11.972   1.059
   71    HE1  HIS   8           HE1      HIS   8  -0.532 -10.778   4.964
   72    H    ASN   9           H        ASN   9  -4.854 -11.997  -0.219
   73    HA   ASN   9           HA       ASN   9  -5.903 -14.591  -0.862
   74    HB2  ASN   9          2HB       ASN   9  -6.972 -11.936  -0.247
   75    HB3  ASN   9          3HB       ASN   9  -7.896 -12.784  -1.483
   76   HD21  ASN   9          1HD2      ASN   9  -9.557 -13.805  -0.660
   77   HD22  ASN   9          2HD2      ASN   9  -9.605 -14.625   0.861
   78    H    LEU  10           H        LEU  10  -4.616 -11.955  -2.638
   79    HA   LEU  10           HA       LEU  10  -5.658 -13.100  -5.145
   80    HB2  LEU  10          2HB       LEU  10  -5.135 -10.857  -6.129
   81    HB3  LEU  10          3HB       LEU  10  -6.450 -10.882  -4.955
   82    HG   LEU  10           HG       LEU  10  -4.660 -10.111  -3.264
   83   HD11  LEU  10          1HD1      LEU  10  -2.594 -10.094  -4.124
   84   HD12  LEU  10          2HD1      LEU  10  -3.083  -8.569  -4.861
   85   HD13  LEU  10          3HD1      LEU  10  -3.179 -10.065  -5.788
   86   HD21  LEU  10          1HD2      LEU  10  -4.915  -7.723  -4.122
   87   HD22  LEU  10          2HD2      LEU  10  -6.395  -8.628  -3.804
   88   HD23  LEU  10          3HD2      LEU  10  -5.824  -8.425  -5.461
   89    H    PHE  11           H        PHE  11  -2.854 -12.263  -3.314
   90    HA   PHE  11           HA       PHE  11  -0.999 -12.370  -5.495
   91    HB2  PHE  11          2HB       PHE  11  -0.806 -12.158  -2.528
   92    HB3  PHE  11          3HB       PHE  11   0.614 -12.711  -3.408
   93    HD1  PHE  11           HD1      PHE  11  -0.813  -9.933  -2.018
   94    HD2  PHE  11           HD2      PHE  11   0.989 -11.200  -5.660
   95    HE1  PHE  11           HE1      PHE  11  -0.237  -7.599  -2.541
   96    HE2  PHE  11           HE2      PHE  11   1.570  -8.868  -6.188
   97    HZ   PHE  11           HZ       PHE  11   0.957  -7.064  -4.627
   98    H    ARG  12           H        ARG  12  -2.034 -14.469  -6.250
   99    HA   ARG  12           HA       ARG  12  -0.647 -16.743  -4.988
  100    HB2  ARG  12          2HB       ARG  12  -3.366 -16.598  -6.276
  101    HB3  ARG  12          3HB       ARG  12  -2.521 -18.125  -6.060
  102    HG2  ARG  12          2HG       ARG  12  -2.343 -17.178  -3.565
  103    HG3  ARG  12          3HG       ARG  12  -3.836 -16.385  -4.075
  104    HD2  ARG  12          2HD       ARG  12  -4.795 -18.528  -4.686
  105    HD3  ARG  12          3HD       ARG  12  -3.287 -19.343  -4.275
  106    HE   ARG  12           HE       ARG  12  -3.914 -19.294  -2.081
  107   HH11  ARG  12          1HH1      ARG  12  -5.793 -16.948  -3.838
  108   HH12  ARG  12          2HH1      ARG  12  -6.816 -16.567  -2.492
  109   HH21  ARG  12          1HH2      ARG  12  -5.255 -18.801  -0.302
  110   HH22  ARG  12          2HH2      ARG  12  -6.508 -17.621  -0.482
  111    H    LYS  13           H        LYS  13  -2.392 -16.467  -8.060
  112    HA   LYS  13           HA       LYS  13   0.124 -17.109  -9.456
  113    HB2  LYS  13          2HB       LYS  13  -1.202 -18.395 -11.077
  114    HB3  LYS  13          3HB       LYS  13  -1.360 -19.043  -9.450
  115    HG2  LYS  13          2HG       LYS  13  -3.518 -17.873  -9.225
  116    HG3  LYS  13          3HG       LYS  13  -3.363 -17.319 -10.893
  117    HD2  LYS  13          2HD       LYS  13  -2.953 -20.010 -11.144
  118    HD3  LYS  13          3HD       LYS  13  -4.142 -19.939  -9.841
  119    HE2  LYS  13          2HE       LYS  13  -5.150 -18.135 -11.622
  120    HE3  LYS  13          3HE       LYS  13  -4.424 -19.331 -12.695
  121    HZ1  LYS  13          1HZ       LYS  13  -6.361 -19.943 -10.528
  122    HZ2  LYS  13          2HZ       LYS  13  -5.709 -21.051 -11.627
  123    HZ3  LYS  13          3HZ       LYS  13  -6.747 -19.831 -12.171
  124    H    LEU  14           H        LEU  14  -3.005 -15.482  -9.640
  125    HA   LEU  14           HA       LEU  14  -2.731 -14.328 -12.170
  126    HB2  LEU  14          2HB       LEU  14  -4.291 -12.557 -11.221
  127    HB3  LEU  14          3HB       LEU  14  -4.856 -14.227 -11.211
  128    HG   LEU  14           HG       LEU  14  -3.538 -13.506  -8.725
  129   HD11  LEU  14          1HD1      LEU  14  -5.432 -12.055  -7.953
  130   HD12  LEU  14          2HD1      LEU  14  -5.889 -11.867  -9.646
  131   HD13  LEU  14          3HD1      LEU  14  -4.318 -11.291  -9.087
  132   HD21  LEU  14          1HD2      LEU  14  -6.009 -14.190  -8.030
  133   HD22  LEU  14          2HD2      LEU  14  -4.805 -15.384  -8.518
  134   HD23  LEU  14          3HD2      LEU  14  -6.018 -14.829  -9.674
  135    H    THR  15           H        THR  15  -1.113 -13.647  -9.234
  136    HA   THR  15           HA       THR  15  -0.272 -10.993 -10.141
  137    HB   THR  15           HB       THR  15   0.769 -10.755  -7.926
  138    HG1  THR  15           HG1      THR  15  -0.098 -13.440  -7.665
  139   HG21  THR  15          1HG2      THR  15  -2.089 -11.727  -7.792
  140   HG22  THR  15          2HG2      THR  15  -1.573 -10.096  -8.219
  141   HG23  THR  15          3HG2      THR  15  -1.285 -10.715  -6.593
  142    H    HIS  16           H        HIS  16   1.269 -13.933  -8.824
  143    HA   HIS  16           HA       HIS  16   3.889 -13.237  -9.537
  144    HB2  HIS  16          2HB       HIS  16   2.496 -15.716  -8.703
  145    HB3  HIS  16          3HB       HIS  16   4.027 -15.931  -9.546
  146    HD1  HIS  16           HD1      HIS  16   3.008 -13.416  -6.872
  147    HD2  HIS  16           HD2      HIS  16   5.858 -16.348  -7.606
  148    HE1  HIS  16           HE1      HIS  16   4.567 -13.347  -4.900
  149    H    ARG  17           H        ARG  17   1.269 -14.304 -11.445
  150    HA   ARG  17           HA       ARG  17   2.448 -15.737 -13.487
  151    HB2  ARG  17          2HB       ARG  17   0.035 -14.124 -13.160
  152    HB3  ARG  17          3HB       ARG  17   0.638 -14.121 -14.812
  153    HG2  ARG  17          2HG       ARG  17   0.508 -16.505 -14.936
  154    HG3  ARG  17          3HG       ARG  17   0.123 -16.620 -13.217
  155    HD2  ARG  17          2HD       ARG  17  -2.044 -16.289 -13.606
  156    HD3  ARG  17          3HD       ARG  17  -1.711 -14.857 -14.579
  157    HE   ARG  17           HE       ARG  17  -1.099 -16.965 -16.209
  158   HH11  ARG  17          1HH1      ARG  17  -3.910 -15.949 -14.424
  159   HH12  ARG  17          2HH1      ARG  17  -5.034 -16.651 -15.541
  160   HH21  ARG  17          1HH2      ARG  17  -2.568 -17.893 -17.687
  161   HH22  ARG  17          2HH2      ARG  17  -4.269 -17.757 -17.396
  162    H    LEU  18           H        LEU  18   2.351 -12.237 -13.014
  163    HA   LEU  18           HA       LEU  18   4.308 -11.965 -15.201
  164    HB2  LEU  18          2HB       LEU  18   3.451  -9.676 -15.520
  165    HB3  LEU  18          3HB       LEU  18   2.247 -10.921 -15.847
  166    HG   LEU  18           HG       LEU  18   1.761 -10.290 -13.218
  167   HD11  LEU  18          1HD1      LEU  18   3.361  -8.223 -14.122
  168   HD12  LEU  18          2HD1      LEU  18   2.291  -8.188 -12.721
  169   HD13  LEU  18          3HD1      LEU  18   1.720  -7.595 -14.280
  170   HD21  LEU  18          1HD2      LEU  18  -0.181 -10.404 -14.320
  171   HD22  LEU  18          2HD2      LEU  18   0.535  -9.840 -15.829
  172   HD23  LEU  18          3HD2      LEU  18   0.034  -8.676 -14.602
  173    H    PHE  19           H        PHE  19   3.359 -11.019 -11.967
  174    HA   PHE  19           HA       PHE  19   5.296  -9.055 -11.483
  175    HB2  PHE  19          2HB       PHE  19   3.248  -9.863 -10.052
  176    HB3  PHE  19          3HB       PHE  19   4.436 -10.932  -9.313
  177    HD1  PHE  19           HD1      PHE  19   2.924  -7.780  -9.146
  178    HD2  PHE  19           HD2      PHE  19   6.652  -9.742  -8.538
  179    HE1  PHE  19           HE1      PHE  19   3.644  -5.948  -7.670
  180    HE2  PHE  19           HE2      PHE  19   7.378  -7.913  -7.060
  181    HZ   PHE  19           HZ       PHE  19   5.873  -6.013  -6.624
  182    H    ARG  20           H        ARG  20   5.469 -12.548 -11.422
  183    HA   ARG  20           HA       ARG  20   8.239 -12.422 -10.459
  184    HB2  ARG  20          2HB       ARG  20   6.268 -14.056  -9.634
  185    HB3  ARG  20          3HB       ARG  20   6.929 -15.039 -10.934
  186    HG2  ARG  20          2HG       ARG  20   9.186 -14.263  -9.610
  187    HG3  ARG  20          3HG       ARG  20   8.019 -14.429  -8.296
  188    HD2  ARG  20          2HD       ARG  20   8.668 -16.591  -8.373
  189    HD3  ARG  20          3HD       ARG  20   7.479 -16.671  -9.672
  190    HE   ARG  20           HE       ARG  20   9.850 -15.952 -10.872
  191   HH11  ARG  20          1HH1      ARG  20   8.689 -18.625  -8.966
  192   HH12  ARG  20          2HH1      ARG  20   9.750 -19.780  -9.703
  193   HH21  ARG  20          1HH2      ARG  20  11.251 -17.463 -11.849
  194   HH22  ARG  20          2HH2      ARG  20  11.207 -19.118 -11.342
  195    H    ARG  21           H        ARG  21   7.597 -11.559 -13.108
  196    HA   ARG  21           HA       ARG  21   8.891 -13.671 -14.706
  197    HB2  ARG  21          2HB       ARG  21   6.691 -13.263 -15.569
  198    HB3  ARG  21          3HB       ARG  21   6.939 -11.522 -15.532
  199    HG2  ARG  21          2HG       ARG  21   7.788 -11.539 -17.576
  200    HG3  ARG  21          3HG       ARG  21   8.961 -12.781 -17.136
  201    HD2  ARG  21          2HD       ARG  21   7.712 -14.450 -17.999
  202    HD3  ARG  21          3HD       ARG  21   6.193 -13.719 -17.483
  203    HE   ARG  21           HE       ARG  21   7.352 -12.237 -19.603
  204   HH11  ARG  21          1HH1      ARG  21   5.636 -15.190 -18.924
  205   HH12  ARG  21          2HH1      ARG  21   4.927 -15.293 -20.501
  206   HH21  ARG  21          1HH2      ARG  21   6.424 -12.363 -21.683
  207   HH22  ARG  21          2HH2      ARG  21   5.377 -13.685 -22.070
  208    H    ASN  22           H        ASN  22   8.412 -10.184 -15.211
  209    HA   ASN  22           HA       ASN  22  11.256  -9.956 -15.869
  210    HB2  ASN  22          2HB       ASN  22   8.804  -8.617 -16.749
  211    HB3  ASN  22          3HB       ASN  22  10.124  -7.501 -16.415
  212   HD21  ASN  22          1HD2      ASN  22   8.848  -9.820 -18.554
  213   HD22  ASN  22          2HD2      ASN  22  10.129  -9.798 -19.713
  214    H    PHE  23           H        PHE  23   8.841  -8.813 -13.616
  215    HA   PHE  23           HA       PHE  23  10.238  -6.662 -12.493
  216    HB2  PHE  23          2HB       PHE  23   7.922  -8.305 -11.789
  217    HB3  PHE  23          3HB       PHE  23   8.803  -7.716 -10.383
  218    HD1  PHE  23           HD1      PHE  23   8.881  -5.371  -9.854
  219    HD2  PHE  23           HD2      PHE  23   6.830  -6.765 -13.313
  220    HE1  PHE  23           HE1      PHE  23   7.776  -3.184 -10.076
  221    HE2  PHE  23           HE2      PHE  23   5.722  -4.580 -13.541
  222    HZ   PHE  23           HZ       PHE  23   6.195  -2.786 -11.922
  223    H    GLY  24           H        GLY  24  10.636 -10.084 -12.137
  224    HA2  GLY  24          2HA       GLY  24  11.881 -10.283  -9.664
  225    HA3  GLY  24          3HA       GLY  24  12.226 -11.323 -11.038
  226    H    TYR  25           H        TYR  25  13.105  -8.949 -12.632
  227    HA   TYR  25           HA       TYR  25  15.865  -9.037 -11.823
  228    HB2  TYR  25          2HB       TYR  25  14.350  -7.962 -14.155
  229    HB3  TYR  25          3HB       TYR  25  15.948  -7.299 -13.833
  230    HD1  TYR  25           HD1      TYR  25  14.677 -10.785 -13.460
  231    HD2  TYR  25           HD2      TYR  25  17.337  -8.155 -15.487
  232    HE1  TYR  25           HE1      TYR  25  15.699 -12.709 -14.602
  233    HE2  TYR  25           HE2      TYR  25  18.365 -10.072 -16.636
  234    HH   TYR  25           HH       TYR  25  17.281 -13.394 -15.998
  235    H    THR  26           H        THR  26  13.215  -6.786 -11.600
  236    HA   THR  26           HA       THR  26  14.906  -4.572 -10.811
  237    HB   THR  26           HB       THR  26  12.445  -3.687 -10.188
  238    HG1  THR  26           HG1      THR  26  11.609  -5.832 -10.837
  239   HG21  THR  26          1HG2      THR  26  12.383  -3.236 -12.854
  240   HG22  THR  26          2HG2      THR  26  14.072  -3.700 -12.647
  241   HG23  THR  26          3HG2      THR  26  13.411  -2.346 -11.731
  242    H    LEU  27           H        LEU  27  12.917  -7.014  -9.296
  243    HA   LEU  27           HA       LEU  27  12.715  -5.840  -6.738
  244    HB2  LEU  27          2HB       LEU  27  12.570  -8.683  -7.698
  245    HB3  LEU  27          3HB       LEU  27  12.365  -8.251  -6.002
  246    HG   LEU  27           HG       LEU  27  10.623  -7.214  -8.234
  247   HD11  LEU  27          1HD1      LEU  27   9.029  -8.848  -7.718
  248   HD12  LEU  27          2HD1      LEU  27   9.863  -9.323  -6.239
  249   HD13  LEU  27          3HD1      LEU  27  10.555  -9.728  -7.810
  250   HD21  LEU  27          1HD2      LEU  27  10.934  -6.541  -5.455
  251   HD22  LEU  27          2HD2      LEU  27   9.313  -7.166  -5.764
  252   HD23  LEU  27          3HD2      LEU  27   9.918  -5.788  -6.685
  253    H    ARG  28           H        ARG  28  15.202  -7.739  -8.296
  254    HA   ARG  28           HA       ARG  28  16.685  -8.581  -6.109
  255    HB2  ARG  28          2HB       ARG  28  17.044  -9.090  -8.592
  256    HB3  ARG  28          3HB       ARG  28  17.939  -7.578  -8.657
  257    HG2  ARG  28          2HG       ARG  28  19.039  -8.887  -6.491
  258    HG3  ARG  28          3HG       ARG  28  18.747 -10.176  -7.661
  259    HD2  ARG  28          2HD       ARG  28  19.870  -8.667  -9.370
  260    HD3  ARG  28          3HD       ARG  28  20.391  -7.682  -8.004
  261    HE   ARG  28           HE       ARG  28  21.107 -10.348  -7.518
  262   HH11  ARG  28          1HH1      ARG  28  21.922  -7.710  -9.637
  263   HH12  ARG  28          2HH1      ARG  28  23.559  -8.228  -9.867
  264   HH21  ARG  28          1HH2      ARG  28  23.260 -11.041  -7.812
  265   HH22  ARG  28          2HH2      ARG  28  24.319 -10.124  -8.829
  Start of MODEL    3
    1    H1   LYS   1           H        LYS   1  -7.032  -1.011   2.085
    2    HA   LYS   1           HA       LYS   1  -8.073  -2.655   0.445
    3    HB2  LYS   1          2HB       LYS   1  -9.333   0.039   0.955
    4    HB3  LYS   1          3HB       LYS   1 -10.193  -1.283   0.176
    5    HG2  LYS   1          2HG       LYS   1  -8.912  -2.039   2.688
    6    HG3  LYS   1          3HG       LYS   1 -10.140  -0.782   2.859
    7    HD2  LYS   1          2HD       LYS   1 -11.589  -2.333   1.377
    8    HD3  LYS   1          3HD       LYS   1 -10.428  -3.583   1.831
    9    HE2  LYS   1          2HE       LYS   1 -10.944  -3.343   4.135
   10    HE3  LYS   1          3HE       LYS   1 -11.858  -1.864   3.846
   11    HZ1  LYS   1          1HZ       LYS   1 -13.609  -3.038   2.906
   12    HZ2  LYS   1          2HZ       LYS   1 -13.148  -4.018   4.205
   13    HZ3  LYS   1          3HZ       LYS   1 -12.681  -4.426   2.631
   14    H    TYR   2           H        TYR   2  -6.254  -0.222  -0.773
   15    HA   TYR   2           HA       TYR   2  -7.406  -0.532  -3.469
   16    HB2  TYR   2          2HB       TYR   2  -6.793   1.856  -1.999
   17    HB3  TYR   2          3HB       TYR   2  -5.761   1.771  -3.423
   18    HD1  TYR   2           HD1      TYR   2  -6.922   1.342  -5.684
   19    HD2  TYR   2           HD2      TYR   2  -8.991   2.610  -2.190
   20    HE1  TYR   2           HE1      TYR   2  -8.777   2.147  -7.083
   21    HE2  TYR   2           HE2      TYR   2 -10.853   3.417  -3.578
   22    HH   TYR   2           HH       TYR   2 -10.725   3.218  -7.121
   23    H    GLU   3           H        GLU   3  -4.341   0.876  -2.386
   24    HA   GLU   3           HA       GLU   3  -2.942  -1.006  -4.153
   25    HB2  GLU   3          2HB       GLU   3  -2.416   1.784  -3.259
   26    HB3  GLU   3          3HB       GLU   3  -1.027   0.760  -3.593
   27    HG2  GLU   3          2HG       GLU   3  -2.227   0.265  -5.826
   28    HG3  GLU   3          3HG       GLU   3  -3.156   1.717  -5.456
   29    H    ILE   4           H        ILE   4  -3.764  -0.836  -1.030
   30    HA   ILE   4           HA       ILE   4  -1.185  -1.823  -0.022
   31    HB   ILE   4           HB       ILE   4  -2.364  -1.595   2.246
   32   HG12  ILE   4          2HG1      ILE   4  -4.607  -1.219   0.878
   33   HG13  ILE   4          3HG1      ILE   4  -4.341  -0.440   2.434
   34   HG21  ILE   4          1HG2      ILE   4  -1.604   0.760   0.538
   35   HG22  ILE   4          2HG2      ILE   4  -1.940   0.896   2.264
   36   HG23  ILE   4          3HG2      ILE   4  -0.606  -0.111   1.702
   37   HD11  ILE   4          1HD1      ILE   4  -3.549   0.962  -0.073
   38   HD12  ILE   4          2HD1      ILE   4  -5.239   0.933   0.430
   39   HD13  ILE   4          3HD1      ILE   4  -4.015   1.629   1.491
   40    H    THR   5           H        THR   5  -4.305  -2.814  -0.946
   41    HA   THR   5           HA       THR   5  -4.201  -5.263   0.647
   42    HB   THR   5           HB       THR   5  -6.439  -5.603  -0.784
   43    HG1  THR   5           HG1      THR   5  -5.924  -3.471  -1.818
   44   HG21  THR   5          1HG2      THR   5  -6.313  -5.558   1.652
   45   HG22  THR   5          2HG2      THR   5  -7.670  -4.585   1.085
   46   HG23  THR   5          3HG2      THR   5  -6.186  -3.800   1.626
   47    H    THR   6           H        THR   6  -2.502  -4.504  -1.802
   48    HA   THR   6           HA       THR   6  -3.255  -6.511  -3.747
   49    HB   THR   6           HB       THR   6  -0.836  -5.790  -4.613
   50    HG1  THR   6           HG1      THR   6  -0.089  -4.301  -3.291
   51   HG21  THR   6          1HG2      THR   6  -1.920  -4.028  -5.928
   52   HG22  THR   6          2HG2      THR   6  -3.297  -4.050  -4.826
   53   HG23  THR   6          3HG2      THR   6  -2.939  -5.462  -5.820
   54    H    ILE   7           H        ILE   7  -3.119  -8.221  -2.022
   55    HA   ILE   7           HA       ILE   7  -0.357  -9.232  -1.823
   56    HB   ILE   7           HB       ILE   7  -2.619  -9.656   0.134
   57   HG12  ILE   7          2HG1      ILE   7  -0.750  -8.537   1.628
   58   HG13  ILE   7          3HG1      ILE   7  -0.207  -7.887   0.085
   59   HG21  ILE   7          1HG2      ILE   7  -1.354 -11.653   0.086
   60   HG22  ILE   7          2HG2      ILE   7   0.171 -10.771   0.019
   61   HG23  ILE   7          3HG2      ILE   7  -0.794 -10.752   1.495
   62   HD11  ILE   7          1HD1      ILE   7  -3.068  -7.612   0.869
   63   HD12  ILE   7          2HD1      ILE   7  -1.855  -6.539   1.569
   64   HD13  ILE   7          3HD1      ILE   7  -2.083  -6.591  -0.179
   65    H    HIS   8           H        HIS   8  -3.573 -10.646  -1.253
   66    HA   HIS   8           HA       HIS   8  -2.868 -12.776  -3.164
   67    HB2  HIS   8          2HB       HIS   8  -3.890 -12.879  -0.430
   68    HB3  HIS   8          3HB       HIS   8  -4.858 -13.827  -1.554
   69    HD1  HIS   8           HD1      HIS   8  -1.133 -13.478  -1.916
   70    HD2  HIS   8           HD2      HIS   8  -3.932 -16.282  -0.666
   71    HE1  HIS   8           HE1      HIS   8   0.143 -15.628  -1.646
   72    H    ASN   9           H        ASN   9  -5.270 -10.496  -2.103
   73    HA   ASN   9           HA       ASN   9  -7.559 -11.413  -3.339
   74    HB2  ASN   9          2HB       ASN   9  -6.543  -8.813  -2.443
   75    HB3  ASN   9          3HB       ASN   9  -7.705  -8.697  -3.762
   76   HD21  ASN   9          1HD2      ASN   9  -9.012  -7.612  -2.144
   77   HD22  ASN   9          2HD2      ASN   9  -9.972  -8.561  -1.066
   78    H    LEU  10           H        LEU  10  -5.671  -8.770  -4.782
   79    HA   LEU  10           HA       LEU  10  -6.667  -9.001  -7.344
   80    HB2  LEU  10          2HB       LEU  10  -4.011  -8.026  -6.335
   81    HB3  LEU  10          3HB       LEU  10  -4.454  -7.943  -8.038
   82    HG   LEU  10           HG       LEU  10  -6.545  -6.653  -7.097
   83   HD11  LEU  10          1HD1      LEU  10  -4.907  -6.977  -4.769
   84   HD12  LEU  10          2HD1      LEU  10  -6.503  -6.244  -4.920
   85   HD13  LEU  10          3HD1      LEU  10  -5.057  -5.266  -5.168
   86   HD21  LEU  10          1HD2      LEU  10  -4.842  -4.577  -7.036
   87   HD22  LEU  10          2HD2      LEU  10  -5.370  -5.360  -8.526
   88   HD23  LEU  10          3HD2      LEU  10  -3.816  -5.787  -7.808
   89    H    PHE  11           H        PHE  11  -3.523 -10.267  -6.223
   90    HA   PHE  11           HA       PHE  11  -3.692 -12.285  -8.364
   91    HB2  PHE  11          2HB       PHE  11  -1.078 -12.312  -7.855
   92    HB3  PHE  11          3HB       PHE  11  -1.791 -11.169  -8.987
   93    HD1  PHE  11           HD1      PHE  11  -1.744  -8.845  -8.577
   94    HD2  PHE  11           HD2      PHE  11  -0.522 -11.574  -5.548
   95    HE1  PHE  11           HE1      PHE  11  -0.830  -6.975  -7.266
   96    HE2  PHE  11           HE2      PHE  11   0.393  -9.708  -4.231
   97    HZ   PHE  11           HZ       PHE  11   0.239  -7.404  -5.090
   98    H    ARG  12           H        ARG  12  -4.125 -14.244  -7.617
   99    HA   ARG  12           HA       ARG  12  -3.205 -14.964  -4.915
  100    HB2  ARG  12          2HB       ARG  12  -5.732 -15.257  -6.229
  101    HB3  ARG  12          3HB       ARG  12  -5.092 -16.855  -5.868
  102    HG2  ARG  12          2HG       ARG  12  -4.656 -15.382  -3.551
  103    HG3  ARG  12          3HG       ARG  12  -6.260 -14.897  -4.106
  104    HD2  ARG  12          2HD       ARG  12  -7.129 -17.007  -3.868
  105    HD3  ARG  12          3HD       ARG  12  -5.567 -17.792  -4.096
  106    HE   ARG  12           HE       ARG  12  -5.273 -17.729  -1.838
  107   HH11  ARG  12          1HH1      ARG  12  -7.651 -15.341  -2.713
  108   HH12  ARG  12          2HH1      ARG  12  -8.018 -14.917  -1.074
  109   HH21  ARG  12          1HH2      ARG  12  -5.748 -17.179   0.324
  110   HH22  ARG  12          2HH2      ARG  12  -6.934 -15.962   0.653
  111    H    LYS  13           H        LYS  13  -4.124 -16.818  -7.815
  112    HA   LYS  13           HA       LYS  13  -1.932 -18.661  -7.319
  113    HB2  LYS  13          2HB       LYS  13  -2.961 -20.096  -8.912
  114    HB3  LYS  13          3HB       LYS  13  -4.260 -19.414  -7.943
  115    HG2  LYS  13          2HG       LYS  13  -4.205 -17.623  -9.937
  116    HG3  LYS  13          3HG       LYS  13  -3.631 -19.052 -10.800
  117    HD2  LYS  13          2HD       LYS  13  -5.602 -20.210 -10.463
  118    HD3  LYS  13          3HD       LYS  13  -6.038 -19.258  -9.041
  119    HE2  LYS  13          2HE       LYS  13  -6.033 -17.334 -10.931
  120    HE3  LYS  13          3HE       LYS  13  -6.505 -18.726 -11.904
  121    HZ1  LYS  13          1HZ       LYS  13  -7.919 -18.600  -9.422
  122    HZ2  LYS  13          2HZ       LYS  13  -8.520 -18.739 -10.996
  123    HZ3  LYS  13          3HZ       LYS  13  -8.163 -17.213 -10.359
  124    H    LEU  14           H        LEU  14  -2.855 -16.170  -9.593
  125    HA   LEU  14           HA       LEU  14  -0.986 -16.745 -11.620
  126    HB2  LEU  14          2HB       LEU  14  -1.309 -14.375 -12.279
  127    HB3  LEU  14          3HB       LEU  14  -2.808 -15.279 -12.079
  128    HG   LEU  14           HG       LEU  14  -1.964 -13.794  -9.693
  129   HD11  LEU  14          1HD1      LEU  14  -2.282 -12.450 -12.316
  130   HD12  LEU  14          2HD1      LEU  14  -1.310 -11.996 -10.918
  131   HD13  LEU  14          3HD1      LEU  14  -3.049 -11.703 -10.914
  132   HD21  LEU  14          1HD2      LEU  14  -4.085 -14.658  -9.522
  133   HD22  LEU  14          2HD2      LEU  14  -4.457 -14.378 -11.224
  134   HD23  LEU  14          3HD2      LEU  14  -4.436 -13.026 -10.090
  135    H    THR  15           H        THR  15  -0.574 -15.540  -8.473
  136    HA   THR  15           HA       THR  15   1.540 -13.780  -8.646
  137    HB   THR  15           HB       THR  15   2.258 -14.641  -6.408
  138    HG1  THR  15           HG1      THR  15   1.258 -16.854  -7.119
  139   HG21  THR  15          1HG2      THR  15   0.534 -12.923  -6.578
  140   HG22  THR  15          2HG2      THR  15   0.181 -14.021  -5.244
  141   HG23  THR  15          3HG2      THR  15  -0.704 -14.165  -6.762
  142    H    HIS  16           H        HIS  16   1.547 -17.267  -9.002
  143    HA   HIS  16           HA       HIS  16   4.465 -17.249  -9.317
  144    HB2  HIS  16          2HB       HIS  16   4.296 -19.713  -9.162
  145    HB3  HIS  16          3HB       HIS  16   3.629 -18.907  -7.746
  146    HD1  HIS  16           HD1      HIS  16   2.314 -20.314 -11.033
  147    HD2  HIS  16           HD2      HIS  16   1.203 -19.869  -7.054
  148    HE1  HIS  16           HE1      HIS  16   0.090 -21.468 -10.822
  149    H    ARG  17           H        ARG  17   1.507 -17.562 -11.051
  150    HA   ARG  17           HA       ARG  17   2.308 -19.047 -13.272
  151    HB2  ARG  17          2HB       ARG  17  -0.023 -18.462 -12.868
  152    HB3  ARG  17          3HB       ARG  17   0.339 -16.759 -13.115
  153    HG2  ARG  17          2HG       ARG  17   0.494 -16.975 -15.386
  154    HG3  ARG  17          3HG       ARG  17   0.962 -18.674 -15.302
  155    HD2  ARG  17          2HD       ARG  17  -1.149 -19.166 -15.814
  156    HD3  ARG  17          3HD       ARG  17  -1.579 -18.613 -14.196
  157    HE   ARG  17           HE       ARG  17  -2.485 -16.714 -15.114
  158   HH11  ARG  17          1HH1      ARG  17  -0.589 -18.378 -17.513
  159   HH12  ARG  17          2HH1      ARG  17  -1.139 -17.387 -18.824
  160   HH21  ARG  17          1HH2      ARG  17  -3.216 -15.402 -16.832
  161   HH22  ARG  17          2HH2      ARG  17  -2.633 -15.694 -18.435
  162    H    LEU  18           H        LEU  18   1.815 -15.529 -13.425
  163    HA   LEU  18           HA       LEU  18   4.249 -15.353 -15.077
  164    HB2  LEU  18          2HB       LEU  18   1.522 -14.341 -15.496
  165    HB3  LEU  18          3HB       LEU  18   2.806 -13.180 -15.828
  166    HG   LEU  18           HG       LEU  18   2.630 -15.914 -17.090
  167   HD11  LEU  18          1HD1      LEU  18   0.739 -14.293 -17.631
  168   HD12  LEU  18          2HD1      LEU  18   1.654 -14.949 -18.988
  169   HD13  LEU  18          3HD1      LEU  18   1.968 -13.307 -18.424
  170   HD21  LEU  18          1HD2      LEU  18   4.651 -13.870 -17.006
  171   HD22  LEU  18          2HD2      LEU  18   4.085 -14.111 -18.660
  172   HD23  LEU  18          3HD2      LEU  18   4.710 -15.476 -17.733
  173    H    PHE  19           H        PHE  19   2.265 -13.876 -12.598
  174    HA   PHE  19           HA       PHE  19   3.594 -11.447 -12.290
  175    HB2  PHE  19          2HB       PHE  19   1.653 -12.976 -10.836
  176    HB3  PHE  19          3HB       PHE  19   2.849 -12.348  -9.708
  177    HD1  PHE  19           HD1      PHE  19   0.553 -11.327 -12.438
  178    HD2  PHE  19           HD2      PHE  19   2.753 -10.136  -8.995
  179    HE1  PHE  19           HE1      PHE  19  -0.561  -9.134 -12.489
  180    HE2  PHE  19           HE2      PHE  19   1.642  -7.942  -9.040
  181    HZ   PHE  19           HZ       PHE  19  -0.018  -7.438 -10.788
  182    H    ARG  20           H        ARG  20   4.541 -14.656 -11.403
  183    HA   ARG  20           HA       ARG  20   6.357 -14.204  -9.364
  184    HB2  ARG  20          2HB       ARG  20   5.590 -16.387 -10.751
  185    HB3  ARG  20          3HB       ARG  20   7.185 -16.137 -11.448
  186    HG2  ARG  20          2HG       ARG  20   8.011 -16.023  -9.024
  187    HG3  ARG  20          3HG       ARG  20   6.450 -16.734  -8.608
  188    HD2  ARG  20          2HD       ARG  20   6.955 -18.739  -9.560
  189    HD3  ARG  20          3HD       ARG  20   7.991 -18.017 -10.790
  190    HE   ARG  20           HE       ARG  20   8.815 -19.082  -8.298
  191   HH11  ARG  20          1HH1      ARG  20   9.468 -16.493 -10.533
  192   HH12  ARG  20          2HH1      ARG  20  11.126 -16.328 -10.059
  193   HH21  ARG  20          1HH2      ARG  20  10.997 -18.873  -7.666
  194   HH22  ARG  20          2HH2      ARG  20  11.995 -17.683  -8.429
  195    H    ARG  21           H        ARG  21   6.662 -13.605 -12.796
  196    HA   ARG  21           HA       ARG  21   9.497 -13.070 -12.650
  197    HB2  ARG  21          2HB       ARG  21   8.695 -13.999 -14.703
  198    HB3  ARG  21          3HB       ARG  21   7.456 -12.759 -14.850
  199    HG2  ARG  21          2HG       ARG  21   9.114 -11.075 -15.278
  200    HG3  ARG  21          3HG       ARG  21  10.415 -12.226 -14.967
  201    HD2  ARG  21          2HD       ARG  21  10.150 -13.276 -16.973
  202    HD3  ARG  21          3HD       ARG  21   8.422 -12.935 -17.046
  203    HE   ARG  21           HE       ARG  21   9.769 -10.512 -17.298
  204   HH11  ARG  21          1HH1      ARG  21   9.411 -13.499 -19.050
  205   HH12  ARG  21          2HH1      ARG  21   9.659 -12.770 -20.602
  206   HH21  ARG  21          1HH2      ARG  21  10.097  -9.540 -19.336
  207   HH22  ARG  21          2HH2      ARG  21  10.050 -10.518 -20.763
  208    H    ASN  22           H        ASN  22   6.504 -11.255 -12.627
  209    HA   ASN  22           HA       ASN  22   7.632  -8.696 -13.084
  210    HB2  ASN  22          2HB       ASN  22   5.025  -9.795 -12.410
  211    HB3  ASN  22          3HB       ASN  22   5.339  -8.288 -11.555
  212   HD21  ASN  22          1HD2      ASN  22   4.996  -6.454 -12.597
  213   HD22  ASN  22          2HD2      ASN  22   4.760  -6.293 -14.301
  214    H    PHE  23           H        PHE  23   7.156 -10.656 -10.224
  215    HA   PHE  23           HA       PHE  23   7.463  -8.742  -8.233
  216    HB2  PHE  23          2HB       PHE  23   7.660 -11.641  -8.436
  217    HB3  PHE  23          3HB       PHE  23   8.778 -10.982  -7.246
  218    HD1  PHE  23           HD1      PHE  23   5.333  -9.960  -8.232
  219    HD2  PHE  23           HD2      PHE  23   7.904 -11.391  -5.157
  220    HE1  PHE  23           HE1      PHE  23   3.490  -9.779  -6.611
  221    HE2  PHE  23           HE2      PHE  23   6.066 -11.213  -3.531
  222    HZ   PHE  23           HZ       PHE  23   3.855 -10.406  -4.258
  223    H    GLY  24           H        GLY  24   9.807 -10.129 -10.384
  224    HA2  GLY  24          2HA       GLY  24  12.183  -9.725  -9.014
  225    HA3  GLY  24          3HA       GLY  24  12.012  -9.611 -10.760
  226    H    TYR  25           H        TYR  25  10.062  -7.369 -10.449
  227    HA   TYR  25           HA       TYR  25  12.012  -5.254 -10.452
  228    HB2  TYR  25          2HB       TYR  25   9.114  -5.497 -11.102
  229    HB3  TYR  25          3HB       TYR  25   9.738  -3.898 -10.715
  230    HD1  TYR  25           HD1      TYR  25   9.755  -2.758 -12.747
  231    HD2  TYR  25           HD2      TYR  25  11.376  -6.687 -12.563
  232    HE1  TYR  25           HE1      TYR  25  10.579  -2.519 -15.052
  233    HE2  TYR  25           HE2      TYR  25  12.206  -6.459 -14.867
  234    HH   TYR  25           HH       TYR  25  11.277  -3.831 -16.902
  235    H    THR  26           H        THR  26   9.633  -6.511  -8.252
  236    HA   THR  26           HA       THR  26   9.739  -4.193  -6.512
  237    HB   THR  26           HB       THR  26   8.446  -6.015  -5.011
  238    HG1  THR  26           HG1      THR  26   8.764  -7.602  -6.741
  239   HG21  THR  26          1HG2      THR  26   6.559  -4.825  -5.498
  240   HG22  THR  26          2HG2      THR  26   6.844  -4.876  -7.238
  241   HG23  THR  26          3HG2      THR  26   7.753  -3.752  -6.228
  242    H    LEU  27           H        LEU  27  11.121  -7.398  -6.719
  243    HA   LEU  27           HA       LEU  27  12.186  -7.359  -4.044
  244    HB2  LEU  27          2HB       LEU  27  11.996  -9.240  -6.241
  245    HB3  LEU  27          3HB       LEU  27  13.590  -9.268  -5.490
  246    HG   LEU  27           HG       LEU  27  11.065  -9.543  -3.882
  247   HD11  LEU  27          1HD1      LEU  27  12.552 -11.993  -4.422
  248   HD12  LEU  27          2HD1      LEU  27  11.762 -11.316  -5.845
  249   HD13  LEU  27          3HD1      LEU  27  10.813 -11.698  -4.409
  250   HD21  LEU  27          1HD2      LEU  27  13.959  -9.681  -3.388
  251   HD22  LEU  27          2HD2      LEU  27  13.007 -10.967  -2.647
  252   HD23  LEU  27          3HD2      LEU  27  12.635  -9.279  -2.294
  253    H    ARG  28           H        ARG  28  13.238  -6.408  -7.213
  254    HA   ARG  28           HA       ARG  28  16.013  -6.390  -6.819
  255    HB2  ARG  28          2HB       ARG  28  14.115  -5.125  -8.697
  256    HB3  ARG  28          3HB       ARG  28  15.663  -4.310  -8.520
  257    HG2  ARG  28          2HG       ARG  28  15.919  -7.192  -8.850
  258    HG3  ARG  28          3HG       ARG  28  15.128  -6.395 -10.212
  259    HD2  ARG  28          2HD       ARG  28  16.997  -4.834 -10.390
  260    HD3  ARG  28          3HD       ARG  28  17.781  -5.606  -9.012
  261    HE   ARG  28           HE       ARG  28  17.297  -7.573 -10.926
  262   HH11  ARG  28          1HH1      ARG  28  19.211  -4.688 -10.554
  263   HH12  ARG  28          2HH1      ARG  28  20.470  -5.231 -11.613
  264   HH21  ARG  28          1HH2      ARG  28  18.949  -8.298 -12.322
  265   HH22  ARG  28          2HH2      ARG  28  20.320  -7.284 -12.619
  Start of MODEL    4
    1    H1   LYS   1           H        LYS   1  -3.103   2.171   1.453
    2    HA   LYS   1           HA       LYS   1  -2.395   1.284   3.945
    3    HB2  LYS   1          2HB       LYS   1  -5.105   1.865   4.001
    4    HB3  LYS   1          3HB       LYS   1  -5.065   0.123   3.762
    5    HG2  LYS   1          2HG       LYS   1  -4.286  -0.277   5.833
    6    HG3  LYS   1          3HG       LYS   1  -3.254   1.155   5.837
    7    HD2  LYS   1          2HD       LYS   1  -6.190   1.583   5.908
    8    HD3  LYS   1          3HD       LYS   1  -5.425   0.951   7.368
    9    HE2  LYS   1          2HE       LYS   1  -4.867   3.041   7.882
   10    HE3  LYS   1          3HE       LYS   1  -3.760   3.017   6.510
   11    HZ1  LYS   1          1HZ       LYS   1  -6.616   3.716   6.193
   12    HZ2  LYS   1          2HZ       LYS   1  -5.333   4.033   5.137
   13    HZ3  LYS   1          3HZ       LYS   1  -5.455   4.880   6.597
   14    H    TYR   2           H        TYR   2  -3.484  -1.277   4.070
   15    HA   TYR   2           HA       TYR   2  -2.459  -2.421   1.563
   16    HB2  TYR   2          2HB       TYR   2  -1.376  -2.935   3.846
   17    HB3  TYR   2          3HB       TYR   2  -2.796  -3.932   4.145
   18    HD1  TYR   2           HD1      TYR   2  -3.022  -6.075   3.148
   19    HD2  TYR   2           HD2      TYR   2   0.146  -3.501   1.949
   20    HE1  TYR   2           HE1      TYR   2  -1.973  -7.941   1.937
   21    HE2  TYR   2           HE2      TYR   2   1.203  -5.360   0.733
   22    HH   TYR   2           HH       TYR   2  -0.398  -8.272   0.072
   23    H    GLU   3           H        GLU   3  -4.675  -3.568   4.109
   24    HA   GLU   3           HA       GLU   3  -6.167  -5.266   2.510
   25    HB2  GLU   3          2HB       GLU   3  -6.954  -3.735   4.989
   26    HB3  GLU   3          3HB       GLU   3  -7.978  -4.955   4.246
   27    HG2  GLU   3          2HG       GLU   3  -6.356  -6.663   4.660
   28    HG3  GLU   3          3HG       GLU   3  -5.181  -5.474   5.219
   29    H    ILE   4           H        ILE   4  -6.185  -1.840   2.634
   30    HA   ILE   4           HA       ILE   4  -8.807  -1.302   1.769
   31    HB   ILE   4           HB       ILE   4  -7.918   0.864   0.979
   32   HG12  ILE   4          2HG1      ILE   4  -5.384   1.148   1.731
   33   HG13  ILE   4          3HG1      ILE   4  -5.333  -0.574   1.373
   34   HG21  ILE   4          1HG2      ILE   4  -6.910   1.544   3.227
   35   HG22  ILE   4          2HG2      ILE   4  -8.528   0.843   3.239
   36   HG23  ILE   4          3HG2      ILE   4  -7.138  -0.141   3.697
   37   HD11  ILE   4          1HD1      ILE   4  -6.609   0.505  -0.818
   38   HD12  ILE   4          2HD1      ILE   4  -5.369   1.694  -0.420
   39   HD13  ILE   4          3HD1      ILE   4  -4.917   0.017  -0.722
   40    H    THR   5           H        THR   5  -5.982  -2.411   0.086
   41    HA   THR   5           HA       THR   5  -7.394  -2.130  -2.484
   42    HB   THR   5           HB       THR   5  -5.347  -0.970  -2.678
   43    HG1  THR   5           HG1      THR   5  -4.751  -3.566  -3.681
   44   HG21  THR   5          1HG2      THR   5  -4.274  -1.853  -0.650
   45   HG22  THR   5          2HG2      THR   5  -3.182  -1.898  -2.035
   46   HG23  THR   5          3HG2      THR   5  -3.968  -3.377  -1.482
   47    H    THR   6           H        THR   6  -8.304  -3.942  -3.174
   48    HA   THR   6           HA       THR   6  -7.845  -6.487  -2.083
   49    HB   THR   6           HB       THR   6  -9.309  -7.356  -3.735
   50    HG1  THR   6           HG1      THR   6  -8.513  -5.089  -5.241
   51   HG21  THR   6          1HG2      THR   6 -10.394  -4.590  -3.675
   52   HG22  THR   6          2HG2      THR   6 -10.089  -5.385  -2.130
   53   HG23  THR   6          3HG2      THR   6 -11.182  -6.122  -3.301
   54    H    ILE   7           H        ILE   7  -6.212  -4.743  -4.566
   55    HA   ILE   7           HA       ILE   7  -5.136  -6.834  -6.082
   56    HB   ILE   7           HB       ILE   7  -3.855  -4.176  -5.435
   57   HG12  ILE   7          2HG1      ILE   7  -5.053  -4.517  -8.074
   58   HG13  ILE   7          3HG1      ILE   7  -6.233  -4.668  -6.776
   59   HG21  ILE   7          1HG2      ILE   7  -2.697  -4.563  -7.631
   60   HG22  ILE   7          2HG2      ILE   7  -2.191  -5.624  -6.317
   61   HG23  ILE   7          3HG2      ILE   7  -3.284  -6.225  -7.564
   62   HD11  ILE   7          1HD1      ILE   7  -4.936  -2.318  -7.832
   63   HD12  ILE   7          2HD1      ILE   7  -6.353  -2.457  -6.791
   64   HD13  ILE   7          3HD1      ILE   7  -4.738  -2.443  -6.084
   65    H    HIS   8           H        HIS   8  -3.173  -4.909  -3.831
   66    HA   HIS   8           HA       HIS   8  -1.251  -6.952  -3.484
   67    HB2  HIS   8          2HB       HIS   8  -1.770  -4.277  -2.320
   68    HB3  HIS   8          3HB       HIS   8  -0.801  -5.374  -1.340
   69    HD1  HIS   8           HD1      HIS   8  -0.739  -4.739  -5.094
   70    HD2  HIS   8           HD2      HIS   8   1.755  -4.615  -1.774
   71    HE1  HIS   8           HE1      HIS   8   1.539  -4.160  -5.986
   72    H    ASN   9           H        ASN   9  -4.322  -6.495  -2.125
   73    HA   ASN   9           HA       ASN   9  -4.032  -7.491   0.461
   74    HB2  ASN   9          2HB       ASN   9  -6.121  -6.524  -0.148
   75    HB3  ASN   9          3HB       ASN   9  -6.327  -7.642  -1.492
   76   HD21  ASN   9          1HD2      ASN   9  -5.371  -8.239   1.859
   77   HD22  ASN   9          2HD2      ASN   9  -6.685  -9.298   2.229
   78    H    LEU  10           H        LEU  10  -5.366  -9.378  -2.252
   79    HA   LEU  10           HA       LEU  10  -4.011 -11.747  -1.139
   80    HB2  LEU  10          2HB       LEU  10  -5.941 -12.948  -2.422
   81    HB3  LEU  10          3HB       LEU  10  -6.210 -12.282  -0.812
   82    HG   LEU  10           HG       LEU  10  -7.326 -10.348  -1.776
   83   HD11  LEU  10          1HD1      LEU  10  -6.887 -11.673  -4.448
   84   HD12  LEU  10          2HD1      LEU  10  -6.027 -10.247  -3.866
   85   HD13  LEU  10          3HD1      LEU  10  -7.767 -10.175  -4.144
   86   HD21  LEU  10          1HD2      LEU  10  -8.429 -12.886  -2.970
   87   HD22  LEU  10          2HD2      LEU  10  -9.326 -11.433  -2.530
   88   HD23  LEU  10          3HD2      LEU  10  -8.592 -12.431  -1.274
   89    H    PHE  11           H        PHE  11  -2.495 -10.356  -2.801
   90    HA   PHE  11           HA       PHE  11  -2.865 -11.083  -5.553
   91    HB2  PHE  11          2HB       PHE  11  -1.537  -9.065  -4.412
   92    HB3  PHE  11          3HB       PHE  11  -0.202 -10.202  -4.561
   93    HD1  PHE  11           HD1      PHE  11  -1.992  -7.654  -6.165
   94    HD2  PHE  11           HD2      PHE  11   0.044 -11.313  -6.929
   95    HE1  PHE  11           HE1      PHE  11  -1.706  -6.999  -8.519
   96    HE2  PHE  11           HE2      PHE  11   0.334 -10.663  -9.284
   97    HZ   PHE  11           HZ       PHE  11  -0.541  -8.504 -10.082
   98    H    ARG  12           H        ARG  12  -3.084 -13.434  -4.571
   99    HA   ARG  12           HA       ARG  12  -0.436 -14.717  -4.726
  100    HB2  ARG  12          2HB       ARG  12  -1.556 -16.638  -3.536
  101    HB3  ARG  12          3HB       ARG  12  -1.371 -15.170  -2.586
  102    HG2  ARG  12          2HG       ARG  12  -3.610 -14.761  -2.520
  103    HG3  ARG  12          3HG       ARG  12  -3.913 -15.556  -4.066
  104    HD2  ARG  12          2HD       ARG  12  -3.156 -17.693  -2.715
  105    HD3  ARG  12          3HD       ARG  12  -3.670 -16.720  -1.337
  106    HE   ARG  12           HE       ARG  12  -5.622 -16.801  -3.429
  107   HH11  ARG  12          1HH1      ARG  12  -4.356 -18.505  -0.670
  108   HH12  ARG  12          2HH1      ARG  12  -5.830 -19.361  -0.358
  109   HH21  ARG  12          1HH2      ARG  12  -7.568 -17.922  -3.030
  110   HH22  ARG  12          2HH2      ARG  12  -7.656 -19.029  -1.702
  111    H    LYS  13           H        LYS  13  -0.801 -14.479  -7.099
  112    HA   LYS  13           HA       LYS  13  -2.822 -15.743  -8.522
  113    HB2  LYS  13          2HB       LYS  13  -0.279 -14.559  -9.096
  114    HB3  LYS  13          3HB       LYS  13  -0.412 -16.070  -9.985
  115    HG2  LYS  13          2HG       LYS  13  -2.345 -13.763 -10.074
  116    HG3  LYS  13          3HG       LYS  13  -1.205 -14.236 -11.336
  117    HD2  LYS  13          2HD       LYS  13  -2.679 -16.543 -10.752
  118    HD3  LYS  13          3HD       LYS  13  -3.857 -15.229 -10.793
  119    HE2  LYS  13          2HE       LYS  13  -2.663 -14.550 -12.985
  120    HE3  LYS  13          3HE       LYS  13  -2.016 -16.190 -12.954
  121    HZ1  LYS  13          1HZ       LYS  13  -3.923 -16.465 -14.166
  122    HZ2  LYS  13          2HZ       LYS  13  -4.792 -15.296 -13.306
  123    HZ3  LYS  13          3HZ       LYS  13  -4.501 -16.812 -12.615
  124    H    LEU  14           H        LEU  14  -3.428 -17.796  -8.570
  125    HA   LEU  14           HA       LEU  14  -2.128 -19.910  -7.349
  126    HB2  LEU  14          2HB       LEU  14  -3.583 -21.362  -8.807
  127    HB3  LEU  14          3HB       LEU  14  -4.415 -20.152  -7.833
  128    HG   LEU  14           HG       LEU  14  -3.800 -19.163 -10.490
  129   HD11  LEU  14          1HD1      LEU  14  -4.116 -21.714 -10.799
  130   HD12  LEU  14          2HD1      LEU  14  -5.012 -20.602 -11.834
  131   HD13  LEU  14          3HD1      LEU  14  -5.814 -21.372 -10.466
  132   HD21  LEU  14          1HD2      LEU  14  -6.283 -19.503  -8.823
  133   HD22  LEU  14          2HD2      LEU  14  -6.284 -18.765 -10.425
  134   HD23  LEU  14          3HD2      LEU  14  -5.363 -18.026  -9.114
  135    H    THR  15           H        THR  15  -1.779 -18.656 -10.596
  136    HA   THR  15           HA       THR  15   0.310 -20.675 -11.101
  137    HB   THR  15           HB       THR  15  -0.114 -20.372 -13.517
  138    HG1  THR  15           HG1      THR  15  -1.359 -18.229 -12.812
  139   HG21  THR  15          1HG2      THR  15  -1.897 -21.609 -11.609
  140   HG22  THR  15          2HG2      THR  15  -1.361 -22.193 -13.184
  141   HG23  THR  15          3HG2      THR  15  -2.764 -21.131 -13.068
  142    H    HIS  16           H        HIS  16   1.624 -19.032  -9.890
  143    HA   HIS  16           HA       HIS  16   2.199 -16.531 -11.159
  144    HB2  HIS  16          2HB       HIS  16   4.114 -16.487  -9.498
  145    HB3  HIS  16          3HB       HIS  16   2.501 -16.610  -8.802
  146    HD1  HIS  16           HD1      HIS  16   3.700 -17.614  -6.665
  147    HD2  HIS  16           HD2      HIS  16   3.928 -19.944 -10.098
  148    HE1  HIS  16           HE1      HIS  16   4.409 -19.896  -5.883
  149    H    ARG  17           H        ARG  17   2.572 -17.638 -13.299
  150    HA   ARG  17           HA       ARG  17   5.339 -18.616 -13.522
  151    HB2  ARG  17          2HB       ARG  17   4.461 -19.357 -15.856
  152    HB3  ARG  17          3HB       ARG  17   4.023 -20.294 -14.434
  153    HG2  ARG  17          2HG       ARG  17   1.845 -19.324 -14.374
  154    HG3  ARG  17          3HG       ARG  17   2.274 -18.160 -15.630
  155    HD2  ARG  17          2HD       ARG  17   1.002 -19.860 -16.685
  156    HD3  ARG  17          3HD       ARG  17   2.681 -20.122 -17.153
  157    HE   ARG  17           HE       ARG  17   2.359 -21.707 -14.970
  158   HH11  ARG  17          1HH1      ARG  17   0.667 -21.363 -17.993
  159   HH12  ARG  17          2HH1      ARG  17   0.175 -23.023 -18.056
  160   HH21  ARG  17          1HH2      ARG  17   1.717 -23.894 -15.041
  161   HH22  ARG  17          2HH2      ARG  17   0.772 -24.462 -16.375
  162    H    LEU  18           H        LEU  18   3.035 -16.252 -14.677
  163    HA   LEU  18           HA       LEU  18   5.146 -15.022 -16.320
  164    HB2  LEU  18          2HB       LEU  18   2.168 -14.588 -16.477
  165    HB3  LEU  18          3HB       LEU  18   3.385 -13.916 -17.560
  166    HG   LEU  18           HG       LEU  18   3.487 -16.815 -17.482
  167   HD11  LEU  18          1HD1      LEU  18   1.028 -15.835 -18.822
  168   HD12  LEU  18          2HD1      LEU  18   0.971 -16.098 -17.079
  169   HD13  LEU  18          3HD1      LEU  18   1.402 -17.425 -18.157
  170   HD21  LEU  18          1HD2      LEU  18   4.598 -15.664 -19.213
  171   HD22  LEU  18          2HD2      LEU  18   3.176 -14.690 -19.587
  172   HD23  LEU  18          3HD2      LEU  18   3.191 -16.412 -19.968
  173    H    PHE  19           H        PHE  19   2.810 -14.492 -13.769
  174    HA   PHE  19           HA       PHE  19   3.112 -11.682 -13.579
  175    HB2  PHE  19          2HB       PHE  19   1.950 -13.829 -11.880
  176    HB3  PHE  19          3HB       PHE  19   2.343 -12.305 -11.092
  177    HD1  PHE  19           HD1      PHE  19   0.276 -13.908 -13.670
  178    HD2  PHE  19           HD2      PHE  19   1.074 -10.329 -11.508
  179    HE1  PHE  19           HE1      PHE  19  -1.836 -12.947 -14.488
  180    HE2  PHE  19           HE2      PHE  19  -1.037  -9.363 -12.321
  181    HZ   PHE  19           HZ       PHE  19  -2.496 -10.672 -13.813
  182    H    ARG  20           H        ARG  20   4.976 -14.366 -12.422
  183    HA   ARG  20           HA       ARG  20   6.387 -13.006 -10.368
  184    HB2  ARG  20          2HB       ARG  20   6.170 -15.585 -10.997
  185    HB3  ARG  20          3HB       ARG  20   7.673 -15.249 -11.845
  186    HG2  ARG  20          2HG       ARG  20   7.711 -14.166  -9.168
  187    HG3  ARG  20          3HG       ARG  20   7.374 -15.899  -9.167
  188    HD2  ARG  20          2HD       ARG  20   9.355 -16.080 -10.789
  189    HD3  ARG  20          3HD       ARG  20   9.758 -14.445 -10.267
  190    HE   ARG  20           HE       ARG  20  10.533 -15.313  -8.302
  191   HH11  ARG  20          1HH1      ARG  20   8.479 -17.667  -9.838
  192   HH12  ARG  20          2HH1      ARG  20   8.835 -18.917  -8.692
  193   HH21  ARG  20          1HH2      ARG  20  11.009 -16.950  -6.788
  194   HH22  ARG  20          2HH2      ARG  20  10.274 -18.508  -6.957
  195    H    ARG  21           H        ARG  21   6.722 -13.165 -13.815
  196    HA   ARG  21           HA       ARG  21   9.427 -12.153 -13.836
  197    HB2  ARG  21          2HB       ARG  21   8.423 -13.689 -15.595
  198    HB3  ARG  21          3HB       ARG  21   7.521 -12.293 -16.169
  199    HG2  ARG  21          2HG       ARG  21  10.372 -11.773 -15.883
  200    HG3  ARG  21          3HG       ARG  21  10.003 -13.066 -17.026
  201    HD2  ARG  21          2HD       ARG  21   8.204 -10.835 -17.361
  202    HD3  ARG  21          3HD       ARG  21   9.885 -10.316 -17.484
  203    HE   ARG  21           HE       ARG  21   9.455 -12.651 -19.023
  204   HH11  ARG  21          1HH1      ARG  21   8.820  -9.228 -18.998
  205   HH12  ARG  21          2HH1      ARG  21   8.751  -9.096 -20.724
  206   HH21  ARG  21          1HH2      ARG  21   9.368 -12.490 -21.297
  207   HH22  ARG  21          2HH2      ARG  21   9.062 -10.952 -22.031
  208    H    ASN  22           H        ASN  22   6.192 -10.882 -14.015
  209    HA   ASN  22           HA       ASN  22   6.985  -8.294 -14.985
  210    HB2  ASN  22          2HB       ASN  22   4.458  -9.617 -14.200
  211    HB3  ASN  22          3HB       ASN  22   4.512  -7.873 -13.959
  212   HD21  ASN  22          1HD2      ASN  22   5.096 -10.391 -16.362
  213   HD22  ASN  22          2HD2      ASN  22   4.648  -9.436 -17.731
  214    H    PHE  23           H        PHE  23   6.419  -9.793 -11.875
  215    HA   PHE  23           HA       PHE  23   6.220  -7.500 -10.285
  216    HB2  PHE  23          2HB       PHE  23   6.746 -10.352  -9.861
  217    HB3  PHE  23          3HB       PHE  23   7.511  -9.312  -8.664
  218    HD1  PHE  23           HD1      PHE  23   4.241  -9.094 -10.441
  219    HD2  PHE  23           HD2      PHE  23   6.288  -9.402  -6.721
  220    HE1  PHE  23           HE1      PHE  23   2.098  -8.899  -9.248
  221    HE2  PHE  23           HE2      PHE  23   4.148  -9.208  -5.523
  222    HZ   PHE  23           HZ       PHE  23   2.049  -8.957  -6.787
  223    H    GLY  24           H        GLY  24   8.952  -8.992 -11.810
  224    HA2  GLY  24          2HA       GLY  24  11.052  -8.055 -10.236
  225    HA3  GLY  24          3HA       GLY  24  11.152  -8.358 -11.964
  226    H    TYR  25           H        TYR  25   8.959  -6.319 -12.377
  227    HA   TYR  25           HA       TYR  25  10.730  -4.057 -12.657
  228    HB2  TYR  25          2HB       TYR  25   7.996  -4.766 -13.609
  229    HB3  TYR  25          3HB       TYR  25   8.423  -3.060 -13.532
  230    HD1  TYR  25           HD1      TYR  25  10.428  -6.062 -14.490
  231    HD2  TYR  25           HD2      TYR  25   8.783  -2.329 -15.699
  232    HE1  TYR  25           HE1      TYR  25  11.583  -6.261 -16.653
  233    HE2  TYR  25           HE2      TYR  25   9.932  -2.518 -17.865
  234    HH   TYR  25           HH       TYR  25  11.643  -5.434 -18.790
  235    H    THR  26           H        THR  26   8.192  -5.075 -10.529
  236    HA   THR  26           HA       THR  26   7.859  -2.420  -9.383
  237    HB   THR  26           HB       THR  26   6.425  -3.963  -7.719
  238    HG1  THR  26           HG1      THR  26   6.949  -5.918  -8.739
  239   HG21  THR  26          1HG2      THR  26   5.781  -2.761 -10.376
  240   HG22  THR  26          2HG2      THR  26   5.257  -2.273  -8.765
  241   HG23  THR  26          3HG2      THR  26   4.544  -3.691  -9.532
  242    H    LEU  27           H        LEU  27   9.403  -5.474  -8.655
  243    HA   LEU  27           HA       LEU  27  10.062  -4.699  -5.946
  244    HB2  LEU  27          2HB       LEU  27   9.927  -7.114  -7.398
  245    HB3  LEU  27          3HB       LEU  27  11.601  -6.922  -6.882
  246    HG   LEU  27           HG       LEU  27   9.401  -6.602  -4.886
  247   HD11  LEU  27          1HD1      LEU  27   8.871  -8.771  -4.775
  248   HD12  LEU  27          2HD1      LEU  27  10.531  -9.291  -5.063
  249   HD13  LEU  27          3HD1      LEU  27   9.495  -8.858  -6.422
  250   HD21  LEU  27          1HD2      LEU  27  11.954  -6.178  -4.571
  251   HD22  LEU  27          2HD2      LEU  27  12.040  -7.937  -4.471
  252   HD23  LEU  27          3HD2      LEU  27  11.043  -7.037  -3.328
  253    H    ARG  28           H        ARG  28  11.565  -4.718  -9.095
  254    HA   ARG  28           HA       ARG  28  14.013  -3.603  -7.891
  255    HB2  ARG  28          2HB       ARG  28  13.724  -5.812  -9.624
  256    HB3  ARG  28          3HB       ARG  28  14.433  -4.520 -10.583
  257    HG2  ARG  28          2HG       ARG  28  16.247  -4.291  -9.006
  258    HG3  ARG  28          3HG       ARG  28  15.512  -5.499  -7.949
  259    HD2  ARG  28          2HD       ARG  28  15.630  -6.980 -10.124
  260    HD3  ARG  28          3HD       ARG  28  16.907  -5.844 -10.558
  261    HE   ARG  28           HE       ARG  28  17.043  -7.917  -8.594
  262   HH11  ARG  28          1HH1      ARG  28  18.254  -4.772  -9.467
  263   HH12  ARG  28          2HH1      ARG  28  19.739  -4.957  -8.593
  264   HH21  ARG  28          1HH2      ARG  28  18.993  -8.172  -7.439
  265   HH22  ARG  28          2HH2      ARG  28  20.158  -6.892  -7.440
  Start of MODEL    5
    1    H1   LYS   1           H        LYS   1 -10.658  -6.599  -8.139
    2    HA   LYS   1           HA       LYS   1 -11.045  -8.995  -7.404
    3    HB2  LYS   1          2HB       LYS   1 -13.439  -8.789  -8.253
    4    HB3  LYS   1          3HB       LYS   1 -12.782  -9.014  -9.869
    5    HG2  LYS   1          2HG       LYS   1 -12.122 -11.208  -9.424
    6    HG3  LYS   1          3HG       LYS   1 -12.241 -10.984  -7.677
    7    HD2  LYS   1          2HD       LYS   1 -14.390 -11.578  -7.673
    8    HD3  LYS   1          3HD       LYS   1 -14.767 -10.456  -8.982
    9    HE2  LYS   1          2HE       LYS   1 -13.283 -12.859  -9.793
   10    HE3  LYS   1          3HE       LYS   1 -14.905 -13.163  -9.174
   11    HZ1  LYS   1          1HZ       LYS   1 -15.835 -12.281 -10.984
   12    HZ2  LYS   1          2HZ       LYS   1 -14.318 -12.458 -11.711
   13    HZ3  LYS   1          3HZ       LYS   1 -14.764 -10.972 -11.036
   14    H    TYR   2           H        TYR   2 -10.013  -7.020  -9.868
   15    HA   TYR   2           HA       TYR   2  -8.379  -9.176 -11.038
   16    HB2  TYR   2          2HB       TYR   2  -9.927  -8.307 -12.700
   17    HB3  TYR   2          3HB       TYR   2  -9.407  -6.659 -12.366
   18    HD1  TYR   2           HD1      TYR   2  -7.357  -9.736 -12.832
   19    HD2  TYR   2           HD2      TYR   2  -8.450  -5.916 -14.355
   20    HE1  TYR   2           HE1      TYR   2  -5.623  -9.937 -14.564
   21    HE2  TYR   2           HE2      TYR   2  -6.720  -6.108 -16.093
   22    HH   TYR   2           HH       TYR   2  -5.416  -8.707 -17.113
   23    H    GLU   3           H        GLU   3  -8.218  -5.630 -11.213
   24    HA   GLU   3           HA       GLU   3  -5.383  -5.771 -10.538
   25    HB2  GLU   3          2HB       GLU   3  -6.934  -4.151 -12.265
   26    HB3  GLU   3          3HB       GLU   3  -6.293  -3.094 -11.016
   27    HG2  GLU   3          2HG       GLU   3  -4.041  -4.272 -11.537
   28    HG3  GLU   3          3HG       GLU   3  -4.834  -4.720 -13.046
   29    H    ILE   4           H        ILE   4  -8.399  -4.397  -9.355
   30    HA   ILE   4           HA       ILE   4  -7.181  -2.949  -7.206
   31    HB   ILE   4           HB       ILE   4  -9.471  -2.625  -6.377
   32   HG12  ILE   4          2HG1      ILE   4 -11.233  -3.516  -8.183
   33   HG13  ILE   4          3HG1      ILE   4 -10.021  -4.781  -8.354
   34   HG21  ILE   4          1HG2      ILE   4  -9.108  -2.196  -9.338
   35   HG22  ILE   4          2HG2      ILE   4 -10.353  -1.423  -8.358
   36   HG23  ILE   4          3HG2      ILE   4  -8.650  -1.093  -8.041
   37   HD11  ILE   4          1HD1      ILE   4 -10.358  -5.575  -6.231
   38   HD12  ILE   4          2HD1      ILE   4 -10.978  -4.035  -5.636
   39   HD13  ILE   4          3HD1      ILE   4 -11.983  -5.050  -6.671
   40    H    THR   5           H        THR   5  -7.649  -6.191  -7.717
   41    HA   THR   5           HA       THR   5  -8.499  -7.073  -5.160
   42    HB   THR   5           HB       THR   5  -6.788  -9.020  -6.388
   43    HG1  THR   5           HG1      THR   5  -7.030  -8.430  -8.412
   44   HG21  THR   5          1HG2      THR   5  -9.106 -10.097  -6.770
   45   HG22  THR   5          2HG2      THR   5  -9.728  -8.706  -5.883
   46   HG23  THR   5          3HG2      THR   5  -8.579  -9.800  -5.114
   47    H    THR   6           H        THR   6  -5.614  -5.678  -6.200
   48    HA   THR   6           HA       THR   6  -3.918  -7.034  -4.270
   49    HB   THR   6           HB       THR   6  -3.329  -4.743  -6.154
   50    HG1  THR   6           HG1      THR   6  -3.370  -6.482  -7.424
   51   HG21  THR   6          1HG2      THR   6  -1.887  -5.681  -3.861
   52   HG22  THR   6          2HG2      THR   6  -1.474  -4.379  -4.976
   53   HG23  THR   6          3HG2      THR   6  -0.964  -6.031  -5.321
   54    H    ILE   7           H        ILE   7  -4.468  -6.495  -2.220
   55    HA   ILE   7           HA       ILE   7  -4.468  -3.624  -1.550
   56    HB   ILE   7           HB       ILE   7  -5.954  -5.807  -0.085
   57   HG12  ILE   7          2HG1      ILE   7  -7.917  -4.252  -0.975
   58   HG13  ILE   7          3HG1      ILE   7  -6.748  -3.906  -2.244
   59   HG21  ILE   7          1HG2      ILE   7  -5.697  -2.846   0.327
   60   HG22  ILE   7          2HG2      ILE   7  -7.065  -3.758   0.962
   61   HG23  ILE   7          3HG2      ILE   7  -5.427  -4.150   1.483
   62   HD11  ILE   7          1HD1      ILE   7  -7.553  -5.706  -3.261
   63   HD12  ILE   7          2HD1      ILE   7  -6.683  -6.649  -2.051
   64   HD13  ILE   7          3HD1      ILE   7  -8.384  -6.256  -1.807
   65    H    HIS   8           H        HIS   8  -4.386  -6.524   0.488
   66    HA   HIS   8           HA       HIS   8  -1.754  -5.655   1.488
   67    HB2  HIS   8          2HB       HIS   8  -4.247  -6.117   2.922
   68    HB3  HIS   8          3HB       HIS   8  -2.923  -7.082   3.567
   69    HD1  HIS   8           HD1      HIS   8  -3.592  -3.444   2.670
   70    HD2  HIS   8           HD2      HIS   8  -1.387  -5.737   5.342
   71    HE1  HIS   8           HE1      HIS   8  -2.494  -1.798   4.222
   72    H    ASN   9           H        ASN   9  -3.803  -8.503   2.078
   73    HA   ASN   9           HA       ASN   9  -1.594 -10.182   1.083
   74    HB2  ASN   9          2HB       ASN   9  -3.449 -10.709   3.415
   75    HB3  ASN   9          3HB       ASN   9  -2.305 -11.881   2.766
   76   HD21  ASN   9          1HD2      ASN   9  -2.779  -9.514   5.037
   77   HD22  ASN   9          2HD2      ASN   9  -1.133  -9.211   5.465
   78    H    LEU  10           H        LEU  10  -3.987  -9.148  -0.303
   79    HA   LEU  10           HA       LEU  10  -5.533 -11.595  -0.748
   80    HB2  LEU  10          2HB       LEU  10  -6.012  -8.714  -1.101
   81    HB3  LEU  10          3HB       LEU  10  -6.673  -9.746  -2.368
   82    HG   LEU  10           HG       LEU  10  -7.302  -9.908   0.579
   83   HD11  LEU  10          1HD1      LEU  10  -9.194  -9.251  -1.653
   84   HD12  LEU  10          2HD1      LEU  10  -8.253  -8.001  -0.840
   85   HD13  LEU  10          3HD1      LEU  10  -9.388  -8.988   0.080
   86   HD21  LEU  10          1HD2      LEU  10  -7.372 -11.950  -1.309
   87   HD22  LEU  10          2HD2      LEU  10  -9.038 -11.379  -1.201
   88   HD23  LEU  10          3HD2      LEU  10  -8.194 -11.918   0.252
   89    H    PHE  11           H        PHE  11  -3.529 -12.495  -1.766
   90    HA   PHE  11           HA       PHE  11  -3.368 -11.684  -4.595
   91    HB2  PHE  11          2HB       PHE  11  -1.260 -12.421  -2.635
   92    HB3  PHE  11          3HB       PHE  11  -1.048 -12.994  -4.286
   93    HD1  PHE  11           HD1      PHE  11  -2.376  -9.807  -2.877
   94    HD2  PHE  11           HD2      PHE  11   0.535 -11.705  -5.334
   95    HE1  PHE  11           HE1      PHE  11  -1.489  -7.604  -3.522
   96    HE2  PHE  11           HE2      PHE  11   1.427  -9.506  -5.983
   97    HZ   PHE  11           HZ       PHE  11   0.416  -7.452  -5.076
   98    H    ARG  12           H        ARG  12  -4.318 -13.109  -5.878
   99    HA   ARG  12           HA       ARG  12  -4.162 -15.966  -5.167
  100    HB2  ARG  12          2HB       ARG  12  -6.427 -14.302  -6.143
  101    HB3  ARG  12          3HB       ARG  12  -6.318 -15.953  -6.741
  102    HG2  ARG  12          2HG       ARG  12  -5.934 -16.245  -4.033
  103    HG3  ARG  12          3HG       ARG  12  -7.140 -14.961  -4.139
  104    HD2  ARG  12          2HD       ARG  12  -8.704 -16.323  -5.110
  105    HD3  ARG  12          3HD       ARG  12  -7.491 -17.369  -5.846
  106    HE   ARG  12           HE       ARG  12  -8.684 -17.660  -3.253
  107   HH11  ARG  12          1HH1      ARG  12  -5.887 -18.366  -5.201
  108   HH12  ARG  12          2HH1      ARG  12  -5.422 -19.748  -4.266
  109   HH21  ARG  12          1HH2      ARG  12  -8.082 -19.478  -2.012
  110   HH22  ARG  12          2HH2      ARG  12  -6.671 -20.380  -2.452
  111    H    LYS  13           H        LYS  13  -5.211 -14.238  -8.089
  112    HA   LYS  13           HA       LYS  13  -3.900 -16.084  -9.811
  113    HB2  LYS  13          2HB       LYS  13  -4.685 -14.708 -11.616
  114    HB3  LYS  13          3HB       LYS  13  -5.958 -14.801 -10.406
  115    HG2  LYS  13          2HG       LYS  13  -4.671 -12.566  -9.601
  116    HG3  LYS  13          3HG       LYS  13  -4.403 -12.495 -11.344
  117    HD2  LYS  13          2HD       LYS  13  -7.136 -13.067 -10.273
  118    HD3  LYS  13          3HD       LYS  13  -6.535 -11.408 -10.313
  119    HE2  LYS  13          2HE       LYS  13  -7.666 -11.648 -12.341
  120    HE3  LYS  13          3HE       LYS  13  -5.972 -11.880 -12.770
  121    HZ1  LYS  13          1HZ       LYS  13  -8.110 -13.631 -13.180
  122    HZ2  LYS  13          2HZ       LYS  13  -7.062 -14.365 -12.075
  123    HZ3  LYS  13          3HZ       LYS  13  -6.482 -13.859 -13.581
  124    H    LEU  14           H        LEU  14  -3.087 -12.921  -8.528
  125    HA   LEU  14           HA       LEU  14  -0.651 -12.816 -10.135
  126    HB2  LEU  14          2HB       LEU  14  -0.374 -10.584  -8.995
  127    HB3  LEU  14          3HB       LEU  14  -1.765 -10.748 -10.066
  128    HG   LEU  14           HG       LEU  14  -2.250 -11.287  -7.200
  129   HD11  LEU  14          1HD1      LEU  14  -0.678  -9.196  -7.538
  130   HD12  LEU  14          2HD1      LEU  14  -2.031  -9.160  -6.407
  131   HD13  LEU  14          3HD1      LEU  14  -2.196  -8.427  -8.002
  132   HD21  LEU  14          1HD2      LEU  14  -4.013  -9.407  -8.378
  133   HD22  LEU  14          2HD2      LEU  14  -4.327 -11.088  -7.949
  134   HD23  LEU  14          3HD2      LEU  14  -3.721 -10.686  -9.556
  135    H    THR  15           H        THR  15  -1.185 -14.712  -7.842
  136    HA   THR  15           HA       THR  15   0.226 -14.104  -5.555
  137    HB   THR  15           HB       THR  15   0.869 -16.672  -5.691
  138    HG1  THR  15           HG1      THR  15   0.236 -17.474  -7.545
  139   HG21  THR  15          1HG2      THR  15  -0.726 -15.796  -4.110
  140   HG22  THR  15          2HG2      THR  15  -1.426 -17.215  -4.889
  141   HG23  THR  15          3HG2      THR  15  -1.935 -15.599  -5.378
  142    H    HIS  16           H        HIS  16   1.652 -16.228  -8.023
  143    HA   HIS  16           HA       HIS  16   4.222 -14.851  -7.593
  144    HB2  HIS  16          2HB       HIS  16   3.536 -17.618  -7.262
  145    HB3  HIS  16          3HB       HIS  16   4.718 -17.465  -8.559
  146    HD1  HIS  16           HD1      HIS  16   6.988 -17.810  -7.675
  147    HD2  HIS  16           HD2      HIS  16   4.571 -15.813  -4.949
  148    HE1  HIS  16           HE1      HIS  16   8.456 -17.350  -5.685
  149    H    ARG  17           H        ARG  17   2.012 -14.566  -9.650
  150    HA   ARG  17           HA       ARG  17   3.547 -15.207 -12.072
  151    HB2  ARG  17          2HB       ARG  17   0.735 -15.260 -11.419
  152    HB3  ARG  17          3HB       ARG  17   1.022 -14.217 -12.805
  153    HG2  ARG  17          2HG       ARG  17   2.108 -17.011 -12.633
  154    HG3  ARG  17          3HG       ARG  17   0.515 -16.641 -13.297
  155    HD2  ARG  17          2HD       ARG  17   2.981 -15.252 -14.290
  156    HD3  ARG  17          3HD       ARG  17   2.507 -16.830 -14.916
  157    HE   ARG  17           HE       ARG  17   1.311 -14.312 -15.529
  158   HH11  ARG  17          1HH1      ARG  17   0.667 -17.716 -15.181
  159   HH12  ARG  17          2HH1      ARG  17  -0.690 -17.702 -16.258
  160   HH21  ARG  17          1HH2      ARG  17  -0.473 -14.281 -16.949
  161   HH22  ARG  17          2HH2      ARG  17  -1.337 -15.748 -17.264
  162    H    LEU  18           H        LEU  18   2.034 -12.589 -10.290
  163    HA   LEU  18           HA       LEU  18   3.297 -10.676 -12.142
  164    HB2  LEU  18          2HB       LEU  18   0.676 -10.575 -10.697
  165    HB3  LEU  18          3HB       LEU  18   1.490  -9.090 -11.186
  166    HG   LEU  18           HG       LEU  18   1.454 -10.599 -13.502
  167   HD11  LEU  18          1HD1      LEU  18  -1.220 -10.872 -12.138
  168   HD12  LEU  18          2HD1      LEU  18  -0.079 -12.190 -12.401
  169   HD13  LEU  18          3HD1      LEU  18  -0.813 -11.371 -13.780
  170   HD21  LEU  18          1HD2      LEU  18  -0.322  -8.402 -12.469
  171   HD22  LEU  18          2HD2      LEU  18  -0.409  -9.002 -14.126
  172   HD23  LEU  18          3HD2      LEU  18   1.081  -8.268 -13.529
  173    H    PHE  19           H        PHE  19   4.291 -11.993  -9.644
  174    HA   PHE  19           HA       PHE  19   4.775  -9.559  -8.056
  175    HB2  PHE  19          2HB       PHE  19   3.609 -11.759  -7.086
  176    HB3  PHE  19          3HB       PHE  19   5.288 -12.243  -6.877
  177    HD1  PHE  19           HD1      PHE  19   6.001 -11.972  -4.721
  178    HD2  PHE  19           HD2      PHE  19   3.395  -9.058  -6.406
  179    HE1  PHE  19           HE1      PHE  19   6.117 -10.668  -2.638
  180    HE2  PHE  19           HE2      PHE  19   3.508  -7.749  -4.326
  181    HZ   PHE  19           HZ       PHE  19   4.870  -8.553  -2.438
  182    H    ARG  20           H        ARG  20   6.173 -12.191  -9.809
  183    HA   ARG  20           HA       ARG  20   8.767 -12.233  -8.819
  184    HB2  ARG  20          2HB       ARG  20   9.411 -13.262 -10.873
  185    HB3  ARG  20          3HB       ARG  20   7.775 -13.800 -10.517
  186    HG2  ARG  20          2HG       ARG  20   7.077 -11.817 -12.047
  187    HG3  ARG  20          3HG       ARG  20   8.736 -11.938 -12.638
  188    HD2  ARG  20          2HD       ARG  20   8.231 -14.442 -12.922
  189    HD3  ARG  20          3HD       ARG  20   6.538 -13.976 -12.760
  190    HE   ARG  20           HE       ARG  20   7.708 -12.340 -14.697
  191   HH11  ARG  20          1HH1      ARG  20   6.886 -15.688 -14.216
  192   HH12  ARG  20          2HH1      ARG  20   6.651 -16.008 -15.903
  193   HH21  ARG  20          1HH2      ARG  20   7.401 -12.748 -16.920
  194   HH22  ARG  20          2HH2      ARG  20   6.945 -14.335 -17.440
  195    H    ARG  21           H        ARG  21   7.198  -9.934 -10.926
  196    HA   ARG  21           HA       ARG  21   9.584  -8.644 -11.813
  197    HB2  ARG  21          2HB       ARG  21   6.702  -7.735 -11.782
  198    HB3  ARG  21          3HB       ARG  21   8.011  -6.828 -12.529
  199    HG2  ARG  21          2HG       ARG  21   8.043  -9.531 -13.477
  200    HG3  ARG  21          3HG       ARG  21   6.433  -8.837 -13.678
  201    HD2  ARG  21          2HD       ARG  21   7.789  -6.782 -14.596
  202    HD3  ARG  21          3HD       ARG  21   9.031  -8.002 -14.878
  203    HE   ARG  21           HE       ARG  21   6.571  -8.905 -15.908
  204   HH11  ARG  21          1HH1      ARG  21   9.062  -6.552 -16.527
  205   HH12  ARG  21          2HH1      ARG  21   8.784  -6.515 -18.236
  206   HH21  ARG  21          1HH2      ARG  21   6.196  -8.865 -18.158
  207   HH22  ARG  21          2HH2      ARG  21   7.153  -7.830 -19.163
  208    H    ASN  22           H        ASN  22   7.415  -8.253  -9.094
  209    HA   ASN  22           HA       ASN  22   8.578  -5.744  -8.269
  210    HB2  ASN  22          2HB       ASN  22   6.319  -7.424  -7.458
  211    HB3  ASN  22          3HB       ASN  22   7.163  -6.687  -6.099
  212   HD21  ASN  22          1HD2      ASN  22   6.114  -5.748  -9.360
  213   HD22  ASN  22          2HD2      ASN  22   5.436  -4.231  -8.887
  214    H    PHE  23           H        PHE  23   8.914  -9.139  -7.481
  215    HA   PHE  23           HA       PHE  23  10.309  -8.935  -5.072
  216    HB2  PHE  23          2HB       PHE  23   9.641 -10.989  -6.918
  217    HB3  PHE  23          3HB       PHE  23  11.367 -11.113  -6.595
  218    HD1  PHE  23           HD1      PHE  23  11.736 -12.827  -5.114
  219    HD2  PHE  23           HD2      PHE  23   8.463 -10.189  -4.445
  220    HE1  PHE  23           HE1      PHE  23  11.256 -13.967  -2.987
  221    HE2  PHE  23           HE2      PHE  23   7.978 -11.324  -2.317
  222    HZ   PHE  23           HZ       PHE  23   9.376 -13.216  -1.585
  223    H    GLY  24           H        GLY  24  11.301  -8.260  -8.308
  224    HA2  GLY  24          2HA       GLY  24  14.055  -8.630  -8.172
  225    HA3  GLY  24          3HA       GLY  24  13.257  -7.417  -9.162
  226    H    TYR  25           H        TYR  25  12.091  -6.244  -6.621
  227    HA   TYR  25           HA       TYR  25  14.308  -4.450  -6.115
  228    HB2  TYR  25          2HB       TYR  25  11.378  -4.432  -5.587
  229    HB3  TYR  25          3HB       TYR  25  12.399  -3.465  -4.529
  230    HD1  TYR  25           HD1      TYR  25  12.203  -1.240  -5.112
  231    HD2  TYR  25           HD2      TYR  25  12.506  -4.147  -8.204
  232    HE1  TYR  25           HE1      TYR  25  12.244   0.558  -6.790
  233    HE2  TYR  25           HE2      TYR  25  12.549  -2.357  -9.890
  234    HH   TYR  25           HH       TYR  25  11.813   0.907  -9.125
  235    H    THR  26           H        THR  26  12.713  -7.095  -4.566
  236    HA   THR  26           HA       THR  26  13.865  -6.495  -1.961
  237    HB   THR  26           HB       THR  26  12.800  -9.005  -1.713
  238    HG1  THR  26           HG1      THR  26  11.961  -8.966  -3.833
  239   HG21  THR  26          1HG2      THR  26  12.425  -6.866  -0.375
  240   HG22  THR  26          2HG2      THR  26  11.057  -7.971  -0.504
  241   HG23  THR  26          3HG2      THR  26  11.116  -6.520  -1.504
  242    H    LEU  27           H        LEU  27  14.356  -8.646  -4.677
  243    HA   LEU  27           HA       LEU  27  16.490 -10.049  -3.243
  244    HB2  LEU  27          2HB       LEU  27  15.258 -11.669  -4.281
  245    HB3  LEU  27          3HB       LEU  27  14.830 -10.627  -5.636
  246    HG   LEU  27           HG       LEU  27  17.084 -10.932  -6.565
  247   HD11  LEU  27          1HD1      LEU  27  17.730 -11.759  -3.990
  248   HD12  LEU  27          2HD1      LEU  27  18.773 -11.794  -5.411
  249   HD13  LEU  27          3HD1      LEU  27  17.832 -13.220  -4.974
  250   HD21  LEU  27          1HD2      LEU  27  16.813 -13.252  -7.256
  251   HD22  LEU  27          2HD2      LEU  27  15.260 -12.416  -7.247
  252   HD23  LEU  27          3HD2      LEU  27  15.673 -13.524  -5.938
  253    H    ARG  28           H        ARG  28  15.907  -7.923  -5.970
  254    HA   ARG  28           HA       ARG  28  18.822  -7.695  -6.342
  255    HB2  ARG  28          2HB       ARG  28  16.854  -8.379  -8.239
  256    HB3  ARG  28          3HB       ARG  28  17.341  -6.732  -8.615
  257    HG2  ARG  28          2HG       ARG  28  19.545  -7.345  -9.029
  258    HG3  ARG  28          3HG       ARG  28  19.382  -8.872  -8.158
  259    HD2  ARG  28          2HD       ARG  28  17.634  -9.440  -9.982
  260    HD3  ARG  28          3HD       ARG  28  18.395  -8.132 -10.887
  261    HE   ARG  28           HE       ARG  28  20.369  -9.906  -9.942
  262   HH11  ARG  28          1HH1      ARG  28  17.806  -9.709 -12.289
  263   HH12  ARG  28          2HH1      ARG  28  18.549 -10.824 -13.387
  264   HH21  ARG  28          1HH2      ARG  28  21.358 -11.376 -11.379
  265   HH22  ARG  28          2HH2      ARG  28  20.569 -11.772 -12.868
  Start of MODEL    6
    1    H1   LYS   1           H        LYS   1  -4.923  -9.419   3.155
    2    HA   LYS   1           HA       LYS   1  -2.160  -9.445   2.225
    3    HB2  LYS   1          2HB       LYS   1  -3.156  -9.218  -0.025
    4    HB3  LYS   1          3HB       LYS   1  -3.790 -10.605   0.851
    5    HG2  LYS   1          2HG       LYS   1  -5.478  -8.409   1.414
    6    HG3  LYS   1          3HG       LYS   1  -5.203  -8.441  -0.330
    7    HD2  LYS   1          2HD       LYS   1  -6.891  -9.934  -0.314
    8    HD3  LYS   1          3HD       LYS   1  -5.625 -11.069   0.158
    9    HE2  LYS   1          2HE       LYS   1  -6.260 -11.041   2.390
   10    HE3  LYS   1          3HE       LYS   1  -7.095  -9.496   2.237
   11    HZ1  LYS   1          1HZ       LYS   1  -8.198 -12.037   2.096
   12    HZ2  LYS   1          2HZ       LYS   1  -8.290 -11.399   0.532
   13    HZ3  LYS   1          3HZ       LYS   1  -8.978 -10.559   1.830
   14    H    TYR   2           H        TYR   2  -0.991  -7.653   2.180
   15    HA   TYR   2           HA       TYR   2  -2.382  -5.071   1.891
   16    HB2  TYR   2          2HB       TYR   2  -1.482  -5.275   4.138
   17    HB3  TYR   2          3HB       TYR   2   0.101  -5.704   3.498
   18    HD1  TYR   2           HD1      TYR   2  -2.255  -2.994   2.487
   19    HD2  TYR   2           HD2      TYR   2   1.540  -3.994   4.129
   20    HE1  TYR   2           HE1      TYR   2  -1.626  -0.616   2.466
   21    HE2  TYR   2           HE2      TYR   2   2.179  -1.619   4.114
   22    HH   TYR   2           HH       TYR   2   1.030   0.597   4.135
   23    H    GLU   3           H        GLU   3   1.046  -5.999   1.822
   24    HA   GLU   3           HA       GLU   3   1.400  -4.459  -0.615
   25    HB2  GLU   3          2HB       GLU   3   3.043  -5.186   1.603
   26    HB3  GLU   3          3HB       GLU   3   3.799  -5.789   0.135
   27    HG2  GLU   3          2HG       GLU   3   3.298  -3.376  -0.746
   28    HG3  GLU   3          3HG       GLU   3   3.246  -2.989   0.973
   29    H    ILE   4           H        ILE   4   1.286  -7.779   0.424
   30    HA   ILE   4           HA       ILE   4   2.515  -8.955  -1.836
   31    HB   ILE   4           HB       ILE   4   1.385 -11.038  -1.138
   32   HG12  ILE   4          2HG1      ILE   4   0.207 -10.683   1.226
   33   HG13  ILE   4          3HG1      ILE   4  -0.148  -9.104   0.535
   34   HG21  ILE   4          1HG2      ILE   4   2.532  -9.568   1.227
   35   HG22  ILE   4          2HG2      ILE   4   2.557 -11.304   0.925
   36   HG23  ILE   4          3HG2      ILE   4   3.503 -10.219  -0.093
   37   HD11  ILE   4          1HD1      ILE   4  -1.797 -11.129   0.266
   38   HD12  ILE   4          2HD1      ILE   4  -1.562  -9.958  -1.032
   39   HD13  ILE   4          3HD1      ILE   4  -0.738 -11.516  -1.090
   40    H    THR   5           H        THR   5  -0.450  -7.374  -1.471
   41    HA   THR   5           HA       THR   5  -1.563  -8.700  -3.854
   42    HB   THR   5           HB       THR   5  -3.154  -8.881  -2.115
   43    HG1  THR   5           HG1      THR   5  -3.937  -6.533  -3.522
   44   HG21  THR   5          1HG2      THR   5  -3.902  -6.983  -0.755
   45   HG22  THR   5          2HG2      THR   5  -2.744  -5.937  -1.576
   46   HG23  THR   5          3HG2      THR   5  -2.172  -7.263  -0.565
   47    H    THR   6           H        THR   6  -1.410  -7.618  -5.695
   48    HA   THR   6           HA       THR   6  -0.325  -5.108  -6.036
   49    HB   THR   6           HB       THR   6  -1.939  -5.243  -8.221
   50    HG1  THR   6           HG1      THR   6  -2.717  -7.317  -7.109
   51   HG21  THR   6          1HG2      THR   6   0.305  -5.125  -8.684
   52   HG22  THR   6          2HG2      THR   6  -0.001  -6.812  -9.099
   53   HG23  THR   6          3HG2      THR   6   0.719  -6.403  -7.542
   54    H    ILE   7           H        ILE   7  -3.739  -5.684  -6.831
   55    HA   ILE   7           HA       ILE   7  -4.342  -3.005  -5.770
   56    HB   ILE   7           HB       ILE   7  -5.850  -4.612  -7.835
   57   HG12  ILE   7          2HG1      ILE   7  -4.715  -1.980  -8.522
   58   HG13  ILE   7          3HG1      ILE   7  -3.523  -3.233  -8.196
   59   HG21  ILE   7          1HG2      ILE   7  -7.539  -3.368  -6.946
   60   HG22  ILE   7          2HG2      ILE   7  -6.455  -2.097  -6.382
   61   HG23  ILE   7          3HG2      ILE   7  -6.892  -2.190  -8.088
   62   HD11  ILE   7          1HD1      ILE   7  -3.779  -3.863 -10.302
   63   HD12  ILE   7          2HD1      ILE   7  -5.378  -4.458  -9.851
   64   HD13  ILE   7          3HD1      ILE   7  -5.194  -2.831 -10.508
   65    H    HIS   8           H        HIS   8  -6.609  -5.591  -6.539
   66    HA   HIS   8           HA       HIS   8  -7.360  -5.710  -3.693
   67    HB2  HIS   8          2HB       HIS   8  -8.978  -5.046  -6.034
   68    HB3  HIS   8          3HB       HIS   8  -9.672  -6.347  -5.071
   69    HD1  HIS   8           HD1      HIS   8  -8.974  -2.698  -5.027
   70    HD2  HIS   8           HD2      HIS   8 -10.479  -5.602  -2.465
   71    HE1  HIS   8           HE1      HIS   8 -10.040  -1.435  -3.132
   72    H    ASN   9           H        ASN   9  -8.537  -7.466  -6.543
   73    HA   ASN   9           HA       ASN   9  -7.511  -9.952  -5.340
   74    HB2  ASN   9          2HB       ASN   9 -10.212  -9.399  -6.560
   75    HB3  ASN   9          3HB       ASN   9  -9.580 -11.035  -6.403
   76   HD21  ASN   9          1HD2      ASN   9  -9.931 -12.072  -4.569
   77   HD22  ASN   9          2HD2      ASN   9 -10.476 -11.355  -3.094
   78    H    LEU  10           H        LEU  10  -6.165  -8.400  -7.285
   79    HA   LEU  10           HA       LEU  10  -6.545  -9.057  -9.932
   80    HB2  LEU  10          2HB       LEU  10  -4.340  -8.126  -8.285
   81    HB3  LEU  10          3HB       LEU  10  -3.794  -9.113  -9.639
   82    HG   LEU  10           HG       LEU  10  -5.434  -6.586  -9.806
   83   HD11  LEU  10          1HD1      LEU  10  -3.356  -5.744  -9.512
   84   HD12  LEU  10          2HD1      LEU  10  -3.230  -6.100 -11.235
   85   HD13  LEU  10          3HD1      LEU  10  -2.557  -7.221 -10.052
   86   HD21  LEU  10          1HD2      LEU  10  -6.176  -7.944 -11.579
   87   HD22  LEU  10          2HD2      LEU  10  -4.553  -8.556 -11.899
   88   HD23  LEU  10          3HD2      LEU  10  -4.957  -6.882 -12.284
   89    H    PHE  11           H        PHE  11  -3.922 -10.607  -8.111
   90    HA   PHE  11           HA       PHE  11  -4.648 -13.152  -9.407
   91    HB2  PHE  11          2HB       PHE  11  -2.087 -13.605  -8.983
   92    HB3  PHE  11          3HB       PHE  11  -2.613 -12.697 -10.396
   93    HD1  PHE  11           HD1      PHE  11  -2.133 -10.366 -10.625
   94    HD2  PHE  11           HD2      PHE  11  -1.051 -12.468  -7.085
   95    HE1  PHE  11           HE1      PHE  11  -0.706  -8.480  -9.945
   96    HE2  PHE  11           HE2      PHE  11   0.376 -10.584  -6.399
   97    HZ   PHE  11           HZ       PHE  11   0.549  -8.587  -7.829
   98    H    ARG  12           H        ARG  12  -5.574 -14.413  -7.930
   99    HA   ARG  12           HA       ARG  12  -5.428 -14.201  -5.184
  100    HB2  ARG  12          2HB       ARG  12  -5.880 -16.683  -6.851
  101    HB3  ARG  12          3HB       ARG  12  -6.202 -16.567  -5.126
  102    HG2  ARG  12          2HG       ARG  12  -8.260 -15.945  -5.667
  103    HG3  ARG  12          3HG       ARG  12  -7.566 -14.415  -6.208
  104    HD2  ARG  12          2HD       ARG  12  -7.102 -15.826  -8.400
  105    HD3  ARG  12          3HD       ARG  12  -8.461 -16.768  -7.788
  106    HE   ARG  12           HE       ARG  12  -9.211 -14.097  -7.695
  107   HH11  ARG  12          1HH1      ARG  12  -8.340 -16.466 -10.093
  108   HH12  ARG  12          2HH1      ARG  12  -9.317 -15.758 -11.336
  109   HH21  ARG  12          1HH2      ARG  12 -10.501 -13.156  -9.323
  110   HH22  ARG  12          2HH2      ARG  12 -10.546 -13.875 -10.898
  111    H    LYS  13           H        LYS  13  -3.306 -15.941  -7.383
  112    HA   LYS  13           HA       LYS  13  -1.601 -16.669  -5.094
  113    HB2  LYS  13          2HB       LYS  13  -2.514 -18.178  -7.365
  114    HB3  LYS  13          3HB       LYS  13  -0.758 -18.076  -7.392
  115    HG2  LYS  13          2HG       LYS  13  -0.755 -19.787  -5.981
  116    HG3  LYS  13          3HG       LYS  13  -1.346 -18.664  -4.754
  117    HD2  LYS  13          2HD       LYS  13  -3.067 -20.104  -4.593
  118    HD3  LYS  13          3HD       LYS  13  -3.651 -19.294  -6.049
  119    HE2  LYS  13          2HE       LYS  13  -2.507 -20.994  -7.418
  120    HE3  LYS  13          3HE       LYS  13  -1.995 -21.815  -5.945
  121    HZ1  LYS  13          1HZ       LYS  13  -4.836 -21.304  -6.137
  122    HZ2  LYS  13          2HZ       LYS  13  -4.017 -22.695  -5.634
  123    HZ3  LYS  13          3HZ       LYS  13  -4.235 -22.392  -7.284
  124    H    LEU  14           H        LEU  14  -0.184 -15.024  -4.896
  125    HA   LEU  14           HA       LEU  14   1.053 -13.883  -7.280
  126    HB2  LEU  14          2HB       LEU  14   1.885 -12.163  -5.860
  127    HB3  LEU  14          3HB       LEU  14   0.190 -12.428  -5.460
  128    HG   LEU  14           HG       LEU  14   1.957 -13.990  -3.770
  129   HD11  LEU  14          1HD1      LEU  14   3.575 -12.292  -3.975
  130   HD12  LEU  14          2HD1      LEU  14   2.715 -11.950  -2.474
  131   HD13  LEU  14          3HD1      LEU  14   2.358 -11.016  -3.927
  132   HD21  LEU  14          1HD2      LEU  14  -0.202 -11.937  -3.341
  133   HD22  LEU  14          2HD2      LEU  14   0.632 -12.756  -2.021
  134   HD23  LEU  14          3HD2      LEU  14  -0.321 -13.689  -3.176
  135    H    THR  15           H        THR  15   1.723 -16.558  -6.740
  136    HA   THR  15           HA       THR  15   4.378 -16.502  -5.535
  137    HB   THR  15           HB       THR  15   4.146 -19.045  -6.401
  138    HG1  THR  15           HG1      THR  15   2.147 -19.506  -6.892
  139   HG21  THR  15          1HG2      THR  15   4.602 -18.796  -4.156
  140   HG22  THR  15          2HG2      THR  15   2.947 -19.402  -4.088
  141   HG23  THR  15          3HG2      THR  15   3.263 -17.678  -3.899
  142    H    HIS  16           H        HIS  16   3.300 -18.319  -8.378
  143    HA   HIS  16           HA       HIS  16   5.541 -17.140  -9.887
  144    HB2  HIS  16          2HB       HIS  16   5.559 -19.395 -11.110
  145    HB3  HIS  16          3HB       HIS  16   6.216 -19.359  -9.476
  146    HD1  HIS  16           HD1      HIS  16   5.501 -21.309  -8.157
  147    HD2  HIS  16           HD2      HIS  16   2.598 -20.172 -10.903
  148    HE1  HIS  16           HE1      HIS  16   3.615 -22.945  -7.857
  149    H    ARG  17           H        ARG  17   2.323 -17.117  -9.656
  150    HA   ARG  17           HA       ARG  17   1.412 -17.662 -12.270
  151    HB2  ARG  17          2HB       ARG  17  -0.153 -17.537 -10.436
  152    HB3  ARG  17          3HB       ARG  17   0.294 -15.867 -10.113
  153    HG2  ARG  17          2HG       ARG  17  -0.965 -15.054 -11.811
  154    HG3  ARG  17          3HG       ARG  17  -0.727 -16.482 -12.820
  155    HD2  ARG  17          2HD       ARG  17  -2.403 -17.677 -11.739
  156    HD3  ARG  17          3HD       ARG  17  -2.351 -16.644 -10.311
  157    HE   ARG  17           HE       ARG  17  -3.159 -15.040 -12.414
  158   HH11  ARG  17          1HH1      ARG  17  -4.316 -17.874 -10.756
  159   HH12  ARG  17          2HH1      ARG  17  -5.987 -17.524 -11.051
  160   HH21  ARG  17          1HH2      ARG  17  -5.356 -14.569 -12.810
  161   HH22  ARG  17          2HH2      ARG  17  -6.577 -15.644 -12.221
  162    H    LEU  18           H        LEU  18   1.300 -14.408 -10.875
  163    HA   LEU  18           HA       LEU  18   2.449 -13.377 -13.385
  164    HB2  LEU  18          2HB       LEU  18   0.098 -12.474 -11.786
  165    HB3  LEU  18          3HB       LEU  18   1.026 -11.288 -12.702
  166    HG   LEU  18           HG       LEU  18  -0.291 -13.722 -13.903
  167   HD11  LEU  18          1HD1      LEU  18  -1.760 -11.814 -14.900
  168   HD12  LEU  18          2HD1      LEU  18  -1.255 -10.933 -13.458
  169   HD13  LEU  18          3HD1      LEU  18  -2.119 -12.463 -13.300
  170   HD21  LEU  18          1HD2      LEU  18   1.733 -12.077 -14.877
  171   HD22  LEU  18          2HD2      LEU  18   0.262 -11.496 -15.657
  172   HD23  LEU  18          3HD2      LEU  18   0.730 -13.191 -15.805
  173    H    PHE  19           H        PHE  19   2.166 -13.006  -9.903
  174    HA   PHE  19           HA       PHE  19   3.572 -10.682  -9.466
  175    HB2  PHE  19          2HB       PHE  19   2.452 -12.250  -7.766
  176    HB3  PHE  19          3HB       PHE  19   3.980 -13.125  -7.752
  177    HD1  PHE  19           HD1      PHE  19   2.411  -9.850  -7.070
  178    HD2  PHE  19           HD2      PHE  19   5.822 -12.337  -6.521
  179    HE1  PHE  19           HE1      PHE  19   3.294  -8.267  -5.406
  180    HE2  PHE  19           HE2      PHE  19   6.709 -10.759  -4.856
  181    HZ   PHE  19           HZ       PHE  19   5.445  -8.721  -4.296
  182    H    ARG  20           H        ARG  20   4.787 -13.846 -10.343
  183    HA   ARG  20           HA       ARG  20   7.464 -13.626  -9.722
  184    HB2  ARG  20          2HB       ARG  20   7.816 -15.076 -11.801
  185    HB3  ARG  20          3HB       ARG  20   6.741 -15.700 -10.558
  186    HG2  ARG  20          2HG       ARG  20   4.880 -15.480 -11.856
  187    HG3  ARG  20          3HG       ARG  20   5.547 -14.130 -12.776
  188    HD2  ARG  20          2HD       ARG  20   7.130 -15.742 -13.841
  189    HD3  ARG  20          3HD       ARG  20   6.263 -17.046 -13.031
  190    HE   ARG  20           HE       ARG  20   4.310 -15.717 -14.359
  191   HH11  ARG  20          1HH1      ARG  20   7.367 -17.087 -15.307
  192   HH12  ARG  20          2HH1      ARG  20   6.852 -17.449 -16.921
  193   HH21  ARG  20          1HH2      ARG  20   3.620 -16.188 -16.481
  194   HH22  ARG  20          2HH2      ARG  20   4.721 -16.936 -17.588
  195    H    ARG  21           H        ARG  21   5.692 -12.188 -12.392
  196    HA   ARG  21           HA       ARG  21   8.150 -10.763 -13.177
  197    HB2  ARG  21          2HB       ARG  21   7.103 -12.438 -14.839
  198    HB3  ARG  21          3HB       ARG  21   5.834 -11.236 -15.035
  199    HG2  ARG  21          2HG       ARG  21   7.098  -9.971 -16.355
  200    HG3  ARG  21          3HG       ARG  21   8.489 -10.091 -15.276
  201    HD2  ARG  21          2HD       ARG  21   9.085 -12.233 -16.216
  202    HD3  ARG  21          3HD       ARG  21   7.630 -12.236 -17.212
  203    HE   ARG  21           HE       ARG  21  10.094 -10.920 -17.784
  204   HH11  ARG  21          1HH1      ARG  21   6.645 -10.715 -18.209
  205   HH12  ARG  21          2HH1      ARG  21   6.748  -9.774 -19.660
  206   HH21  ARG  21          1HH2      ARG  21  10.244  -9.682 -19.693
  207   HH22  ARG  21          2HH2      ARG  21   8.796  -9.188 -20.504
  208    H    ASN  22           H        ASN  22   5.870 -10.159 -11.252
  209    HA   ASN  22           HA       ASN  22   5.071  -7.578 -12.430
  210    HB2  ASN  22          2HB       ASN  22   3.508  -9.631 -11.161
  211    HB3  ASN  22          3HB       ASN  22   3.409  -8.148 -10.216
  212   HD21  ASN  22          1HD2      ASN  22   3.099  -6.139 -11.639
  213   HD22  ASN  22          2HD2      ASN  22   1.892  -6.278 -12.867
  214    H    PHE  23           H        PHE  23   6.752  -9.155  -9.913
  215    HA   PHE  23           HA       PHE  23   6.596  -7.425  -7.776
  216    HB2  PHE  23          2HB       PHE  23   8.749  -8.256  -7.081
  217    HB3  PHE  23          3HB       PHE  23   7.864  -9.580  -7.832
  218    HD1  PHE  23           HD1      PHE  23   8.441 -10.270 -10.160
  219    HD2  PHE  23           HD2      PHE  23  10.812  -7.520  -7.939
  220    HE1  PHE  23           HE1      PHE  23  10.325 -10.660 -11.694
  221    HE2  PHE  23           HE2      PHE  23  12.699  -7.905  -9.470
  222    HZ   PHE  23           HZ       PHE  23  12.457  -9.476 -11.350
  223    H    GLY  24           H        GLY  24   8.473  -7.096 -10.742
  224    HA2  GLY  24          2HA       GLY  24  10.119  -4.968 -10.060
  225    HA3  GLY  24          3HA       GLY  24   9.506  -5.272 -11.679
  226    H    TYR  25           H        TYR  25   6.699  -4.983 -10.621
  227    HA   TYR  25           HA       TYR  25   6.660  -2.046 -10.674
  228    HB2  TYR  25          2HB       TYR  25   4.938  -4.145 -11.820
  229    HB3  TYR  25          3HB       TYR  25   4.073  -2.783 -11.117
  230    HD1  TYR  25           HD1      TYR  25   7.109  -3.273 -13.255
  231    HD2  TYR  25           HD2      TYR  25   3.483  -1.141 -12.613
  232    HE1  TYR  25           HE1      TYR  25   7.524  -1.965 -15.296
  233    HE2  TYR  25           HE2      TYR  25   3.887   0.172 -14.653
  234    HH   TYR  25           HH       TYR  25   6.845  -0.264 -16.563
  235    H    THR  26           H        THR  26   5.978  -4.768  -8.720
  236    HA   THR  26           HA       THR  26   4.094  -3.412  -6.994
  237    HB   THR  26           HB       THR  26   5.462  -5.936  -6.168
  238    HG1  THR  26           HG1      THR  26   4.975  -6.385  -8.310
  239   HG21  THR  26          1HG2      THR  26   3.739  -6.076  -4.754
  240   HG22  THR  26          2HG2      THR  26   2.571  -5.836  -6.054
  241   HG23  THR  26          3HG2      THR  26   3.297  -4.443  -5.252
  242    H    LEU  27           H        LEU  27   7.244  -4.966  -6.353
  243    HA   LEU  27           HA       LEU  27   7.629  -3.241  -4.049
  244    HB2  LEU  27          2HB       LEU  27   9.472  -4.631  -3.494
  245    HB3  LEU  27          3HB       LEU  27   8.149  -5.677  -4.003
  246    HG   LEU  27           HG       LEU  27   9.423  -5.529  -6.327
  247   HD11  LEU  27          1HD1      LEU  27  11.929  -5.786  -5.046
  248   HD12  LEU  27          2HD1      LEU  27  11.223  -4.255  -4.529
  249   HD13  LEU  27          3HD1      LEU  27  11.429  -4.595  -6.247
  250   HD21  LEU  27          1HD2      LEU  27   8.894  -7.525  -4.855
  251   HD22  LEU  27          2HD2      LEU  27  10.494  -7.303  -4.147
  252   HD23  LEU  27          3HD2      LEU  27  10.332  -7.655  -5.868
  253    H    ARG  28           H        ARG  28   8.706  -3.522  -7.327
  254    HA   ARG  28           HA       ARG  28  10.744  -1.451  -6.866
  255    HB2  ARG  28          2HB       ARG  28  10.701  -3.827  -8.483
  256    HB3  ARG  28          3HB       ARG  28  10.931  -2.420  -9.511
  257    HG2  ARG  28          2HG       ARG  28  12.782  -1.731  -7.936
  258    HG3  ARG  28          3HG       ARG  28  12.640  -3.338  -7.222
  259    HD2  ARG  28          2HD       ARG  28  12.782  -3.973  -9.843
  260    HD3  ARG  28          3HD       ARG  28  13.756  -2.503  -9.818
  261    HE   ARG  28           HE       ARG  28  14.532  -4.233  -7.720
  262   HH11  ARG  28          1HH1      ARG  28  14.736  -3.858 -11.175
  263   HH12  ARG  28          2HH1      ARG  28  16.223  -4.735 -11.314
  264   HH21  ARG  28          1HH2      ARG  28  16.490  -5.390  -7.889
  265   HH22  ARG  28          2HH2      ARG  28  17.220  -5.607  -9.444
  Start of MODEL    7
    1    H1   LYS   1           H        LYS   1 -13.513  -4.990  -1.813
    2    HA   LYS   1           HA       LYS   1 -14.486  -5.364   0.707
    3    HB2  LYS   1          2HB       LYS   1 -15.916  -5.696  -1.182
    4    HB3  LYS   1          3HB       LYS   1 -14.931  -7.030  -1.770
    5    HG2  LYS   1          2HG       LYS   1 -15.910  -8.525  -0.410
    6    HG3  LYS   1          3HG       LYS   1 -16.029  -7.384   0.932
    7    HD2  LYS   1          2HD       LYS   1 -17.912  -6.275  -0.248
    8    HD3  LYS   1          3HD       LYS   1 -17.830  -7.533  -1.485
    9    HE2  LYS   1          2HE       LYS   1 -18.173  -9.213   0.354
   10    HE3  LYS   1          3HE       LYS   1 -18.496  -7.859   1.435
   11    HZ1  LYS   1          1HZ       LYS   1 -20.281  -7.192  -0.156
   12    HZ2  LYS   1          2HZ       LYS   1 -20.568  -8.649   0.653
   13    HZ3  LYS   1          3HZ       LYS   1 -20.051  -8.664  -0.957
   14    H    TYR   2           H        TYR   2 -13.478  -8.234  -1.118
   15    HA   TYR   2           HA       TYR   2 -12.213  -9.247   1.345
   16    HB2  TYR   2          2HB       TYR   2 -14.270 -10.467   0.888
   17    HB3  TYR   2          3HB       TYR   2 -13.741 -10.794  -0.759
   18    HD1  TYR   2           HD1      TYR   2 -11.792 -11.034   2.403
   19    HD2  TYR   2           HD2      TYR   2 -13.573 -13.121  -0.849
   20    HE1  TYR   2           HE1      TYR   2 -10.726 -13.116   3.164
   21    HE2  TYR   2           HE2      TYR   2 -12.514 -15.209  -0.097
   22    HH   TYR   2           HH       TYR   2 -10.451 -15.833   1.281
   23    H    GLU   3           H        GLU   3 -12.300 -10.417  -2.010
   24    HA   GLU   3           HA       GLU   3  -9.374 -10.597  -1.946
   25    HB2  GLU   3          2HB       GLU   3 -11.315 -11.824  -3.913
   26    HB3  GLU   3          3HB       GLU   3  -9.588 -12.139  -3.819
   27    HG2  GLU   3          2HG       GLU   3 -10.536 -12.688  -1.269
   28    HG3  GLU   3          3HG       GLU   3 -11.765 -13.336  -2.354
   29    H    ILE   4           H        ILE   4 -11.291  -8.234  -2.616
   30    HA   ILE   4           HA       ILE   4  -9.976  -7.504  -5.153
   31    HB   ILE   4           HB       ILE   4 -12.233  -7.541  -5.710
   32   HG12  ILE   4          2HG1      ILE   4 -10.958  -5.206  -5.852
   33   HG13  ILE   4          3HG1      ILE   4 -12.632  -5.382  -6.368
   34   HG21  ILE   4          1HG2      ILE   4 -12.702  -6.530  -2.931
   35   HG22  ILE   4          2HG2      ILE   4 -13.946  -6.380  -4.171
   36   HG23  ILE   4          3HG2      ILE   4 -13.344  -7.973  -3.715
   37   HD11  ILE   4          1HD1      ILE   4 -12.071  -4.629  -3.547
   38   HD12  ILE   4          2HD1      ILE   4 -11.903  -3.415  -4.816
   39   HD13  ILE   4          3HD1      ILE   4 -13.448  -4.228  -4.573
   40    H    THR   5           H        THR   5 -10.871  -6.491  -1.925
   41    HA   THR   5           HA       THR   5 -10.283  -3.800  -1.969
   42    HB   THR   5           HB       THR   5  -9.187  -4.854   0.445
   43    HG1  THR   5           HG1      THR   5 -10.263  -6.655   0.657
   44   HG21  THR   5          1HG2      THR   5 -11.481  -3.231  -0.449
   45   HG22  THR   5          2HG2      THR   5 -10.318  -2.937   0.845
   46   HG23  THR   5          3HG2      THR   5 -11.676  -4.030   1.111
   47    H    THR   6           H        THR   6  -8.092  -6.522  -2.006
   48    HA   THR   6           HA       THR   6  -5.813  -4.652  -2.023
   49    HB   THR   6           HB       THR   6  -4.724  -7.166  -1.637
   50    HG1  THR   6           HG1      THR   6  -6.039  -7.808   0.292
   51   HG21  THR   6          1HG2      THR   6  -3.931  -6.285   0.338
   52   HG22  THR   6          2HG2      THR   6  -5.460  -5.495   0.724
   53   HG23  THR   6          3HG2      THR   6  -4.402  -4.814  -0.512
   54    H    ILE   7           H        ILE   7  -4.886  -4.383  -3.935
   55    HA   ILE   7           HA       ILE   7  -5.128  -6.532  -5.935
   56    HB   ILE   7           HB       ILE   7  -4.697  -3.580  -6.408
   57   HG12  ILE   7          2HG1      ILE   7  -7.109  -4.793  -7.504
   58   HG13  ILE   7          3HG1      ILE   7  -7.049  -4.904  -5.749
   59   HG21  ILE   7          1HG2      ILE   7  -3.640  -4.751  -8.164
   60   HG22  ILE   7          2HG2      ILE   7  -4.955  -5.920  -8.276
   61   HG23  ILE   7          3HG2      ILE   7  -5.211  -4.253  -8.793
   62   HD11  ILE   7          1HD1      ILE   7  -7.502  -2.601  -7.467
   63   HD12  ILE   7          2HD1      ILE   7  -7.930  -2.863  -5.776
   64   HD13  ILE   7          3HD1      ILE   7  -6.310  -2.311  -6.200
   65    H    HIS   8           H        HIS   8  -2.963  -3.727  -5.642
   66    HA   HIS   8           HA       HIS   8  -0.724  -5.183  -6.618
   67    HB2  HIS   8          2HB       HIS   8  -1.290  -2.435  -5.751
   68    HB3  HIS   8          3HB       HIS   8   0.359  -2.962  -5.425
   69    HD1  HIS   8           HD1      HIS   8   1.943  -3.088  -7.381
   70    HD2  HIS   8           HD2      HIS   8  -1.997  -2.455  -8.536
   71    HE1  HIS   8           HE1      HIS   8   2.038  -2.571  -9.840
   72    H    ASN   9           H        ASN   9  -2.188  -5.067  -3.598
   73    HA   ASN   9           HA       ASN   9   0.189  -5.389  -2.003
   74    HB2  ASN   9          2HB       ASN   9  -2.575  -4.874  -1.519
   75    HB3  ASN   9          3HB       ASN   9  -2.121  -6.314  -0.612
   76   HD21  ASN   9          1HD2      ASN   9  -1.099  -2.999  -1.283
   77   HD22  ASN   9          2HD2      ASN   9  -0.420  -2.706   0.278
   78    H    LEU  10           H        LEU  10  -2.301  -7.480  -3.367
   79    HA   LEU  10           HA       LEU  10  -0.692  -9.810  -2.551
   80    HB2  LEU  10          2HB       LEU  10  -2.814 -11.103  -2.627
   81    HB3  LEU  10          3HB       LEU  10  -2.748  -9.882  -1.358
   82    HG   LEU  10           HG       LEU  10  -4.054  -8.411  -3.052
   83   HD11  LEU  10          1HD1      LEU  10  -4.204 -11.122  -4.267
   84   HD12  LEU  10          2HD1      LEU  10  -4.118  -9.539  -5.039
   85   HD13  LEU  10          3HD1      LEU  10  -5.632 -10.089  -4.321
   86   HD21  LEU  10          1HD2      LEU  10  -6.103  -9.115  -2.098
   87   HD22  LEU  10          2HD2      LEU  10  -4.860  -9.413  -0.882
   88   HD23  LEU  10          3HD2      LEU  10  -5.502 -10.752  -1.835
   89    H    PHE  11           H        PHE  11  -0.679  -8.094  -5.021
   90    HA   PHE  11           HA       PHE  11  -1.812  -9.498  -7.176
   91    HB2  PHE  11          2HB       PHE  11  -0.419  -7.138  -6.879
   92    HB3  PHE  11          3HB       PHE  11   0.706  -8.137  -7.793
   93    HD1  PHE  11           HD1      PHE  11  -0.415  -9.442  -9.813
   94    HD2  PHE  11           HD2      PHE  11  -1.933  -5.878  -8.049
   95    HE1  PHE  11           HE1      PHE  11  -1.658  -8.951 -11.880
   96    HE2  PHE  11           HE2      PHE  11  -3.178  -5.382 -10.112
   97    HZ   PHE  11           HZ       PHE  11  -3.042  -6.920 -12.030
   98    H    ARG  12           H        ARG  12   1.142  -9.948  -5.382
   99    HA   ARG  12           HA       ARG  12   1.828 -12.208  -7.146
  100    HB2  ARG  12          2HB       ARG  12   4.138 -11.855  -6.703
  101    HB3  ARG  12          3HB       ARG  12   3.463 -10.286  -7.119
  102    HG2  ARG  12          2HG       ARG  12   4.293  -9.465  -5.242
  103    HG3  ARG  12          3HG       ARG  12   3.238 -10.544  -4.326
  104    HD2  ARG  12          2HD       ARG  12   5.055 -12.321  -4.749
  105    HD3  ARG  12          3HD       ARG  12   6.088 -10.953  -5.162
  106    HE   ARG  12           HE       ARG  12   4.906 -10.405  -2.701
  107   HH11  ARG  12          1HH1      ARG  12   7.141 -12.688  -4.083
  108   HH12  ARG  12          2HH1      ARG  12   8.006 -12.936  -2.603
  109   HH21  ARG  12          1HH2      ARG  12   6.037 -10.724  -0.745
  110   HH22  ARG  12          2HH2      ARG  12   7.376 -11.819  -0.704
  111    H    LYS  13           H        LYS  13   0.079 -12.053  -4.727
  112    HA   LYS  13           HA       LYS  13   1.432 -13.297  -2.560
  113    HB2  LYS  13          2HB       LYS  13  -0.599 -12.117  -2.106
  114    HB3  LYS  13          3HB       LYS  13  -1.491 -13.076  -3.279
  115    HG2  LYS  13          2HG       LYS  13  -1.990 -13.708  -0.961
  116    HG3  LYS  13          3HG       LYS  13  -1.292 -15.038  -1.889
  117    HD2  LYS  13          2HD       LYS  13   0.367 -15.235  -0.422
  118    HD3  LYS  13          3HD       LYS  13   0.809 -13.541  -0.651
  119    HE2  LYS  13          2HE       LYS  13  -1.086 -12.990   0.949
  120    HE3  LYS  13          3HE       LYS  13  -1.135 -14.712   1.325
  121    HZ1  LYS  13          1HZ       LYS  13   0.475 -12.842   2.501
  122    HZ2  LYS  13          2HZ       LYS  13   1.517 -13.665   1.454
  123    HZ3  LYS  13          3HZ       LYS  13   0.642 -14.521   2.621
  124    H    LEU  14           H        LEU  14  -1.245 -14.746  -4.393
  125    HA   LEU  14           HA       LEU  14   0.244 -17.289  -4.374
  126    HB2  LEU  14          2HB       LEU  14  -1.871 -18.448  -4.259
  127    HB3  LEU  14          3HB       LEU  14  -1.726 -17.309  -2.921
  128    HG   LEU  14           HG       LEU  14  -3.103 -16.114  -5.165
  129   HD11  LEU  14          1HD1      LEU  14  -5.182 -17.516  -4.836
  130   HD12  LEU  14          2HD1      LEU  14  -4.135 -18.731  -4.105
  131   HD13  LEU  14          3HD1      LEU  14  -3.888 -18.250  -5.784
  132   HD21  LEU  14          1HD2      LEU  14  -3.188 -15.192  -2.950
  133   HD22  LEU  14          2HD2      LEU  14  -3.827 -16.701  -2.297
  134   HD23  LEU  14          3HD2      LEU  14  -4.806 -15.731  -3.398
  135    H    THR  15           H        THR  15  -1.497 -14.974  -6.252
  136    HA   THR  15           HA       THR  15  -1.197 -16.682  -8.637
  137    HB   THR  15           HB       THR  15  -2.998 -15.344  -9.679
  138    HG1  THR  15           HG1      THR  15  -2.544 -13.647  -7.806
  139   HG21  THR  15          1HG2      THR  15  -3.249 -17.308  -7.672
  140   HG22  THR  15          2HG2      THR  15  -4.398 -16.916  -8.951
  141   HG23  THR  15          3HG2      THR  15  -4.522 -16.124  -7.380
  142    H    HIS  16           H        HIS  16   1.062 -15.777  -8.511
  143    HA   HIS  16           HA       HIS  16   1.453 -13.011  -9.152
  144    HB2  HIS  16          2HB       HIS  16   3.839 -13.794  -9.587
  145    HB3  HIS  16          3HB       HIS  16   3.220 -14.039  -7.957
  146    HD1  HIS  16           HD1      HIS  16   2.117 -16.424 -10.577
  147    HD2  HIS  16           HD2      HIS  16   5.050 -16.181  -7.645
  148    HE1  HIS  16           HE1      HIS  16   3.039 -18.753 -10.354
  149    H    ARG  17           H        ARG  17  -0.159 -13.228 -10.997
  150    HA   ARG  17           HA       ARG  17   0.310 -14.598 -13.345
  151    HB2  ARG  17          2HB       ARG  17  -1.182 -12.182 -12.577
  152    HB3  ARG  17          3HB       ARG  17  -0.720 -12.243 -14.272
  153    HG2  ARG  17          2HG       ARG  17  -1.695 -14.747 -13.909
  154    HG3  ARG  17          3HG       ARG  17  -2.702 -13.816 -12.798
  155    HD2  ARG  17          2HD       ARG  17  -2.541 -12.294 -15.144
  156    HD3  ARG  17          3HD       ARG  17  -2.792 -13.957 -15.670
  157    HE   ARG  17           HE       ARG  17  -4.669 -12.270 -14.285
  158   HH11  ARG  17          1HH1      ARG  17  -3.752 -15.545 -15.031
  159   HH12  ARG  17          2HH1      ARG  17  -5.342 -16.186 -14.777
  160   HH21  ARG  17          1HH2      ARG  17  -6.766 -13.102 -13.947
  161   HH22  ARG  17          2HH2      ARG  17  -7.055 -14.795 -14.161
  162    H    LEU  18           H        LEU  18   0.941 -11.105 -13.143
  163    HA   LEU  18           HA       LEU  18   3.329 -11.537 -14.812
  164    HB2  LEU  18          2HB       LEU  18   1.559  -9.106 -14.593
  165    HB3  LEU  18          3HB       LEU  18   3.012  -9.221 -15.584
  166    HG   LEU  18           HG       LEU  18   1.529 -11.331 -16.497
  167   HD11  LEU  18          1HD1      LEU  18  -0.281  -9.850 -15.015
  168   HD12  LEU  18          2HD1      LEU  18  -0.662 -11.043 -16.256
  169   HD13  LEU  18          3HD1      LEU  18  -0.557  -9.334 -16.679
  170   HD21  LEU  18          1HD2      LEU  18   2.762  -9.670 -17.821
  171   HD22  LEU  18          2HD2      LEU  18   1.482  -8.494 -17.523
  172   HD23  LEU  18          3HD2      LEU  18   1.141  -9.952 -18.456
  173    H    PHE  19           H        PHE  19   3.384 -11.778 -11.978
  174    HA   PHE  19           HA       PHE  19   4.990  -9.414 -11.256
  175    HB2  PHE  19          2HB       PHE  19   2.907 -10.866  -9.795
  176    HB3  PHE  19          3HB       PHE  19   4.381 -10.633  -8.861
  177    HD1  PHE  19           HD1      PHE  19   1.788  -8.848 -10.809
  178    HD2  PHE  19           HD2      PHE  19   4.880  -8.560  -7.898
  179    HE1  PHE  19           HE1      PHE  19   1.097  -6.540 -10.308
  180    HE2  PHE  19           HE2      PHE  19   4.193  -6.253  -7.392
  181    HZ   PHE  19           HZ       PHE  19   2.299  -5.240  -8.597
  182    H    ARG  20           H        ARG  20   4.781 -12.894 -11.340
  183    HA   ARG  20           HA       ARG  20   7.011 -13.539  -9.772
  184    HB2  ARG  20          2HB       ARG  20   5.151 -15.021 -10.949
  185    HB3  ARG  20          3HB       ARG  20   6.388 -15.169 -12.190
  186    HG2  ARG  20          2HG       ARG  20   6.983 -15.745  -9.310
  187    HG3  ARG  20          3HG       ARG  20   6.283 -16.964 -10.377
  188    HD2  ARG  20          2HD       ARG  20   8.270 -16.240 -11.948
  189    HD3  ARG  20          3HD       ARG  20   8.987 -15.715 -10.425
  190    HE   ARG  20           HE       ARG  20   7.976 -18.386 -10.298
  191   HH11  ARG  20          1HH1      ARG  20  10.673 -16.432 -11.314
  192   HH12  ARG  20          2HH1      ARG  20  11.822 -17.723 -11.190
  193   HH21  ARG  20          1HH2      ARG  20   9.480 -20.093 -10.132
  194   HH22  ARG  20          2HH2      ARG  20  11.143 -19.805 -10.519
  195    H    ARG  21           H        ARG  21   6.738 -12.446 -13.080
  196    HA   ARG  21           HA       ARG  21   9.551 -12.958 -13.617
  197    HB2  ARG  21          2HB       ARG  21   9.069 -12.132 -15.866
  198    HB3  ARG  21          3HB       ARG  21   7.909 -13.366 -15.393
  199    HG2  ARG  21          2HG       ARG  21   6.285 -11.603 -14.847
  200    HG3  ARG  21          3HG       ARG  21   7.447 -10.391 -15.392
  201    HD2  ARG  21          2HD       ARG  21   6.551 -10.613 -17.419
  202    HD3  ARG  21          3HD       ARG  21   7.325 -12.195 -17.488
  203    HE   ARG  21           HE       ARG  21   4.959 -12.624 -16.181
  204   HH11  ARG  21          1HH1      ARG  21   5.892 -11.302 -19.264
  205   HH12  ARG  21          2HH1      ARG  21   4.440 -11.804 -20.065
  206   HH21  ARG  21          1HH2      ARG  21   3.043 -13.289 -17.225
  207   HH22  ARG  21          2HH2      ARG  21   2.820 -12.933 -18.904
  208    H    ASN  22           H        ASN  22   7.411 -10.301 -12.857
  209    HA   ASN  22           HA       ASN  22   9.056  -8.155 -13.581
  210    HB2  ASN  22          2HB       ASN  22   6.628  -8.548 -12.068
  211    HB3  ASN  22          3HB       ASN  22   7.662  -7.369 -11.266
  212   HD21  ASN  22          1HD2      ASN  22   8.581  -5.673 -12.741
  213   HD22  ASN  22          2HD2      ASN  22   7.518  -5.020 -13.936
  214    H    PHE  23           H        PHE  23   9.051 -10.221 -10.756
  215    HA   PHE  23           HA       PHE  23  10.649  -8.681  -9.053
  216    HB2  PHE  23          2HB       PHE  23   9.742 -11.446  -9.201
  217    HB3  PHE  23          3HB       PHE  23  11.357 -11.310  -8.513
  218    HD1  PHE  23           HD1      PHE  23  11.542 -10.988  -6.249
  219    HD2  PHE  23           HD2      PHE  23   8.002  -9.704  -8.234
  220    HE1  PHE  23           HE1      PHE  23  10.565 -10.346  -4.084
  221    HE2  PHE  23           HE2      PHE  23   7.020  -9.059  -6.072
  222    HZ   PHE  23           HZ       PHE  23   8.302  -9.379  -3.994
  223    H    GLY  24           H        GLY  24  11.447 -10.554 -11.859
  224    HA2  GLY  24          2HA       GLY  24  14.147 -11.087 -11.429
  225    HA3  GLY  24          3HA       GLY  24  13.416 -10.823 -13.005
  226    H    TYR  25           H        TYR  25  12.573  -8.076 -12.157
  227    HA   TYR  25           HA       TYR  25  14.980  -6.743 -13.003
  228    HB2  TYR  25          2HB       TYR  25  12.138  -5.957 -12.565
  229    HB3  TYR  25          3HB       TYR  25  13.357  -4.688 -12.543
  230    HD1  TYR  25           HD1      TYR  25  13.203  -3.511 -14.529
  231    HD2  TYR  25           HD2      TYR  25  13.009  -7.760 -14.641
  232    HE1  TYR  25           HE1      TYR  25  13.176  -3.439 -16.987
  233    HE2  TYR  25           HE2      TYR  25  12.982  -7.699 -17.100
  234    HH   TYR  25           HH       TYR  25  13.544  -4.756 -18.872
  235    H    THR  26           H        THR  26  13.310  -7.308 -10.022
  236    HA   THR  26           HA       THR  26  14.800  -5.255  -8.597
  237    HB   THR  26           HB       THR  26  13.551  -6.626  -6.625
  238    HG1  THR  26           HG1      THR  26  12.627  -8.036  -8.297
  239   HG21  THR  26          1HG2      THR  26  12.468  -4.463  -8.423
  240   HG22  THR  26          2HG2      THR  26  13.287  -4.277  -6.873
  241   HG23  THR  26          3HG2      THR  26  11.667  -4.968  -6.937
  242    H    LEU  27           H        LEU  27  14.778  -8.727  -9.031
  243    HA   LEU  27           HA       LEU  27  17.067  -8.948  -7.191
  244    HB2  LEU  27          2HB       LEU  27  15.089 -11.027  -8.109
  245    HB3  LEU  27          3HB       LEU  27  16.525 -11.382  -7.150
  246    HG   LEU  27           HG       LEU  27  14.149  -9.730  -6.296
  247   HD11  LEU  27          1HD1      LEU  27  13.472 -11.929  -6.102
  248   HD12  LEU  27          2HD1      LEU  27  14.168 -11.615  -4.513
  249   HD13  LEU  27          3HD1      LEU  27  15.094 -12.506  -5.720
  250   HD21  LEU  27          1HD2      LEU  27  16.042  -8.728  -5.294
  251   HD22  LEU  27          2HD2      LEU  27  16.780 -10.292  -4.947
  252   HD23  LEU  27          3HD2      LEU  27  15.338  -9.782  -4.068
  253    H    ARG  28           H        ARG  28  17.105  -8.083 -10.014
  254    HA   ARG  28           HA       ARG  28  17.950 -10.044 -11.780
  255    HB2  ARG  28          2HB       ARG  28  19.015  -8.280 -13.038
  256    HB3  ARG  28          3HB       ARG  28  17.500  -7.678 -12.379
  257    HG2  ARG  28          2HG       ARG  28  18.737  -6.562 -10.580
  258    HG3  ARG  28          3HG       ARG  28  20.251  -7.143 -11.278
  259    HD2  ARG  28          2HD       ARG  28  18.416  -5.673 -13.077
  260    HD3  ARG  28          3HD       ARG  28  19.224  -4.735 -11.822
  261    HE   ARG  28           HE       ARG  28  21.109  -6.350 -13.149
  262   HH11  ARG  28          1HH1      ARG  28  19.120  -3.540 -13.665
  263   HH12  ARG  28          2HH1      ARG  28  20.197  -2.828 -14.819
  264   HH21  ARG  28          1HH2      ARG  28  22.536  -5.423 -14.668
  265   HH22  ARG  28          2HH2      ARG  28  22.140  -3.900 -15.390
  Start of MODEL    8
    1    H1   LYS   1           H        LYS   1  -5.665  -3.547   6.696
    2    HA   LYS   1           HA       LYS   1  -4.332  -5.788   5.392
    3    HB2  LYS   1          2HB       LYS   1  -6.192  -5.612   7.763
    4    HB3  LYS   1          3HB       LYS   1  -5.620  -7.138   7.102
    5    HG2  LYS   1          2HG       LYS   1  -3.588  -6.923   8.023
    6    HG3  LYS   1          3HG       LYS   1  -3.509  -5.190   7.697
    7    HD2  LYS   1          2HD       LYS   1  -5.197  -4.914   9.578
    8    HD3  LYS   1          3HD       LYS   1  -4.861  -6.598   9.987
    9    HE2  LYS   1          2HE       LYS   1  -2.408  -5.919  10.059
   10    HE3  LYS   1          3HE       LYS   1  -2.981  -4.252  10.030
   11    HZ1  LYS   1          1HZ       LYS   1  -2.940  -4.543  12.251
   12    HZ2  LYS   1          2HZ       LYS   1  -3.113  -6.223  12.165
   13    HZ3  LYS   1          3HZ       LYS   1  -4.467  -5.224  11.994
   14    H    TYR   2           H        TYR   2  -7.017  -3.940   4.843
   15    HA   TYR   2           HA       TYR   2  -8.409  -6.167   3.506
   16    HB2  TYR   2          2HB       TYR   2  -9.762  -5.309   5.338
   17    HB3  TYR   2          3HB       TYR   2  -9.599  -3.667   4.725
   18    HD1  TYR   2           HD1      TYR   2 -10.666  -7.008   3.410
   19    HD2  TYR   2           HD2      TYR   2 -11.441  -2.830   3.633
   20    HE1  TYR   2           HE1      TYR   2 -12.698  -7.319   2.059
   21    HE2  TYR   2           HE2      TYR   2 -13.476  -3.130   2.284
   22    HH   TYR   2           HH       TYR   2 -15.120  -5.230   1.873
   23    H    GLU   3           H        GLU   3  -8.739  -2.634   3.324
   24    HA   GLU   3           HA       GLU   3  -8.972  -2.692   0.482
   25    HB2  GLU   3          2HB       GLU   3  -8.716  -0.451   2.482
   26    HB3  GLU   3          3HB       GLU   3  -8.824  -0.159   0.751
   27    HG2  GLU   3          2HG       GLU   3 -10.938  -1.845   1.218
   28    HG3  GLU   3          3HG       GLU   3 -10.902  -0.840   2.666
   29    H    ILE   4           H        ILE   4  -6.329  -2.801   2.544
   30    HA   ILE   4           HA       ILE   4  -4.426  -1.215   1.239
   31    HB   ILE   4           HB       ILE   4  -2.729  -2.696   2.268
   32   HG12  ILE   4          2HG1      ILE   4  -3.878  -4.403   3.936
   33   HG13  ILE   4          3HG1      ILE   4  -5.153  -4.383   2.723
   34   HG21  ILE   4          1HG2      ILE   4  -3.578  -2.377   4.662
   35   HG22  ILE   4          2HG2      ILE   4  -3.433  -0.944   3.645
   36   HG23  ILE   4          3HG2      ILE   4  -5.014  -1.674   3.920
   37   HD11  ILE   4          1HD1      ILE   4  -2.939  -5.995   2.713
   38   HD12  ILE   4          2HD1      ILE   4  -3.979  -5.655   1.329
   39   HD13  ILE   4          3HD1      ILE   4  -2.505  -4.719   1.576
   40    H    THR   5           H        THR   5  -5.859  -4.216   0.350
   41    HA   THR   5           HA       THR   5  -3.871  -4.562  -1.798
   42    HB   THR   5           HB       THR   5  -3.855  -6.552  -0.538
   43    HG1  THR   5           HG1      THR   5  -5.756  -7.099  -2.585
   44   HG21  THR   5          1HG2      THR   5  -5.865  -6.137   0.795
   45   HG22  THR   5          2HG2      THR   5  -5.878  -7.768   0.123
   46   HG23  THR   5          3HG2      THR   5  -6.875  -6.507  -0.602
   47    H    THR   6           H        THR   6  -4.522  -4.009  -3.761
   48    HA   THR   6           HA       THR   6  -7.409  -3.931  -4.327
   49    HB   THR   6           HB       THR   6  -6.332  -2.571  -6.404
   50    HG1  THR   6           HG1      THR   6  -4.671  -2.010  -4.153
   51   HG21  THR   6          1HG2      THR   6  -7.021  -1.464  -3.679
   52   HG22  THR   6          2HG2      THR   6  -8.143  -1.764  -5.006
   53   HG23  THR   6          3HG2      THR   6  -6.909  -0.513  -5.159
   54    H    ILE   7           H        ILE   7  -4.732  -3.975  -6.624
   55    HA   ILE   7           HA       ILE   7  -5.760  -6.528  -7.678
   56    HB   ILE   7           HB       ILE   7  -4.697  -4.187  -9.263
   57   HG12  ILE   7          2HG1      ILE   7  -7.305  -5.163 -10.020
   58   HG13  ILE   7          3HG1      ILE   7  -7.284  -4.753  -8.309
   59   HG21  ILE   7          1HG2      ILE   7  -5.500  -5.690 -11.201
   60   HG22  ILE   7          2HG2      ILE   7  -3.946  -6.039 -10.445
   61   HG23  ILE   7          3HG2      ILE   7  -5.364  -7.003 -10.031
   62   HD11  ILE   7          1HD1      ILE   7  -7.642  -2.657  -8.923
   63   HD12  ILE   7          2HD1      ILE   7  -5.992  -2.636  -9.546
   64   HD13  ILE   7          3HD1      ILE   7  -7.334  -3.032 -10.618
   65    H    HIS   8           H        HIS   8  -2.974  -4.554  -8.623
   66    HA   HIS   8           HA       HIS   8  -1.229  -6.726  -8.887
   67    HB2  HIS   8          2HB       HIS   8  -1.103  -3.884  -9.195
   68    HB3  HIS   8          3HB       HIS   8   0.306  -4.413  -8.282
   69    HD1  HIS   8           HD1      HIS   8  -0.739  -3.886 -11.630
   70    HD2  HIS   8           HD2      HIS   8   1.585  -6.758  -9.729
   71    HE1  HIS   8           HE1      HIS   8   0.623  -4.960 -13.450
   72    H    ASN   9           H        ASN   9  -2.280  -5.028  -6.102
   73    HA   ASN   9           HA       ASN   9  -0.144  -5.249  -4.359
   74    HB2  ASN   9          2HB       ASN   9  -3.119  -5.346  -3.949
   75    HB3  ASN   9          3HB       ASN   9  -2.023  -5.554  -2.587
   76   HD21  ASN   9          1HD2      ASN   9  -0.956  -3.821  -1.772
   77   HD22  ASN   9          2HD2      ASN   9  -1.203  -2.199  -2.314
   78    H    LEU  10           H        LEU  10  -2.904  -7.475  -4.128
   79    HA   LEU  10           HA       LEU  10  -0.985  -9.670  -3.694
   80    HB2  LEU  10          2HB       LEU  10  -3.546  -9.007  -2.286
   81    HB3  LEU  10          3HB       LEU  10  -2.920 -10.654  -2.303
   82    HG   LEU  10           HG       LEU  10  -1.668  -8.215  -1.057
   83   HD11  LEU  10          1HD1      LEU  10  -1.972  -9.319   0.992
   84   HD12  LEU  10          2HD1      LEU  10  -2.328 -10.858   0.207
   85   HD13  LEU  10          3HD1      LEU  10  -3.492  -9.535   0.122
   86   HD21  LEU  10          1HD2      LEU  10   0.315  -9.119  -1.530
   87   HD22  LEU  10          2HD2      LEU  10  -0.413 -10.621  -2.101
   88   HD23  LEU  10          3HD2      LEU  10  -0.110 -10.385  -0.379
   89    H    PHE  11           H        PHE  11  -1.149 -10.075  -5.988
   90    HA   PHE  11           HA       PHE  11  -3.689 -11.349  -6.765
   91    HB2  PHE  11          2HB       PHE  11  -2.472  -9.314  -8.064
   92    HB3  PHE  11          3HB       PHE  11  -1.714 -10.685  -8.868
   93    HD1  PHE  11           HD1      PHE  11  -4.303  -8.446  -9.116
   94    HD2  PHE  11           HD2      PHE  11  -3.540 -12.622  -9.431
   95    HE1  PHE  11           HE1      PHE  11  -6.289  -8.697 -10.546
   96    HE2  PHE  11           HE2      PHE  11  -5.524 -12.879 -10.863
   97    HZ   PHE  11           HZ       PHE  11  -6.901 -10.916 -11.423
   98    H    ARG  12           H        ARG  12  -0.205 -11.690  -6.623
   99    HA   ARG  12           HA       ARG  12  -0.329 -14.369  -7.770
  100    HB2  ARG  12          2HB       ARG  12   1.520 -13.162  -8.584
  101    HB3  ARG  12          3HB       ARG  12   1.920 -12.532  -6.992
  102    HG2  ARG  12          2HG       ARG  12   2.841 -14.570  -6.293
  103    HG3  ARG  12          3HG       ARG  12   2.098 -15.457  -7.625
  104    HD2  ARG  12          2HD       ARG  12   4.532 -15.079  -7.919
  105    HD3  ARG  12          3HD       ARG  12   3.550 -14.399  -9.216
  106    HE   ARG  12           HE       ARG  12   4.251 -12.305  -8.605
  107   HH11  ARG  12          1HH1      ARG  12   5.009 -14.558  -6.062
  108   HH12  ARG  12          2HH1      ARG  12   5.954 -13.421  -5.158
  109   HH21  ARG  12          1HH2      ARG  12   5.493 -10.799  -7.425
  110   HH22  ARG  12          2HH2      ARG  12   6.228 -11.283  -5.934
  111    H    LYS  13           H        LYS  13  -1.326 -15.623  -6.232
  112    HA   LYS  13           HA       LYS  13  -0.264 -15.635  -3.513
  113    HB2  LYS  13          2HB       LYS  13  -2.660 -15.637  -3.657
  114    HB3  LYS  13          3HB       LYS  13  -2.646 -16.991  -4.778
  115    HG2  LYS  13          2HG       LYS  13  -3.313 -17.599  -2.472
  116    HG3  LYS  13          3HG       LYS  13  -1.909 -18.489  -3.066
  117    HD2  LYS  13          2HD       LYS  13  -0.634 -17.715  -1.410
  118    HD3  LYS  13          3HD       LYS  13  -1.109 -16.049  -1.747
  119    HE2  LYS  13          2HE       LYS  13  -2.639 -16.025  -0.100
  120    HE3  LYS  13          3HE       LYS  13  -3.178 -17.668  -0.443
  121    HZ1  LYS  13          1HZ       LYS  13  -2.210 -17.820   1.642
  122    HZ2  LYS  13          2HZ       LYS  13  -0.932 -16.783   1.254
  123    HZ3  LYS  13          3HZ       LYS  13  -0.971 -18.351   0.620
  124    H    LEU  14           H        LEU  14  -1.399 -18.351  -5.493
  125    HA   LEU  14           HA       LEU  14   1.143 -19.725  -4.912
  126    HB2  LEU  14          2HB       LEU  14  -0.131 -21.832  -4.904
  127    HB3  LEU  14          3HB       LEU  14  -0.617 -20.726  -3.621
  128    HG   LEU  14           HG       LEU  14  -2.383 -20.164  -5.677
  129   HD11  LEU  14          1HD1      LEU  14  -1.539 -22.211  -6.822
  130   HD12  LEU  14          2HD1      LEU  14  -3.261 -22.247  -6.445
  131   HD13  LEU  14          3HD1      LEU  14  -2.122 -23.156  -5.451
  132   HD21  LEU  14          1HD2      LEU  14  -3.262 -20.162  -3.560
  133   HD22  LEU  14          2HD2      LEU  14  -2.483 -21.680  -3.114
  134   HD23  LEU  14          3HD2      LEU  14  -3.897 -21.690  -4.169
  135    H    THR  15           H        THR  15  -0.784 -18.447  -7.294
  136    HA   THR  15           HA       THR  15   0.200 -20.334  -9.328
  137    HB   THR  15           HB       THR  15  -1.516 -19.362 -10.829
  138    HG1  THR  15           HG1      THR  15  -1.578 -17.392  -9.238
  139   HG21  THR  15          1HG2      THR  15  -2.646 -20.366  -8.213
  140   HG22  THR  15          2HG2      THR  15  -1.997 -21.384  -9.498
  141   HG23  THR  15          3HG2      THR  15  -3.443 -20.416  -9.785
  142    H    HIS  16           H        HIS  16   2.287 -19.091  -8.898
  143    HA   HIS  16           HA       HIS  16   2.484 -16.423  -9.921
  144    HB2  HIS  16          2HB       HIS  16   4.985 -16.914  -9.776
  145    HB3  HIS  16          3HB       HIS  16   4.078 -16.994  -8.268
  146    HD1  HIS  16           HD1      HIS  16   5.888 -19.144 -10.740
  147    HD2  HIS  16           HD2      HIS  16   3.929 -19.523  -7.096
  148    HE1  HIS  16           HE1      HIS  16   6.462 -21.445  -9.904
  149    H    ARG  17           H        ARG  17   1.339 -17.074 -11.975
  150    HA   ARG  17           HA       ARG  17   2.846 -18.569 -13.914
  151    HB2  ARG  17          2HB       ARG  17   0.222 -17.187 -13.827
  152    HB3  ARG  17          3HB       ARG  17   0.973 -17.348 -15.409
  153    HG2  ARG  17          2HG       ARG  17   0.741 -19.612 -15.447
  154    HG3  ARG  17          3HG       ARG  17   0.830 -19.762 -13.691
  155    HD2  ARG  17          2HD       ARG  17  -1.386 -19.759 -13.533
  156    HD3  ARG  17          3HD       ARG  17  -1.483 -18.235 -14.414
  157    HE   ARG  17           HE       ARG  17  -2.029 -20.845 -15.434
  158   HH11  ARG  17          1HH1      ARG  17  -0.861 -17.680 -16.292
  159   HH12  ARG  17          2HH1      ARG  17  -1.317 -17.820 -17.958
  160   HH21  ARG  17          1HH2      ARG  17  -2.634 -21.042 -17.624
  161   HH22  ARG  17          2HH2      ARG  17  -2.326 -19.733 -18.714
  162    H    LEU  18           H        LEU  18   1.515 -15.295 -14.291
  163    HA   LEU  18           HA       LEU  18   4.080 -14.493 -15.499
  164    HB2  LEU  18          2HB       LEU  18   1.250 -13.873 -16.228
  165    HB3  LEU  18          3HB       LEU  18   2.529 -12.728 -16.629
  166    HG   LEU  18           HG       LEU  18   3.223 -15.394 -17.494
  167   HD11  LEU  18          1HD1      LEU  18   1.539 -15.763 -19.137
  168   HD12  LEU  18          2HD1      LEU  18   0.729 -14.250 -18.732
  169   HD13  LEU  18          3HD1      LEU  18   0.730 -15.584 -17.579
  170   HD21  LEU  18          1HD2      LEU  18   2.627 -13.189 -19.382
  171   HD22  LEU  18          2HD2      LEU  18   4.011 -14.280 -19.311
  172   HD23  LEU  18          3HD2      LEU  18   3.902 -12.919 -18.194
  173    H    PHE  19           H        PHE  19   1.612 -13.756 -13.191
  174    HA   PHE  19           HA       PHE  19   2.046 -11.055 -12.722
  175    HB2  PHE  19          2HB       PHE  19   1.011 -13.330 -11.119
  176    HB3  PHE  19          3HB       PHE  19   1.488 -11.887 -10.230
  177    HD1  PHE  19           HD1      PHE  19   0.404  -9.705 -10.774
  178    HD2  PHE  19           HD2      PHE  19  -0.993 -13.405 -12.347
  179    HE1  PHE  19           HE1      PHE  19  -1.753  -8.655 -11.319
  180    HE2  PHE  19           HE2      PHE  19  -3.152 -12.361 -12.896
  181    HZ   PHE  19           HZ       PHE  19  -3.534  -9.982 -12.383
  182    H    ARG  20           H        ARG  20   4.018 -13.791 -11.947
  183    HA   ARG  20           HA       ARG  20   5.621 -12.419  -9.986
  184    HB2  ARG  20          2HB       ARG  20   5.168 -14.992 -10.286
  185    HB3  ARG  20          3HB       ARG  20   6.533 -14.898 -11.390
  186    HG2  ARG  20          2HG       ARG  20   7.824 -13.829  -9.499
  187    HG3  ARG  20          3HG       ARG  20   6.486 -14.300  -8.449
  188    HD2  ARG  20          2HD       ARG  20   7.028 -16.495  -8.520
  189    HD3  ARG  20          3HD       ARG  20   7.564 -16.416 -10.198
  190    HE   ARG  20           HE       ARG  20   9.178 -16.070  -7.838
  191   HH11  ARG  20          1HH1      ARG  20   8.890 -15.433 -11.248
  192   HH12  ARG  20          2HH1      ARG  20  10.595 -15.241 -11.489
  193   HH21  ARG  20          1HH2      ARG  20  11.425 -15.819  -8.142
  194   HH22  ARG  20          2HH2      ARG  20  12.036 -15.462  -9.722
  195    H    ARG  21           H        ARG  21   5.736 -13.026 -13.424
  196    HA   ARG  21           HA       ARG  21   8.467 -12.191 -13.734
  197    HB2  ARG  21          2HB       ARG  21   7.397 -13.785 -15.289
  198    HB3  ARG  21          3HB       ARG  21   6.295 -12.518 -15.812
  199    HG2  ARG  21          2HG       ARG  21   8.241 -11.212 -16.606
  200    HG3  ARG  21          3HG       ARG  21   9.282 -12.572 -16.178
  201    HD2  ARG  21          2HD       ARG  21   8.485 -13.892 -17.879
  202    HD3  ARG  21          3HD       ARG  21   6.930 -13.064 -17.937
  203    HE   ARG  21           HE       ARG  21   9.128 -11.413 -18.757
  204   HH11  ARG  21          1HH1      ARG  21   6.819 -13.805 -19.789
  205   HH12  ARG  21          2HH1      ARG  21   6.879 -13.333 -21.455
  206   HH21  ARG  21          1HH2      ARG  21   9.216 -10.781 -20.947
  207   HH22  ARG  21          2HH2      ARG  21   8.243 -11.613 -22.113
  208    H    ASN  22           H        ASN  22   5.333 -10.675 -13.810
  209    HA   ASN  22           HA       ASN  22   6.272  -8.248 -15.046
  210    HB2  ASN  22          2HB       ASN  22   3.705  -9.356 -14.185
  211    HB3  ASN  22          3HB       ASN  22   3.858  -7.633 -13.850
  212   HD21  ASN  22          1HD2      ASN  22   3.085  -6.411 -15.395
  213   HD22  ASN  22          2HD2      ASN  22   3.096  -6.766 -17.086
  214    H    PHE  23           H        PHE  23   5.730  -9.442 -11.801
  215    HA   PHE  23           HA       PHE  23   5.796  -7.009 -10.411
  216    HB2  PHE  23          2HB       PHE  23   5.784  -9.786  -9.764
  217    HB3  PHE  23          3HB       PHE  23   7.066  -9.015  -8.835
  218    HD1  PHE  23           HD1      PHE  23   6.536  -7.198  -7.264
  219    HD2  PHE  23           HD2      PHE  23   3.490  -9.360  -9.305
  220    HE1  PHE  23           HE1      PHE  23   4.870  -6.359  -5.660
  221    HE2  PHE  23           HE2      PHE  23   1.819  -8.523  -7.705
  222    HZ   PHE  23           HZ       PHE  23   2.508  -7.020  -5.880
  223    H    GLY  24           H        GLY  24   8.309  -8.870 -11.898
  224    HA2  GLY  24          2HA       GLY  24  10.562  -8.081 -10.489
  225    HA3  GLY  24          3HA       GLY  24  10.540  -8.429 -12.211
  226    H    TYR  25           H        TYR  25   8.568  -6.210 -12.631
  227    HA   TYR  25           HA       TYR  25  10.528  -4.134 -13.023
  228    HB2  TYR  25          2HB       TYR  25   7.707  -4.603 -13.858
  229    HB3  TYR  25          3HB       TYR  25   8.289  -2.942 -13.837
  230    HD1  TYR  25           HD1      TYR  25   8.513  -2.354 -16.080
  231    HD2  TYR  25           HD2      TYR  25  10.093  -6.073 -14.747
  232    HE1  TYR  25           HE1      TYR  25   9.559  -2.691 -18.280
  233    HE2  TYR  25           HE2      TYR  25  11.145  -6.420 -16.943
  234    HH   TYR  25           HH       TYR  25  11.495  -5.592 -18.968
  235    H    THR  26           H        THR  26   7.930  -4.818 -10.813
  236    HA   THR  26           HA       THR  26   7.896  -2.128  -9.729
  237    HB   THR  26           HB       THR  26   6.464  -3.631  -7.946
  238    HG1  THR  26           HG1      THR  26   6.763  -5.502  -9.289
  239   HG21  THR  26          1HG2      THR  26   4.465  -2.884  -9.265
  240   HG22  THR  26          2HG2      THR  26   5.576  -2.334 -10.520
  241   HG23  THR  26          3HG2      THR  26   5.630  -1.608  -8.914
  242    H    LEU  27           H        LEU  27   9.220  -5.273  -8.946
  243    HA   LEU  27           HA       LEU  27  10.132  -4.372  -6.334
  244    HB2  LEU  27          2HB       LEU  27  10.741  -6.592  -5.907
  245    HB3  LEU  27          3HB       LEU  27   9.230  -6.689  -6.809
  246    HG   LEU  27           HG       LEU  27  10.941  -6.948  -8.843
  247   HD11  LEU  27          1HD1      LEU  27  13.020  -6.933  -7.907
  248   HD12  LEU  27          2HD1      LEU  27  12.664  -8.658  -7.814
  249   HD13  LEU  27          3HD1      LEU  27  12.466  -7.639  -6.388
  250   HD21  LEU  27          1HD2      LEU  27   9.308  -8.568  -8.616
  251   HD22  LEU  27          2HD2      LEU  27   9.781  -8.964  -6.964
  252   HD23  LEU  27          3HD2      LEU  27  10.784  -9.486  -8.318
  253    H    ARG  28           H        ARG  28  11.383  -5.022  -9.537
  254    HA   ARG  28           HA       ARG  28  14.039  -4.123  -8.626
  255    HB2  ARG  28          2HB       ARG  28  13.334  -6.511  -9.964
  256    HB3  ARG  28          3HB       ARG  28  14.170  -5.506 -11.140
  257    HG2  ARG  28          2HG       ARG  28  15.490  -5.572  -8.545
  258    HG3  ARG  28          3HG       ARG  28  15.356  -7.157  -9.309
  259    HD2  ARG  28          2HD       ARG  28  16.199  -4.956 -11.075
  260    HD3  ARG  28          3HD       ARG  28  17.342  -5.392  -9.805
  261    HE   ARG  28           HE       ARG  28  16.481  -7.738 -11.061
  262   HH11  ARG  28          1HH1      ARG  28  18.351  -4.887 -11.762
  263   HH12  ARG  28          2HH1      ARG  28  19.354  -5.675 -12.935
  264   HH21  ARG  28          1HH2      ARG  28  17.794  -8.787 -12.603
  265   HH22  ARG  28          2HH2      ARG  28  19.035  -7.893 -13.414
  Start of MODEL    9
    1    H1   LYS   1           H        LYS   1  -7.690  -0.745  -0.938
    2    HA   LYS   1           HA       LYS   1  -8.859   0.415  -2.570
    3    HB2  LYS   1          2HB       LYS   1  -6.012   1.404  -2.744
    4    HB3  LYS   1          3HB       LYS   1  -7.362   2.215  -3.527
    5    HG2  LYS   1          2HG       LYS   1  -7.951   1.721  -0.756
    6    HG3  LYS   1          3HG       LYS   1  -6.429   2.597  -0.929
    7    HD2  LYS   1          2HD       LYS   1  -7.598   4.216  -2.411
    8    HD3  LYS   1          3HD       LYS   1  -9.113   3.378  -2.066
    9    HE2  LYS   1          2HE       LYS   1  -8.489   3.792   0.413
   10    HE3  LYS   1          3HE       LYS   1  -7.390   5.007  -0.237
   11    HZ1  LYS   1          1HZ       LYS   1  -9.085   6.395  -0.416
   12    HZ2  LYS   1          2HZ       LYS   1 -10.139   5.231   0.211
   13    HZ3  LYS   1          3HZ       LYS   1  -9.888   5.332  -1.458
   14    H    TYR   2           H        TYR   2  -5.775   0.241  -4.299
   15    HA   TYR   2           HA       TYR   2  -7.180  -1.119  -6.505
   16    HB2  TYR   2          2HB       TYR   2  -6.747   1.176  -7.139
   17    HB3  TYR   2          3HB       TYR   2  -5.060   1.033  -6.656
   18    HD1  TYR   2           HD1      TYR   2  -3.892   1.418  -8.645
   19    HD2  TYR   2           HD2      TYR   2  -7.109  -1.366  -8.628
   20    HE1  TYR   2           HE1      TYR   2  -3.295   0.723 -10.928
   21    HE2  TYR   2           HE2      TYR   2  -6.521  -2.069 -10.910
   22    HH   TYR   2           HH       TYR   2  -4.428  -0.328 -12.887
   23    H    GLU   3           H        GLU   3  -3.771  -0.268  -5.999
   24    HA   GLU   3           HA       GLU   3  -3.065  -3.063  -6.516
   25    HB2  GLU   3          2HB       GLU   3  -1.313  -0.599  -6.464
   26    HB3  GLU   3          3HB       GLU   3  -0.796  -2.217  -6.918
   27    HG2  GLU   3          2HG       GLU   3  -3.051  -1.545  -8.499
   28    HG3  GLU   3          3HG       GLU   3  -1.923  -0.192  -8.546
   29    H    ILE   4           H        ILE   4  -3.972  -1.661  -3.902
   30    HA   ILE   4           HA       ILE   4  -1.729  -2.588  -2.231
   31    HB   ILE   4           HB       ILE   4  -1.984  -0.347  -1.671
   32   HG12  ILE   4          2HG1      ILE   4  -2.419  -2.150   0.233
   33   HG13  ILE   4          3HG1      ILE   4  -2.487  -0.423   0.568
   34   HG21  ILE   4          1HG2      ILE   4  -3.836   0.400  -2.833
   35   HG22  ILE   4          2HG2      ILE   4  -4.899  -0.817  -2.129
   36   HG23  ILE   4          3HG2      ILE   4  -4.365   0.555  -1.158
   37   HD11  ILE   4          1HD1      ILE   4  -4.751  -0.425   0.824
   38   HD12  ILE   4          2HD1      ILE   4  -4.984  -1.805  -0.249
   39   HD13  ILE   4          3HD1      ILE   4  -4.370  -2.052   1.385
   40    H    THR   5           H        THR   5  -5.160  -2.799  -2.837
   41    HA   THR   5           HA       THR   5  -5.807  -4.307  -0.503
   42    HB   THR   5           HB       THR   5  -7.743  -4.956  -2.375
   43    HG1  THR   5           HG1      THR   5  -6.819  -3.511  -3.884
   44   HG21  THR   5          1HG2      THR   5  -8.546  -4.276  -0.335
   45   HG22  THR   5          2HG2      THR   5  -8.867  -2.827  -1.287
   46   HG23  THR   5          3HG2      THR   5  -7.450  -2.898  -0.241
   47    H    THR   6           H        THR   6  -4.074  -5.081  -3.247
   48    HA   THR   6           HA       THR   6  -4.915  -7.869  -3.351
   49    HB   THR   6           HB       THR   6  -2.907  -7.895  -5.066
   50    HG1  THR   6           HG1      THR   6  -2.051  -5.956  -5.179
   51   HG21  THR   6          1HG2      THR   6  -5.676  -6.808  -5.406
   52   HG22  THR   6          2HG2      THR   6  -5.005  -8.348  -5.942
   53   HG23  THR   6          3HG2      THR   6  -4.573  -6.858  -6.780
   54    H    ILE   7           H        ILE   7  -4.208  -8.873  -1.520
   55    HA   ILE   7           HA       ILE   7  -1.297  -8.851  -1.051
   56    HB   ILE   7           HB       ILE   7  -3.503  -9.190   0.984
   57   HG12  ILE   7          2HG1      ILE   7  -2.143  -7.152   1.943
   58   HG13  ILE   7          3HG1      ILE   7  -1.623  -6.971   0.271
   59   HG21  ILE   7          1HG2      ILE   7  -1.078  -8.900   2.306
   60   HG22  ILE   7          2HG2      ILE   7  -2.031 -10.375   2.157
   61   HG23  ILE   7          3HG2      ILE   7  -0.741 -10.040   1.003
   62   HD11  ILE   7          1HD1      ILE   7  -3.786  -5.778   1.277
   63   HD12  ILE   7          2HD1      ILE   7  -3.644  -6.250  -0.417
   64   HD13  ILE   7          3HD1      ILE   7  -4.521  -7.279   0.715
   65    H    HIS   8           H        HIS   8  -3.969 -10.884   0.124
   66    HA   HIS   8           HA       HIS   8  -2.556 -13.222  -0.982
   67    HB2  HIS   8          2HB       HIS   8  -3.445 -12.659   1.719
   68    HB3  HIS   8          3HB       HIS   8  -4.171 -14.143   1.107
   69    HD1  HIS   8           HD1      HIS   8  -1.036 -12.759   2.424
   70    HD2  HIS   8           HD2      HIS   8  -2.241 -16.149   0.347
   71    HE1  HIS   8           HE1      HIS   8   0.867 -14.389   2.636
   72    H    ASN   9           H        ASN   9  -5.616 -11.632  -0.420
   73    HA   ASN   9           HA       ASN   9  -7.429 -13.594  -1.096
   74    HB2  ASN   9          2HB       ASN   9  -7.386 -10.633  -1.281
   75    HB3  ASN   9          3HB       ASN   9  -8.614 -11.459  -2.236
   76   HD21  ASN   9          1HD2      ASN   9  -7.222 -12.168   0.943
   77   HD22  ASN   9          2HD2      ASN   9  -8.724 -12.143   1.797
   78    H    LEU  10           H        LEU  10  -6.556 -11.072  -3.445
   79    HA   LEU  10           HA       LEU  10  -7.317 -12.602  -5.681
   80    HB2  LEU  10          2HB       LEU  10  -5.436 -10.250  -5.541
   81    HB3  LEU  10          3HB       LEU  10  -6.185 -10.880  -7.007
   82    HG   LEU  10           HG       LEU  10  -8.391 -10.360  -5.567
   83   HD11  LEU  10          1HD1      LEU  10  -6.308  -9.113  -4.099
   84   HD12  LEU  10          2HD1      LEU  10  -8.046  -9.058  -3.809
   85   HD13  LEU  10          3HD1      LEU  10  -7.287  -7.850  -4.846
   86   HD21  LEU  10          1HD2      LEU  10  -8.511  -9.382  -7.588
   87   HD22  LEU  10          2HD2      LEU  10  -6.812  -8.908  -7.577
   88   HD23  LEU  10          3HD2      LEU  10  -8.004  -7.938  -6.711
   89    H    PHE  11           H        PHE  11  -4.277 -12.254  -3.984
   90    HA   PHE  11           HA       PHE  11  -2.641 -13.460  -5.969
   91    HB2  PHE  11          2HB       PHE  11  -2.331 -12.767  -3.083
   92    HB3  PHE  11          3HB       PHE  11  -1.182 -13.894  -3.796
   93    HD1  PHE  11           HD1      PHE  11   0.350 -13.173  -5.540
   94    HD2  PHE  11           HD2      PHE  11  -2.360 -10.449  -3.709
   95    HE1  PHE  11           HE1      PHE  11   1.635 -11.285  -6.456
   96    HE2  PHE  11           HE2      PHE  11  -1.080  -8.556  -4.623
   97    HZ   PHE  11           HZ       PHE  11   0.920  -8.973  -5.998
   98    H    ARG  12           H        ARG  12  -3.826 -15.323  -6.598
   99    HA   ARG  12           HA       ARG  12  -3.662 -17.539  -4.661
  100    HB2  ARG  12          2HB       ARG  12  -5.800 -16.758  -6.579
  101    HB3  ARG  12          3HB       ARG  12  -5.513 -18.476  -6.337
  102    HG2  ARG  12          2HG       ARG  12  -6.281 -18.447  -4.196
  103    HG3  ARG  12          3HG       ARG  12  -5.791 -16.773  -3.926
  104    HD2  ARG  12          2HD       ARG  12  -7.856 -16.088  -4.360
  105    HD3  ARG  12          3HD       ARG  12  -7.765 -16.803  -5.969
  106    HE   ARG  12           HE       ARG  12  -8.325 -18.868  -4.212
  107   HH11  ARG  12          1HH1      ARG  12  -9.820 -15.903  -5.258
  108   HH12  ARG  12          2HH1      ARG  12 -11.435 -16.477  -5.008
  109   HH21  ARG  12          1HH2      ARG  12 -10.447 -19.635  -3.880
  110   HH22  ARG  12          2HH2      ARG  12 -11.791 -18.600  -4.224
  111    H    LYS  13           H        LYS  13  -4.270 -17.398  -8.160
  112    HA   LYS  13           HA       LYS  13  -2.117 -19.359  -8.534
  113    HB2  LYS  13          2HB       LYS  13  -3.202 -19.743 -10.762
  114    HB3  LYS  13          3HB       LYS  13  -4.211 -20.147  -9.380
  115    HG2  LYS  13          2HG       LYS  13  -5.777 -18.697  -9.990
  116    HG3  LYS  13          3HG       LYS  13  -4.597 -17.405 -10.217
  117    HD2  LYS  13          2HD       LYS  13  -5.451 -17.666 -12.351
  118    HD3  LYS  13          3HD       LYS  13  -4.009 -18.683 -12.403
  119    HE2  LYS  13          2HE       LYS  13  -5.348 -20.660 -12.016
  120    HE3  LYS  13          3HE       LYS  13  -6.799 -19.676 -11.828
  121    HZ1  LYS  13          1HZ       LYS  13  -6.667 -19.026 -14.113
  122    HZ2  LYS  13          2HZ       LYS  13  -6.591 -20.714 -14.040
  123    HZ3  LYS  13          3HZ       LYS  13  -5.185 -19.816 -14.316
  124    H    LEU  14           H        LEU  14  -3.243 -16.196  -9.533
  125    HA   LEU  14           HA       LEU  14  -1.423 -15.800 -11.658
  126    HB2  LEU  14          2HB       LEU  14  -1.915 -13.384 -11.304
  127    HB3  LEU  14          3HB       LEU  14  -3.339 -14.402 -11.512
  128    HG   LEU  14           HG       LEU  14  -2.573 -13.956  -8.716
  129   HD11  LEU  14          1HD1      LEU  14  -3.771 -11.630 -10.180
  130   HD12  LEU  14          2HD1      LEU  14  -2.030 -11.771  -9.935
  131   HD13  LEU  14          3HD1      LEU  14  -3.112 -11.693  -8.545
  132   HD21  LEU  14          1HD2      LEU  14  -4.634 -14.876  -8.798
  133   HD22  LEU  14          2HD2      LEU  14  -4.987 -14.213 -10.394
  134   HD23  LEU  14          3HD2      LEU  14  -5.138 -13.194  -8.962
  135    H    THR  15           H        THR  15  -0.958 -15.962  -8.314
  136    HA   THR  15           HA       THR  15   1.004 -14.110  -7.750
  137    HB   THR  15           HB       THR  15   1.749 -15.534  -5.972
  138    HG1  THR  15           HG1      THR  15   0.829 -17.547  -7.670
  139   HG21  THR  15          1HG2      THR  15  -0.838 -14.757  -6.261
  140   HG22  THR  15          2HG2      THR  15  -0.183 -15.507  -4.806
  141   HG23  THR  15          3HG2      THR  15  -1.034 -16.489  -5.998
  142    H    HIS  16           H        HIS  16   1.261 -17.108  -9.548
  143    HA   HIS  16           HA       HIS  16   4.150 -16.693  -9.861
  144    HB2  HIS  16          2HB       HIS  16   4.176 -19.004 -10.759
  145    HB3  HIS  16          3HB       HIS  16   3.543 -18.922  -9.117
  146    HD1  HIS  16           HD1      HIS  16   2.076 -18.876 -12.636
  147    HD2  HIS  16           HD2      HIS  16   1.296 -20.384  -8.844
  148    HE1  HIS  16           HE1      HIS  16  -0.028 -20.233 -12.871
  149    H    ARG  17           H        ARG  17   1.164 -16.398 -11.492
  150    HA   ARG  17           HA       ARG  17   1.784 -16.845 -14.142
  151    HB2  ARG  17          2HB       ARG  17  -0.467 -16.323 -13.529
  152    HB3  ARG  17          3HB       ARG  17   0.006 -14.757 -12.884
  153    HG2  ARG  17          2HG       ARG  17   0.469 -13.922 -15.079
  154    HG3  ARG  17          3HG       ARG  17   0.221 -15.519 -15.787
  155    HD2  ARG  17          2HD       ARG  17  -2.023 -15.328 -15.747
  156    HD3  ARG  17          3HD       ARG  17  -2.025 -14.503 -14.189
  157    HE   ARG  17           HE       ARG  17  -1.005 -12.761 -16.137
  158   HH11  ARG  17          1HH1      ARG  17  -3.993 -14.295 -15.220
  159   HH12  ARG  17          2HH1      ARG  17  -4.990 -13.033 -15.864
  160   HH21  ARG  17          1HH2      ARG  17  -2.307 -11.094 -16.989
  161   HH22  ARG  17          2HH2      ARG  17  -4.030 -11.213 -16.871
  162    H    LEU  18           H        LEU  18   1.616 -13.527 -12.879
  163    HA   LEU  18           HA       LEU  18   4.022 -12.900 -14.461
  164    HB2  LEU  18          2HB       LEU  18   1.406 -11.532 -14.224
  165    HB3  LEU  18          3HB       LEU  18   2.838 -10.508 -14.313
  166    HG   LEU  18           HG       LEU  18   2.268 -12.629 -16.366
  167   HD11  LEU  18          1HD1      LEU  18   0.404 -10.869 -16.043
  168   HD12  LEU  18          2HD1      LEU  18   1.031 -11.163 -17.665
  169   HD13  LEU  18          3HD1      LEU  18   1.564  -9.747 -16.757
  170   HD21  LEU  18          1HD2      LEU  18   4.503 -11.165 -15.902
  171   HD22  LEU  18          2HD2      LEU  18   3.650 -10.128 -17.046
  172   HD23  LEU  18          3HD2      LEU  18   4.031 -11.795 -17.481
  173    H    PHE  19           H        PHE  19   2.223 -12.357 -11.503
  174    HA   PHE  19           HA       PHE  19   3.741 -10.348 -10.337
  175    HB2  PHE  19          2HB       PHE  19   2.004 -12.532  -9.321
  176    HB3  PHE  19          3HB       PHE  19   3.087 -11.775  -8.157
  177    HD1  PHE  19           HD1      PHE  19   3.107  -9.062  -8.485
  178    HD2  PHE  19           HD2      PHE  19  -0.121 -11.700  -9.346
  179    HE1  PHE  19           HE1      PHE  19   1.519  -7.201  -8.218
  180    HE2  PHE  19           HE2      PHE  19  -1.713  -9.843  -9.081
  181    HZ   PHE  19           HZ       PHE  19  -0.894  -7.590  -8.517
  182    H    ARG  20           H        ARG  20   4.487 -13.695 -10.840
  183    HA   ARG  20           HA       ARG  20   6.472 -14.075  -8.906
  184    HB2  ARG  20          2HB       ARG  20   5.379 -15.570 -10.970
  185    HB3  ARG  20          3HB       ARG  20   7.063 -15.384 -11.442
  186    HG2  ARG  20          2HG       ARG  20   6.429 -16.219  -8.655
  187    HG3  ARG  20          3HG       ARG  20   6.298 -17.397  -9.963
  188    HD2  ARG  20          2HD       ARG  20   8.482 -17.701  -9.328
  189    HD3  ARG  20          3HD       ARG  20   8.672 -16.494 -10.600
  190    HE   ARG  20           HE       ARG  20   8.390 -15.053  -8.287
  191   HH11  ARG  20          1HH1      ARG  20  10.555 -17.526  -9.436
  192   HH12  ARG  20          2HH1      ARG  20  11.900 -16.968  -8.496
  193   HH21  ARG  20          1HH2      ARG  20  10.153 -14.309  -7.045
  194   HH22  ARG  20          2HH2      ARG  20  11.670 -15.139  -7.136
  195    H    ARG  21           H        ARG  21   6.557 -12.487 -12.023
  196    HA   ARG  21           HA       ARG  21   9.451 -12.108 -11.823
  197    HB2  ARG  21          2HB       ARG  21   7.443 -11.735 -14.024
  198    HB3  ARG  21          3HB       ARG  21   9.017 -10.955 -14.114
  199    HG2  ARG  21          2HG       ARG  21   9.425 -13.678 -13.426
  200    HG3  ARG  21          3HG       ARG  21   8.317 -13.610 -14.798
  201    HD2  ARG  21          2HD       ARG  21  10.361 -13.614 -15.859
  202    HD3  ARG  21          3HD       ARG  21  10.032 -11.886 -15.737
  203    HE   ARG  21           HE       ARG  21  11.455 -12.638 -13.464
  204   HH11  ARG  21          1HH1      ARG  21  11.930 -12.443 -16.907
  205   HH12  ARG  21          2HH1      ARG  21  13.635 -12.160 -16.788
  206   HH21  ARG  21          1HH2      ARG  21  13.699 -12.266 -13.293
  207   HH22  ARG  21          2HH2      ARG  21  14.641 -12.061 -14.731
  208    H    ASN  22           H        ASN  22   6.430 -10.366 -11.627
  209    HA   ASN  22           HA       ASN  22   7.352  -7.744 -11.866
  210    HB2  ASN  22          2HB       ASN  22   4.924  -8.991 -11.254
  211    HB3  ASN  22          3HB       ASN  22   5.271  -7.972  -9.860
  212   HD21  ASN  22          1HD2      ASN  22   3.531  -7.973 -12.493
  213   HD22  ASN  22          2HD2      ASN  22   3.618  -6.315 -12.972
  214    H    PHE  23           H        PHE  23   7.452  -9.973  -9.170
  215    HA   PHE  23           HA       PHE  23   8.024  -8.163  -7.110
  216    HB2  PHE  23          2HB       PHE  23   8.412 -11.081  -7.537
  217    HB3  PHE  23          3HB       PHE  23   9.331 -10.328  -6.238
  218    HD1  PHE  23           HD1      PHE  23   6.482 -12.100  -6.870
  219    HD2  PHE  23           HD2      PHE  23   7.746  -8.574  -4.849
  220    HE1  PHE  23           HE1      PHE  23   4.511 -12.238  -5.404
  221    HE2  PHE  23           HE2      PHE  23   5.778  -8.707  -3.379
  222    HZ   PHE  23           HZ       PHE  23   4.158 -10.541  -3.654
  223    H    GLY  24           H        GLY  24   9.984  -9.400  -9.682
  224    HA2  GLY  24          2HA       GLY  24  12.546  -9.059  -8.609
  225    HA3  GLY  24          3HA       GLY  24  12.144  -8.960 -10.317
  226    H    TYR  25           H        TYR  25  10.213  -6.707  -9.506
  227    HA   TYR  25           HA       TYR  25  12.190  -4.593  -9.816
  228    HB2  TYR  25          2HB       TYR  25   9.264  -4.857 -10.283
  229    HB3  TYR  25          3HB       TYR  25   9.876  -3.252  -9.897
  230    HD1  TYR  25           HD1      TYR  25   9.859  -2.025 -11.862
  231    HD2  TYR  25           HD2      TYR  25  11.356  -6.007 -11.936
  232    HE1  TYR  25           HE1      TYR  25  10.544  -1.718 -14.205
  233    HE2  TYR  25           HE2      TYR  25  12.046  -5.711 -14.278
  234    HH   TYR  25           HH       TYR  25  11.271  -2.765 -16.063
  235    H    THR  26           H        THR  26  10.040  -5.885  -7.429
  236    HA   THR  26           HA       THR  26  10.285  -3.550  -5.705
  237    HB   THR  26           HB       THR  26   9.027  -5.326  -4.128
  238    HG1  THR  26           HG1      THR  26   9.154  -6.962  -5.784
  239   HG21  THR  26          1HG2      THR  26   7.480  -4.009  -6.340
  240   HG22  THR  26          2HG2      THR  26   8.291  -3.055  -5.097
  241   HG23  THR  26          3HG2      THR  26   7.038  -4.210  -4.645
  242    H    LEU  27           H        LEU  27  11.681  -6.691  -6.128
  243    HA   LEU  27           HA       LEU  27  13.095  -6.450  -3.562
  244    HB2  LEU  27          2HB       LEU  27  12.179  -8.544  -3.510
  245    HB3  LEU  27          3HB       LEU  27  12.270  -8.744  -5.259
  246    HG   LEU  27           HG       LEU  27  14.685  -9.159  -5.073
  247   HD11  LEU  27          1HD1      LEU  27  14.420  -7.959  -2.582
  248   HD12  LEU  27          2HD1      LEU  27  15.861  -8.736  -3.237
  249   HD13  LEU  27          3HD1      LEU  27  14.745  -9.657  -2.228
  250   HD21  LEU  27          1HD2      LEU  27  14.514 -11.372  -4.309
  251   HD22  LEU  27          2HD2      LEU  27  12.899 -10.966  -4.890
  252   HD23  LEU  27          3HD2      LEU  27  13.239 -10.968  -3.159
  253    H    ARG  28           H        ARG  28  13.521  -6.762  -7.027
  254    HA   ARG  28           HA       ARG  28  16.410  -6.315  -6.655
  255    HB2  ARG  28          2HB       ARG  28  14.955  -8.232  -8.316
  256    HB3  ARG  28          3HB       ARG  28  16.142  -7.300  -9.218
  257    HG2  ARG  28          2HG       ARG  28  17.663  -7.959  -7.142
  258    HG3  ARG  28          3HG       ARG  28  16.528  -9.310  -7.081
  259    HD2  ARG  28          2HD       ARG  28  17.775  -8.543  -9.684
  260    HD3  ARG  28          3HD       ARG  28  18.710  -9.473  -8.514
  261    HE   ARG  28           HE       ARG  28  16.129 -10.602  -8.993
  262   HH11  ARG  28          1HH1      ARG  28  19.377 -10.366 -10.226
  263   HH12  ARG  28          2HH1      ARG  28  19.300 -11.870 -11.083
  264   HH21  ARG  28          1HH2      ARG  28  16.017 -12.584 -10.117
  265   HH22  ARG  28          2HH2      ARG  28  17.388 -13.131 -11.020
  Start of MODEL   10
    1    H1   LYS   1           H        LYS   1 -11.962 -11.132   1.201
    2    HA   LYS   1           HA       LYS   1 -11.004 -10.643  -0.922
    3    HB2  LYS   1          2HB       LYS   1  -9.106  -9.357   1.038
    4    HB3  LYS   1          3HB       LYS   1  -9.613  -8.742  -0.530
    5    HG2  LYS   1          2HG       LYS   1 -11.969  -8.680   0.462
    6    HG3  LYS   1          3HG       LYS   1 -11.173  -8.873   2.026
    7    HD2  LYS   1          2HD       LYS   1  -9.698  -6.874   0.929
    8    HD3  LYS   1          3HD       LYS   1 -11.285  -6.547   0.229
    9    HE2  LYS   1          2HE       LYS   1 -11.268  -7.170   3.107
   10    HE3  LYS   1          3HE       LYS   1 -10.476  -5.662   2.654
   11    HZ1  LYS   1          1HZ       LYS   1 -12.723  -5.497   1.236
   12    HZ2  LYS   1          2HZ       LYS   1 -12.557  -4.866   2.797
   13    HZ3  LYS   1          3HZ       LYS   1 -13.285  -6.375   2.569
   14    H    TYR   2           H        TYR   2  -9.814 -11.702  -2.351
   15    HA   TYR   2           HA       TYR   2  -7.204 -12.771  -1.493
   16    HB2  TYR   2          2HB       TYR   2  -8.795 -14.585  -1.860
   17    HB3  TYR   2          3HB       TYR   2  -9.158 -13.969  -3.468
   18    HD1  TYR   2           HD1      TYR   2  -6.291 -15.200  -1.419
   19    HD2  TYR   2           HD2      TYR   2  -8.012 -14.826  -5.293
   20    HE1  TYR   2           HE1      TYR   2  -4.482 -16.582  -2.350
   21    HE2  TYR   2           HE2      TYR   2  -6.208 -16.208  -6.234
   22    HH   TYR   2           HH       TYR   2  -4.564 -18.127  -5.075
   23    H    GLU   3           H        GLU   3  -8.815 -12.461  -4.648
   24    HA   GLU   3           HA       GLU   3  -6.379 -11.252  -5.716
   25    HB2  GLU   3          2HB       GLU   3  -8.260 -13.085  -6.733
   26    HB3  GLU   3          3HB       GLU   3  -8.460 -11.614  -7.675
   27    HG2  GLU   3          2HG       GLU   3  -5.830 -13.005  -7.236
   28    HG3  GLU   3          3HG       GLU   3  -6.857 -13.227  -8.651
   29    H    ILE   4           H        ILE   4  -9.526 -10.392  -4.705
   30    HA   ILE   4           HA       ILE   4  -9.838  -8.073  -6.356
   31    HB   ILE   4           HB       ILE   4 -11.685  -7.481  -4.844
   32   HG12  ILE   4          2HG1      ILE   4 -12.160  -9.526  -3.171
   33   HG13  ILE   4          3HG1      ILE   4 -10.400  -9.578  -3.176
   34   HG21  ILE   4          1HG2      ILE   4 -11.662 -10.386  -5.652
   35   HG22  ILE   4          2HG2      ILE   4 -13.097  -9.423  -5.306
   36   HG23  ILE   4          3HG2      ILE   4 -12.081  -9.023  -6.690
   37   HD11  ILE   4          1HD1      ILE   4 -11.679  -6.943  -2.763
   38   HD12  ILE   4          2HD1      ILE   4 -11.778  -8.119  -1.451
   39   HD13  ILE   4          3HD1      ILE   4 -10.204  -7.614  -2.067
   40    H    THR   5           H        THR   5  -8.218  -8.781  -3.392
   41    HA   THR   5           HA       THR   5  -8.111  -6.099  -2.402
   42    HB   THR   5           HB       THR   5  -7.856  -7.852  -0.798
   43    HG1  THR   5           HG1      THR   5  -6.157  -5.901  -1.027
   44   HG21  THR   5          1HG2      THR   5  -7.026  -9.764  -1.689
   45   HG22  THR   5          2HG2      THR   5  -5.499  -9.129  -1.076
   46   HG23  THR   5          3HG2      THR   5  -5.929  -8.908  -2.772
   47    H    THR   6           H        THR   6  -7.446  -5.189  -4.539
   48    HA   THR   6           HA       THR   6  -4.513  -5.285  -4.832
   49    HB   THR   6           HB       THR   6  -6.580  -4.814  -6.988
   50    HG1  THR   6           HG1      THR   6  -4.882  -6.970  -6.304
   51   HG21  THR   6          1HG2      THR   6  -3.985  -5.215  -8.050
   52   HG22  THR   6          2HG2      THR   6  -3.864  -3.956  -6.820
   53   HG23  THR   6          3HG2      THR   6  -4.997  -3.776  -8.159
   54    H    ILE   7           H        ILE   7  -3.817  -3.516  -3.776
   55    HA   ILE   7           HA       ILE   7  -5.063  -0.937  -4.477
   56    HB   ILE   7           HB       ILE   7  -3.725  -1.691  -1.876
   57   HG12  ILE   7          2HG1      ILE   7  -6.144  -0.972  -1.102
   58   HG13  ILE   7          3HG1      ILE   7  -6.572  -1.408  -2.753
   59   HG21  ILE   7          1HG2      ILE   7  -4.926   0.678  -1.400
   60   HG22  ILE   7          2HG2      ILE   7  -3.233   0.506  -1.858
   61   HG23  ILE   7          3HG2      ILE   7  -4.442   0.896  -3.081
   62   HD11  ILE   7          1HD1      ILE   7  -5.073  -3.550  -1.921
   63   HD12  ILE   7          2HD1      ILE   7  -5.972  -3.097  -0.472
   64   HD13  ILE   7          3HD1      ILE   7  -6.834  -3.466  -1.966
   65    H    HIS   8           H        HIS   8  -2.083  -1.637  -2.705
   66    HA   HIS   8           HA       HIS   8  -0.569  -0.331  -4.870
   67    HB2  HIS   8          2HB       HIS   8  -0.804   0.395  -2.078
   68    HB3  HIS   8          3HB       HIS   8   0.872   0.060  -2.500
   69    HD1  HIS   8           HD1      HIS   8   1.124   1.251  -5.245
   70    HD2  HIS   8           HD2      HIS   8  -1.011   3.087  -2.190
   71    HE1  HIS   8           HE1      HIS   8   1.041   3.690  -5.854
   72    H    ASN   9           H        ASN   9   0.343  -1.966  -1.845
   73    HA   ASN   9           HA       ASN   9   1.915  -3.869  -3.456
   74    HB2  ASN   9          2HB       ASN   9   3.580  -3.906  -1.647
   75    HB3  ASN   9          3HB       ASN   9   3.389  -2.284  -2.307
   76   HD21  ASN   9          1HD2      ASN   9   3.801  -3.912   0.455
   77   HD22  ASN   9          2HD2      ASN   9   3.036  -2.836   1.570
   78    H    LEU  10           H        LEU  10  -0.826  -4.065  -2.351
   79    HA   LEU  10           HA       LEU  10  -0.485  -6.179  -0.348
   80    HB2  LEU  10          2HB       LEU  10  -2.631  -4.282  -1.042
   81    HB3  LEU  10          3HB       LEU  10  -3.162  -5.899  -0.582
   82    HG   LEU  10           HG       LEU  10  -1.507  -4.014   1.096
   83   HD11  LEU  10          1HD1      LEU  10  -3.990  -3.555   0.766
   84   HD12  LEU  10          2HD1      LEU  10  -3.413  -3.705   2.425
   85   HD13  LEU  10          3HD1      LEU  10  -4.268  -5.047   1.665
   86   HD21  LEU  10          1HD2      LEU  10  -2.632  -6.287   2.465
   87   HD22  LEU  10          2HD2      LEU  10  -0.964  -5.714   2.420
   88   HD23  LEU  10          3HD2      LEU  10  -1.558  -6.801   1.164
   89    H    PHE  11           H        PHE  11   0.395  -7.529  -2.143
   90    HA   PHE  11           HA       PHE  11  -1.783  -8.754  -3.704
   91    HB2  PHE  11          2HB       PHE  11   1.044  -8.126  -4.371
   92    HB3  PHE  11          3HB       PHE  11   0.389  -9.629  -5.012
   93    HD1  PHE  11           HD1      PHE  11  -1.211  -6.308  -4.499
   94    HD2  PHE  11           HD2      PHE  11   0.038  -9.290  -7.267
   95    HE1  PHE  11           HE1      PHE  11  -2.281  -5.055  -6.326
   96    HE2  PHE  11           HE2      PHE  11  -1.029  -8.041  -9.099
   97    HZ   PHE  11           HZ       PHE  11  -2.189  -5.920  -8.630
   98    H    ARG  12           H        ARG  12  -2.442 -10.466  -2.546
   99    HA   ARG  12           HA       ARG  12  -0.459 -12.170  -1.236
  100    HB2  ARG  12          2HB       ARG  12  -3.063 -11.352  -0.561
  101    HB3  ARG  12          3HB       ARG  12  -3.184 -13.067  -0.927
  102    HG2  ARG  12          2HG       ARG  12  -1.168 -11.912   0.982
  103    HG3  ARG  12          3HG       ARG  12  -2.751 -12.519   1.471
  104    HD2  ARG  12          2HD       ARG  12  -0.931 -14.244  -0.154
  105    HD3  ARG  12          3HD       ARG  12  -0.660 -14.074   1.580
  106    HE   ARG  12           HE       ARG  12  -3.328 -14.685   1.300
  107   HH11  ARG  12          1HH1      ARG  12  -0.296 -16.169   0.449
  108   HH12  ARG  12          2HH1      ARG  12  -0.903 -17.787   0.577
  109   HH21  ARG  12          1HH2      ARG  12  -4.138 -16.810   1.472
  110   HH22  ARG  12          2HH2      ARG  12  -3.089 -18.150   1.158
  111    H    LYS  13           H        LYS  13  -0.824 -12.082  -4.164
  112    HA   LYS  13           HA       LYS  13  -2.048 -14.629  -4.823
  113    HB2  LYS  13          2HB       LYS  13  -1.369 -14.052  -7.151
  114    HB3  LYS  13          3HB       LYS  13  -2.386 -12.836  -6.390
  115    HG2  LYS  13          2HG       LYS  13  -0.870 -11.290  -6.827
  116    HG3  LYS  13          3HG       LYS  13   0.314 -12.165  -5.853
  117    HD2  LYS  13          2HD       LYS  13   1.416 -12.186  -7.846
  118    HD3  LYS  13          3HD       LYS  13   0.448 -13.647  -8.059
  119    HE2  LYS  13          2HE       LYS  13  -1.174 -11.521  -8.898
  120    HE3  LYS  13          3HE       LYS  13   0.424 -11.198  -9.569
  121    HZ1  LYS  13          1HZ       LYS  13   0.433 -13.391 -10.552
  122    HZ2  LYS  13          2HZ       LYS  13  -0.941 -12.543 -11.057
  123    HZ3  LYS  13          3HZ       LYS  13  -1.076 -13.743  -9.873
  124    H    LEU  14           H        LEU  14  -0.983 -16.481  -4.687
  125    HA   LEU  14           HA       LEU  14   1.939 -16.457  -4.616
  126    HB2  LEU  14          2HB       LEU  14   1.692 -18.805  -3.857
  127    HB3  LEU  14          3HB       LEU  14   0.917 -17.623  -2.804
  128    HG   LEU  14           HG       LEU  14  -0.897 -18.746  -4.794
  129   HD11  LEU  14          1HD1      LEU  14  -0.941 -20.956  -4.167
  130   HD12  LEU  14          2HD1      LEU  14  -0.106 -20.655  -2.643
  131   HD13  LEU  14          3HD1      LEU  14   0.792 -20.631  -4.161
  132   HD21  LEU  14          1HD2      LEU  14  -1.192 -18.966  -1.834
  133   HD22  LEU  14          2HD2      LEU  14  -2.410 -18.641  -3.067
  134   HD23  LEU  14          3HD2      LEU  14  -1.273 -17.377  -2.597
  135    H    THR  15           H        THR  15   0.568 -16.032  -7.116
  136    HA   THR  15           HA       THR  15   1.408 -18.456  -8.570
  137    HB   THR  15           HB       THR  15  -0.201 -17.841 -10.341
  138    HG1  THR  15           HG1      THR  15  -0.235 -15.527  -9.214
  139   HG21  THR  15          1HG2      THR  15  -1.919 -17.893  -7.933
  140   HG22  THR  15          2HG2      THR  15  -0.721 -19.180  -8.069
  141   HG23  THR  15          3HG2      THR  15  -1.914 -18.948  -9.346
  142    H    HIS  16           H        HIS  16   3.542 -17.312  -8.428
  143    HA   HIS  16           HA       HIS  16   3.927 -14.927  -9.963
  144    HB2  HIS  16          2HB       HIS  16   6.387 -15.557  -9.696
  145    HB3  HIS  16          3HB       HIS  16   5.482 -15.266  -8.213
  146    HD1  HIS  16           HD1      HIS  16   7.128 -17.991 -10.180
  147    HD2  HIS  16           HD2      HIS  16   5.149 -17.493  -6.560
  148    HE1  HIS  16           HE1      HIS  16   7.536 -20.113  -8.892
  149    H    ARG  17           H        ARG  17   2.746 -15.863 -11.868
  150    HA   ARG  17           HA       ARG  17   4.357 -17.683 -13.488
  151    HB2  ARG  17          2HB       ARG  17   1.525 -16.827 -13.453
  152    HB3  ARG  17          3HB       ARG  17   2.213 -17.142 -15.040
  153    HG2  ARG  17          2HG       ARG  17   3.051 -19.324 -13.659
  154    HG3  ARG  17          3HG       ARG  17   1.496 -18.996 -12.892
  155    HD2  ARG  17          2HD       ARG  17   1.767 -19.045 -15.876
  156    HD3  ARG  17          3HD       ARG  17   1.565 -20.538 -14.961
  157    HE   ARG  17           HE       ARG  17  -0.419 -18.720 -14.174
  158   HH11  ARG  17          1HH1      ARG  17   0.511 -20.633 -16.930
  159   HH12  ARG  17          2HH1      ARG  17  -1.108 -20.800 -17.525
  160   HH21  ARG  17          1HH2      ARG  17  -2.555 -18.932 -14.947
  161   HH22  ARG  17          2HH2      ARG  17  -2.851 -19.831 -16.397
  162    H    LEU  18           H        LEU  18   2.422 -14.852 -14.423
  163    HA   LEU  18           HA       LEU  18   4.642 -14.013 -16.154
  164    HB2  LEU  18          2HB       LEU  18   1.746 -13.187 -16.262
  165    HB3  LEU  18          3HB       LEU  18   2.998 -12.781 -17.434
  166    HG   LEU  18           HG       LEU  18   2.431 -15.659 -16.968
  167   HD11  LEU  18          1HD1      LEU  18   0.483 -13.709 -18.050
  168   HD12  LEU  18          2HD1      LEU  18   0.216 -15.238 -17.215
  169   HD13  LEU  18          3HD1      LEU  18   0.676 -15.232 -18.917
  170   HD21  LEU  18          1HD2      LEU  18   3.133 -15.894 -19.178
  171   HD22  LEU  18          2HD2      LEU  18   4.173 -14.619 -18.542
  172   HD23  LEU  18          3HD2      LEU  18   2.796 -14.206 -19.565
  173    H    PHE  19           H        PHE  19   2.589 -13.015 -13.526
  174    HA   PHE  19           HA       PHE  19   3.100 -10.251 -13.580
  175    HB2  PHE  19          2HB       PHE  19   2.041 -12.193 -11.620
  176    HB3  PHE  19          3HB       PHE  19   2.729 -10.724 -10.935
  177    HD1  PHE  19           HD1      PHE  19   0.383 -11.805 -13.623
  178    HD2  PHE  19           HD2      PHE  19   1.371  -8.888 -10.685
  179    HE1  PHE  19           HE1      PHE  19  -1.706 -10.603 -14.119
  180    HE2  PHE  19           HE2      PHE  19  -0.717  -7.682 -11.176
  181    HZ   PHE  19           HZ       PHE  19  -2.259  -8.539 -12.894
  182    H    ARG  20           H        ARG  20   4.931 -12.955 -12.340
  183    HA   ARG  20           HA       ARG  20   6.690 -11.633 -10.631
  184    HB2  ARG  20          2HB       ARG  20   6.382 -14.188 -11.261
  185    HB3  ARG  20          3HB       ARG  20   7.713 -13.842 -12.357
  186    HG2  ARG  20          2HG       ARG  20   8.853 -12.845 -10.252
  187    HG3  ARG  20          3HG       ARG  20   7.665 -13.811  -9.374
  188    HD2  ARG  20          2HD       ARG  20   8.448 -15.768 -10.810
  189    HD3  ARG  20          3HD       ARG  20   9.811 -14.743 -11.258
  190    HE   ARG  20           HE       ARG  20   9.718 -14.718  -8.505
  191   HH11  ARG  20          1HH1      ARG  20  10.089 -17.108 -11.009
  192   HH12  ARG  20          2HH1      ARG  20  11.058 -18.165 -10.037
  193   HH21  ARG  20          1HH2      ARG  20  10.994 -16.101  -7.215
  194   HH22  ARG  20          2HH2      ARG  20  11.572 -17.592  -7.879
  195    H    ARG  21           H        ARG  21   6.564 -11.749 -14.106
  196    HA   ARG  21           HA       ARG  21   9.228 -10.775 -14.525
  197    HB2  ARG  21          2HB       ARG  21   7.455 -12.032 -16.125
  198    HB3  ARG  21          3HB       ARG  21   7.184 -10.369 -16.629
  199    HG2  ARG  21          2HG       ARG  21   9.431 -10.113 -17.318
  200    HG3  ARG  21          3HG       ARG  21   9.914 -11.618 -16.534
  201    HD2  ARG  21          2HD       ARG  21   8.783 -12.931 -18.129
  202    HD3  ARG  21          3HD       ARG  21   7.881 -11.547 -18.745
  203    HE   ARG  21           HE       ARG  21  10.598 -11.046 -19.137
  204   HH11  ARG  21          1HH1      ARG  21   8.140 -13.248 -20.246
  205   HH12  ARG  21          2HH1      ARG  21   8.871 -13.488 -21.799
  206   HH21  ARG  21          1HH2      ARG  21  11.570 -11.354 -21.177
  207   HH22  ARG  21          2HH2      ARG  21  10.823 -12.411 -22.326
  208    H    ASN  22           H        ASN  22   6.104  -9.358 -13.985
  209    HA   ASN  22           HA       ASN  22   6.950  -6.719 -14.845
  210    HB2  ASN  22          2HB       ASN  22   4.445  -8.034 -14.391
  211    HB3  ASN  22          3HB       ASN  22   4.508  -6.574 -13.408
  212   HD21  ASN  22          1HD2      ASN  22   3.554  -4.958 -14.389
  213   HD22  ASN  22          2HD2      ASN  22   3.631  -4.595 -16.076
  214    H    PHE  23           H        PHE  23   6.524  -8.528 -11.887
  215    HA   PHE  23           HA       PHE  23   6.508  -6.453 -10.027
  216    HB2  PHE  23          2HB       PHE  23   6.985  -9.328 -10.000
  217    HB3  PHE  23          3HB       PHE  23   7.952  -8.480  -8.797
  218    HD1  PHE  23           HD1      PHE  23   6.627  -6.716  -7.364
  219    HD2  PHE  23           HD2      PHE  23   4.857  -9.983  -9.441
  220    HE1  PHE  23           HE1      PHE  23   4.673  -6.602  -5.873
  221    HE2  PHE  23           HE2      PHE  23   2.900  -9.873  -7.953
  222    HZ   PHE  23           HZ       PHE  23   2.806  -8.181  -6.167
  223    H    GLY  24           H        GLY  24   9.108  -7.782 -11.913
  224    HA2  GLY  24          2HA       GLY  24  11.311  -6.953 -10.398
  225    HA3  GLY  24          3HA       GLY  24  11.307  -7.169 -12.142
  226    H    TYR  25           H        TYR  25   9.066  -5.100 -12.243
  227    HA   TYR  25           HA       TYR  25  10.835  -2.828 -12.535
  228    HB2  TYR  25          2HB       TYR  25   8.058  -3.499 -13.377
  229    HB3  TYR  25          3HB       TYR  25   8.474  -1.796 -13.219
  230    HD1  TYR  25           HD1      TYR  25   8.615  -0.988 -15.396
  231    HD2  TYR  25           HD2      TYR  25  10.543  -4.654 -14.422
  232    HE1  TYR  25           HE1      TYR  25   9.648  -1.031 -17.628
  233    HE2  TYR  25           HE2      TYR  25  11.582  -4.706 -16.651
  234    HH   TYR  25           HH       TYR  25  11.917  -2.205 -18.583
  235    H    THR  26           H        THR  26   8.429  -3.971 -10.321
  236    HA   THR  26           HA       THR  26   8.152  -1.382  -9.020
  237    HB   THR  26           HB       THR  26   6.870  -3.148  -7.370
  238    HG1  THR  26           HG1      THR  26   6.567  -4.940  -8.440
  239   HG21  THR  26          1HG2      THR  26   5.967  -1.055  -8.295
  240   HG22  THR  26          2HG2      THR  26   4.814  -2.382  -8.435
  241   HG23  THR  26          3HG2      THR  26   5.727  -1.853  -9.848
  242    H    LEU  27           H        LEU  27   8.647  -4.602  -7.596
  243    HA   LEU  27           HA       LEU  27  10.349  -3.421  -5.558
  244    HB2  LEU  27          2HB       LEU  27   8.860  -5.950  -5.901
  245    HB3  LEU  27          3HB       LEU  27  10.339  -6.036  -4.946
  246    HG   LEU  27           HG       LEU  27   9.031  -3.864  -3.870
  247   HD11  LEU  27          1HD1      LEU  27   6.947  -5.997  -4.164
  248   HD12  LEU  27          2HD1      LEU  27   7.057  -4.655  -5.302
  249   HD13  LEU  27          3HD1      LEU  27   6.767  -4.339  -3.592
  250   HD21  LEU  27          1HD2      LEU  27   9.274  -6.748  -3.103
  251   HD22  LEU  27          2HD2      LEU  27   8.400  -5.613  -2.075
  252   HD23  LEU  27          3HD2      LEU  27  10.105  -5.342  -2.438
  253    H    ARG  28           H        ARG  28  10.677  -6.526  -7.258
  254    HA   ARG  28           HA       ARG  28  13.467  -6.621  -7.044
  255    HB2  ARG  28          2HB       ARG  28  11.387  -8.114  -8.516
  256    HB3  ARG  28          3HB       ARG  28  13.001  -8.188  -9.211
  257    HG2  ARG  28          2HG       ARG  28  12.589  -8.732  -6.302
  258    HG3  ARG  28          3HG       ARG  28  12.263  -9.982  -7.505
  259    HD2  ARG  28          2HD       ARG  28  14.578  -9.601  -8.389
  260    HD3  ARG  28          3HD       ARG  28  14.866  -8.551  -7.002
  261    HE   ARG  28           HE       ARG  28  13.920 -11.094  -6.173
  262   HH11  ARG  28          1HH1      ARG  28  16.749  -9.453  -7.367
  263   HH12  ARG  28          2HH1      ARG  28  17.862 -10.550  -6.618
  264   HH21  ARG  28          1HH2      ARG  28  15.375 -12.545  -5.182
  265   HH22  ARG  28          2HH2      ARG  28  17.079 -12.308  -5.376
  Start of MODEL   11
    1    H1   LYS   1           H        LYS   1  -3.168   3.884   3.802
    2    HA   LYS   1           HA       LYS   1  -0.852   2.619   3.779
    3    HB2  LYS   1          2HB       LYS   1  -1.642   4.500   5.355
    4    HB3  LYS   1          3HB       LYS   1  -2.044   3.208   6.479
    5    HG2  LYS   1          2HG       LYS   1   0.145   2.680   6.874
    6    HG3  LYS   1          3HG       LYS   1   0.685   3.265   5.299
    7    HD2  LYS   1          2HD       LYS   1   0.140   5.593   6.115
    8    HD3  LYS   1          3HD       LYS   1  -0.069   4.890   7.721
    9    HE2  LYS   1          2HE       LYS   1   2.365   3.888   6.834
   10    HE3  LYS   1          3HE       LYS   1   2.359   5.565   6.290
   11    HZ1  LYS   1          1HZ       LYS   1   1.658   6.112   8.650
   12    HZ2  LYS   1          2HZ       LYS   1   3.261   5.619   8.427
   13    HZ3  LYS   1          3HZ       LYS   1   2.122   4.535   9.051
   14    H    TYR   2           H        TYR   2  -3.674   1.001   4.373
   15    HA   TYR   2           HA       TYR   2  -2.247  -1.235   5.659
   16    HB2  TYR   2          2HB       TYR   2  -3.939  -0.339   7.163
   17    HB3  TYR   2          3HB       TYR   2  -5.165  -0.476   5.908
   18    HD1  TYR   2           HD1      TYR   2  -2.608  -2.726   7.465
   19    HD2  TYR   2           HD2      TYR   2  -6.638  -2.216   6.199
   20    HE1  TYR   2           HE1      TYR   2  -3.132  -5.003   8.235
   21    HE2  TYR   2           HE2      TYR   2  -7.173  -4.490   6.967
   22    HH   TYR   2           HH       TYR   2  -6.094  -6.567   7.462
   23    H    GLU   3           H        GLU   3  -5.402  -0.971   4.046
   24    HA   GLU   3           HA       GLU   3  -5.014  -3.429   2.650
   25    HB2  GLU   3          2HB       GLU   3  -7.136  -1.310   2.639
   26    HB3  GLU   3          3HB       GLU   3  -7.147  -2.576   1.419
   27    HG2  GLU   3          2HG       GLU   3  -6.831  -3.553   4.157
   28    HG3  GLU   3          3HG       GLU   3  -8.356  -2.724   3.849
   29    H    ILE   4           H        ILE   4  -3.902  -0.332   2.089
   30    HA   ILE   4           HA       ILE   4  -4.141  -0.041  -0.688
   31    HB   ILE   4           HB       ILE   4  -2.171   1.450  -0.533
   32   HG12  ILE   4          2HG1      ILE   4  -1.511   1.849   2.002
   33   HG13  ILE   4          3HG1      ILE   4  -1.990   0.162   2.157
   34   HG21  ILE   4          1HG2      ILE   4  -4.040   1.964   1.764
   35   HG22  ILE   4          2HG2      ILE   4  -3.242   3.139   0.721
   36   HG23  ILE   4          3HG2      ILE   4  -4.533   2.124   0.079
   37   HD11  ILE   4          1HD1      ILE   4  -0.237   0.613  -0.109
   38   HD12  ILE   4          2HD1      ILE   4   0.489   1.093   1.426
   39   HD13  ILE   4          3HD1      ILE   4  -0.114  -0.551   1.211
   40    H    THR   5           H        THR   5  -2.077  -2.050   1.234
   41    HA   THR   5           HA       THR   5  -0.106  -2.532  -0.783
   42    HB   THR   5           HB       THR   5  -0.342  -4.684   1.146
   43    HG1  THR   5           HG1      THR   5  -1.007  -3.478   2.763
   44   HG21  THR   5          1HG2      THR   5   1.961  -3.936   1.698
   45   HG22  THR   5          2HG2      THR   5   1.735  -2.555   0.623
   46   HG23  THR   5          3HG2      THR   5   1.712  -4.194  -0.029
   47    H    THR   6           H        THR   6  -3.173  -3.940   0.084
   48    HA   THR   6           HA       THR   6  -2.756  -6.199  -1.725
   49    HB   THR   6           HB       THR   6  -5.381  -5.865  -0.401
   50    HG1  THR   6           HG1      THR   6  -4.180  -5.273   1.351
   51   HG21  THR   6          1HG2      THR   6  -3.448  -8.095  -0.960
   52   HG22  THR   6          2HG2      THR   6  -5.102  -7.890  -1.538
   53   HG23  THR   6          3HG2      THR   6  -4.803  -8.315   0.147
   54    H    ILE   7           H        ILE   7  -3.222  -5.907  -3.798
   55    HA   ILE   7           HA       ILE   7  -5.522  -4.198  -4.492
   56    HB   ILE   7           HB       ILE   7  -4.114  -4.194  -6.790
   57   HG12  ILE   7          2HG1      ILE   7  -1.923  -3.830  -4.785
   58   HG13  ILE   7          3HG1      ILE   7  -2.302  -5.454  -5.349
   59   HG21  ILE   7          1HG2      ILE   7  -3.509  -2.254  -4.574
   60   HG22  ILE   7          2HG2      ILE   7  -3.565  -1.944  -6.308
   61   HG23  ILE   7          3HG2      ILE   7  -5.053  -2.288  -5.426
   62   HD11  ILE   7          1HD1      ILE   7  -1.371  -5.103  -7.352
   63   HD12  ILE   7          2HD1      ILE   7  -1.998  -3.458  -7.472
   64   HD13  ILE   7          3HD1      ILE   7  -0.541  -3.781  -6.532
   65    H    HIS   8           H        HIS   8  -3.603  -6.208  -6.648
   66    HA   HIS   8           HA       HIS   8  -5.951  -7.948  -7.029
   67    HB2  HIS   8          2HB       HIS   8  -4.319  -6.452  -8.980
   68    HB3  HIS   8          3HB       HIS   8  -4.670  -8.121  -9.422
   69    HD1  HIS   8           HD1      HIS   8  -5.874  -5.161 -10.433
   70    HD2  HIS   8           HD2      HIS   8  -7.780  -8.299  -8.488
   71    HE1  HIS   8           HE1      HIS   8  -8.319  -4.890 -10.957
   72    H    ASN   9           H        ASN   9  -3.086  -7.964  -5.658
   73    HA   ASN   9           HA       ASN   9  -1.834 -10.250  -6.851
   74    HB2  ASN   9          2HB       ASN   9  -1.269  -9.324  -4.052
   75    HB3  ASN   9          3HB       ASN   9  -0.160 -10.000  -5.243
   76   HD21  ASN   9          1HD2      ASN   9  -0.113  -7.500  -3.636
   77   HD22  ASN   9          2HD2      ASN   9   0.116  -6.233  -4.789
   78    H    LEU  10           H        LEU  10  -4.238 -11.190  -6.601
   79    HA   LEU  10           HA       LEU  10  -4.223 -12.847  -4.163
   80    HB2  LEU  10          2HB       LEU  10  -6.715 -13.080  -4.641
   81    HB3  LEU  10          3HB       LEU  10  -6.145 -11.544  -3.990
   82    HG   LEU  10           HG       LEU  10  -6.159 -10.701  -6.394
   83   HD11  LEU  10          1HD1      LEU  10  -7.663 -13.284  -6.724
   84   HD12  LEU  10          2HD1      LEU  10  -6.264 -12.713  -7.632
   85   HD13  LEU  10          3HD1      LEU  10  -7.828 -11.924  -7.834
   86   HD21  LEU  10          1HD2      LEU  10  -8.103 -10.769  -4.422
   87   HD22  LEU  10          2HD2      LEU  10  -8.959 -11.254  -5.886
   88   HD23  LEU  10          3HD2      LEU  10  -8.082  -9.723  -5.842
   89    H    PHE  11           H        PHE  11  -3.065 -13.185  -6.964
   90    HA   PHE  11           HA       PHE  11  -4.540 -15.291  -8.195
   91    HB2  PHE  11          2HB       PHE  11  -1.596 -14.836  -8.604
   92    HB3  PHE  11          3HB       PHE  11  -2.794 -15.409  -9.761
   93    HD1  PHE  11           HD1      PHE  11  -1.142 -12.541  -8.346
   94    HD2  PHE  11           HD2      PHE  11  -4.459 -13.805 -10.693
   95    HE1  PHE  11           HE1      PHE  11  -1.412 -10.247  -9.194
   96    HE2  PHE  11           HE2      PHE  11  -4.734 -11.514 -11.546
   97    HZ   PHE  11           HZ       PHE  11  -3.209  -9.731 -10.797
   98    H    ARG  12           H        ARG  12  -4.695 -17.320  -7.533
   99    HA   ARG  12           HA       ARG  12  -3.488 -18.408  -5.311
  100    HB2  ARG  12          2HB       ARG  12  -5.343 -19.265  -7.155
  101    HB3  ARG  12          3HB       ARG  12  -4.012 -20.387  -7.405
  102    HG2  ARG  12          2HG       ARG  12  -4.900 -19.860  -4.620
  103    HG3  ARG  12          3HG       ARG  12  -5.915 -20.867  -5.653
  104    HD2  ARG  12          2HD       ARG  12  -3.546 -21.989  -6.166
  105    HD3  ARG  12          3HD       ARG  12  -3.218 -21.383  -4.544
  106    HE   ARG  12           HE       ARG  12  -4.948 -23.560  -5.264
  107   HH11  ARG  12          1HH1      ARG  12  -4.256 -21.127  -2.873
  108   HH12  ARG  12          2HH1      ARG  12  -5.007 -22.000  -1.578
  109   HH21  ARG  12          1HH2      ARG  12  -5.940 -24.719  -3.568
  110   HH22  ARG  12          2HH2      ARG  12  -5.964 -24.043  -1.975
  111    H    LYS  13           H        LYS  13  -2.395 -18.493  -8.666
  112    HA   LYS  13           HA       LYS  13   0.161 -19.622  -7.727
  113    HB2  LYS  13          2HB       LYS  13  -1.503 -20.240 -10.111
  114    HB3  LYS  13          3HB       LYS  13   0.242 -20.240 -10.331
  115    HG2  LYS  13          2HG       LYS  13  -0.236 -22.447  -9.823
  116    HG3  LYS  13          3HG       LYS  13   0.289 -21.783  -8.274
  117    HD2  LYS  13          2HD       LYS  13  -1.654 -22.339  -7.351
  118    HD3  LYS  13          3HD       LYS  13  -2.523 -21.376  -8.549
  119    HE2  LYS  13          2HE       LYS  13  -2.033 -23.477 -10.072
  120    HE3  LYS  13          3HE       LYS  13  -1.928 -24.293  -8.513
  121    HZ1  LYS  13          1HZ       LYS  13  -4.216 -22.576  -8.738
  122    HZ2  LYS  13          2HZ       LYS  13  -4.123 -24.190  -8.243
  123    HZ3  LYS  13          3HZ       LYS  13  -4.212 -23.814  -9.890
  124    H    LEU  14           H        LEU  14   0.478 -17.211  -7.347
  125    HA   LEU  14           HA       LEU  14   0.925 -15.585  -9.682
  126    HB2  LEU  14          2HB       LEU  14   1.837 -13.957  -8.014
  127    HB3  LEU  14          3HB       LEU  14   0.166 -14.452  -7.750
  128    HG   LEU  14           HG       LEU  14   1.690 -16.202  -6.200
  129   HD11  LEU  14          1HD1      LEU  14   2.793 -13.411  -6.151
  130   HD12  LEU  14          2HD1      LEU  14   3.663 -14.939  -6.281
  131   HD13  LEU  14          3HD1      LEU  14   2.898 -14.487  -4.757
  132   HD21  LEU  14          1HD2      LEU  14  -0.245 -14.029  -5.833
  133   HD22  LEU  14          2HD2      LEU  14   0.775 -14.350  -4.431
  134   HD23  LEU  14          3HD2      LEU  14  -0.200 -15.645  -5.127
  135    H    THR  15           H        THR  15   2.613 -18.067  -8.374
  136    HA   THR  15           HA       THR  15   5.242 -17.286  -8.132
  137    HB   THR  15           HB       THR  15   5.821 -19.599  -9.007
  138    HG1  THR  15           HG1      THR  15   3.103 -19.471  -9.594
  139   HG21  THR  15          1HG2      THR  15   4.298 -20.673  -7.096
  140   HG22  THR  15          2HG2      THR  15   4.068 -18.970  -6.698
  141   HG23  THR  15          3HG2      THR  15   5.692 -19.656  -6.733
  142    H    HIS  16           H        HIS  16   4.281 -19.041 -11.053
  143    HA   HIS  16           HA       HIS  16   5.794 -17.073 -12.642
  144    HB2  HIS  16          2HB       HIS  16   6.181 -19.135 -14.187
  145    HB3  HIS  16          3HB       HIS  16   7.170 -18.947 -12.741
  146    HD1  HIS  16           HD1      HIS  16   4.605 -21.135 -14.290
  147    HD2  HIS  16           HD2      HIS  16   6.602 -20.790 -10.663
  148    HE1  HIS  16           HE1      HIS  16   4.176 -23.296 -13.078
  149    H    ARG  17           H        ARG  17   3.206 -16.534 -12.339
  150    HA   ARG  17           HA       ARG  17   1.913 -17.532 -14.792
  151    HB2  ARG  17          2HB       ARG  17   0.609 -18.148 -12.875
  152    HB3  ARG  17          3HB       ARG  17   0.711 -16.522 -12.214
  153    HG2  ARG  17          2HG       ARG  17  -0.673 -15.667 -13.998
  154    HG3  ARG  17          3HG       ARG  17  -0.705 -17.255 -14.768
  155    HD2  ARG  17          2HD       ARG  17  -1.833 -18.174 -12.790
  156    HD3  ARG  17          3HD       ARG  17  -1.823 -16.573 -12.051
  157    HE   ARG  17           HE       ARG  17  -3.579 -15.967 -13.399
  158   HH11  ARG  17          1HH1      ARG  17  -2.208 -18.955 -14.545
  159   HH12  ARG  17          2HH1      ARG  17  -3.484 -19.258 -15.677
  160   HH21  ARG  17          1HH2      ARG  17  -5.264 -16.355 -14.887
  161   HH22  ARG  17          2HH2      ARG  17  -5.221 -17.778 -15.872
  162    H    LEU  18           H        LEU  18   1.253 -14.699 -12.761
  163    HA   LEU  18           HA       LEU  18   1.697 -13.003 -15.131
  164    HB2  LEU  18          2HB       LEU  18  -0.467 -12.968 -13.067
  165    HB3  LEU  18          3HB       LEU  18  -0.021 -11.484 -13.906
  166    HG   LEU  18           HG       LEU  18  -0.537 -13.720 -15.711
  167   HD11  LEU  18          1HD1      LEU  18  -2.803 -14.044 -15.344
  168   HD12  LEU  18          2HD1      LEU  18  -2.946 -12.614 -14.322
  169   HD13  LEU  18          3HD1      LEU  18  -2.135 -14.056 -13.712
  170   HD21  LEU  18          1HD2      LEU  18  -0.380 -11.053 -15.947
  171   HD22  LEU  18          2HD2      LEU  18  -2.124 -11.229 -15.751
  172   HD23  LEU  18          3HD2      LEU  18  -1.294 -12.071 -17.060
  173    H    PHE  19           H        PHE  19   1.781 -13.168 -11.597
  174    HA   PHE  19           HA       PHE  19   2.873 -10.656 -11.082
  175    HB2  PHE  19          2HB       PHE  19   2.043 -12.645  -9.505
  176    HB3  PHE  19          3HB       PHE  19   3.774 -12.952  -9.415
  177    HD1  PHE  19           HD1      PHE  19   5.236 -11.478  -8.237
  178    HD2  PHE  19           HD2      PHE  19   1.105 -10.544  -8.666
  179    HE1  PHE  19           HE1      PHE  19   5.459  -9.722  -6.529
  180    HE2  PHE  19           HE2      PHE  19   1.322  -8.786  -6.959
  181    HZ   PHE  19           HZ       PHE  19   3.501  -8.372  -5.888
  182    H    ARG  20           H        ARG  20   4.304 -13.476 -12.443
  183    HA   ARG  20           HA       ARG  20   7.017 -12.485 -11.994
  184    HB2  ARG  20          2HB       ARG  20   5.862 -15.066 -12.285
  185    HB3  ARG  20          3HB       ARG  20   6.968 -14.826 -13.631
  186    HG2  ARG  20          2HG       ARG  20   8.653 -14.070 -11.846
  187    HG3  ARG  20          3HG       ARG  20   7.554 -14.835 -10.697
  188    HD2  ARG  20          2HD       ARG  20   7.707 -16.919 -12.081
  189    HD3  ARG  20          3HD       ARG  20   8.971 -16.127 -13.021
  190    HE   ARG  20           HE       ARG  20   9.685 -15.978 -10.330
  191   HH11  ARG  20          1HH1      ARG  20   9.223 -18.391 -12.796
  192   HH12  ARG  20          2HH1      ARG  20  10.379 -19.491 -12.121
  193   HH21  ARG  20          1HH2      ARG  20  11.210 -17.417  -9.431
  194   HH22  ARG  20          2HH2      ARG  20  11.507 -18.936 -10.206
  195    H    ARG  21           H        ARG  21   5.015 -11.207 -13.813
  196    HA   ARG  21           HA       ARG  21   6.525 -11.426 -16.334
  197    HB2  ARG  21          2HB       ARG  21   3.651 -10.604 -15.884
  198    HB3  ARG  21          3HB       ARG  21   4.477 -10.536 -17.435
  199    HG2  ARG  21          2HG       ARG  21   4.921 -13.064 -17.000
  200    HG3  ARG  21          3HG       ARG  21   3.571 -12.909 -15.874
  201    HD2  ARG  21          2HD       ARG  21   2.097 -12.922 -17.539
  202    HD3  ARG  21          3HD       ARG  21   2.956 -11.631 -18.378
  203    HE   ARG  21           HE       ARG  21   3.116 -14.458 -18.908
  204   HH11  ARG  21          1HH1      ARG  21   4.682 -11.368 -19.251
  205   HH12  ARG  21          2HH1      ARG  21   5.628 -11.853 -20.620
  206   HH21  ARG  21          1HH2      ARG  21   4.355 -15.108 -20.710
  207   HH22  ARG  21          2HH2      ARG  21   5.440 -13.980 -21.449
  208    H    ASN  22           H        ASN  22   4.305  -8.970 -15.040
  209    HA   ASN  22           HA       ASN  22   6.286  -6.922 -15.721
  210    HB2  ASN  22          2HB       ASN  22   3.378  -7.063 -15.764
  211    HB3  ASN  22          3HB       ASN  22   3.955  -5.622 -14.933
  212   HD21  ASN  22          1HD2      ASN  22   4.999  -7.481 -17.773
  213   HD22  ASN  22          2HD2      ASN  22   5.081  -6.124 -18.840
  214    H    PHE  23           H        PHE  23   4.457  -8.235 -13.040
  215    HA   PHE  23           HA       PHE  23   4.924  -6.247 -11.134
  216    HB2  PHE  23          2HB       PHE  23   4.089  -9.059 -11.121
  217    HB3  PHE  23          3HB       PHE  23   4.933  -8.565  -9.657
  218    HD1  PHE  23           HD1      PHE  23   4.087  -6.462  -8.467
  219    HD2  PHE  23           HD2      PHE  23   1.840  -8.568 -11.406
  220    HE1  PHE  23           HE1      PHE  23   2.021  -5.427  -7.623
  221    HE2  PHE  23           HE2      PHE  23  -0.230  -7.536 -10.567
  222    HZ   PHE  23           HZ       PHE  23  -0.141  -5.963  -8.674
  223    H    GLY  24           H        GLY  24   7.019  -8.677 -12.444
  224    HA2  GLY  24          2HA       GLY  24   8.939  -8.715 -10.347
  225    HA3  GLY  24          3HA       GLY  24   9.200  -9.255 -11.998
  226    H    TYR  25           H        TYR  25   8.289  -6.476 -12.882
  227    HA   TYR  25           HA       TYR  25  10.946  -5.290 -12.731
  228    HB2  TYR  25          2HB       TYR  25   8.618  -5.061 -14.553
  229    HB3  TYR  25          3HB       TYR  25   9.597  -3.612 -14.350
  230    HD1  TYR  25           HD1      TYR  25  10.884  -3.356 -16.256
  231    HD2  TYR  25           HD2      TYR  25  10.534  -7.224 -14.518
  232    HE1  TYR  25           HE1      TYR  25  12.514  -4.226 -17.879
  233    HE2  TYR  25           HE2      TYR  25  12.164  -8.104 -16.135
  234    HH   TYR  25           HH       TYR  25  12.896  -7.257 -18.656
  235    H    THR  26           H        THR  26   7.669  -4.704 -11.679
  236    HA   THR  26           HA       THR  26   8.232  -2.011 -10.783
  237    HB   THR  26           HB       THR  26   5.867  -2.566  -9.608
  238    HG1  THR  26           HG1      THR  26   5.094  -4.379 -10.357
  239   HG21  THR  26          1HG2      THR  26   5.590  -0.800 -10.968
  240   HG22  THR  26          2HG2      THR  26   5.046  -1.982 -12.159
  241   HG23  THR  26          3HG2      THR  26   6.721  -1.429 -12.165
  242    H    LEU  27           H        LEU  27   6.763  -4.691  -8.966
  243    HA   LEU  27           HA       LEU  27   7.479  -3.804  -6.447
  244    HB2  LEU  27          2HB       LEU  27   6.582  -6.333  -7.625
  245    HB3  LEU  27          3HB       LEU  27   7.495  -6.514  -6.129
  246    HG   LEU  27           HG       LEU  27   5.020  -6.443  -5.837
  247   HD11  LEU  27          1HD1      LEU  27   6.120  -5.981  -3.874
  248   HD12  LEU  27          2HD1      LEU  27   5.172  -4.510  -4.087
  249   HD13  LEU  27          3HD1      LEU  27   6.882  -4.525  -4.515
  250   HD21  LEU  27          1HD2      LEU  27   3.736  -4.643  -6.386
  251   HD22  LEU  27          2HD2      LEU  27   4.944  -4.529  -7.666
  252   HD23  LEU  27          3HD2      LEU  27   5.072  -3.501  -6.238
  253    H    ARG  28           H        ARG  28   9.365  -5.554  -8.798
  254    HA   ARG  28           HA       ARG  28  11.624  -5.584  -6.905
  255    HB2  ARG  28          2HB       ARG  28  10.624  -7.622  -8.798
  256    HB3  ARG  28          3HB       ARG  28  12.369  -7.407  -8.766
  257    HG2  ARG  28          2HG       ARG  28  11.345  -7.530  -6.089
  258    HG3  ARG  28          3HG       ARG  28  10.797  -8.925  -7.022
  259    HD2  ARG  28          2HD       ARG  28  13.629  -8.190  -7.365
  260    HD3  ARG  28          3HD       ARG  28  13.185  -8.782  -5.765
  261    HE   ARG  28           HE       ARG  28  12.086 -10.555  -7.569
  262   HH11  ARG  28          1HH1      ARG  28  15.268  -9.410  -6.744
  263   HH12  ARG  28          2HH1      ARG  28  16.057 -10.888  -7.187
  264   HH21  ARG  28          1HH2      ARG  28  13.112 -12.506  -8.156
  265   HH22  ARG  28          2HH2      ARG  28  14.830 -12.647  -7.991
  Start of MODEL   12
    1    H1   LYS   1           H        LYS   1   1.789  -2.887   5.093
    2    HA   LYS   1           HA       LYS   1   0.780  -2.124   3.160
    3    HB2  LYS   1          2HB       LYS   1   0.489  -5.089   3.318
    4    HB3  LYS   1          3HB       LYS   1  -0.284  -4.250   1.980
    5    HG2  LYS   1          2HG       LYS   1   1.650  -4.341   0.909
    6    HG3  LYS   1          3HG       LYS   1   2.295  -3.202   2.094
    7    HD2  LYS   1          2HD       LYS   1   2.218  -6.120   2.735
    8    HD3  LYS   1          3HD       LYS   1   3.489  -5.490   1.684
    9    HE2  LYS   1          2HE       LYS   1   3.131  -3.836   4.030
   10    HE3  LYS   1          3HE       LYS   1   3.468  -5.510   4.468
   11    HZ1  LYS   1          1HZ       LYS   1   5.114  -4.193   2.419
   12    HZ2  LYS   1          2HZ       LYS   1   5.519  -5.453   3.472
   13    HZ3  LYS   1          3HZ       LYS   1   5.410  -3.869   4.053
   14    H    TYR   2           H        TYR   2  -1.031  -1.155   2.442
   15    HA   TYR   2           HA       TYR   2  -3.584  -1.966   3.671
   16    HB2  TYR   2          2HB       TYR   2  -2.838   0.172   4.576
   17    HB3  TYR   2          3HB       TYR   2  -2.648   0.820   2.950
   18    HD1  TYR   2           HD1      TYR   2  -4.383   2.038   2.016
   19    HD2  TYR   2           HD2      TYR   2  -5.244  -0.674   5.179
   20    HE1  TYR   2           HE1      TYR   2  -6.710   2.833   2.055
   21    HE2  TYR   2           HE2      TYR   2  -7.574   0.112   5.227
   22    HH   TYR   2           HH       TYR   2  -8.598   2.921   3.622
   23    H    GLU   3           H        GLU   3  -2.729   0.307   1.074
   24    HA   GLU   3           HA       GLU   3  -4.875  -0.707  -0.565
   25    HB2  GLU   3          2HB       GLU   3  -3.127   1.643  -0.541
   26    HB3  GLU   3          3HB       GLU   3  -3.450   1.029  -2.156
   27    HG2  GLU   3          2HG       GLU   3  -5.935   1.004  -1.022
   28    HG3  GLU   3          3HG       GLU   3  -5.201   2.432  -0.295
   29    H    ILE   4           H        ILE   4  -1.780  -1.704  -0.004
   30    HA   ILE   4           HA       ILE   4  -1.428  -2.730  -2.741
   31    HB   ILE   4           HB       ILE   4   0.939  -3.265  -1.863
   32   HG12  ILE   4          2HG1      ILE   4   0.045  -2.580   0.533
   33   HG13  ILE   4          3HG1      ILE   4   1.711  -2.265   0.061
   34   HG21  ILE   4          1HG2      ILE   4  -0.127  -0.545  -2.515
   35   HG22  ILE   4          2HG2      ILE   4   1.593  -0.796  -2.221
   36   HG23  ILE   4          3HG2      ILE   4   0.788  -1.656  -3.533
   37   HD11  ILE   4          1HD1      ILE   4   0.280  -0.415   1.204
   38   HD12  ILE   4          2HD1      ILE   4   1.374  -0.007  -0.118
   39   HD13  ILE   4          3HD1      ILE   4  -0.355  -0.179  -0.424
   40    H    THR   5           H        THR   5  -2.057  -3.603   0.518
   41    HA   THR   5           HA       THR   5  -1.086  -6.178   0.719
   42    HB   THR   5           HB       THR   5  -3.729  -6.145   1.822
   43    HG1  THR   5           HG1      THR   5  -3.792  -3.946   1.783
   44   HG21  THR   5          1HG2      THR   5  -2.047  -5.729   3.917
   45   HG22  THR   5          2HG2      THR   5  -0.932  -6.359   2.704
   46   HG23  THR   5          3HG2      THR   5  -2.346  -7.301   3.177
   47    H    THR   6           H        THR   6  -3.774  -4.985  -1.147
   48    HA   THR   6           HA       THR   6  -5.027  -7.492  -1.623
   49    HB   THR   6           HB       THR   6  -5.701  -5.969  -3.808
   50    HG1  THR   6           HG1      THR   6  -5.489  -4.142  -1.646
   51   HG21  THR   6          1HG2      THR   6  -6.938  -5.828  -1.055
   52   HG22  THR   6          2HG2      THR   6  -7.232  -7.097  -2.243
   53   HG23  THR   6          3HG2      THR   6  -7.736  -5.441  -2.578
   54    H    ILE   7           H        ILE   7  -3.256  -8.866  -2.173
   55    HA   ILE   7           HA       ILE   7  -2.292  -8.482  -4.932
   56    HB   ILE   7           HB       ILE   7  -0.857  -9.883  -2.673
   57   HG12  ILE   7          2HG1      ILE   7   0.443  -7.613  -3.993
   58   HG13  ILE   7          3HG1      ILE   7  -1.037  -7.173  -3.147
   59   HG21  ILE   7          1HG2      ILE   7   0.014  -9.368  -5.514
   60   HG22  ILE   7          2HG2      ILE   7   0.994 -10.106  -4.249
   61   HG23  ILE   7          3HG2      ILE   7  -0.448 -10.931  -4.841
   62   HD11  ILE   7          1HD1      ILE   7   0.254  -8.772  -1.331
   63   HD12  ILE   7          2HD1      ILE   7   1.573  -7.885  -2.097
   64   HD13  ILE   7          3HD1      ILE   7   0.243  -7.009  -1.341
   65    H    HIS   8           H        HIS   8  -2.164 -11.237  -2.696
   66    HA   HIS   8           HA       HIS   8  -2.758 -13.138  -4.685
   67    HB2  HIS   8          2HB       HIS   8  -2.549 -13.161  -1.716
   68    HB3  HIS   8          3HB       HIS   8  -3.380 -14.512  -2.480
   69    HD1  HIS   8           HD1      HIS   8  -1.886 -16.399  -3.000
   70    HD2  HIS   8           HD2      HIS   8   0.142 -12.773  -3.070
   71    HE1  HIS   8           HE1      HIS   8   0.511 -16.978  -3.495
   72    H    ASN   9           H        ASN   9  -4.763 -11.002  -2.966
   73    HA   ASN   9           HA       ASN   9  -7.140 -12.486  -2.774
   74    HB2  ASN   9          2HB       ASN   9  -6.359  -9.662  -2.600
   75    HB3  ASN   9          3HB       ASN   9  -8.002  -9.909  -3.183
   76   HD21  ASN   9          1HD2      ASN   9  -6.018 -11.649  -0.818
   77   HD22  ASN   9          2HD2      ASN   9  -7.133 -11.486   0.492
   78    H    LEU  10           H        LEU  10  -6.705  -9.797  -5.056
   79    HA   LEU  10           HA       LEU  10  -8.710 -10.492  -6.809
   80    HB2  LEU  10          2HB       LEU  10  -6.098  -9.234  -7.623
   81    HB3  LEU  10          3HB       LEU  10  -7.659  -9.069  -8.426
   82    HG   LEU  10           HG       LEU  10  -7.611  -7.074  -7.350
   83   HD11  LEU  10          1HD1      LEU  10  -8.435  -8.564  -4.895
   84   HD12  LEU  10          2HD1      LEU  10  -9.418  -8.651  -6.356
   85   HD13  LEU  10          3HD1      LEU  10  -9.108  -7.091  -5.594
   86   HD21  LEU  10          1HD2      LEU  10  -5.407  -8.169  -6.065
   87   HD22  LEU  10          2HD2      LEU  10  -6.495  -7.706  -4.757
   88   HD23  LEU  10          3HD2      LEU  10  -5.983  -6.506  -5.945
   89    H    PHE  11           H        PHE  11  -5.256 -11.319  -7.094
   90    HA   PHE  11           HA       PHE  11  -6.024 -13.468  -8.957
   91    HB2  PHE  11          2HB       PHE  11  -3.438 -13.252  -9.510
   92    HB3  PHE  11          3HB       PHE  11  -4.629 -12.204 -10.273
   93    HD1  PHE  11           HD1      PHE  11  -4.852  -9.872  -9.590
   94    HD2  PHE  11           HD2      PHE  11  -1.862 -12.402  -7.923
   95    HE1  PHE  11           HE1      PHE  11  -3.660  -7.895  -8.736
   96    HE2  PHE  11           HE2      PHE  11  -0.666 -10.430  -7.066
   97    HZ   PHE  11           HZ       PHE  11  -1.565  -8.173  -7.471
   98    H    ARG  12           H        ARG  12  -5.903 -15.429  -8.110
   99    HA   ARG  12           HA       ARG  12  -3.902 -15.933  -6.005
  100    HB2  ARG  12          2HB       ARG  12  -6.729 -16.351  -6.015
  101    HB3  ARG  12          3HB       ARG  12  -5.934 -17.918  -5.937
  102    HG2  ARG  12          2HG       ARG  12  -4.544 -16.356  -4.116
  103    HG3  ARG  12          3HG       ARG  12  -6.234 -15.894  -3.900
  104    HD2  ARG  12          2HD       ARG  12  -6.120 -17.685  -2.481
  105    HD3  ARG  12          3HD       ARG  12  -6.608 -18.497  -3.968
  106    HE   ARG  12           HE       ARG  12  -4.570 -19.546  -4.029
  107   HH11  ARG  12          1HH1      ARG  12  -4.454 -16.931  -1.734
  108   HH12  ARG  12          2HH1      ARG  12  -2.905 -17.380  -1.103
  109   HH21  ARG  12          1HH2      ARG  12  -2.530 -20.148  -3.207
  110   HH22  ARG  12          2HH2      ARG  12  -1.810 -19.210  -1.942
  111    H    LYS  13           H        LYS  13  -5.317 -17.002  -8.994
  112    HA   LYS  13           HA       LYS  13  -3.777 -19.477  -8.995
  113    HB2  LYS  13          2HB       LYS  13  -4.970 -20.030 -11.018
  114    HB3  LYS  13          3HB       LYS  13  -6.122 -19.451  -9.822
  115    HG2  LYS  13          2HG       LYS  13  -5.561 -17.145 -11.096
  116    HG3  LYS  13          3HG       LYS  13  -5.339 -18.300 -12.413
  117    HD2  LYS  13          2HD       LYS  13  -7.697 -19.019 -11.006
  118    HD3  LYS  13          3HD       LYS  13  -7.764 -17.284 -11.326
  119    HE2  LYS  13          2HE       LYS  13  -7.003 -19.223 -13.481
  120    HE3  LYS  13          3HE       LYS  13  -8.696 -18.919 -13.095
  121    HZ1  LYS  13          1HZ       LYS  13  -8.550 -16.735 -13.784
  122    HZ2  LYS  13          2HZ       LYS  13  -7.565 -17.522 -14.912
  123    HZ3  LYS  13          3HZ       LYS  13  -6.867 -16.671 -13.627
  124    H    LEU  14           H        LEU  14  -3.866 -16.344 -10.585
  125    HA   LEU  14           HA       LEU  14  -1.590 -17.064 -12.268
  126    HB2  LEU  14          2HB       LEU  14  -1.942 -14.736 -13.182
  127    HB3  LEU  14          3HB       LEU  14  -3.236 -15.899 -13.467
  128    HG   LEU  14           HG       LEU  14  -3.790 -14.458 -11.060
  129   HD11  LEU  14          1HD1      LEU  14  -2.532 -12.611 -11.712
  130   HD12  LEU  14          2HD1      LEU  14  -4.157 -12.230 -12.281
  131   HD13  LEU  14          3HD1      LEU  14  -2.940 -12.813 -13.416
  132   HD21  LEU  14          1HD2      LEU  14  -5.664 -15.261 -12.055
  133   HD22  LEU  14          2HD2      LEU  14  -5.038 -15.021 -13.686
  134   HD23  LEU  14          3HD2      LEU  14  -5.670 -13.650 -12.773
  135    H    THR  15           H        THR  15  -1.512 -16.639  -9.282
  136    HA   THR  15           HA       THR  15  -0.164 -14.231  -8.709
  137    HB   THR  15           HB       THR  15   0.820 -16.002  -6.845
  138    HG1  THR  15           HG1      THR  15  -0.360 -17.744  -7.606
  139   HG21  THR  15          1HG2      THR  15  -1.477 -14.145  -7.028
  140   HG22  THR  15          2HG2      THR  15  -0.130 -14.174  -5.889
  141   HG23  THR  15          3HG2      THR  15  -1.488 -15.279  -5.678
  142    H    HIS  16           H        HIS  16   1.347 -17.444  -8.513
  143    HA   HIS  16           HA       HIS  16   3.948 -16.373  -8.987
  144    HB2  HIS  16          2HB       HIS  16   2.798 -19.084  -8.534
  145    HB3  HIS  16          3HB       HIS  16   4.390 -18.984  -9.281
  146    HD1  HIS  16           HD1      HIS  16   3.413 -19.880  -6.241
  147    HD2  HIS  16           HD2      HIS  16   5.625 -16.567  -7.422
  148    HE1  HIS  16           HE1      HIS  16   4.701 -19.169  -4.202
  149    H    ARG  17           H        ARG  17   1.418 -17.113 -11.040
  150    HA   ARG  17           HA       ARG  17   2.541 -18.349 -13.235
  151    HB2  ARG  17          2HB       ARG  17   0.275 -16.526 -12.775
  152    HB3  ARG  17          3HB       ARG  17   0.894 -16.527 -14.421
  153    HG2  ARG  17          2HG       ARG  17   0.132 -19.033 -12.946
  154    HG3  ARG  17          3HG       ARG  17  -0.984 -18.123 -13.965
  155    HD2  ARG  17          2HD       ARG  17   1.512 -18.604 -15.329
  156    HD3  ARG  17          3HD       ARG  17   0.800 -20.115 -14.765
  157    HE   ARG  17           HE       ARG  17  -0.134 -18.479 -16.899
  158   HH11  ARG  17          1HH1      ARG  17  -1.181 -20.619 -14.361
  159   HH12  ARG  17          2HH1      ARG  17  -2.634 -21.089 -15.178
  160   HH21  ARG  17          1HH2      ARG  17  -2.045 -19.090 -17.985
  161   HH22  ARG  17          2HH2      ARG  17  -3.124 -20.220 -17.240
  162    H    LEU  18           H        LEU  18   1.966 -14.842 -13.250
  163    HA   LEU  18           HA       LEU  18   4.582 -14.511 -14.567
  164    HB2  LEU  18          2HB       LEU  18   2.144 -12.800 -15.010
  165    HB3  LEU  18          3HB       LEU  18   3.668 -12.740 -15.894
  166    HG   LEU  18           HG       LEU  18   2.516 -15.362 -16.111
  167   HD11  LEU  18          1HD1      LEU  18   0.666 -13.074 -16.382
  168   HD12  LEU  18          2HD1      LEU  18   0.339 -14.764 -15.998
  169   HD13  LEU  18          3HD1      LEU  18   0.629 -14.280 -17.668
  170   HD21  LEU  18          1HD2      LEU  18   3.199 -13.139 -18.021
  171   HD22  LEU  18          2HD2      LEU  18   2.584 -14.706 -18.550
  172   HD23  LEU  18          3HD2      LEU  18   4.116 -14.607 -17.681
  173    H    PHE  19           H        PHE  19   2.271 -13.252 -12.262
  174    HA   PHE  19           HA       PHE  19   3.362 -10.793 -11.649
  175    HB2  PHE  19          2HB       PHE  19   1.391 -12.423 -10.570
  176    HB3  PHE  19          3HB       PHE  19   2.546 -12.240  -9.254
  177    HD1  PHE  19           HD1      PHE  19   3.034 -10.027  -8.329
  178    HD2  PHE  19           HD2      PHE  19   0.069 -10.588 -11.331
  179    HE1  PHE  19           HE1      PHE  19   2.098  -7.810  -7.814
  180    HE2  PHE  19           HE2      PHE  19  -0.871  -8.371 -10.822
  181    HZ   PHE  19           HZ       PHE  19   0.144  -6.979  -9.062
  182    H    ARG  20           H        ARG  20   4.530 -13.977 -10.857
  183    HA   ARG  20           HA       ARG  20   6.272 -13.343  -8.758
  184    HB2  ARG  20          2HB       ARG  20   5.792 -15.638  -9.211
  185    HB3  ARG  20          3HB       ARG  20   6.376 -15.500 -10.864
  186    HG2  ARG  20          2HG       ARG  20   8.620 -15.393 -10.175
  187    HG3  ARG  20          3HG       ARG  20   8.172 -15.088  -8.496
  188    HD2  ARG  20          2HD       ARG  20   7.560 -17.290  -8.125
  189    HD3  ARG  20          3HD       ARG  20   7.309 -17.614  -9.840
  190    HE   ARG  20           HE       ARG  20  10.039 -17.026  -9.179
  191   HH11  ARG  20          1HH1      ARG  20   7.616 -19.521  -9.338
  192   HH12  ARG  20          2HH1      ARG  20   8.765 -20.808  -9.496
  193   HH21  ARG  20          1HH2      ARG  20  11.561 -18.711  -9.387
  194   HH22  ARG  20          2HH2      ARG  20  11.009 -20.346  -9.523
  195    H    ARG  21           H        ARG  21   6.613 -13.037 -12.233
  196    HA   ARG  21           HA       ARG  21   9.276 -11.846 -11.816
  197    HB2  ARG  21          2HB       ARG  21   8.211 -13.289 -14.250
  198    HB3  ARG  21          3HB       ARG  21   9.771 -12.482 -14.162
  199    HG2  ARG  21          2HG       ARG  21  10.075 -14.077 -12.077
  200    HG3  ARG  21          3HG       ARG  21   8.883 -15.039 -12.953
  201    HD2  ARG  21          2HD       ARG  21  10.692 -15.880 -13.993
  202    HD3  ARG  21          3HD       ARG  21  10.583 -14.407 -14.956
  203    HE   ARG  21           HE       ARG  21  12.156 -14.057 -12.596
  204   HH11  ARG  21          1HH1      ARG  21  12.205 -15.249 -15.866
  205   HH12  ARG  21          2HH1      ARG  21  13.912 -15.026 -16.060
  206   HH21  ARG  21          1HH2      ARG  21  14.404 -13.759 -12.839
  207   HH22  ARG  21          2HH2      ARG  21  15.162 -14.180 -14.337
  208    H    ASN  22           H        ASN  22   6.531 -10.642 -11.764
  209    HA   ASN  22           HA       ASN  22   6.894  -8.696 -13.947
  210    HB2  ASN  22          2HB       ASN  22   4.575 -10.173 -13.108
  211    HB3  ASN  22          3HB       ASN  22   4.280  -8.449 -12.901
  212   HD21  ASN  22          1HD2      ASN  22   3.137  -7.775 -14.563
  213   HD22  ASN  22          2HD2      ASN  22   3.450  -8.132 -16.224
  214    H    PHE  23           H        PHE  23   6.790  -9.192 -10.573
  215    HA   PHE  23           HA       PHE  23   5.896  -6.807  -9.534
  216    HB2  PHE  23          2HB       PHE  23   7.248  -7.263  -7.592
  217    HB3  PHE  23          3HB       PHE  23   6.641  -8.794  -8.214
  218    HD1  PHE  23           HD1      PHE  23   8.182 -10.225  -9.605
  219    HD2  PHE  23           HD2      PHE  23   9.542  -6.882  -7.348
  220    HE1  PHE  23           HE1      PHE  23  10.481 -11.097  -9.704
  221    HE2  PHE  23           HE2      PHE  23  11.842  -7.748  -7.444
  222    HZ   PHE  23           HZ       PHE  23  12.315  -9.858  -8.624
  223    H    GLY  24           H        GLY  24   9.024  -7.529 -10.992
  224    HA2  GLY  24          2HA       GLY  24  10.461  -5.270 -10.290
  225    HA3  GLY  24          3HA       GLY  24  10.660  -6.138 -11.805
  226    H    TYR  25           H        TYR  25   7.828  -5.557 -12.548
  227    HA   TYR  25           HA       TYR  25   8.309  -2.829 -13.515
  228    HB2  TYR  25          2HB       TYR  25   6.919  -5.210 -14.606
  229    HB3  TYR  25          3HB       TYR  25   6.200  -3.648 -14.979
  230    HD1  TYR  25           HD1      TYR  25   6.817  -2.755 -17.005
  231    HD2  TYR  25           HD2      TYR  25   9.644  -5.116 -14.874
  232    HE1  TYR  25           HE1      TYR  25   8.445  -2.434 -18.820
  233    HE2  TYR  25           HE2      TYR  25  11.280  -4.801 -16.683
  234    HH   TYR  25           HH       TYR  25  11.336  -4.247 -19.038
  235    H    THR  26           H        THR  26   6.019  -4.817 -11.763
  236    HA   THR  26           HA       THR  26   4.096  -2.648 -11.546
  237    HB   THR  26           HB       THR  26   3.090  -4.492  -9.876
  238    HG1  THR  26           HG1      THR  26   4.029  -6.368 -10.102
  239   HG21  THR  26          1HG2      THR  26   2.262  -3.513 -12.142
  240   HG22  THR  26          2HG2      THR  26   1.607  -5.048 -11.571
  241   HG23  THR  26          3HG2      THR  26   2.860  -5.030 -12.812
  242    H    LEU  27           H        LEU  27   5.343  -4.829  -9.029
  243    HA   LEU  27           HA       LEU  27   4.959  -3.105  -6.898
  244    HB2  LEU  27          2HB       LEU  27   6.018  -5.650  -7.280
  245    HB3  LEU  27          3HB       LEU  27   7.323  -4.733  -6.531
  246    HG   LEU  27           HG       LEU  27   4.649  -4.542  -5.266
  247   HD11  LEU  27          1HD1      LEU  27   5.018  -6.973  -5.919
  248   HD12  LEU  27          2HD1      LEU  27   4.726  -6.637  -4.213
  249   HD13  LEU  27          3HD1      LEU  27   6.365  -6.958  -4.780
  250   HD21  LEU  27          1HD2      LEU  27   6.033  -4.595  -3.236
  251   HD22  LEU  27          2HD2      LEU  27   6.543  -3.331  -4.356
  252   HD23  LEU  27          3HD2      LEU  27   7.469  -4.828  -4.233
  253    H    ARG  28           H        ARG  28   7.530  -3.199  -9.235
  254    HA   ARG  28           HA       ARG  28   9.022  -1.167  -7.726
  255    HB2  ARG  28          2HB       ARG  28   9.817  -3.405  -9.332
  256    HB3  ARG  28          3HB       ARG  28  10.445  -1.929 -10.052
  257    HG2  ARG  28          2HG       ARG  28  11.321  -1.352  -7.741
  258    HG3  ARG  28          3HG       ARG  28  10.954  -3.022  -7.306
  259    HD2  ARG  28          2HD       ARG  28  12.324  -3.250  -9.695
  260    HD3  ARG  28          3HD       ARG  28  13.157  -1.939  -8.863
  261    HE   ARG  28           HE       ARG  28  13.207  -4.714  -8.182
  262   HH11  ARG  28          1HH1      ARG  28  13.427  -1.489  -6.889
  263   HH12  ARG  28          2HH1      ARG  28  14.364  -1.964  -5.512
  264   HH21  ARG  28          1HH2      ARG  28  14.440  -5.353  -6.372
  265   HH22  ARG  28          2HH2      ARG  28  14.941  -4.162  -5.219
  Start of MODEL   13
    1    H1   LYS   1           H        LYS   1  -4.665  -1.887   7.557
    2    HA   LYS   1           HA       LYS   1  -2.698  -0.417   6.998
    3    HB2  LYS   1          2HB       LYS   1  -2.680   0.285   9.477
    4    HB3  LYS   1          3HB       LYS   1  -1.775  -1.197   9.754
    5    HG2  LYS   1          2HG       LYS   1  -0.120   0.403   9.529
    6    HG3  LYS   1          3HG       LYS   1  -0.195  -0.321   7.921
    7    HD2  LYS   1          2HD       LYS   1  -1.944   1.612   7.510
    8    HD3  LYS   1          3HD       LYS   1  -1.069   2.374   8.840
    9    HE2  LYS   1          2HE       LYS   1   0.662   2.864   7.526
   10    HE3  LYS   1          3HE       LYS   1   0.738   1.218   6.900
   11    HZ1  LYS   1          1HZ       LYS   1  -1.500   2.582   5.828
   12    HZ2  LYS   1          2HZ       LYS   1  -0.193   1.878   5.017
   13    HZ3  LYS   1          3HZ       LYS   1  -0.093   3.480   5.553
   14    H    TYR   2           H        TYR   2  -3.644  -3.451   7.896
   15    HA   TYR   2           HA       TYR   2  -1.143  -4.647   6.895
   16    HB2  TYR   2          2HB       TYR   2  -1.484  -5.242   9.230
   17    HB3  TYR   2          3HB       TYR   2  -3.116  -5.798   8.878
   18    HD1  TYR   2           HD1      TYR   2  -3.322  -8.086   8.944
   19    HD2  TYR   2           HD2      TYR   2   0.279  -6.408   7.421
   20    HE1  TYR   2           HE1      TYR   2  -2.461 -10.348   8.505
   21    HE2  TYR   2           HE2      TYR   2   1.150  -8.665   6.977
   22    HH   TYR   2           HH       TYR   2  -0.163 -11.088   6.526
   23    H    GLU   3           H        GLU   3  -4.402  -5.951   7.438
   24    HA   GLU   3           HA       GLU   3  -4.380  -7.400   4.996
   25    HB2  GLU   3          2HB       GLU   3  -6.021  -7.245   7.327
   26    HB3  GLU   3          3HB       GLU   3  -7.053  -7.075   5.913
   27    HG2  GLU   3          2HG       GLU   3  -6.212  -9.153   5.008
   28    HG3  GLU   3          3HG       GLU   3  -5.090  -9.313   6.358
   29    H    ILE   4           H        ILE   4  -5.023  -4.164   5.712
   30    HA   ILE   4           HA       ILE   4  -7.064  -3.527   3.902
   31    HB   ILE   4           HB       ILE   4  -6.153  -1.225   3.942
   32   HG12  ILE   4          2HG1      ILE   4  -4.223  -1.024   5.745
   33   HG13  ILE   4          3HG1      ILE   4  -3.851  -2.655   5.200
   34   HG21  ILE   4          1HG2      ILE   4  -6.388  -2.658   6.581
   35   HG22  ILE   4          2HG2      ILE   4  -6.373  -0.903   6.410
   36   HG23  ILE   4          3HG2      ILE   4  -7.669  -1.849   5.679
   37   HD11  ILE   4          1HD1      ILE   4  -4.266  -0.792   3.008
   38   HD12  ILE   4          2HD1      ILE   4  -2.938  -0.336   4.075
   39   HD13  ILE   4          3HD1      ILE   4  -2.946  -1.923   3.307
   40    H    THR   5           H        THR   5  -3.732  -4.291   3.403
   41    HA   THR   5           HA       THR   5  -3.383  -3.045   0.880
   42    HB   THR   5           HB       THR   5  -1.884  -5.544   1.412
   43    HG1  THR   5           HG1      THR   5  -1.664  -4.947   3.458
   44   HG21  THR   5          1HG2      THR   5  -1.547  -3.522  -0.309
   45   HG22  THR   5          2HG2      THR   5  -0.199  -4.465   0.327
   46   HG23  THR   5          3HG2      THR   5  -0.595  -2.902   1.039
   47    H    THR   6           H        THR   6  -4.859  -6.017   1.895
   48    HA   THR   6           HA       THR   6  -4.811  -7.281  -0.677
   49    HB   THR   6           HB       THR   6  -6.864  -8.062   1.330
   50    HG1  THR   6           HG1      THR   6  -4.141  -8.755   1.727
   51   HG21  THR   6          1HG2      THR   6  -6.852  -9.686  -0.240
   52   HG22  THR   6          2HG2      THR   6  -5.463 -10.285   0.667
   53   HG23  THR   6          3HG2      THR   6  -5.217  -9.299  -0.775
   54    H    ILE   7           H        ILE   7  -5.869  -6.360  -2.320
   55    HA   ILE   7           HA       ILE   7  -8.636  -5.459  -1.846
   56    HB   ILE   7           HB       ILE   7  -8.006  -4.154  -4.120
   57   HG12  ILE   7          2HG1      ILE   7  -5.508  -3.750  -2.521
   58   HG13  ILE   7          3HG1      ILE   7  -5.590  -5.095  -3.654
   59   HG21  ILE   7          1HG2      ILE   7  -7.343  -2.239  -2.411
   60   HG22  ILE   7          2HG2      ILE   7  -8.992  -2.850  -2.535
   61   HG23  ILE   7          3HG2      ILE   7  -7.934  -3.422  -1.245
   62   HD11  ILE   7          1HD1      ILE   7  -6.406  -2.449  -4.676
   63   HD12  ILE   7          2HD1      ILE   7  -4.694  -2.682  -4.323
   64   HD13  ILE   7          3HD1      ILE   7  -5.512  -3.749  -5.463
   65    H    HIS   8           H        HIS   8  -6.959  -5.772  -4.923
   66    HA   HIS   8           HA       HIS   8  -8.782  -7.978  -5.629
   67    HB2  HIS   8          2HB       HIS   8  -8.212  -5.427  -7.000
   68    HB3  HIS   8          3HB       HIS   8  -8.231  -6.848  -8.041
   69    HD1  HIS   8           HD1      HIS   8 -10.528  -6.556  -5.090
   70    HD2  HIS   8           HD2      HIS   8 -10.659  -6.188  -9.226
   71    HE1  HIS   8           HE1      HIS   8 -12.970  -6.428  -5.677
   72    H    ASN   9           H        ASN   9  -5.746  -7.468  -4.853
   73    HA   ASN   9           HA       ASN   9  -4.334  -8.603  -7.077
   74    HB2  ASN   9          2HB       ASN   9  -2.429  -8.724  -5.458
   75    HB3  ASN   9          3HB       ASN   9  -3.137  -7.118  -5.605
   76   HD21  ASN   9          1HD2      ASN   9  -2.288  -9.622  -3.512
   77   HD22  ASN   9          2HD2      ASN   9  -3.003  -8.993  -2.071
   78    H    LEU  10           H        LEU  10  -6.258 -10.343  -6.843
   79    HA   LEU  10           HA       LEU  10  -5.106 -12.629  -5.382
   80    HB2  LEU  10          2HB       LEU  10  -7.312 -13.524  -5.108
   81    HB3  LEU  10          3HB       LEU  10  -7.281 -11.871  -4.497
   82    HG   LEU  10           HG       LEU  10  -8.128 -11.752  -7.194
   83   HD11  LEU  10          1HD1      LEU  10  -8.626 -14.207  -6.791
   84   HD12  LEU  10          2HD1      LEU  10  -9.973 -13.203  -7.328
   85   HD13  LEU  10          3HD1      LEU  10  -9.838 -13.664  -5.631
   86   HD21  LEU  10          1HD2      LEU  10  -8.671 -10.374  -5.065
   87   HD22  LEU  10          2HD2      LEU  10  -9.964 -11.552  -4.841
   88   HD23  LEU  10          3HD2      LEU  10  -9.908 -10.571  -6.306
   89    H    PHE  11           H        PHE  11  -6.207 -11.378  -8.393
   90    HA   PHE  11           HA       PHE  11  -6.810 -13.631  -9.860
   91    HB2  PHE  11          2HB       PHE  11  -5.773 -12.315 -11.817
   92    HB3  PHE  11          3HB       PHE  11  -7.118 -11.577 -10.953
   93    HD1  PHE  11           HD1      PHE  11  -6.862  -9.535  -9.799
   94    HD2  PHE  11           HD2      PHE  11  -3.454 -11.540 -11.375
   95    HE1  PHE  11           HE1      PHE  11  -5.492  -7.536  -9.372
   96    HE2  PHE  11           HE2      PHE  11  -2.079  -9.545 -10.950
   97    HZ   PHE  11           HZ       PHE  11  -3.097  -7.539  -9.946
   98    H    ARG  12           H        ARG  12  -3.700 -12.492  -8.766
   99    HA   ARG  12           HA       ARG  12  -2.420 -14.780 -10.111
  100    HB2  ARG  12          2HB       ARG  12  -0.328 -13.524 -10.051
  101    HB3  ARG  12          3HB       ARG  12  -1.575 -12.613 -10.893
  102    HG2  ARG  12          2HG       ARG  12  -1.187 -10.893  -9.561
  103    HG3  ARG  12          3HG       ARG  12  -1.702 -11.862  -8.179
  104    HD2  ARG  12          2HD       ARG  12   0.405 -11.378  -7.484
  105    HD3  ARG  12          3HD       ARG  12   0.768 -12.817  -8.436
  106    HE   ARG  12           HE       ARG  12   0.989 -10.773 -10.218
  107   HH11  ARG  12          1HH1      ARG  12   2.399 -11.464  -7.111
  108   HH12  ARG  12          2HH1      ARG  12   3.877 -10.626  -7.449
  109   HH21  ARG  12          1HH2      ARG  12   2.930  -9.666 -10.675
  110   HH22  ARG  12          2HH2      ARG  12   4.178  -9.603  -9.477
  111    H    LYS  13           H        LYS  13  -3.745 -15.212  -7.732
  112    HA   LYS  13           HA       LYS  13  -2.361 -14.909  -5.364
  113    HB2  LYS  13          2HB       LYS  13  -4.570 -15.794  -5.299
  114    HB3  LYS  13          3HB       LYS  13  -4.133 -17.147  -6.334
  115    HG2  LYS  13          2HG       LYS  13  -4.423 -17.804  -3.988
  116    HG3  LYS  13          3HG       LYS  13  -2.788 -18.111  -4.578
  117    HD2  LYS  13          2HD       LYS  13  -2.922 -15.471  -3.481
  118    HD3  LYS  13          3HD       LYS  13  -3.570 -16.624  -2.312
  119    HE2  LYS  13          2HE       LYS  13  -1.095 -17.458  -3.666
  120    HE3  LYS  13          3HE       LYS  13  -0.937 -16.056  -2.609
  121    HZ1  LYS  13          1HZ       LYS  13  -1.067 -18.748  -1.887
  122    HZ2  LYS  13          2HZ       LYS  13  -2.468 -18.006  -1.297
  123    HZ3  LYS  13          3HZ       LYS  13  -0.947 -17.402  -0.870
  124    H    LEU  14           H        LEU  14  -2.431 -18.065  -6.994
  125    HA   LEU  14           HA       LEU  14   0.434 -18.351  -6.366
  126    HB2  LEU  14          2HB       LEU  14   0.107 -20.655  -5.896
  127    HB3  LEU  14          3HB       LEU  14  -1.090 -19.749  -4.973
  128    HG   LEU  14           HG       LEU  14  -2.203 -20.563  -7.495
  129   HD11  LEU  14          1HD1      LEU  14  -1.956 -22.842  -7.524
  130   HD12  LEU  14          2HD1      LEU  14  -1.512 -22.928  -5.820
  131   HD13  LEU  14          3HD1      LEU  14  -0.346 -22.342  -7.006
  132   HD21  LEU  14          1HD2      LEU  14  -2.817 -21.256  -4.624
  133   HD22  LEU  14          2HD2      LEU  14  -3.860 -21.618  -6.000
  134   HD23  LEU  14          3HD2      LEU  14  -3.520 -19.942  -5.566
  135    H    THR  15           H        THR  15  -1.707 -17.981  -8.814
  136    HA   THR  15           HA       THR  15  -0.546 -19.884 -10.669
  137    HB   THR  15           HB       THR  15  -2.152 -19.184 -12.244
  138    HG1  THR  15           HG1      THR  15  -1.898 -16.945 -12.119
  139   HG21  THR  15          1HG2      THR  15  -4.016 -19.860 -11.169
  140   HG22  THR  15          2HG2      THR  15  -3.895 -18.591  -9.951
  141   HG23  THR  15          3HG2      THR  15  -2.934 -20.061  -9.792
  142    H    HIS  16           H        HIS  16   0.208 -16.811  -9.535
  143    HA   HIS  16           HA       HIS  16   1.047 -15.289 -11.614
  144    HB2  HIS  16          2HB       HIS  16   3.098 -14.767 -10.056
  145    HB3  HIS  16          3HB       HIS  16   1.469 -14.314  -9.562
  146    HD1  HIS  16           HD1      HIS  16   2.969 -17.777  -9.280
  147    HD2  HIS  16           HD2      HIS  16   1.727 -14.638  -6.857
  148    HE1  HIS  16           HE1      HIS  16   3.079 -18.659  -6.927
  149    H    ARG  17           H        ARG  17   1.874 -16.146 -13.438
  150    HA   ARG  17           HA       ARG  17   4.359 -17.711 -13.186
  151    HB2  ARG  17          2HB       ARG  17   1.920 -18.231 -14.686
  152    HB3  ARG  17          3HB       ARG  17   3.344 -18.241 -15.719
  153    HG2  ARG  17          2HG       ARG  17   3.995 -20.218 -14.949
  154    HG3  ARG  17          3HG       ARG  17   3.793 -19.712 -13.270
  155    HD2  ARG  17          2HD       ARG  17   1.575 -20.400 -13.200
  156    HD3  ARG  17          3HD       ARG  17   1.409 -20.371 -14.955
  157    HE   ARG  17           HE       ARG  17   3.253 -22.309 -14.531
  158   HH11  ARG  17          1HH1      ARG  17   0.064 -21.707 -13.270
  159   HH12  ARG  17          2HH1      ARG  17  -0.302 -23.384 -13.037
  160   HH21  ARG  17          1HH2      ARG  17   2.782 -24.520 -14.229
  161   HH22  ARG  17          2HH2      ARG  17   1.245 -24.983 -13.582
  162    H    LEU  18           H        LEU  18   2.644 -15.170 -14.878
  163    HA   LEU  18           HA       LEU  18   5.175 -14.396 -16.174
  164    HB2  LEU  18          2HB       LEU  18   2.360 -14.360 -17.162
  165    HB3  LEU  18          3HB       LEU  18   3.500 -13.156 -17.760
  166    HG   LEU  18           HG       LEU  18   4.707 -15.728 -17.980
  167   HD11  LEU  18          1HD1      LEU  18   1.961 -15.544 -19.209
  168   HD12  LEU  18          2HD1      LEU  18   2.453 -16.647 -17.925
  169   HD13  LEU  18          3HD1      LEU  18   3.157 -16.798 -19.535
  170   HD21  LEU  18          1HD2      LEU  18   5.096 -13.618 -19.301
  171   HD22  LEU  18          2HD2      LEU  18   3.607 -13.985 -20.173
  172   HD23  LEU  18          3HD2      LEU  18   4.972 -15.100 -20.249
  173    H    PHE  19           H        PHE  19   2.323 -13.351 -14.436
  174    HA   PHE  19           HA       PHE  19   2.783 -10.569 -14.573
  175    HB2  PHE  19          2HB       PHE  19   1.037 -12.384 -13.065
  176    HB3  PHE  19          3HB       PHE  19   1.471 -10.921 -12.185
  177    HD1  PHE  19           HD1      PHE  19  -0.213  -9.374 -12.266
  178    HD2  PHE  19           HD2      PHE  19   0.651 -11.657 -15.753
  179    HE1  PHE  19           HE1      PHE  19  -1.926  -8.119 -13.508
  180    HE2  PHE  19           HE2      PHE  19  -1.061 -10.406 -17.001
  181    HZ   PHE  19           HZ       PHE  19  -2.351  -8.633 -15.879
  182    H    ARG  20           H        ARG  20   4.154 -13.091 -12.632
  183    HA   ARG  20           HA       ARG  20   5.310 -11.235 -10.719
  184    HB2  ARG  20          2HB       ARG  20   6.273 -13.257  -9.685
  185    HB3  ARG  20          3HB       ARG  20   4.530 -13.381  -9.889
  186    HG2  ARG  20          2HG       ARG  20   4.903 -15.356 -10.826
  187    HG3  ARG  20          3HG       ARG  20   5.544 -14.475 -12.215
  188    HD2  ARG  20          2HD       ARG  20   7.711 -14.904 -11.660
  189    HD3  ARG  20          3HD       ARG  20   7.374 -14.936  -9.930
  190    HE   ARG  20           HE       ARG  20   7.342 -17.161 -11.738
  191   HH11  ARG  20          1HH1      ARG  20   6.071 -15.900  -8.753
  192   HH12  ARG  20          2HH1      ARG  20   5.733 -17.463  -8.085
  193   HH21  ARG  20          1HH2      ARG  20   6.903 -19.224 -10.870
  194   HH22  ARG  20          2HH2      ARG  20   6.208 -19.353  -9.290
  195    H    ARG  21           H        ARG  21   6.227 -13.030 -13.563
  196    HA   ARG  21           HA       ARG  21   9.051 -12.679 -13.216
  197    HB2  ARG  21          2HB       ARG  21   8.180 -14.554 -14.515
  198    HB3  ARG  21          3HB       ARG  21   7.438 -13.441 -15.656
  199    HG2  ARG  21          2HG       ARG  21   9.382 -13.018 -16.720
  200    HG3  ARG  21          3HG       ARG  21  10.342 -13.139 -15.245
  201    HD2  ARG  21          2HD       ARG  21  11.003 -14.997 -16.483
  202    HD3  ARG  21          3HD       ARG  21   9.818 -15.651 -15.353
  203    HE   ARG  21           HE       ARG  21   8.336 -15.057 -17.540
  204   HH11  ARG  21          1HH1      ARG  21  11.248 -16.897 -17.040
  205   HH12  ARG  21          2HH1      ARG  21  10.939 -17.988 -18.351
  206   HH21  ARG  21          1HH2      ARG  21   7.918 -16.486 -19.268
  207   HH22  ARG  21          2HH2      ARG  21   9.045 -17.752 -19.618
  208    H    ASN  22           H        ASN  22   6.466 -10.925 -14.786
  209    HA   ASN  22           HA       ASN  22   8.267  -9.142 -16.178
  210    HB2  ASN  22          2HB       ASN  22   5.455  -9.775 -16.273
  211    HB3  ASN  22          3HB       ASN  22   5.678  -8.032 -16.153
  212   HD21  ASN  22          1HD2      ASN  22   4.767  -9.788 -18.364
  213   HD22  ASN  22          2HD2      ASN  22   5.784  -9.389 -19.703
  214    H    PHE  23           H        PHE  23   6.372  -9.164 -13.236
  215    HA   PHE  23           HA       PHE  23   6.388  -6.446 -12.621
  216    HB2  PHE  23          2HB       PHE  23   5.898  -8.940 -11.207
  217    HB3  PHE  23          3HB       PHE  23   6.657  -7.737 -10.169
  218    HD1  PHE  23           HD1      PHE  23   5.004  -6.937  -8.773
  219    HD2  PHE  23           HD2      PHE  23   4.194  -7.345 -12.932
  220    HE1  PHE  23           HE1      PHE  23   2.825  -5.840  -8.453
  221    HE2  PHE  23           HE2      PHE  23   2.014  -6.248 -12.618
  222    HZ   PHE  23           HZ       PHE  23   1.327  -5.493 -10.377
  223    H    GLY  24           H        GLY  24   8.927  -8.804 -12.488
  224    HA2  GLY  24          2HA       GLY  24  10.668  -7.705 -10.632
  225    HA3  GLY  24          3HA       GLY  24  11.173  -8.590 -12.064
  226    H    TYR  25           H        TYR  25   9.873  -6.567 -13.825
  227    HA   TYR  25           HA       TYR  25  12.147  -4.832 -14.060
  228    HB2  TYR  25          2HB       TYR  25   9.669  -5.341 -15.639
  229    HB3  TYR  25          3HB       TYR  25  10.512  -3.817 -15.894
  230    HD1  TYR  25           HD1      TYR  25  11.902  -7.204 -15.201
  231    HD2  TYR  25           HD2      TYR  25  11.502  -4.018 -17.992
  232    HE1  TYR  25           HE1      TYR  25  13.480  -8.337 -16.711
  233    HE2  TYR  25           HE2      TYR  25  13.077  -5.142 -19.510
  234    HH   TYR  25           HH       TYR  25  13.799  -7.697 -19.852
  235    H    THR  26           H        THR  26   8.920  -4.594 -12.781
  236    HA   THR  26           HA       THR  26   9.039  -1.701 -12.555
  237    HB   THR  26           HB       THR  26   6.850  -2.325 -11.121
  238    HG1  THR  26           HG1      THR  26   7.334  -4.625 -11.540
  239   HG21  THR  26          1HG2      THR  26   6.792  -2.450 -14.129
  240   HG22  THR  26          2HG2      THR  26   7.102  -0.954 -13.247
  241   HG23  THR  26          3HG2      THR  26   5.569  -1.800 -13.038
  242    H    LEU  27           H        LEU  27   9.447  -4.536 -10.548
  243    HA   LEU  27           HA       LEU  27   9.920  -2.804  -8.216
  244    HB2  LEU  27          2HB       LEU  27   9.032  -5.650  -8.490
  245    HB3  LEU  27          3HB       LEU  27   9.781  -5.084  -6.998
  246    HG   LEU  27           HG       LEU  27   7.313  -3.832  -8.190
  247   HD11  LEU  27          1HD1      LEU  27   5.978  -5.329  -7.188
  248   HD12  LEU  27          2HD1      LEU  27   7.037  -5.490  -5.787
  249   HD13  LEU  27          3HD1      LEU  27   7.391  -6.383  -7.265
  250   HD21  LEU  27          1HD2      LEU  27   7.069  -3.074  -5.789
  251   HD22  LEU  27          2HD2      LEU  27   8.377  -2.330  -6.710
  252   HD23  LEU  27          3HD2      LEU  27   8.732  -3.609  -5.547
  253    H    ARG  28           H        ARG  28  11.808  -3.350 -10.414
  254    HA   ARG  28           HA       ARG  28  13.756  -5.219  -9.776
  255    HB2  ARG  28          2HB       ARG  28  15.295  -3.850 -11.099
  256    HB3  ARG  28          3HB       ARG  28  13.728  -3.978 -11.886
  257    HG2  ARG  28          2HG       ARG  28  13.135  -1.760 -11.212
  258    HG3  ARG  28          3HG       ARG  28  14.586  -1.627 -10.217
  259    HD2  ARG  28          2HD       ARG  28  15.465  -2.330 -12.788
  260    HD3  ARG  28          3HD       ARG  28  14.237  -1.086 -13.017
  261    HE   ARG  28           HE       ARG  28  15.817  -0.092 -11.040
  262   HH11  ARG  28          1HH1      ARG  28  16.404  -1.294 -14.254
  263   HH12  ARG  28          2HH1      ARG  28  17.777  -0.273 -14.526
  264   HH21  ARG  28          1HH2      ARG  28  17.624   1.257 -11.386
  265   HH22  ARG  28          2HH2      ARG  28  18.470   1.177 -12.894
  Start of MODEL   14
    1    H1   LYS   1           H        LYS   1  -3.723   2.062   7.937
    2    HA   LYS   1           HA       LYS   1  -3.721  -0.104   9.155
    3    HB2  LYS   1          2HB       LYS   1  -4.511   2.118  10.205
    4    HB3  LYS   1          3HB       LYS   1  -6.136   1.473  10.009
    5    HG2  LYS   1          2HG       LYS   1  -5.206  -0.585  11.276
    6    HG3  LYS   1          3HG       LYS   1  -3.926   0.522  11.779
    7    HD2  LYS   1          2HD       LYS   1  -5.824   2.093  12.485
    8    HD3  LYS   1          3HD       LYS   1  -6.875   0.683  12.331
    9    HE2  LYS   1          2HE       LYS   1  -5.628  -0.507  13.990
   10    HE3  LYS   1          3HE       LYS   1  -4.386   0.743  14.028
   11    HZ1  LYS   1          1HZ       LYS   1  -5.940   0.870  15.909
   12    HZ2  LYS   1          2HZ       LYS   1  -7.214   1.154  14.833
   13    HZ3  LYS   1          3HZ       LYS   1  -5.955   2.276  14.968
   14    H    TYR   2           H        TYR   2  -5.964   0.297   6.760
   15    HA   TYR   2           HA       TYR   2  -7.441  -2.114   7.592
   16    HB2  TYR   2          2HB       TYR   2  -8.930  -0.187   7.547
   17    HB3  TYR   2          3HB       TYR   2  -8.419   0.202   5.908
   18    HD1  TYR   2           HD1      TYR   2  -9.742  -2.786   7.737
   19    HD2  TYR   2           HD2      TYR   2  -9.917  -0.349   4.254
   20    HE1  TYR   2           HE1      TYR   2 -11.548  -4.199   6.846
   21    HE2  TYR   2           HE2      TYR   2 -11.724  -1.754   3.354
   22    HH   TYR   2           HH       TYR   2 -12.387  -4.678   4.227
   23    H    GLU   3           H        GLU   3  -7.191  -0.358   4.513
   24    HA   GLU   3           HA       GLU   3  -6.954  -2.783   3.027
   25    HB2  GLU   3          2HB       GLU   3  -7.440  -0.023   2.470
   26    HB3  GLU   3          3HB       GLU   3  -6.120  -0.573   1.446
   27    HG2  GLU   3          2HG       GLU   3  -7.483  -1.749   0.148
   28    HG3  GLU   3          3HG       GLU   3  -8.309  -2.471   1.527
   29    H    ILE   4           H        ILE   4  -4.746  -1.011   4.796
   30    HA   ILE   4           HA       ILE   4  -2.430  -1.083   3.220
   31    HB   ILE   4           HB       ILE   4  -1.177  -0.983   5.353
   32   HG12  ILE   4          2HG1      ILE   4  -2.840  -0.634   7.387
   33   HG13  ILE   4          3HG1      ILE   4  -3.871  -1.694   6.432
   34   HG21  ILE   4          1HG2      ILE   4  -3.482   0.833   4.807
   35   HG22  ILE   4          2HG2      ILE   4  -2.471   1.104   6.225
   36   HG23  ILE   4          3HG2      ILE   4  -1.754   1.123   4.614
   37   HD11  ILE   4          1HD1      ILE   4  -2.695  -3.491   6.991
   38   HD12  ILE   4          2HD1      ILE   4  -1.158  -2.692   6.658
   39   HD13  ILE   4          3HD1      ILE   4  -1.943  -2.477   8.222
   40    H    THR   5           H        THR   5  -4.094  -3.573   4.958
   41    HA   THR   5           HA       THR   5  -1.878  -5.407   5.018
   42    HB   THR   5           HB       THR   5  -4.441  -6.719   5.243
   43    HG1  THR   5           HG1      THR   5  -5.417  -4.931   5.985
   44   HG21  THR   5          1HG2      THR   5  -3.574  -7.285   7.471
   45   HG22  THR   5          2HG2      THR   5  -2.267  -6.120   7.254
   46   HG23  THR   5          3HG2      THR   5  -2.360  -7.545   6.219
   47    H    THR   6           H        THR   6  -4.486  -4.654   2.843
   48    HA   THR   6           HA       THR   6  -3.820  -6.987   1.182
   49    HB   THR   6           HB       THR   6  -6.144  -5.203   0.578
   50    HG1  THR   6           HG1      THR   6  -6.006  -7.148   2.651
   51   HG21  THR   6          1HG2      THR   6  -6.613  -8.032   0.436
   52   HG22  THR   6          2HG2      THR   6  -5.123  -7.629  -0.416
   53   HG23  THR   6          3HG2      THR   6  -6.634  -6.835  -0.858
   54    H    ILE   7           H        ILE   7  -1.941  -4.989   1.158
   55    HA   ILE   7           HA       ILE   7  -2.143  -2.907  -0.607
   56    HB   ILE   7           HB       ILE   7   0.343  -3.690  -1.224
   57   HG12  ILE   7          2HG1      ILE   7   0.156  -4.837   1.521
   58   HG13  ILE   7          3HG1      ILE   7  -0.332  -5.855   0.170
   59   HG21  ILE   7          1HG2      ILE   7   1.097  -2.451   0.768
   60   HG22  ILE   7          2HG2      ILE   7  -0.227  -1.643  -0.069
   61   HG23  ILE   7          3HG2      ILE   7  -0.540  -2.538   1.418
   62   HD11  ILE   7          1HD1      ILE   7   1.775  -6.140  -0.536
   63   HD12  ILE   7          2HD1      ILE   7   2.240  -4.481  -0.160
   64   HD13  ILE   7          3HD1      ILE   7   2.179  -5.691   1.121
   65    H    HIS   8           H        HIS   8  -0.271  -5.649  -1.767
   66    HA   HIS   8           HA       HIS   8  -1.851  -5.607  -4.255
   67    HB2  HIS   8          2HB       HIS   8   1.048  -5.360  -3.811
   68    HB3  HIS   8          3HB       HIS   8   0.598  -6.517  -5.061
   69    HD1  HIS   8           HD1      HIS   8  -0.513  -5.579  -7.200
   70    HD2  HIS   8           HD2      HIS   8   0.561  -2.676  -4.429
   71    HE1  HIS   8           HE1      HIS   8  -0.678  -3.389  -8.424
   72    H    ASN   9           H        ASN   9  -1.360  -7.374  -1.631
   73    HA   ASN   9           HA       ASN   9  -0.743  -9.941  -2.755
   74    HB2  ASN   9          2HB       ASN   9  -1.802  -9.092  -0.055
   75    HB3  ASN   9          3HB       ASN   9  -1.471 -10.769  -0.477
   76   HD21  ASN   9          1HD2      ASN   9   0.459 -11.502   0.019
   77   HD22  ASN   9          2HD2      ASN   9   1.874 -10.546   0.284
   78    H    LEU  10           H        LEU  10  -2.618  -9.210  -4.393
   79    HA   LEU  10           HA       LEU  10  -5.069 -10.568  -3.480
   80    HB2  LEU  10          2HB       LEU  10  -6.375  -9.157  -4.868
   81    HB3  LEU  10          3HB       LEU  10  -5.312  -8.123  -3.915
   82    HG   LEU  10           HG       LEU  10  -4.609  -8.902  -6.727
   83   HD11  LEU  10          1HD1      LEU  10  -6.196  -6.465  -5.943
   84   HD12  LEU  10          2HD1      LEU  10  -6.894  -7.907  -6.680
   85   HD13  LEU  10          3HD1      LEU  10  -5.705  -6.952  -7.566
   86   HD21  LEU  10          1HD2      LEU  10  -3.766  -6.338  -6.207
   87   HD22  LEU  10          2HD2      LEU  10  -2.775  -7.793  -6.101
   88   HD23  LEU  10          3HD2      LEU  10  -3.553  -7.148  -4.655
   89    H    PHE  11           H        PHE  11  -2.521 -11.444  -4.935
   90    HA   PHE  11           HA       PHE  11  -3.249 -12.128  -7.585
   91    HB2  PHE  11          2HB       PHE  11  -1.260 -13.642  -5.900
   92    HB3  PHE  11          3HB       PHE  11  -1.260 -13.417  -7.646
   93    HD1  PHE  11           HD1      PHE  11  -0.257 -12.068  -4.456
   94    HD2  PHE  11           HD2      PHE  11  -0.700 -11.192  -8.597
   95    HE1  PHE  11           HE1      PHE  11   1.225 -10.121  -4.199
   96    HE2  PHE  11           HE2      PHE  11   0.782  -9.244  -8.347
   97    HZ   PHE  11           HZ       PHE  11   1.747  -8.706  -6.146
   98    H    ARG  12           H        ARG  12  -5.312 -13.054  -7.503
   99    HA   ARG  12           HA       ARG  12  -5.916 -15.322  -5.886
  100    HB2  ARG  12          2HB       ARG  12  -8.009 -15.382  -7.017
  101    HB3  ARG  12          3HB       ARG  12  -7.591 -13.685  -6.823
  102    HG2  ARG  12          2HG       ARG  12  -6.630 -13.863  -9.199
  103    HG3  ARG  12          3HG       ARG  12  -7.568 -15.354  -9.305
  104    HD2  ARG  12          2HD       ARG  12  -9.565 -14.260  -9.293
  105    HD3  ARG  12          3HD       ARG  12  -8.959 -12.941  -8.292
  106    HE   ARG  12           HE       ARG  12  -7.772 -12.902 -10.871
  107   HH11  ARG  12          1HH1      ARG  12 -10.706 -12.138  -9.161
  108   HH12  ARG  12          2HH1      ARG  12 -11.189 -10.903 -10.276
  109   HH21  ARG  12          1HH2      ARG  12  -8.396 -11.278 -12.347
  110   HH22  ARG  12          2HH2      ARG  12  -9.875 -10.415 -12.088
  111    H    LYS  13           H        LYS  13  -4.495 -14.868  -9.015
  112    HA   LYS  13           HA       LYS  13  -4.949 -17.514  -9.987
  113    HB2  LYS  13          2HB       LYS  13  -3.608 -15.094 -10.899
  114    HB3  LYS  13          3HB       LYS  13  -2.707 -16.548 -11.311
  115    HG2  LYS  13          2HG       LYS  13  -4.063 -16.905 -13.018
  116    HG3  LYS  13          3HG       LYS  13  -5.433 -17.025 -11.912
  117    HD2  LYS  13          2HD       LYS  13  -5.656 -14.561 -11.986
  118    HD3  LYS  13          3HD       LYS  13  -4.352 -14.506 -13.175
  119    HE2  LYS  13          2HE       LYS  13  -5.993 -16.325 -14.317
  120    HE3  LYS  13          3HE       LYS  13  -7.169 -15.315 -13.478
  121    HZ1  LYS  13          1HZ       LYS  13  -6.856 -14.438 -15.650
  122    HZ2  LYS  13          2HZ       LYS  13  -5.173 -14.442 -15.491
  123    HZ3  LYS  13          3HZ       LYS  13  -6.107 -13.371 -14.572
  124    H    LEU  14           H        LEU  14  -3.993 -19.309  -9.316
  125    HA   LEU  14           HA       LEU  14  -1.561 -19.136  -7.718
  126    HB2  LEU  14          2HB       LEU  14  -1.985 -21.500  -7.216
  127    HB3  LEU  14          3HB       LEU  14  -3.358 -20.467  -6.823
  128    HG   LEU  14           HG       LEU  14  -3.669 -21.520  -9.473
  129   HD11  LEU  14          1HD1      LEU  14  -3.575 -23.691  -7.416
  130   HD12  LEU  14          2HD1      LEU  14  -2.146 -23.284  -8.365
  131   HD13  LEU  14          3HD1      LEU  14  -3.619 -23.818  -9.175
  132   HD21  LEU  14          1HD2      LEU  14  -5.240 -22.200  -7.002
  133   HD22  LEU  14          2HD2      LEU  14  -5.800 -22.134  -8.673
  134   HD23  LEU  14          3HD2      LEU  14  -5.383 -20.646  -7.822
  135    H    THR  15           H        THR  15  -1.852 -18.940 -10.787
  136    HA   THR  15           HA       THR  15   0.212 -20.949 -11.419
  137    HB   THR  15           HB       THR  15  -0.568 -20.886 -13.760
  138    HG1  THR  15           HG1      THR  15  -1.755 -18.708 -13.100
  139   HG21  THR  15          1HG2      THR  15  -2.085 -22.520 -13.397
  140   HG22  THR  15          2HG2      THR  15  -3.082 -21.503 -12.356
  141   HG23  THR  15          3HG2      THR  15  -1.645 -22.290 -11.705
  142    H    HIS  16           H        HIS  16   1.634 -19.181 -10.572
  143    HA   HIS  16           HA       HIS  16   1.934 -16.833 -12.223
  144    HB2  HIS  16          2HB       HIS  16   3.921 -17.746 -10.160
  145    HB3  HIS  16          3HB       HIS  16   3.534 -16.104 -10.666
  146    HD1  HIS  16           HD1      HIS  16   1.418 -15.014  -9.637
  147    HD2  HIS  16           HD2      HIS  16   2.259 -18.817  -8.191
  148    HE1  HIS  16           HE1      HIS  16  -0.021 -15.290  -7.593
  149    H    ARG  17           H        ARG  17   2.160 -18.803 -13.960
  150    HA   ARG  17           HA       ARG  17   4.680 -19.988 -14.301
  151    HB2  ARG  17          2HB       ARG  17   2.237 -19.696 -15.836
  152    HB3  ARG  17          3HB       ARG  17   3.656 -19.579 -16.869
  153    HG2  ARG  17          2HG       ARG  17   3.610 -21.801 -16.922
  154    HG3  ARG  17          3HG       ARG  17   4.236 -21.739 -15.273
  155    HD2  ARG  17          2HD       ARG  17   2.120 -22.058 -14.334
  156    HD3  ARG  17          3HD       ARG  17   1.292 -21.604 -15.823
  157    HE   ARG  17           HE       ARG  17   2.877 -23.941 -16.177
  158   HH11  ARG  17          1HH1      ARG  17  -0.140 -22.791 -14.876
  159   HH12  ARG  17          2HH1      ARG  17  -0.950 -24.312 -15.061
  160   HH21  ARG  17          1HH2      ARG  17   1.822 -25.948 -16.426
  161   HH22  ARG  17          2HH2      ARG  17   0.168 -26.107 -15.942
  162    H    LEU  18           H        LEU  18   3.443 -16.833 -15.194
  163    HA   LEU  18           HA       LEU  18   6.112 -16.141 -16.235
  164    HB2  LEU  18          2HB       LEU  18   3.523 -14.813 -17.004
  165    HB3  LEU  18          3HB       LEU  18   5.110 -14.577 -17.734
  166    HG   LEU  18           HG       LEU  18   3.492 -17.119 -17.890
  167   HD11  LEU  18          1HD1      LEU  18   2.367 -15.433 -19.150
  168   HD12  LEU  18          2HD1      LEU  18   3.239 -16.464 -20.284
  169   HD13  LEU  18          3HD1      LEU  18   3.882 -14.877 -19.862
  170   HD21  LEU  18          1HD2      LEU  18   5.133 -17.790 -19.556
  171   HD22  LEU  18          2HD2      LEU  18   5.913 -17.471 -18.007
  172   HD23  LEU  18          3HD2      LEU  18   6.020 -16.286 -19.310
  173    H    PHE  19           H        PHE  19   3.384 -15.178 -14.261
  174    HA   PHE  19           HA       PHE  19   4.115 -12.571 -13.627
  175    HB2  PHE  19          2HB       PHE  19   2.449 -14.667 -12.362
  176    HB3  PHE  19          3HB       PHE  19   2.990 -13.368 -11.305
  177    HD1  PHE  19           HD1      PHE  19   1.572 -13.746 -14.739
  178    HD2  PHE  19           HD2      PHE  19   1.563 -11.597 -11.065
  179    HE1  PHE  19           HE1      PHE  19  -0.238 -12.311 -15.587
  180    HE2  PHE  19           HE2      PHE  19  -0.247 -10.159 -11.906
  181    HZ   PHE  19           HZ       PHE  19  -1.151 -10.515 -14.170
  182    H    ARG  20           H        ARG  20   5.477 -15.583 -12.608
  183    HA   ARG  20           HA       ARG  20   6.758 -14.716 -10.246
  184    HB2  ARG  20          2HB       ARG  20   6.800 -17.070 -11.966
  185    HB3  ARG  20          3HB       ARG  20   8.383 -16.703 -11.293
  186    HG2  ARG  20          2HG       ARG  20   6.928 -16.466  -9.072
  187    HG3  ARG  20          3HG       ARG  20   5.910 -17.607  -9.953
  188    HD2  ARG  20          2HD       ARG  20   7.512 -18.782  -8.544
  189    HD3  ARG  20          3HD       ARG  20   7.832 -19.090 -10.251
  190    HE   ARG  20           HE       ARG  20   9.376 -16.909  -9.269
  191   HH11  ARG  20          1HH1      ARG  20   9.178 -20.385  -9.326
  192   HH12  ARG  20          2HH1      ARG  20  10.883 -20.615  -9.117
  193   HH21  ARG  20          1HH2      ARG  20  11.621 -17.200  -8.994
  194   HH22  ARG  20          2HH2      ARG  20  12.271 -18.803  -8.928
  195    H    ARG  21           H        ARG  21   7.598 -14.498 -13.631
  196    HA   ARG  21           HA       ARG  21  10.092 -13.118 -12.879
  197    HB2  ARG  21          2HB       ARG  21   9.491 -14.683 -15.396
  198    HB3  ARG  21          3HB       ARG  21  10.972 -13.784 -15.095
  199    HG2  ARG  21          2HG       ARG  21  10.917 -15.356 -12.908
  200    HG3  ARG  21          3HG       ARG  21  10.103 -16.401 -14.075
  201    HD2  ARG  21          2HD       ARG  21  12.330 -16.968 -14.359
  202    HD3  ARG  21          3HD       ARG  21  12.072 -15.781 -15.636
  203    HE   ARG  21           HE       ARG  21  12.966 -14.377 -13.428
  204   HH11  ARG  21          1HH1      ARG  21  14.150 -16.900 -15.515
  205   HH12  ARG  21          2HH1      ARG  21  15.815 -16.458 -15.322
  206   HH21  ARG  21          1HH2      ARG  21  15.154 -13.786 -13.166
  207   HH22  ARG  21          2HH2      ARG  21  16.384 -14.687 -13.984
  208    H    ASN  22           H        ASN  22   7.328 -12.068 -13.226
  209    HA   ASN  22           HA       ASN  22   7.848 -10.195 -15.440
  210    HB2  ASN  22          2HB       ASN  22   5.519 -11.753 -14.793
  211    HB3  ASN  22          3HB       ASN  22   5.124 -10.039 -14.706
  212   HD21  ASN  22          1HD2      ASN  22   5.985 -12.678 -16.740
  213   HD22  ASN  22          2HD2      ASN  22   5.791 -11.859 -18.249
  214    H    PHE  23           H        PHE  23   7.381 -10.555 -12.078
  215    HA   PHE  23           HA       PHE  23   6.267  -8.173 -11.266
  216    HB2  PHE  23          2HB       PHE  23   7.399  -8.482  -9.159
  217    HB3  PHE  23          3HB       PHE  23   6.930 -10.064  -9.773
  218    HD1  PHE  23           HD1      PHE  23   8.668 -11.505 -10.867
  219    HD2  PHE  23           HD2      PHE  23   9.642  -7.967  -8.710
  220    HE1  PHE  23           HE1      PHE  23  10.994 -12.278 -10.657
  221    HE2  PHE  23           HE2      PHE  23  11.970  -8.734  -8.498
  222    HZ   PHE  23           HZ       PHE  23  12.649 -10.891  -9.472
  223    H    GLY  24           H        GLY  24   9.569  -8.808 -12.323
  224    HA2  GLY  24          2HA       GLY  24  10.842  -6.481 -11.562
  225    HA3  GLY  24          3HA       GLY  24  11.218  -7.372 -13.029
  226    H    TYR  25           H        TYR  25   8.483  -6.925 -14.092
  227    HA   TYR  25           HA       TYR  25   9.034  -4.419 -15.384
  228    HB2  TYR  25          2HB       TYR  25   6.999  -6.582 -15.690
  229    HB3  TYR  25          3HB       TYR  25   6.643  -4.999 -16.372
  230    HD1  TYR  25           HD1      TYR  25   6.894  -5.127 -18.667
  231    HD2  TYR  25           HD2      TYR  25   9.811  -6.970 -16.179
  232    HE1  TYR  25           HE1      TYR  25   8.232  -5.680 -20.656
  233    HE2  TYR  25           HE2      TYR  25  11.158  -7.527 -18.160
  234    HH   TYR  25           HH       TYR  25  10.028  -7.542 -21.205
  235    H    THR  26           H        THR  26   6.832  -5.586 -12.923
  236    HA   THR  26           HA       THR  26   5.247  -3.184 -12.881
  237    HB   THR  26           HB       THR  26   4.752  -4.448 -10.480
  238    HG1  THR  26           HG1      THR  26   6.155  -6.179 -11.193
  239   HG21  THR  26          1HG2      THR  26   3.505  -4.267 -13.127
  240   HG22  THR  26          2HG2      THR  26   2.805  -4.029 -11.526
  241   HG23  THR  26          3HG2      THR  26   2.984  -5.658 -12.177
  242    H    LEU  27           H        LEU  27   7.865  -4.565 -10.953
  243    HA   LEU  27           HA       LEU  27   7.841  -2.645  -8.891
  244    HB2  LEU  27          2HB       LEU  27   9.604  -4.779  -9.821
  245    HB3  LEU  27          3HB       LEU  27  10.463  -3.432  -9.076
  246    HG   LEU  27           HG       LEU  27   8.231  -4.974  -7.756
  247   HD11  LEU  27          1HD1      LEU  27   9.691  -6.507  -7.089
  248   HD12  LEU  27          2HD1      LEU  27  10.846  -5.275  -6.580
  249   HD13  LEU  27          3HD1      LEU  27  10.834  -5.834  -8.252
  250   HD21  LEU  27          1HD2      LEU  27   8.313  -2.856  -6.767
  251   HD22  LEU  27          2HD2      LEU  27  10.072  -2.775  -6.868
  252   HD23  LEU  27          3HD2      LEU  27   9.304  -3.866  -5.715
  253    H    ARG  28           H        ARG  28   9.190  -2.638 -12.102
  254    HA   ARG  28           HA       ARG  28  11.095  -0.623 -11.874
  255    HB2  ARG  28          2HB       ARG  28  10.231  -2.149 -13.910
  256    HB3  ARG  28          3HB       ARG  28   9.423  -0.643 -14.324
  257    HG2  ARG  28          2HG       ARG  28  11.740   0.434 -14.025
  258    HG3  ARG  28          3HG       ARG  28  12.352  -1.217 -14.140
  259    HD2  ARG  28          2HD       ARG  28  11.111  -1.443 -16.295
  260    HD3  ARG  28          3HD       ARG  28  10.719   0.272 -16.189
  261    HE   ARG  28           HE       ARG  28  13.468   0.076 -15.949
  262   HH11  ARG  28          1HH1      ARG  28  11.036  -0.689 -18.320
  263   HH12  ARG  28          2HH1      ARG  28  12.092  -0.448 -19.672
  264   HH21  ARG  28          1HH2      ARG  28  14.868   0.396 -17.720
  265   HH22  ARG  28          2HH2      ARG  28  14.272   0.168 -19.330
  Start of MODEL   15
    1    H1   LYS   1           H        LYS   1  -9.163 -13.238   3.852
    2    HA   LYS   1           HA       LYS   1  -9.514 -10.933   3.322
    3    HB2  LYS   1          2HB       LYS   1  -6.637 -10.656   4.208
    4    HB3  LYS   1          3HB       LYS   1  -7.593  -9.356   3.510
    5    HG2  LYS   1          2HG       LYS   1  -7.897  -8.883   5.703
    6    HG3  LYS   1          3HG       LYS   1  -9.237 -10.010   5.483
    7    HD2  LYS   1          2HD       LYS   1  -7.290 -11.749   6.099
    8    HD3  LYS   1          3HD       LYS   1  -6.701 -10.333   6.973
    9    HE2  LYS   1          2HE       LYS   1  -8.497 -10.299   8.399
   10    HE3  LYS   1          3HE       LYS   1  -9.570 -11.081   7.239
   11    HZ1  LYS   1          1HZ       LYS   1  -8.007 -12.250   9.297
   12    HZ2  LYS   1          2HZ       LYS   1  -7.602 -12.925   7.800
   13    HZ3  LYS   1          3HZ       LYS   1  -9.206 -12.957   8.335
   14    H    TYR   2           H        TYR   2  -9.323 -10.157   1.252
   15    HA   TYR   2           HA       TYR   2  -7.410 -11.578  -0.482
   16    HB2  TYR   2          2HB       TYR   2  -9.617 -12.302  -1.042
   17    HB3  TYR   2          3HB       TYR   2 -10.230 -10.652  -1.033
   18    HD1  TYR   2           HD1      TYR   2 -10.375  -9.469  -3.030
   19    HD2  TYR   2           HD2      TYR   2  -7.799 -12.848  -2.813
   20    HE1  TYR   2           HE1      TYR   2  -9.954  -9.296  -5.447
   21    HE2  TYR   2           HE2      TYR   2  -7.370 -12.684  -5.229
   22    HH   TYR   2           HH       TYR   2  -8.035 -11.715  -7.155
   23    H    GLU   3           H        GLU   3  -9.514  -8.773  -1.039
   24    HA   GLU   3           HA       GLU   3  -7.252  -7.341  -2.183
   25    HB2  GLU   3          2HB       GLU   3 -10.126  -7.320  -2.534
   26    HB3  GLU   3          3HB       GLU   3  -9.511  -5.693  -2.282
   27    HG2  GLU   3          2HG       GLU   3  -7.921  -6.015  -4.114
   28    HG3  GLU   3          3HG       GLU   3  -8.560  -7.637  -4.374
   29    H    ILE   4           H        ILE   4  -9.374  -7.231   0.589
   30    HA   ILE   4           HA       ILE   4  -8.446  -4.629   1.442
   31    HB   ILE   4           HB       ILE   4  -9.993  -4.735   3.159
   32   HG12  ILE   4          2HG1      ILE   4  -9.185  -6.754   4.244
   33   HG13  ILE   4          3HG1      ILE   4 -10.932  -6.851   4.052
   34   HG21  ILE   4          1HG2      ILE   4 -11.173  -6.606   1.112
   35   HG22  ILE   4          2HG2      ILE   4 -12.055  -5.554   2.216
   36   HG23  ILE   4          3HG2      ILE   4 -11.066  -4.855   0.934
   37   HD11  ILE   4          1HD1      ILE   4 -10.628  -8.293   2.102
   38   HD12  ILE   4          2HD1      ILE   4  -8.880  -8.210   2.323
   39   HD13  ILE   4          3HD1      ILE   4  -9.889  -8.974   3.551
   40    H    THR   5           H        THR   5  -6.940  -7.467   1.344
   41    HA   THR   5           HA       THR   5  -6.009  -8.130   3.840
   42    HB   THR   5           HB       THR   5  -4.334  -8.042   1.322
   43    HG1  THR   5           HG1      THR   5  -5.750  -9.495   0.707
   44   HG21  THR   5          1HG2      THR   5  -3.788 -10.241   3.077
   45   HG22  THR   5          2HG2      THR   5  -3.653  -8.726   3.971
   46   HG23  THR   5          3HG2      THR   5  -2.698  -8.977   2.510
   47    H    THR   6           H        THR   6  -3.939  -6.243   1.654
   48    HA   THR   6           HA       THR   6  -3.160  -4.584   3.964
   49    HB   THR   6           HB       THR   6  -1.001  -4.399   2.303
   50    HG1  THR   6           HG1      THR   6  -1.940  -7.092   2.192
   51   HG21  THR   6          1HG2      THR   6  -1.205  -6.600   4.338
   52   HG22  THR   6          2HG2      THR   6  -1.213  -4.902   4.813
   53   HG23  THR   6          3HG2      THR   6   0.175  -5.572   3.958
   54    H    ILE   7           H        ILE   7  -2.228  -4.327   0.565
   55    HA   ILE   7           HA       ILE   7  -3.626  -1.734   0.449
   56    HB   ILE   7           HB       ILE   7  -1.667  -1.382  -1.370
   57   HG12  ILE   7          2HG1      ILE   7  -0.147  -2.675   0.859
   58   HG13  ILE   7          3HG1      ILE   7  -0.780  -3.681  -0.439
   59   HG21  ILE   7          1HG2      ILE   7  -0.420  -0.336   0.737
   60   HG22  ILE   7          2HG2      ILE   7  -1.893   0.362   0.065
   61   HG23  ILE   7          3HG2      ILE   7  -1.979  -0.675   1.488
   62   HD11  ILE   7          1HD1      ILE   7   0.584  -1.368  -1.484
   63   HD12  ILE   7          2HD1      ILE   7   1.623  -2.305  -0.410
   64   HD13  ILE   7          3HD1      ILE   7   0.860  -3.081  -1.797
   65    H    HIS   8           H        HIS   8  -1.804  -3.274  -2.126
   66    HA   HIS   8           HA       HIS   8  -4.329  -3.754  -3.566
   67    HB2  HIS   8          2HB       HIS   8  -1.909  -2.266  -4.372
   68    HB3  HIS   8          3HB       HIS   8  -2.563  -3.358  -5.590
   69    HD1  HIS   8           HD1      HIS   8  -4.804  -2.731  -6.660
   70    HD2  HIS   8           HD2      HIS   8  -3.557  -0.071  -3.722
   71    HE1  HIS   8           HE1      HIS   8  -6.313  -0.731  -6.879
   72    H    ASN   9           H        ASN   9  -2.074  -5.345  -2.025
   73    HA   ASN   9           HA       ASN   9  -1.133  -7.201  -3.995
   74    HB2  ASN   9          2HB       ASN   9  -1.032  -7.078  -0.994
   75    HB3  ASN   9          3HB       ASN   9  -0.540  -8.538  -1.846
   76   HD21  ASN   9          1HD2      ASN   9   1.543  -8.667  -2.203
   77   HD22  ASN   9          2HD2      ASN   9   2.624  -7.342  -2.447
   78    H    LEU  10           H        LEU  10  -3.634  -7.272  -4.609
   79    HA   LEU  10           HA       LEU  10  -5.108  -9.244  -3.082
   80    HB2  LEU  10          2HB       LEU  10  -6.873  -8.895  -4.718
   81    HB3  LEU  10          3HB       LEU  10  -6.291  -7.364  -4.067
   82    HG   LEU  10           HG       LEU  10  -4.791  -7.522  -6.299
   83   HD11  LEU  10          1HD1      LEU  10  -7.414  -8.817  -7.024
   84   HD12  LEU  10          2HD1      LEU  10  -5.851  -9.632  -6.989
   85   HD13  LEU  10          3HD1      LEU  10  -6.139  -8.327  -8.139
   86   HD21  LEU  10          1HD2      LEU  10  -6.186  -5.853  -7.190
   87   HD22  LEU  10          2HD2      LEU  10  -6.361  -5.714  -5.440
   88   HD23  LEU  10          3HD2      LEU  10  -7.617  -6.506  -6.393
   89    H    PHE  11           H        PHE  11  -2.584  -9.551  -5.028
   90    HA   PHE  11           HA       PHE  11  -3.236 -11.330  -7.049
   91    HB2  PHE  11          2HB       PHE  11  -0.733 -11.548  -5.377
   92    HB3  PHE  11          3HB       PHE  11  -0.939 -11.972  -7.073
   93    HD1  PHE  11           HD1      PHE  11  -1.315 -10.138  -8.745
   94    HD2  PHE  11           HD2      PHE  11  -0.115  -9.381  -4.732
   95    HE1  PHE  11           HE1      PHE  11  -0.552  -7.892  -9.400
   96    HE2  PHE  11           HE2      PHE  11   0.649  -7.134  -5.380
   97    HZ   PHE  11           HZ       PHE  11   0.430  -6.386  -7.716
   98    H    ARG  12           H        ARG  12  -4.169 -13.256  -7.015
   99    HA   ARG  12           HA       ARG  12  -3.833 -14.941  -4.620
  100    HB2  ARG  12          2HB       ARG  12  -6.235 -14.099  -6.061
  101    HB3  ARG  12          3HB       ARG  12  -6.142 -15.840  -5.832
  102    HG2  ARG  12          2HG       ARG  12  -5.650 -15.291  -3.375
  103    HG3  ARG  12          3HG       ARG  12  -6.252 -13.678  -3.766
  104    HD2  ARG  12          2HD       ARG  12  -8.386 -14.522  -4.361
  105    HD3  ARG  12          3HD       ARG  12  -7.805 -16.187  -4.352
  106    HE   ARG  12           HE       ARG  12  -7.579 -14.850  -1.813
  107   HH11  ARG  12          1HH1      ARG  12  -9.635 -16.730  -3.901
  108   HH12  ARG  12          2HH1      ARG  12 -10.614 -17.338  -2.607
  109   HH21  ARG  12          1HH2      ARG  12  -8.862 -15.643  -0.101
  110   HH22  ARG  12          2HH2      ARG  12 -10.174 -16.717  -0.446
  111    H    LYS  13           H        LYS  13  -4.008 -14.798  -8.115
  112    HA   LYS  13           HA       LYS  13  -3.060 -17.587  -8.231
  113    HB2  LYS  13          2HB       LYS  13  -4.112 -17.826 -10.375
  114    HB3  LYS  13          3HB       LYS  13  -5.308 -17.194  -9.251
  115    HG2  LYS  13          2HG       LYS  13  -4.328 -14.894 -10.270
  116    HG3  LYS  13          3HG       LYS  13  -4.135 -15.974 -11.652
  117    HD2  LYS  13          2HD       LYS  13  -6.698 -15.592 -10.107
  118    HD3  LYS  13          3HD       LYS  13  -6.313 -14.794 -11.633
  119    HE2  LYS  13          2HE       LYS  13  -5.900 -17.239 -12.463
  120    HE3  LYS  13          3HE       LYS  13  -6.913 -17.669 -11.086
  121    HZ1  LYS  13          1HZ       LYS  13  -8.027 -17.276 -13.338
  122    HZ2  LYS  13          2HZ       LYS  13  -7.789 -15.630 -13.031
  123    HZ3  LYS  13          3HZ       LYS  13  -8.728 -16.560 -11.975
  124    H    LEU  14           H        LEU  14  -2.671 -14.312  -9.427
  125    HA   LEU  14           HA       LEU  14  -0.345 -15.088 -11.011
  126    HB2  LEU  14          2HB       LEU  14  -0.364 -12.790 -11.814
  127    HB3  LEU  14          3HB       LEU  14  -1.934 -13.561 -12.026
  128    HG   LEU  14           HG       LEU  14  -1.563 -11.939  -9.575
  129   HD11  LEU  14          1HD1      LEU  14  -2.109  -9.870 -10.846
  130   HD12  LEU  14          2HD1      LEU  14  -1.750 -10.744 -12.334
  131   HD13  LEU  14          3HD1      LEU  14  -0.482 -10.485 -11.136
  132   HD21  LEU  14          1HD2      LEU  14  -3.732 -12.474  -9.593
  133   HD22  LEU  14          2HD2      LEU  14  -3.701 -12.920 -11.300
  134   HD23  LEU  14          3HD2      LEU  14  -3.897 -11.230 -10.833
  135    H    THR  15           H        THR  15  -0.515 -15.020  -7.985
  136    HA   THR  15           HA       THR  15   0.901 -12.943  -6.857
  137    HB   THR  15           HB       THR  15   1.903 -15.185  -5.548
  138    HG1  THR  15           HG1      THR  15   0.618 -16.605  -6.698
  139   HG21  THR  15          1HG2      THR  15   0.541 -12.999  -4.857
  140   HG22  THR  15          2HG2      THR  15   0.676 -14.399  -3.793
  141   HG23  THR  15          3HG2      THR  15  -0.775 -14.169  -4.769
  142    H    HIS  16           H        HIS  16   2.481 -16.067  -7.479
  143    HA   HIS  16           HA       HIS  16   4.898 -14.579  -8.269
  144    HB2  HIS  16          2HB       HIS  16   6.101 -16.715  -7.553
  145    HB3  HIS  16          3HB       HIS  16   5.413 -15.727  -6.268
  146    HD1  HIS  16           HD1      HIS  16   4.929 -17.505  -4.566
  147    HD2  HIS  16           HD2      HIS  16   3.376 -18.415  -8.310
  148    HE1  HIS  16           HE1      HIS  16   3.498 -19.544  -4.223
  149    H    ARG  17           H        ARG  17   2.433 -16.269  -9.551
  150    HA   ARG  17           HA       ARG  17   3.487 -18.230 -11.182
  151    HB2  ARG  17          2HB       ARG  17   1.103 -16.530 -11.195
  152    HB3  ARG  17          3HB       ARG  17   1.601 -17.044 -12.801
  153    HG2  ARG  17          2HG       ARG  17   1.189 -18.938 -10.502
  154    HG3  ARG  17          3HG       ARG  17  -0.063 -18.529 -11.677
  155    HD2  ARG  17          2HD       ARG  17   1.103 -19.538 -13.439
  156    HD3  ARG  17          3HD       ARG  17   2.620 -19.554 -12.541
  157    HE   ARG  17           HE       ARG  17   0.533 -21.148 -11.359
  158   HH11  ARG  17          1HH1      ARG  17   3.165 -21.081 -13.638
  159   HH12  ARG  17          2HH1      ARG  17   3.422 -22.794 -13.590
  160   HH21  ARG  17          1HH2      ARG  17   0.862 -23.404 -11.288
  161   HH22  ARG  17          2HH2      ARG  17   2.110 -24.115 -12.254
  162    H    LEU  18           H        LEU  18   2.625 -15.048 -12.513
  163    HA   LEU  18           HA       LEU  18   5.078 -15.168 -14.140
  164    HB2  LEU  18          2HB       LEU  18   2.305 -14.255 -14.818
  165    HB3  LEU  18          3HB       LEU  18   3.700 -13.682 -15.729
  166    HG   LEU  18           HG       LEU  18   3.423 -16.614 -15.439
  167   HD11  LEU  18          1HD1      LEU  18   1.171 -16.301 -15.901
  168   HD12  LEU  18          2HD1      LEU  18   1.881 -16.509 -17.502
  169   HD13  LEU  18          3HD1      LEU  18   1.473 -14.895 -16.923
  170   HD21  LEU  18          1HD2      LEU  18   3.996 -16.317 -17.943
  171   HD22  LEU  18          2HD2      LEU  18   5.235 -15.974 -16.736
  172   HD23  LEU  18          3HD2      LEU  18   4.353 -14.649 -17.496
  173    H    PHE  19           H        PHE  19   2.926 -13.182 -12.228
  174    HA   PHE  19           HA       PHE  19   3.929 -10.651 -12.730
  175    HB2  PHE  19          2HB       PHE  19   1.976 -11.448 -11.189
  176    HB3  PHE  19          3HB       PHE  19   3.211 -11.470  -9.934
  177    HD1  PHE  19           HD1      PHE  19   3.546  -9.566  -8.696
  178    HD2  PHE  19           HD2      PHE  19   1.886  -9.225 -12.600
  179    HE1  PHE  19           HE1      PHE  19   3.240  -7.149  -8.351
  180    HE2  PHE  19           HE2      PHE  19   1.578  -6.807 -12.262
  181    HZ   PHE  19           HZ       PHE  19   2.256  -5.766 -10.135
  182    H    ARG  20           H        ARG  20   5.258 -13.234 -10.776
  183    HA   ARG  20           HA       ARG  20   7.131 -11.836  -9.275
  184    HB2  ARG  20          2HB       ARG  20   6.514 -14.518  -9.752
  185    HB3  ARG  20          3HB       ARG  20   8.197 -14.356 -10.235
  186    HG2  ARG  20          2HG       ARG  20   7.927 -12.994  -7.788
  187    HG3  ARG  20          3HG       ARG  20   7.081 -14.533  -7.616
  188    HD2  ARG  20          2HD       ARG  20   9.394 -14.793  -6.963
  189    HD3  ARG  20          3HD       ARG  20   9.086 -15.699  -8.444
  190    HE   ARG  20           HE       ARG  20  10.018 -13.215  -9.224
  191   HH11  ARG  20          1HH1      ARG  20  11.183 -15.925  -7.374
  192   HH12  ARG  20          2HH1      ARG  20  12.845 -15.655  -7.781
  193   HH21  ARG  20          1HH2      ARG  20  12.203 -12.849  -9.766
  194   HH22  ARG  20          2HH2      ARG  20  13.424 -13.905  -9.141
  195    H    ARG  21           H        ARG  21   7.189 -12.786 -12.640
  196    HA   ARG  21           HA       ARG  21   9.973 -12.047 -12.969
  197    HB2  ARG  21          2HB       ARG  21   7.863 -13.251 -14.693
  198    HB3  ARG  21          3HB       ARG  21   9.183 -12.402 -15.486
  199    HG2  ARG  21          2HG       ARG  21  10.703 -13.876 -14.001
  200    HG3  ARG  21          3HG       ARG  21   9.262 -14.879 -13.820
  201    HD2  ARG  21          2HD       ARG  21   9.164 -15.345 -16.116
  202    HD3  ARG  21          3HD       ARG  21  10.257 -14.022 -16.518
  203    HE   ARG  21           HE       ARG  21  12.038 -15.399 -16.081
  204   HH11  ARG  21          1HH1      ARG  21   9.126 -16.843 -14.833
  205   HH12  ARG  21          2HH1      ARG  21   9.879 -18.360 -14.469
  206   HH21  ARG  21          1HH2      ARG  21  13.041 -17.392 -15.605
  207   HH22  ARG  21          2HH2      ARG  21  12.106 -18.671 -14.907
  208    H    ASN  22           H        ASN  22   6.813 -10.670 -13.473
  209    HA   ASN  22           HA       ASN  22   7.614  -8.561 -15.203
  210    HB2  ASN  22          2HB       ASN  22   5.183  -9.425 -13.870
  211    HB3  ASN  22          3HB       ASN  22   5.357  -7.673 -13.819
  212   HD21  ASN  22          1HD2      ASN  22   6.271  -6.845 -16.057
  213   HD22  ASN  22          2HD2      ASN  22   5.361  -7.390 -17.421
  214    H    PHE  23           H        PHE  23   7.664  -9.023 -11.763
  215    HA   PHE  23           HA       PHE  23   7.752  -6.383 -10.874
  216    HB2  PHE  23          2HB       PHE  23   8.406  -9.009  -9.803
  217    HB3  PHE  23          3HB       PHE  23   9.490  -7.763  -9.194
  218    HD1  PHE  23           HD1      PHE  23   6.612  -9.468  -8.470
  219    HD2  PHE  23           HD2      PHE  23   8.105  -5.484  -8.603
  220    HE1  PHE  23           HE1      PHE  23   4.893  -8.774  -6.852
  221    HE2  PHE  23           HE2      PHE  23   6.390  -4.784  -6.984
  222    HZ   PHE  23           HZ       PHE  23   4.781  -6.429  -6.106
  223    H    GLY  24           H        GLY  24  10.165  -8.325 -12.456
  224    HA2  GLY  24          2HA       GLY  24  12.509  -7.022 -11.741
  225    HA3  GLY  24          3HA       GLY  24  12.232  -7.787 -13.299
  226    H    TYR  25           H        TYR  25   9.930  -5.912 -13.778
  227    HA   TYR  25           HA       TYR  25  11.493  -3.843 -15.036
  228    HB2  TYR  25          2HB       TYR  25   8.647  -4.728 -15.121
  229    HB3  TYR  25          3HB       TYR  25   9.012  -3.078 -15.613
  230    HD1  TYR  25           HD1      TYR  25   8.753  -3.051 -17.925
  231    HD2  TYR  25           HD2      TYR  25  10.973  -6.206 -16.129
  232    HE1  TYR  25           HE1      TYR  25   9.402  -3.857 -20.157
  233    HE2  TYR  25           HE2      TYR  25  11.629  -7.019 -18.356
  234    HH   TYR  25           HH       TYR  25  11.585  -6.627 -20.546
  235    H    THR  26           H        THR  26   9.488  -4.178 -12.219
  236    HA   THR  26           HA       THR  26   9.308  -1.311 -11.789
  237    HB   THR  26           HB       THR  26   8.369  -2.331  -9.480
  238    HG1  THR  26           HG1      THR  26   8.805  -4.501 -10.214
  239   HG21  THR  26          1HG2      THR  26   7.301  -1.036 -11.580
  240   HG22  THR  26          2HG2      THR  26   6.337  -1.666 -10.244
  241   HG23  THR  26          3HG2      THR  26   6.479  -2.587 -11.741
  242    H    LEU  27           H        LEU  27  11.147  -4.053 -10.647
  243    HA   LEU  27           HA       LEU  27  12.305  -2.651  -8.417
  244    HB2  LEU  27          2HB       LEU  27  12.277  -5.339  -9.451
  245    HB3  LEU  27          3HB       LEU  27  13.922  -4.845  -9.054
  246    HG   LEU  27           HG       LEU  27  11.815  -4.369  -7.016
  247   HD11  LEU  27          1HD1      LEU  27  11.679  -6.571  -6.282
  248   HD12  LEU  27          2HD1      LEU  27  13.055  -7.085  -7.257
  249   HD13  LEU  27          3HD1      LEU  27  11.516  -6.711  -8.032
  250   HD21  LEU  27          1HD2      LEU  27  14.398  -5.634  -6.386
  251   HD22  LEU  27          2HD2      LEU  27  13.563  -4.297  -5.595
  252   HD23  LEU  27          3HD2      LEU  27  14.489  -4.011  -7.069
  253    H    ARG  28           H        ARG  28  13.150  -3.297 -11.750
  254    HA   ARG  28           HA       ARG  28  15.878  -2.567 -11.594
  255    HB2  ARG  28          2HB       ARG  28  14.857  -3.850 -13.469
  256    HB3  ARG  28          3HB       ARG  28  14.038  -2.381 -13.985
  257    HG2  ARG  28          2HG       ARG  28  16.445  -1.390 -14.043
  258    HG3  ARG  28          3HG       ARG  28  16.931  -3.085 -14.121
  259    HD2  ARG  28          2HD       ARG  28  16.520  -3.066 -16.303
  260    HD3  ARG  28          3HD       ARG  28  14.818  -2.770 -15.951
  261    HE   ARG  28           HE       ARG  28  16.328  -0.363 -15.864
  262   HH11  ARG  28          1HH1      ARG  28  14.881  -2.659 -18.045
  263   HH12  ARG  28          2HH1      ARG  28  14.675  -1.510 -19.326
  264   HH21  ARG  28          1HH2      ARG  28  16.062   1.159 -17.542
  265   HH22  ARG  28          2HH2      ARG  28  15.348   0.661 -19.039
  Start of MODEL   16
    1    H1   LYS   1           H        LYS   1   0.042   0.912  -0.032
    2    HA   LYS   1           HA       LYS   1   0.341   0.554  -2.590
    3    HB2  LYS   1          2HB       LYS   1   2.710   0.763  -0.723
    4    HB3  LYS   1          3HB       LYS   1   2.778   1.067  -2.454
    5    HG2  LYS   1          2HG       LYS   1   2.076   3.148  -2.178
    6    HG3  LYS   1          3HG       LYS   1   0.670   2.608  -1.258
    7    HD2  LYS   1          2HD       LYS   1   1.806   3.961   0.256
    8    HD3  LYS   1          3HD       LYS   1   2.339   2.337   0.695
    9    HE2  LYS   1          2HE       LYS   1   4.102   3.253  -1.300
   10    HE3  LYS   1          3HE       LYS   1   3.892   4.587  -0.166
   11    HZ1  LYS   1          1HZ       LYS   1   4.895   1.860   0.380
   12    HZ2  LYS   1          2HZ       LYS   1   4.335   2.862   1.621
   13    HZ3  LYS   1          3HZ       LYS   1   5.656   3.340   0.680
   14    H    TYR   2           H        TYR   2   0.661  -2.005  -0.521
   15    HA   TYR   2           HA       TYR   2   2.099  -3.597  -2.542
   16    HB2  TYR   2          2HB       TYR   2   3.421  -3.434  -0.505
   17    HB3  TYR   2          3HB       TYR   2   2.050  -3.970   0.460
   18    HD1  TYR   2           HD1      TYR   2   2.449  -6.072   1.316
   19    HD2  TYR   2           HD2      TYR   2   3.623  -5.240  -2.688
   20    HE1  TYR   2           HE1      TYR   2   3.171  -8.408   1.049
   21    HE2  TYR   2           HE2      TYR   2   4.347  -7.574  -2.967
   22    HH   TYR   2           HH       TYR   2   3.895  -9.773  -1.972
   23    H    GLU   3           H        GLU   3   0.177  -4.464   0.318
   24    HA   GLU   3           HA       GLU   3  -1.155  -6.564  -1.081
   25    HB2  GLU   3          2HB       GLU   3  -1.379  -5.378   1.663
   26    HB3  GLU   3          3HB       GLU   3  -2.604  -6.503   1.093
   27    HG2  GLU   3          2HG       GLU   3  -1.147  -8.280   1.044
   28    HG3  GLU   3          3HG       GLU   3   0.274  -7.249   0.893
   29    H    ILE   4           H        ILE   4  -1.626  -3.259  -1.019
   30    HA   ILE   4           HA       ILE   4  -4.414  -2.994  -0.957
   31    HB   ILE   4           HB       ILE   4  -4.073  -0.888  -2.215
   32   HG12  ILE   4          2HG1      ILE   4  -1.488  -0.350  -2.435
   33   HG13  ILE   4          3HG1      ILE   4  -1.369  -2.098  -2.597
   34   HG21  ILE   4          1HG2      ILE   4  -1.955  -1.117  -0.102
   35   HG22  ILE   4          2HG2      ILE   4  -3.005   0.250  -0.469
   36   HG23  ILE   4          3HG2      ILE   4  -3.673  -1.195   0.290
   37   HD11  ILE   4          1HD1      ILE   4  -2.116  -2.045  -4.686
   38   HD12  ILE   4          2HD1      ILE   4  -3.449  -0.967  -4.271
   39   HD13  ILE   4          3HD1      ILE   4  -1.853  -0.303  -4.617
   40    H    THR   5           H        THR   5  -2.281  -4.161  -3.421
   41    HA   THR   5           HA       THR   5  -4.195  -3.881  -5.565
   42    HB   THR   5           HB       THR   5  -2.250  -5.724  -6.376
   43    HG1  THR   5           HG1      THR   5  -0.602  -5.348  -5.112
   44   HG21  THR   5          1HG2      THR   5  -2.216  -2.724  -6.720
   45   HG22  THR   5          2HG2      THR   5  -3.217  -3.831  -7.660
   46   HG23  THR   5          3HG2      THR   5  -1.459  -3.918  -7.773
   47    H    THR   6           H        THR   6  -3.145  -6.373  -3.339
   48    HA   THR   6           HA       THR   6  -4.834  -8.359  -4.672
   49    HB   THR   6           HB       THR   6  -3.200  -8.933  -2.221
   50    HG1  THR   6           HG1      THR   6  -1.946  -7.831  -3.972
   51   HG21  THR   6          1HG2      THR   6  -2.960 -11.039  -3.931
   52   HG22  THR   6          2HG2      THR   6  -4.571 -10.444  -4.336
   53   HG23  THR   6          3HG2      THR   6  -4.191 -10.905  -2.677
   54    H    ILE   7           H        ILE   7  -6.911  -8.248  -4.098
   55    HA   ILE   7           HA       ILE   7  -7.578  -7.688  -1.290
   56    HB   ILE   7           HB       ILE   7  -9.335  -7.549  -3.742
   57   HG12  ILE   7          2HG1      ILE   7  -9.334  -5.053  -2.867
   58   HG13  ILE   7          3HG1      ILE   7  -7.791  -5.531  -2.168
   59   HG21  ILE   7          1HG2      ILE   7 -10.833  -6.317  -2.018
   60   HG22  ILE   7          2HG2      ILE   7 -10.819  -8.079  -2.051
   61   HG23  ILE   7          3HG2      ILE   7  -9.892  -7.214  -0.825
   62   HD11  ILE   7          1HD1      ILE   7  -7.603  -6.442  -4.747
   63   HD12  ILE   7          2HD1      ILE   7  -8.488  -4.926  -4.919
   64   HD13  ILE   7          3HD1      ILE   7  -6.915  -4.944  -4.122
   65    H    HIS   8           H        HIS   8  -9.318  -9.457  -3.833
   66    HA   HIS   8           HA       HIS   8  -9.496 -11.753  -1.993
   67    HB2  HIS   8          2HB       HIS   8 -11.656 -10.601  -2.199
   68    HB3  HIS   8          3HB       HIS   8 -11.592 -10.784  -3.949
   69    HD1  HIS   8           HD1      HIS   8 -10.870 -13.451  -1.351
   70    HD2  HIS   8           HD2      HIS   8 -13.601 -12.577  -4.358
   71    HE1  HIS   8           HE1      HIS   8 -12.330 -15.489  -1.546
   72    H    ASN   9           H        ASN   9 -10.208 -11.097  -5.428
   73    HA   ASN   9           HA       ASN   9  -8.574 -13.454  -6.107
   74    HB2  ASN   9          2HB       ASN   9 -11.313 -13.053  -6.583
   75    HB3  ASN   9          3HB       ASN   9 -10.526 -12.815  -8.141
   76   HD21  ASN   9          1HD2      ASN   9 -12.224 -14.994  -6.859
   77   HD22  ASN   9          2HD2      ASN   9 -11.359 -16.446  -7.214
   78    H    LEU  10           H        LEU  10  -8.741 -10.172  -6.297
   79    HA   LEU  10           HA       LEU  10  -8.140  -9.455  -8.888
   80    HB2  LEU  10          2HB       LEU  10  -7.333  -8.365  -6.228
   81    HB3  LEU  10          3HB       LEU  10  -6.639  -7.681  -7.696
   82    HG   LEU  10           HG       LEU  10  -9.198  -7.494  -8.372
   83   HD11  LEU  10          1HD1      LEU  10  -9.834  -6.650  -5.724
   84   HD12  LEU  10          2HD1      LEU  10  -9.351  -8.345  -5.687
   85   HD13  LEU  10          3HD1      LEU  10 -10.663  -7.826  -6.745
   86   HD21  LEU  10          1HD2      LEU  10  -8.224  -5.469  -8.453
   87   HD22  LEU  10          2HD2      LEU  10  -7.316  -5.729  -6.964
   88   HD23  LEU  10          3HD2      LEU  10  -9.008  -5.235  -6.891
   89    H    PHE  11           H        PHE  11  -5.573  -9.634  -6.436
   90    HA   PHE  11           HA       PHE  11  -3.712 -10.475  -8.528
   91    HB2  PHE  11          2HB       PHE  11  -3.438  -9.137  -5.879
   92    HB3  PHE  11          3HB       PHE  11  -2.086 -10.106  -6.455
   93    HD1  PHE  11           HD1      PHE  11  -4.427  -7.491  -7.721
   94    HD2  PHE  11           HD2      PHE  11  -0.464  -9.044  -7.677
   95    HE1  PHE  11           HE1      PHE  11  -3.676  -5.606  -9.113
   96    HE2  PHE  11           HE2      PHE  11   0.293  -7.161  -9.068
   97    HZ   PHE  11           HZ       PHE  11  -1.313  -5.439  -9.787
   98    H    ARG  12           H        ARG  12  -5.738 -12.220  -7.118
   99    HA   ARG  12           HA       ARG  12  -3.845 -14.258  -6.143
  100    HB2  ARG  12          2HB       ARG  12  -6.580 -13.499  -5.171
  101    HB3  ARG  12          3HB       ARG  12  -5.984 -15.136  -4.934
  102    HG2  ARG  12          2HG       ARG  12  -4.024 -13.171  -4.129
  103    HG3  ARG  12          3HG       ARG  12  -5.559 -12.952  -3.285
  104    HD2  ARG  12          2HD       ARG  12  -5.515 -15.159  -2.436
  105    HD3  ARG  12          3HD       ARG  12  -4.209 -15.628  -3.524
  106    HE   ARG  12           HE       ARG  12  -3.190 -13.595  -1.979
  107   HH11  ARG  12          1HH1      ARG  12  -4.566 -16.743  -1.414
  108   HH12  ARG  12          2HH1      ARG  12  -3.643 -17.032   0.024
  109   HH21  ARG  12          1HH2      ARG  12  -1.970 -13.963  -0.087
  110   HH22  ARG  12          2HH2      ARG  12  -2.168 -15.450   0.778
  111    H    LYS  13           H        LYS  13  -4.058 -14.324  -8.733
  112    HA   LYS  13           HA       LYS  13  -6.293 -15.659  -9.832
  113    HB2  LYS  13          2HB       LYS  13  -4.815 -14.464 -11.292
  114    HB3  LYS  13          3HB       LYS  13  -3.432 -15.413 -10.764
  115    HG2  LYS  13          2HG       LYS  13  -4.343 -15.999 -13.021
  116    HG3  LYS  13          3HG       LYS  13  -4.211 -17.345 -11.887
  117    HD2  LYS  13          2HD       LYS  13  -6.505 -17.480 -11.583
  118    HD3  LYS  13          3HD       LYS  13  -6.773 -15.814 -12.102
  119    HE2  LYS  13          2HE       LYS  13  -5.610 -17.630 -14.116
  120    HE3  LYS  13          3HE       LYS  13  -7.273 -17.970 -13.641
  121    HZ1  LYS  13          1HZ       LYS  13  -7.494 -16.498 -15.396
  122    HZ2  LYS  13          2HZ       LYS  13  -6.179 -15.547 -14.919
  123    HZ3  LYS  13          3HZ       LYS  13  -7.630 -15.481 -14.051
  124    H    LEU  14           H        LEU  14  -3.081 -17.120  -9.920
  125    HA   LEU  14           HA       LEU  14  -4.255 -19.600  -8.846
  126    HB2  LEU  14          2HB       LEU  14  -2.635 -19.086 -11.252
  127    HB3  LEU  14          3HB       LEU  14  -2.175 -20.504 -10.312
  128    HG   LEU  14           HG       LEU  14  -3.665 -21.133 -12.112
  129   HD11  LEU  14          1HD1      LEU  14  -4.105 -21.657  -9.362
  130   HD12  LEU  14          2HD1      LEU  14  -4.456 -22.688 -10.749
  131   HD13  LEU  14          3HD1      LEU  14  -5.677 -21.562 -10.156
  132   HD21  LEU  14          1HD2      LEU  14  -4.851 -19.107 -12.521
  133   HD22  LEU  14          2HD2      LEU  14  -5.526 -19.102 -10.891
  134   HD23  LEU  14          3HD2      LEU  14  -6.036 -20.327 -12.054
  135    H    THR  15           H        THR  15  -0.903 -19.194  -9.731
  136    HA   THR  15           HA       THR  15  -0.178 -19.207  -6.874
  137    HB   THR  15           HB       THR  15   1.979 -20.392  -7.958
  138    HG1  THR  15           HG1      THR  15   0.584 -20.369 -10.018
  139   HG21  THR  15          1HG2      THR  15  -0.513 -21.388  -6.721
  140   HG22  THR  15          2HG2      THR  15   1.164 -21.590  -6.214
  141   HG23  THR  15          3HG2      THR  15   0.503 -22.599  -7.501
  142    H    HIS  16           H        HIS  16   1.976 -19.120  -9.655
  143    HA   HIS  16           HA       HIS  16   2.725 -16.366  -8.921
  144    HB2  HIS  16          2HB       HIS  16   5.045 -17.084  -9.814
  145    HB3  HIS  16          3HB       HIS  16   4.566 -17.617  -8.205
  146    HD1  HIS  16           HD1      HIS  16   4.887 -18.917 -11.737
  147    HD2  HIS  16           HD2      HIS  16   4.489 -20.337  -7.853
  148    HE1  HIS  16           HE1      HIS  16   5.234 -21.403 -11.891
  149    H    ARG  17           H        ARG  17   0.850 -16.392 -10.710
  150    HA   ARG  17           HA       ARG  17   1.316 -16.928 -13.361
  151    HB2  ARG  17          2HB       ARG  17  -0.457 -15.197 -11.853
  152    HB3  ARG  17          3HB       ARG  17  -0.014 -14.473 -13.393
  153    HG2  ARG  17          2HG       ARG  17  -2.081 -15.792 -13.520
  154    HG3  ARG  17          3HG       ARG  17  -0.816 -16.411 -14.584
  155    HD2  ARG  17          2HD       ARG  17  -0.884 -17.565 -11.875
  156    HD3  ARG  17          3HD       ARG  17  -2.270 -17.943 -12.897
  157    HE   ARG  17           HE       ARG  17   0.382 -18.963 -13.158
  158   HH11  ARG  17          1HH1      ARG  17  -2.477 -18.089 -14.943
  159   HH12  ARG  17          2HH1      ARG  17  -2.149 -19.174 -16.253
  160   HH21  ARG  17          1HH2      ARG  17   0.824 -20.396 -14.877
  161   HH22  ARG  17          2HH2      ARG  17  -0.271 -20.486 -16.215
  162    H    LEU  18           H        LEU  18   1.541 -13.581 -12.188
  163    HA   LEU  18           HA       LEU  18   3.927 -13.243 -13.884
  164    HB2  LEU  18          2HB       LEU  18   3.222 -10.947 -14.286
  165    HB3  LEU  18          3HB       LEU  18   2.010 -12.101 -14.838
  166    HG   LEU  18           HG       LEU  18   1.488 -11.185 -12.134
  167   HD11  LEU  18          1HD1      LEU  18   2.667  -9.201 -13.394
  168   HD12  LEU  18          2HD1      LEU  18   1.233  -8.930 -12.405
  169   HD13  LEU  18          3HD1      LEU  18   1.086  -9.043 -14.159
  170   HD21  LEU  18          1HD2      LEU  18  -0.175 -10.831 -14.613
  171   HD22  LEU  18          2HD2      LEU  18  -0.716 -10.982 -12.942
  172   HD23  LEU  18          3HD2      LEU  18  -0.034 -12.378 -13.777
  173    H    PHE  19           H        PHE  19   2.749 -13.218 -10.768
  174    HA   PHE  19           HA       PHE  19   4.150 -11.047  -9.625
  175    HB2  PHE  19          2HB       PHE  19   3.493 -13.612  -8.185
  176    HB3  PHE  19          3HB       PHE  19   3.604 -11.987  -7.518
  177    HD1  PHE  19           HD1      PHE  19   1.331 -14.315  -7.778
  178    HD2  PHE  19           HD2      PHE  19   1.990 -10.430  -9.386
  179    HE1  PHE  19           HE1      PHE  19  -1.094 -14.032  -8.079
  180    HE2  PHE  19           HE2      PHE  19  -0.434 -10.140  -9.688
  181    HZ   PHE  19           HZ       PHE  19  -1.980 -11.941  -9.034
  182    H    ARG  20           H        ARG  20   5.228 -13.982 -10.914
  183    HA   ARG  20           HA       ARG  20   7.464 -14.476  -9.241
  184    HB2  ARG  20          2HB       ARG  20   6.671 -16.256 -10.622
  185    HB3  ARG  20          3HB       ARG  20   6.827 -15.281 -12.077
  186    HG2  ARG  20          2HG       ARG  20   9.187 -15.402 -12.019
  187    HG3  ARG  20          3HG       ARG  20   9.181 -16.065 -10.384
  188    HD2  ARG  20          2HD       ARG  20   7.649 -17.879 -11.714
  189    HD3  ARG  20          3HD       ARG  20   8.789 -17.398 -12.969
  190    HE   ARG  20           HE       ARG  20  10.076 -18.003 -10.488
  191   HH11  ARG  20          1HH1      ARG  20   8.727 -19.388 -13.384
  192   HH12  ARG  20          2HH1      ARG  20   9.706 -20.816 -13.313
  193   HH21  ARG  20          1HH2      ARG  20  11.369 -19.879 -10.384
  194   HH22  ARG  20          2HH2      ARG  20  11.208 -21.095 -11.605
  195    H    ARG  21           H        ARG  21   6.934 -12.445 -12.044
  196    HA   ARG  21           HA       ARG  21   9.711 -11.486 -11.809
  197    HB2  ARG  21          2HB       ARG  21   7.969 -11.624 -14.276
  198    HB3  ARG  21          3HB       ARG  21   9.554 -10.864 -14.210
  199    HG2  ARG  21          2HG       ARG  21  10.649 -12.831 -14.261
  200    HG3  ARG  21          3HG       ARG  21   9.433 -13.656 -13.283
  201    HD2  ARG  21          2HD       ARG  21   8.462 -12.846 -15.914
  202    HD3  ARG  21          3HD       ARG  21   9.813 -13.977 -15.984
  203    HE   ARG  21           HE       ARG  21   8.076 -15.037 -14.143
  204   HH11  ARG  21          1HH1      ARG  21   7.914 -14.108 -17.494
  205   HH12  ARG  21          2HH1      ARG  21   6.718 -15.293 -17.900
  206   HH21  ARG  21          1HH2      ARG  21   6.501 -16.602 -14.665
  207   HH22  ARG  21          2HH2      ARG  21   5.914 -16.711 -16.290
  208    H    ASN  22           H        ASN  22   7.260 -10.582 -10.421
  209    HA   ASN  22           HA       ASN  22   7.149  -7.824 -11.453
  210    HB2  ASN  22          2HB       ASN  22   5.048  -9.649 -10.730
  211    HB3  ASN  22          3HB       ASN  22   4.995  -8.243  -9.671
  212   HD21  ASN  22          1HD2      ASN  22   3.243  -7.236 -10.468
  213   HD22  ASN  22          2HD2      ASN  22   3.111  -6.637 -12.084
  214    H    PHE  23           H        PHE  23   7.993  -9.849  -8.839
  215    HA   PHE  23           HA       PHE  23   7.680  -8.273  -6.603
  216    HB2  PHE  23          2HB       PHE  23   9.485  -9.519  -5.600
  217    HB3  PHE  23          3HB       PHE  23   8.570 -10.608  -6.636
  218    HD1  PHE  23           HD1      PHE  23   9.494 -11.275  -8.840
  219    HD2  PHE  23           HD2      PHE  23  11.767  -9.061  -6.004
  220    HE1  PHE  23           HE1      PHE  23  11.562 -11.891 -10.022
  221    HE2  PHE  23           HE2      PHE  23  13.839  -9.672  -7.182
  222    HZ   PHE  23           HZ       PHE  23  13.738 -11.088  -9.194
  223    H    GLY  24           H        GLY  24  10.152  -8.071  -9.106
  224    HA2  GLY  24          2HA       GLY  24  11.973  -6.358  -7.937
  225    HA3  GLY  24          3HA       GLY  24  11.594  -6.367  -9.653
  226    H    TYR  25           H        TYR  25   8.770  -5.632  -9.110
  227    HA   TYR  25           HA       TYR  25   9.155  -2.786  -9.137
  228    HB2  TYR  25          2HB       TYR  25   6.847  -4.636  -9.543
  229    HB3  TYR  25          3HB       TYR  25   6.511  -2.950  -9.165
  230    HD1  TYR  25           HD1      TYR  25   5.795  -1.917 -11.108
  231    HD2  TYR  25           HD2      TYR  25   9.146  -4.533 -11.288
  232    HE1  TYR  25           HE1      TYR  25   6.127  -1.319 -13.470
  233    HE2  TYR  25           HE2      TYR  25   9.488  -3.941 -13.651
  234    HH   TYR  25           HH       TYR  25   7.890  -3.041 -15.572
  235    H    THR  26           H        THR  26   7.953  -5.170  -6.869
  236    HA   THR  26           HA       THR  26   6.924  -3.220  -5.018
  237    HB   THR  26           HB       THR  26   7.060  -5.413  -3.491
  238    HG1  THR  26           HG1      THR  26   8.168  -6.588  -5.177
  239   HG21  THR  26          1HG2      THR  26   4.808  -6.031  -4.394
  240   HG22  THR  26          2HG2      THR  26   5.067  -4.861  -5.689
  241   HG23  THR  26          3HG2      THR  26   4.991  -4.319  -4.013
  242    H    LEU  27           H        LEU  27   9.829  -5.209  -5.301
  243    HA   LEU  27           HA       LEU  27  10.929  -4.560  -2.782
  244    HB2  LEU  27          2HB       LEU  27  11.649  -6.109  -5.037
  245    HB3  LEU  27          3HB       LEU  27  12.992  -5.019  -4.699
  246    HG   LEU  27           HG       LEU  27  11.790  -6.730  -2.544
  247   HD11  LEU  27          1HD1      LEU  27  14.204  -7.866  -3.492
  248   HD12  LEU  27          2HD1      LEU  27  13.118  -7.679  -4.868
  249   HD13  LEU  27          3HD1      LEU  27  12.594  -8.584  -3.448
  250   HD21  LEU  27          1HD2      LEU  27  13.550  -6.085  -1.291
  251   HD22  LEU  27          2HD2      LEU  27  13.563  -4.709  -2.394
  252   HD23  LEU  27          3HD2      LEU  27  14.659  -6.065  -2.663
  253    H    ARG  28           H        ARG  28  10.933  -2.941  -5.870
  254    HA   ARG  28           HA       ARG  28  12.944  -1.021  -5.016
  255    HB2  ARG  28          2HB       ARG  28  13.094  -1.693  -7.307
  256    HB3  ARG  28          3HB       ARG  28  11.388  -1.363  -7.578
  257    HG2  ARG  28          2HG       ARG  28  11.703   0.898  -7.724
  258    HG3  ARG  28          3HG       ARG  28  13.151   0.871  -6.715
  259    HD2  ARG  28          2HD       ARG  28  13.855   1.346  -8.935
  260    HD3  ARG  28          3HD       ARG  28  14.317  -0.320  -8.589
  261    HE   ARG  28           HE       ARG  28  12.909  -1.013 -10.251
  262   HH11  ARG  28          1HH1      ARG  28  12.098   2.256  -9.369
  263   HH12  ARG  28          2HH1      ARG  28  10.959   2.460 -10.659
  264   HH21  ARG  28          1HH2      ARG  28  11.411  -0.757 -11.952
  265   HH22  ARG  28          2HH2      ARG  28  10.568   0.745 -12.127
  Start of MODEL   17
    1    H1   LYS   1           H        LYS   1  -3.337   3.404  -1.845
    2    HA   LYS   1           HA       LYS   1  -1.528   1.302  -2.762
    3    HB2  LYS   1          2HB       LYS   1  -1.626   3.751  -3.654
    4    HB3  LYS   1          3HB       LYS   1  -0.700   4.133  -2.209
    5    HG2  LYS   1          2HG       LYS   1   0.589   1.934  -3.347
    6    HG3  LYS   1          3HG       LYS   1   0.175   2.992  -4.698
    7    HD2  LYS   1          2HD       LYS   1   1.521   4.687  -3.961
    8    HD3  LYS   1          3HD       LYS   1   1.346   4.234  -2.264
    9    HE2  LYS   1          2HE       LYS   1   2.636   2.077  -3.497
   10    HE3  LYS   1          3HE       LYS   1   3.403   3.524  -4.150
   11    HZ1  LYS   1          1HZ       LYS   1   2.958   3.407  -1.263
   12    HZ2  LYS   1          2HZ       LYS   1   4.225   4.114  -2.133
   13    HZ3  LYS   1          3HZ       LYS   1   4.189   2.438  -1.903
   14    H    TYR   2           H        TYR   2  -2.710   2.171   0.112
   15    HA   TYR   2           HA       TYR   2  -0.171   1.637   1.511
   16    HB2  TYR   2          2HB       TYR   2  -0.846   3.881   2.035
   17    HB3  TYR   2          3HB       TYR   2  -2.497   3.367   2.364
   18    HD1  TYR   2           HD1      TYR   2  -2.794   4.008   4.600
   19    HD2  TYR   2           HD2      TYR   2   0.653   1.764   3.511
   20    HE1  TYR   2           HE1      TYR   2  -2.236   3.724   6.978
   21    HE2  TYR   2           HE2      TYR   2   1.220   1.473   5.887
   22    HH   TYR   2           HH       TYR   2   0.702   2.000   7.981
   23    H    GLU   3           H        GLU   3  -3.472   1.747   2.768
   24    HA   GLU   3           HA       GLU   3  -3.128  -1.007   3.717
   25    HB2  GLU   3          2HB       GLU   3  -5.022   1.185   4.573
   26    HB3  GLU   3          3HB       GLU   3  -5.075  -0.455   5.203
   27    HG2  GLU   3          2HG       GLU   3  -2.453   0.861   5.349
   28    HG3  GLU   3          3HG       GLU   3  -3.720   1.576   6.345
   29    H    ILE   4           H        ILE   4  -4.110   0.129   0.994
   30    HA   ILE   4           HA       ILE   4  -6.612  -1.423   0.877
   31    HB   ILE   4           HB       ILE   4  -7.208   0.732   0.220
   32   HG12  ILE   4          2HG1      ILE   4  -7.524  -1.236  -1.528
   33   HG13  ILE   4          3HG1      ILE   4  -8.013   0.411  -1.910
   34   HG21  ILE   4          1HG2      ILE   4  -5.776   1.923  -1.592
   35   HG22  ILE   4          2HG2      ILE   4  -5.246   1.944   0.090
   36   HG23  ILE   4          3HG2      ILE   4  -4.507   0.823  -1.053
   37   HD11  ILE   4          1HD1      ILE   4  -6.574  -1.047  -3.569
   38   HD12  ILE   4          2HD1      ILE   4  -6.349   0.697  -3.427
   39   HD13  ILE   4          3HD1      ILE   4  -5.249  -0.405  -2.598
   40    H    THR   5           H        THR   5  -3.408  -1.055  -0.369
   41    HA   THR   5           HA       THR   5  -3.472  -2.317  -2.802
   42    HB   THR   5           HB       THR   5  -1.189  -2.782  -2.572
   43    HG1  THR   5           HG1      THR   5  -1.265  -4.109  -0.734
   44   HG21  THR   5          1HG2      THR   5  -1.076  -0.756  -0.454
   45   HG22  THR   5          2HG2      THR   5  -2.133  -0.337  -1.802
   46   HG23  THR   5          3HG2      THR   5  -0.436  -0.716  -2.097
   47    H    THR   6           H        THR   6  -4.112  -4.247  -3.481
   48    HA   THR   6           HA       THR   6  -4.201  -6.464  -1.538
   49    HB   THR   6           HB       THR   6  -5.947  -6.794  -3.853
   50    HG1  THR   6           HG1      THR   6  -7.482  -5.218  -3.056
   51   HG21  THR   6          1HG2      THR   6  -7.596  -7.213  -1.968
   52   HG22  THR   6          2HG2      THR   6  -6.252  -6.937  -0.860
   53   HG23  THR   6          3HG2      THR   6  -6.185  -8.269  -2.014
   54    H    ILE   7           H        ILE   7  -2.324  -7.510  -2.007
   55    HA   ILE   7           HA       ILE   7  -1.989  -8.441  -4.785
   56    HB   ILE   7           HB       ILE   7   0.191  -7.935  -2.755
   57   HG12  ILE   7          2HG1      ILE   7   0.275  -6.463  -5.278
   58   HG13  ILE   7          3HG1      ILE   7  -1.154  -6.090  -4.321
   59   HG21  ILE   7          1HG2      ILE   7   1.560  -8.234  -4.976
   60   HG22  ILE   7          2HG2      ILE   7   1.073  -9.632  -4.018
   61   HG23  ILE   7          3HG2      ILE   7   0.155  -9.186  -5.457
   62   HD11  ILE   7          1HD1      ILE   7   0.163  -4.599  -3.319
   63   HD12  ILE   7          2HD1      ILE   7   0.820  -5.985  -2.448
   64   HD13  ILE   7          3HD1      ILE   7   1.639  -5.378  -3.887
   65    H    HIS   8           H        HIS   8  -0.477  -9.364  -1.703
   66    HA   HIS   8           HA       HIS   8  -0.567 -12.133  -2.320
   67    HB2  HIS   8          2HB       HIS   8   0.511 -10.453  -0.227
   68    HB3  HIS   8          3HB       HIS   8  -0.240 -11.892   0.455
   69    HD1  HIS   8           HD1      HIS   8   1.764 -11.616  -2.759
   70    HD2  HIS   8           HD2      HIS   8   1.913 -13.472   0.956
   71    HE1  HIS   8           HE1      HIS   8   3.757 -13.147  -2.851
   72    H    ASN   9           H        ASN   9  -2.910 -10.003  -1.169
   73    HA   ASN   9           HA       ASN   9  -4.360 -11.835   0.493
   74    HB2  ASN   9          2HB       ASN   9  -4.575  -9.053  -0.300
   75    HB3  ASN   9          3HB       ASN   9  -6.141  -9.855  -0.361
   76   HD21  ASN   9          1HD2      ASN   9  -3.316  -9.427   1.722
   77   HD22  ASN   9          2HD2      ASN   9  -4.194  -9.441   3.210
   78    H    LEU  10           H        LEU  10  -4.521 -10.792  -2.868
   79    HA   LEU  10           HA       LEU  10  -6.543 -12.882  -3.347
   80    HB2  LEU  10          2HB       LEU  10  -7.070 -11.430  -5.413
   81    HB3  LEU  10          3HB       LEU  10  -7.691 -10.943  -3.838
   82    HG   LEU  10           HG       LEU  10  -5.802  -9.325  -3.668
   83   HD11  LEU  10          1HD1      LEU  10  -4.146 -10.159  -5.085
   84   HD12  LEU  10          2HD1      LEU  10  -4.767  -8.746  -5.936
   85   HD13  LEU  10          3HD1      LEU  10  -5.267 -10.363  -6.430
   86   HD21  LEU  10          1HD2      LEU  10  -6.723  -7.830  -5.557
   87   HD22  LEU  10          2HD2      LEU  10  -7.821  -8.349  -4.278
   88   HD23  LEU  10          3HD2      LEU  10  -7.850  -9.155  -5.848
   89    H    PHE  11           H        PHE  11  -3.713 -13.286  -3.344
   90    HA   PHE  11           HA       PHE  11  -3.012 -13.510  -6.173
   91    HB2  PHE  11          2HB       PHE  11  -1.522 -12.962  -3.865
   92    HB3  PHE  11          3HB       PHE  11  -1.037 -14.583  -4.349
   93    HD1  PHE  11           HD1      PHE  11   0.240 -11.584  -4.445
   94    HD2  PHE  11           HD2      PHE  11  -1.194 -14.432  -7.264
   95    HE1  PHE  11           HE1      PHE  11   1.717 -10.623  -6.162
   96    HE2  PHE  11           HE2      PHE  11   0.281 -13.477  -8.985
   97    HZ   PHE  11           HZ       PHE  11   1.740 -11.570  -8.435
   98    H    ARG  12           H        ARG  12  -5.076 -15.182  -4.851
   99    HA   ARG  12           HA       ARG  12  -4.189 -17.768  -4.321
  100    HB2  ARG  12          2HB       ARG  12  -6.730 -16.478  -4.956
  101    HB3  ARG  12          3HB       ARG  12  -6.642 -18.131  -5.550
  102    HG2  ARG  12          2HG       ARG  12  -5.633 -18.088  -2.896
  103    HG3  ARG  12          3HG       ARG  12  -7.171 -17.224  -2.925
  104    HD2  ARG  12          2HD       ARG  12  -8.359 -19.079  -3.534
  105    HD3  ARG  12          3HD       ARG  12  -6.994 -19.808  -4.379
  106    HE   ARG  12           HE       ARG  12  -6.520 -19.699  -1.584
  107   HH11  ARG  12          1HH1      ARG  12  -8.303 -21.434  -4.019
  108   HH12  ARG  12          2HH1      ARG  12  -8.371 -22.905  -3.106
  109   HH21  ARG  12          1HH2      ARG  12  -6.603 -21.630  -0.373
  110   HH22  ARG  12          2HH2      ARG  12  -7.405 -23.015  -1.032
  111    H    LYS  13           H        LYS  13  -4.532 -16.081  -7.327
  112    HA   LYS  13           HA       LYS  13  -4.799 -18.126  -9.161
  113    HB2  LYS  13          2HB       LYS  13  -4.551 -15.516  -9.441
  114    HB3  LYS  13          3HB       LYS  13  -2.863 -15.918  -9.725
  115    HG2  LYS  13          2HG       LYS  13  -3.537 -16.072 -11.860
  116    HG3  LYS  13          3HG       LYS  13  -4.051 -17.688 -11.369
  117    HD2  LYS  13          2HD       LYS  13  -6.244 -16.365 -10.672
  118    HD3  LYS  13          3HD       LYS  13  -5.669 -15.256 -11.920
  119    HE2  LYS  13          2HE       LYS  13  -6.587 -16.594 -13.438
  120    HE3  LYS  13          3HE       LYS  13  -5.392 -17.817 -13.008
  121    HZ1  LYS  13          1HZ       LYS  13  -8.204 -17.722 -12.425
  122    HZ2  LYS  13          2HZ       LYS  13  -7.261 -18.072 -11.066
  123    HZ3  LYS  13          3HZ       LYS  13  -7.149 -19.044 -12.445
  124    H    LEU  14           H        LEU  14  -3.647 -19.895  -9.520
  125    HA   LEU  14           HA       LEU  14  -0.887 -20.030  -8.571
  126    HB2  LEU  14          2HB       LEU  14  -1.081 -22.408  -8.789
  127    HB3  LEU  14          3HB       LEU  14  -2.491 -21.792  -7.929
  128    HG   LEU  14           HG       LEU  14  -3.054 -21.970 -10.742
  129   HD11  LEU  14          1HD1      LEU  14  -1.214 -23.747 -10.443
  130   HD12  LEU  14          2HD1      LEU  14  -2.725 -24.218 -11.221
  131   HD13  LEU  14          3HD1      LEU  14  -2.434 -24.638  -9.533
  132   HD21  LEU  14          1HD2      LEU  14  -4.774 -21.883  -9.080
  133   HD22  LEU  14          2HD2      LEU  14  -4.139 -23.317  -8.274
  134   HD23  LEU  14          3HD2      LEU  14  -4.860 -23.453  -9.878
  135    H    THR  15           H        THR  15  -1.371 -18.453 -10.870
  136    HA   THR  15           HA       THR  15  -0.029 -20.062 -12.945
  137    HB   THR  15           HB       THR  15  -0.996 -18.530 -14.626
  138    HG1  THR  15           HG1      THR  15  -1.457 -16.968 -12.637
  139   HG21  THR  15          1HG2      THR  15  -3.224 -19.640 -12.935
  140   HG22  THR  15          2HG2      THR  15  -2.125 -20.680 -13.842
  141   HG23  THR  15          3HG2      THR  15  -3.137 -19.513 -14.692
  142    H    HIS  16           H        HIS  16   1.910 -19.375 -11.662
  143    HA   HIS  16           HA       HIS  16   2.701 -16.626 -11.720
  144    HB2  HIS  16          2HB       HIS  16   4.959 -17.603 -11.059
  145    HB3  HIS  16          3HB       HIS  16   3.619 -17.924  -9.963
  146    HD1  HIS  16           HD1      HIS  16   2.836 -20.358  -9.728
  147    HD2  HIS  16           HD2      HIS  16   5.949 -19.851 -12.433
  148    HE1  HIS  16           HE1      HIS  16   3.675 -22.675 -10.229
  149    H    ARG  17           H        ARG  17   2.239 -16.403 -14.078
  150    HA   ARG  17           HA       ARG  17   4.455 -17.383 -15.744
  151    HB2  ARG  17          2HB       ARG  17   1.603 -16.908 -16.224
  152    HB3  ARG  17          3HB       ARG  17   2.646 -16.244 -17.475
  153    HG2  ARG  17          2HG       ARG  17   3.491 -18.901 -16.800
  154    HG3  ARG  17          3HG       ARG  17   1.772 -18.885 -17.198
  155    HD2  ARG  17          2HD       ARG  17   3.889 -17.598 -18.910
  156    HD3  ARG  17          3HD       ARG  17   3.331 -19.255 -19.137
  157    HE   ARG  17           HE       ARG  17   1.195 -17.346 -19.111
  158   HH11  ARG  17          1HH1      ARG  17   3.637 -18.850 -21.084
  159   HH12  ARG  17          2HH1      ARG  17   2.786 -18.586 -22.569
  160   HH21  ARG  17          1HH2      ARG  17   0.064 -16.992 -21.060
  161   HH22  ARG  17          2HH2      ARG  17   0.754 -17.528 -22.555
  162    H    LEU  18           H        LEU  18   2.338 -14.539 -16.008
  163    HA   LEU  18           HA       LEU  18   4.755 -12.889 -16.340
  164    HB2  LEU  18          2HB       LEU  18   3.484 -11.414 -17.714
  165    HB3  LEU  18          3HB       LEU  18   3.240 -13.058 -18.299
  166    HG   LEU  18           HG       LEU  18   1.202 -12.127 -16.402
  167   HD11  LEU  18          1HD1      LEU  18   0.056 -10.785 -18.175
  168   HD12  LEU  18          2HD1      LEU  18   1.574 -10.784 -19.071
  169   HD13  LEU  18          3HD1      LEU  18   1.488 -10.025 -17.481
  170   HD21  LEU  18          1HD2      LEU  18   1.371 -14.226 -17.983
  171   HD22  LEU  18          2HD2      LEU  18   0.678 -13.112 -19.162
  172   HD23  LEU  18          3HD2      LEU  18  -0.179 -13.450 -17.658
  173    H    PHE  19           H        PHE  19   3.385 -13.648 -13.818
  174    HA   PHE  19           HA       PHE  19   2.611 -10.957 -12.901
  175    HB2  PHE  19          2HB       PHE  19   1.171 -13.315 -12.695
  176    HB3  PHE  19          3HB       PHE  19   1.907 -13.147 -11.105
  177    HD1  PHE  19           HD1      PHE  19   1.825 -10.514 -10.312
  178    HD2  PHE  19           HD2      PHE  19  -0.963 -12.516 -12.829
  179    HE1  PHE  19           HE1      PHE  19   0.091  -8.886  -9.681
  180    HE2  PHE  19           HE2      PHE  19  -2.701 -10.891 -12.203
  181    HZ   PHE  19           HZ       PHE  19  -2.175  -9.073 -10.627
  182    H    ARG  20           H        ARG  20   4.717 -13.668 -12.437
  183    HA   ARG  20           HA       ARG  20   5.999 -12.261 -10.187
  184    HB2  ARG  20          2HB       ARG  20   6.046 -15.238 -10.699
  185    HB3  ARG  20          3HB       ARG  20   6.705 -14.396  -9.303
  186    HG2  ARG  20          2HG       ARG  20   4.321 -13.619  -8.854
  187    HG3  ARG  20          3HG       ARG  20   3.831 -14.841 -10.029
  188    HD2  ARG  20          2HD       ARG  20   3.674 -15.961  -7.998
  189    HD3  ARG  20          3HD       ARG  20   5.251 -16.457  -8.612
  190    HE   ARG  20           HE       ARG  20   5.337 -14.154  -6.888
  191   HH11  ARG  20          1HH1      ARG  20   5.383 -17.632  -7.043
  192   HH12  ARG  20          2HH1      ARG  20   6.199 -17.819  -5.526
  193   HH21  ARG  20          1HH2      ARG  20   6.411 -14.387  -4.890
  194   HH22  ARG  20          2HH2      ARG  20   6.782 -15.973  -4.301
  195    H    ARG  21           H        ARG  21   6.489 -11.910 -13.040
  196    HA   ARG  21           HA       ARG  21   9.278 -12.858 -13.161
  197    HB2  ARG  21          2HB       ARG  21   7.888 -13.896 -14.895
  198    HB3  ARG  21          3HB       ARG  21   7.393 -12.305 -15.459
  199    HG2  ARG  21          2HG       ARG  21  10.135 -12.161 -15.544
  200    HG3  ARG  21          3HG       ARG  21   9.803 -13.824 -16.031
  201    HD2  ARG  21          2HD       ARG  21   8.677 -11.312 -17.260
  202    HD3  ARG  21          3HD       ARG  21   9.852 -12.410 -17.984
  203    HE   ARG  21           HE       ARG  21   7.712 -14.000 -17.490
  204   HH11  ARG  21          1HH1      ARG  21   8.139 -10.979 -19.166
  205   HH12  ARG  21          2HH1      ARG  21   6.851 -11.269 -20.288
  206   HH21  ARG  21          1HH2      ARG  21   6.014 -14.394 -18.961
  207   HH22  ARG  21          2HH2      ARG  21   5.642 -13.212 -20.170
  208    H    ASN  22           H        ASN  22   7.057 -10.194 -13.632
  209    HA   ASN  22           HA       ASN  22   9.367  -8.389 -13.937
  210    HB2  ASN  22          2HB       ASN  22   7.295  -8.719 -15.731
  211    HB3  ASN  22          3HB       ASN  22   6.793  -7.304 -14.810
  212   HD21  ASN  22          1HD2      ASN  22   9.524  -8.670 -16.584
  213   HD22  ASN  22          2HD2      ASN  22  10.139  -7.159 -17.150
  214    H    PHE  23           H        PHE  23   6.280  -8.977 -12.397
  215    HA   PHE  23           HA       PHE  23   5.944  -6.528 -11.086
  216    HB2  PHE  23          2HB       PHE  23   4.526  -8.861 -11.219
  217    HB3  PHE  23          3HB       PHE  23   5.110  -8.902  -9.559
  218    HD1  PHE  23           HD1      PHE  23   3.820  -6.232 -11.830
  219    HD2  PHE  23           HD2      PHE  23   3.528  -8.198  -8.066
  220    HE1  PHE  23           HE1      PHE  23   2.024  -4.687 -11.166
  221    HE2  PHE  23           HE2      PHE  23   1.731  -6.657  -7.397
  222    HZ   PHE  23           HZ       PHE  23   0.976  -4.899  -8.947
  223    H    GLY  24           H        GLY  24   8.078  -9.185 -10.452
  224    HA2  GLY  24          2HA       GLY  24   8.611  -8.767  -7.730
  225    HA3  GLY  24          3HA       GLY  24   9.719  -9.502  -8.880
  226    H    TYR  25           H        TYR  25   9.463  -6.878 -10.465
  227    HA   TYR  25           HA       TYR  25  11.704  -5.591  -9.139
  228    HB2  TYR  25          2HB       TYR  25  10.507  -5.511 -11.864
  229    HB3  TYR  25          3HB       TYR  25  11.393  -4.090 -11.322
  230    HD1  TYR  25           HD1      TYR  25  13.392  -4.098 -12.506
  231    HD2  TYR  25           HD2      TYR  25  12.049  -7.708 -10.700
  232    HE1  TYR  25           HE1      TYR  25  15.513  -5.184 -13.114
  233    HE2  TYR  25           HE2      TYR  25  14.166  -8.804 -11.301
  234    HH   TYR  25           HH       TYR  25  16.852  -7.358 -12.004
  235    H    THR  26           H        THR  26   8.321  -5.084  -9.670
  236    HA   THR  26           HA       THR  26   8.490  -2.310  -8.746
  237    HB   THR  26           HB       THR  26   5.815  -2.803  -9.149
  238    HG1  THR  26           HG1      THR  26   6.424  -4.876 -10.068
  239   HG21  THR  26          1HG2      THR  26   6.747  -0.827  -9.985
  240   HG22  THR  26          2HG2      THR  26   6.288  -1.717 -11.437
  241   HG23  THR  26          3HG2      THR  26   7.972  -1.689 -10.915
  242    H    LEU  27           H        LEU  27   6.056  -4.833  -8.154
  243    HA   LEU  27           HA       LEU  27   6.105  -4.088  -5.310
  244    HB2  LEU  27          2HB       LEU  27   3.974  -5.129  -7.127
  245    HB3  LEU  27          3HB       LEU  27   3.854  -5.402  -5.390
  246    HG   LEU  27           HG       LEU  27   4.143  -2.658  -6.593
  247   HD11  LEU  27          1HD1      LEU  27   1.803  -4.419  -6.450
  248   HD12  LEU  27          2HD1      LEU  27   2.098  -2.996  -7.448
  249   HD13  LEU  27          3HD1      LEU  27   1.559  -2.806  -5.779
  250   HD21  LEU  27          1HD2      LEU  27   4.627  -2.390  -4.380
  251   HD22  LEU  27          2HD2      LEU  27   3.667  -3.784  -3.885
  252   HD23  LEU  27          3HD2      LEU  27   2.868  -2.270  -4.310
  253    H    ARG  28           H        ARG  28   8.144  -5.608  -5.646
  254    HA   ARG  28           HA       ARG  28   7.935  -8.348  -5.895
  255    HB2  ARG  28          2HB       ARG  28   9.988  -6.705  -5.447
  256    HB3  ARG  28          3HB       ARG  28   9.775  -7.297  -3.805
  257    HG2  ARG  28          2HG       ARG  28  10.058  -9.584  -4.567
  258    HG3  ARG  28          3HG       ARG  28  10.208  -9.023  -6.234
  259    HD2  ARG  28          2HD       ARG  28  12.401  -8.871  -5.895
  260    HD3  ARG  28          3HD       ARG  28  12.070  -7.528  -4.801
  261    HE   ARG  28           HE       ARG  28  12.629  -8.884  -3.053
  262   HH11  ARG  28          1HH1      ARG  28  11.889 -10.870  -5.815
  263   HH12  ARG  28          2HH1      ARG  28  12.363 -12.347  -5.044
  264   HH21  ARG  28          1HH2      ARG  28  13.256 -10.822  -2.027
  265   HH22  ARG  28          2HH2      ARG  28  13.139 -12.319  -2.888
  Start of MODEL   18
    1    H1   LYS   1           H        LYS   1  -9.439   4.315  -0.759
    2    HA   LYS   1           HA       LYS   1  -9.748   2.868   1.790
    3    HB2  LYS   1          2HB       LYS   1  -8.927   1.861  -0.937
    4    HB3  LYS   1          3HB       LYS   1  -8.805   0.903   0.533
    5    HG2  LYS   1          2HG       LYS   1 -10.926   0.300   0.370
    6    HG3  LYS   1          3HG       LYS   1 -11.444   1.987   0.316
    7    HD2  LYS   1          2HD       LYS   1 -10.939   2.011  -2.114
    8    HD3  LYS   1          3HD       LYS   1 -10.563   0.289  -2.018
    9    HE2  LYS   1          2HE       LYS   1 -13.095   0.722  -0.799
   10    HE3  LYS   1          3HE       LYS   1 -13.090   1.538  -2.362
   11    HZ1  LYS   1          1HZ       LYS   1 -13.722  -0.981  -2.146
   12    HZ2  LYS   1          2HZ       LYS   1 -12.046  -1.194  -2.225
   13    HZ3  LYS   1          3HZ       LYS   1 -12.859  -0.412  -3.486
   14    H    TYR   2           H        TYR   2  -7.929   2.273   2.940
   15    HA   TYR   2           HA       TYR   2  -5.408   3.504   2.039
   16    HB2  TYR   2          2HB       TYR   2  -6.305   4.613   4.018
   17    HB3  TYR   2          3HB       TYR   2  -6.417   3.071   4.858
   18    HD1  TYR   2           HD1      TYR   2  -3.645   4.442   2.780
   19    HD2  TYR   2           HD2      TYR   2  -4.942   3.244   6.651
   20    HE1  TYR   2           HE1      TYR   2  -1.358   4.747   3.634
   21    HE2  TYR   2           HE2      TYR   2  -2.660   3.547   7.516
   22    HH   TYR   2           HH       TYR   2   0.023   4.370   5.372
   23    H    GLU   3           H        GLU   3  -6.199   1.156   4.589
   24    HA   GLU   3           HA       GLU   3  -3.977  -0.507   3.692
   25    HB2  GLU   3          2HB       GLU   3  -5.343  -0.025   6.217
   26    HB3  GLU   3          3HB       GLU   3  -5.129  -1.741   5.899
   27    HG2  GLU   3          2HG       GLU   3  -2.793   0.034   5.488
   28    HG3  GLU   3          3HG       GLU   3  -3.301  -0.291   7.145
   29    H    ILE   4           H        ILE   4  -7.473  -0.627   4.081
   30    HA   ILE   4           HA       ILE   4  -7.720  -3.390   3.397
   31    HB   ILE   4           HB       ILE   4 -10.029  -3.112   3.519
   32   HG12  ILE   4          2HG1      ILE   4 -10.226  -1.353   1.817
   33   HG13  ILE   4          3HG1      ILE   4 -11.189  -0.967   3.239
   34   HG21  ILE   4          1HG2      ILE   4  -8.954  -0.901   5.263
   35   HG22  ILE   4          2HG2      ILE   4 -10.440  -1.816   5.513
   36   HG23  ILE   4          3HG2      ILE   4  -8.876  -2.620   5.648
   37   HD11  ILE   4          1HD1      ILE   4 -10.076   1.007   2.443
   38   HD12  ILE   4          2HD1      ILE   4  -9.393   0.538   4.000
   39   HD13  ILE   4          3HD1      ILE   4  -8.512   0.196   2.511
   40    H    THR   5           H        THR   5  -6.920  -0.721   1.586
   41    HA   THR   5           HA       THR   5  -8.339  -0.882  -0.768
   42    HB   THR   5           HB       THR   5  -6.684   0.859  -0.406
   43    HG1  THR   5           HG1      THR   5  -7.108  -0.335  -2.641
   44   HG21  THR   5          1HG2      THR   5  -5.039  -0.790   0.692
   45   HG22  THR   5          2HG2      THR   5  -4.371   0.510  -0.296
   46   HG23  THR   5          3HG2      THR   5  -4.493  -1.122  -0.951
   47    H    THR   6           H        THR   6  -8.687  -2.478  -2.153
   48    HA   THR   6           HA       THR   6  -6.971  -4.828  -2.120
   49    HB   THR   6           HB       THR   6  -8.969  -5.156  -4.079
   50    HG1  THR   6           HG1      THR   6 -10.242  -3.536  -3.334
   51   HG21  THR   6          1HG2      THR   6  -9.665  -6.938  -2.735
   52   HG22  THR   6          2HG2      THR   6  -9.221  -6.108  -1.244
   53   HG23  THR   6          3HG2      THR   6  -7.966  -6.739  -2.309
   54    H    ILE   7           H        ILE   7  -5.193  -4.705  -3.338
   55    HA   ILE   7           HA       ILE   7  -5.458  -3.623  -6.067
   56    HB   ILE   7           HB       ILE   7  -2.783  -3.495  -5.623
   57   HG12  ILE   7          2HG1      ILE   7  -3.945  -2.452  -3.056
   58   HG13  ILE   7          3HG1      ILE   7  -3.402  -4.122  -3.175
   59   HG21  ILE   7          1HG2      ILE   7  -3.725  -1.647  -6.596
   60   HG22  ILE   7          2HG2      ILE   7  -5.005  -1.529  -5.390
   61   HG23  ILE   7          3HG2      ILE   7  -3.367  -1.013  -4.990
   62   HD11  ILE   7          1HD1      ILE   7  -1.231  -3.550  -3.163
   63   HD12  ILE   7          2HD1      ILE   7  -1.497  -2.090  -4.116
   64   HD13  ILE   7          3HD1      ILE   7  -1.842  -2.089  -2.387
   65    H    HIS   8           H        HIS   8  -2.757  -5.352  -4.591
   66    HA   HIS   8           HA       HIS   8  -3.207  -7.551  -6.500
   67    HB2  HIS   8          2HB       HIS   8  -0.822  -5.914  -5.976
   68    HB3  HIS   8          3HB       HIS   8  -0.516  -7.648  -6.005
   69    HD1  HIS   8           HD1      HIS   8   0.234  -5.307  -8.181
   70    HD2  HIS   8           HD2      HIS   8  -2.569  -8.356  -8.520
   71    HE1  HIS   8           HE1      HIS   8  -0.095  -5.648 -10.651
   72    H    ASN   9           H        ASN   9  -3.455  -6.833  -3.380
   73    HA   ASN   9           HA       ASN   9  -1.973  -8.571  -1.872
   74    HB2  ASN   9          2HB       ASN   9  -3.777  -6.902  -1.124
   75    HB3  ASN   9          3HB       ASN   9  -4.926  -8.210  -1.391
   76   HD21  ASN   9          1HD2      ASN   9  -4.381 -10.283  -0.276
   77   HD22  ASN   9          2HD2      ASN   9  -3.750 -10.173   1.329
   78    H    LEU  10           H        LEU  10  -4.624  -9.310  -4.018
   79    HA   LEU  10           HA       LEU  10  -4.986 -11.998  -3.086
   80    HB2  LEU  10          2HB       LEU  10  -6.200 -10.226  -5.023
   81    HB3  LEU  10          3HB       LEU  10  -5.981 -11.846  -5.682
   82    HG   LEU  10           HG       LEU  10  -7.533 -11.100  -3.205
   83   HD11  LEU  10          1HD1      LEU  10  -8.452 -10.696  -5.593
   84   HD12  LEU  10          2HD1      LEU  10  -9.463 -11.518  -4.406
   85   HD13  LEU  10          3HD1      LEU  10  -8.619 -12.451  -5.641
   86   HD21  LEU  10          1HD2      LEU  10  -7.549 -13.234  -2.562
   87   HD22  LEU  10          2HD2      LEU  10  -6.186 -13.466  -3.657
   88   HD23  LEU  10          3HD2      LEU  10  -7.827 -13.811  -4.206
   89    H    PHE  11           H        PHE  11  -2.510 -12.252  -3.244
   90    HA   PHE  11           HA       PHE  11  -1.434 -12.749  -5.858
   91    HB2  PHE  11          2HB       PHE  11  -0.425 -13.093  -3.053
   92    HB3  PHE  11          3HB       PHE  11   0.448 -13.816  -4.400
   93    HD1  PHE  11           HD1      PHE  11  -0.387 -10.747  -2.664
   94    HD2  PHE  11           HD2      PHE  11   1.454 -12.390  -6.132
   95    HE1  PHE  11           HE1      PHE  11   0.733  -8.597  -3.083
   96    HE2  PHE  11           HE2      PHE  11   2.578 -10.243  -6.556
   97    HZ   PHE  11           HZ       PHE  11   2.219  -8.343  -5.030
   98    H    ARG  12           H        ARG  12  -3.475 -14.223  -6.144
   99    HA   ARG  12           HA       ARG  12  -3.359 -16.843  -5.029
  100    HB2  ARG  12          2HB       ARG  12  -5.003 -15.428  -7.036
  101    HB3  ARG  12          3HB       ARG  12  -4.884 -17.170  -7.243
  102    HG2  ARG  12          2HG       ARG  12  -5.386 -16.643  -4.501
  103    HG3  ARG  12          3HG       ARG  12  -6.531 -15.709  -5.467
  104    HD2  ARG  12          2HD       ARG  12  -6.034 -18.570  -6.150
  105    HD3  ARG  12          3HD       ARG  12  -7.062 -18.181  -4.771
  106    HE   ARG  12           HE       ARG  12  -7.691 -17.838  -7.558
  107   HH11  ARG  12          1HH1      ARG  12  -8.396 -16.813  -4.307
  108   HH12  ARG  12          2HH1      ARG  12  -9.993 -16.260  -4.688
  109   HH21  ARG  12          1HH2      ARG  12  -9.792 -17.114  -8.073
  110   HH22  ARG  12          2HH2      ARG  12 -10.786 -16.433  -6.830
  111    H    LYS  13           H        LYS  13  -3.214 -16.050  -8.490
  112    HA   LYS  13           HA       LYS  13  -1.247 -18.205  -8.821
  113    HB2  LYS  13          2HB       LYS  13  -3.444 -17.135 -10.471
  114    HB3  LYS  13          3HB       LYS  13  -1.978 -17.534 -11.356
  115    HG2  LYS  13          2HG       LYS  13  -3.255 -19.477 -11.450
  116    HG3  LYS  13          3HG       LYS  13  -2.086 -19.792 -10.165
  117    HD2  LYS  13          2HD       LYS  13  -3.797 -19.114  -8.505
  118    HD3  LYS  13          3HD       LYS  13  -4.959 -18.932  -9.822
  119    HE2  LYS  13          2HE       LYS  13  -3.482 -21.498  -9.285
  120    HE3  LYS  13          3HE       LYS  13  -5.036 -21.118  -8.544
  121    HZ1  LYS  13          1HZ       LYS  13  -4.578 -22.225 -11.047
  122    HZ2  LYS  13          2HZ       LYS  13  -5.176 -20.667 -11.323
  123    HZ3  LYS  13          3HZ       LYS  13  -6.062 -21.758 -10.382
  124    H    LEU  14           H        LEU  14   0.495 -16.842  -8.077
  125    HA   LEU  14           HA       LEU  14   1.317 -14.811 -10.045
  126    HB2  LEU  14          2HB       LEU  14   2.568 -13.733  -8.335
  127    HB3  LEU  14          3HB       LEU  14   0.947 -14.029  -7.711
  128    HG   LEU  14           HG       LEU  14   3.114 -15.979  -7.080
  129   HD11  LEU  14          1HD1      LEU  14   4.262 -14.647  -5.707
  130   HD12  LEU  14          2HD1      LEU  14   2.804 -13.866  -5.098
  131   HD13  LEU  14          3HD1      LEU  14   3.537 -13.312  -6.603
  132   HD21  LEU  14          1HD2      LEU  14   1.362 -16.809  -5.978
  133   HD22  LEU  14          2HD2      LEU  14   0.424 -15.331  -6.190
  134   HD23  LEU  14          3HD2      LEU  14   1.568 -15.466  -4.854
  135    H    THR  15           H        THR  15   1.706 -17.685 -10.302
  136    HA   THR  15           HA       THR  15   4.546 -18.093  -9.819
  137    HB   THR  15           HB       THR  15   4.077 -20.340 -10.939
  138    HG1  THR  15           HG1      THR  15   1.363 -19.676 -10.444
  139   HG21  THR  15          1HG2      THR  15   4.265 -20.488  -8.640
  140   HG22  THR  15          2HG2      THR  15   2.618 -21.067  -8.891
  141   HG23  THR  15          3HG2      THR  15   2.899 -19.411  -8.354
  142    H    HIS  16           H        HIS  16   2.668 -18.983 -12.691
  143    HA   HIS  16           HA       HIS  16   4.684 -17.601 -14.339
  144    HB2  HIS  16          2HB       HIS  16   4.107 -19.427 -16.063
  145    HB3  HIS  16          3HB       HIS  16   5.130 -19.877 -14.701
  146    HD1  HIS  16           HD1      HIS  16   1.346 -19.792 -15.182
  147    HD2  HIS  16           HD2      HIS  16   4.368 -22.317 -13.858
  148    HE1  HIS  16           HE1      HIS  16   0.188 -21.900 -14.449
  149    H    ARG  17           H        ARG  17   1.658 -17.320 -13.336
  150    HA   ARG  17           HA       ARG  17   0.147 -17.062 -15.720
  151    HB2  ARG  17          2HB       ARG  17  -1.007 -17.355 -13.636
  152    HB3  ARG  17          3HB       ARG  17  -0.244 -15.926 -12.952
  153    HG2  ARG  17          2HG       ARG  17  -1.684 -14.509 -13.954
  154    HG3  ARG  17          3HG       ARG  17  -1.825 -15.504 -15.404
  155    HD2  ARG  17          2HD       ARG  17  -3.685 -16.470 -14.651
  156    HD3  ARG  17          3HD       ARG  17  -2.932 -16.849 -13.102
  157    HE   ARG  17           HE       ARG  17  -4.028 -15.066 -12.196
  158   HH11  ARG  17          1HH1      ARG  17  -3.922 -14.668 -15.653
  159   HH12  ARG  17          2HH1      ARG  17  -4.928 -13.257 -15.652
  160   HH21  ARG  17          1HH2      ARG  17  -5.353 -13.210 -12.182
  161   HH22  ARG  17          2HH2      ARG  17  -5.740 -12.428 -13.677
  162    H    LEU  18           H        LEU  18   0.730 -14.342 -13.534
  163    HA   LEU  18           HA       LEU  18   1.487 -12.721 -15.876
  164    HB2  LEU  18          2HB       LEU  18   0.294 -10.881 -15.026
  165    HB3  LEU  18          3HB       LEU  18  -0.788 -12.266 -14.895
  166    HG   LEU  18           HG       LEU  18   0.428 -12.198 -12.426
  167   HD11  LEU  18          1HD1      LEU  18  -0.169  -9.364 -13.260
  168   HD12  LEU  18          2HD1      LEU  18   1.439 -10.025 -12.968
  169   HD13  LEU  18          3HD1      LEU  18   0.279  -9.911 -11.645
  170   HD21  LEU  18          1HD2      LEU  18  -2.188 -11.195 -13.486
  171   HD22  LEU  18          2HD2      LEU  18  -1.796 -11.074 -11.770
  172   HD23  LEU  18          3HD2      LEU  18  -1.849 -12.653 -12.554
  173    H    PHE  19           H        PHE  19   2.160 -13.625 -12.608
  174    HA   PHE  19           HA       PHE  19   4.149 -11.539 -12.245
  175    HB2  PHE  19          2HB       PHE  19   3.039 -13.724 -10.514
  176    HB3  PHE  19          3HB       PHE  19   4.550 -12.934 -10.073
  177    HD1  PHE  19           HD1      PHE  19   4.540 -10.410  -9.803
  178    HD2  PHE  19           HD2      PHE  19   0.988 -12.745 -10.008
  179    HE1  PHE  19           HE1      PHE  19   3.277  -8.574  -8.759
  180    HE2  PHE  19           HE2      PHE  19  -0.281 -10.913  -8.966
  181    HZ   PHE  19           HZ       PHE  19   0.863  -8.824  -8.341
  182    H    ARG  20           H        ARG  20   4.201 -14.029 -14.156
  183    HA   ARG  20           HA       ARG  20   6.234 -15.758 -13.494
  184    HB2  ARG  20          2HB       ARG  20   4.905 -16.017 -15.517
  185    HB3  ARG  20          3HB       ARG  20   5.620 -14.563 -16.201
  186    HG2  ARG  20          2HG       ARG  20   6.717 -16.357 -17.238
  187    HG3  ARG  20          3HG       ARG  20   7.851 -15.745 -16.033
  188    HD2  ARG  20          2HD       ARG  20   6.691 -17.556 -14.513
  189    HD3  ARG  20          3HD       ARG  20   6.295 -18.285 -16.069
  190    HE   ARG  20           HE       ARG  20   8.847 -18.242 -14.799
  191   HH11  ARG  20          1HH1      ARG  20   7.262 -18.226 -17.899
  192   HH12  ARG  20          2HH1      ARG  20   8.599 -18.944 -18.733
  193   HH21  ARG  20          1HH2      ARG  20  10.615 -19.188 -15.886
  194   HH22  ARG  20          2HH2      ARG  20  10.506 -19.492 -17.587
  195    H    ARG  21           H        ARG  21   6.836 -13.099 -15.776
  196    HA   ARG  21           HA       ARG  21   9.621 -13.046 -15.053
  197    HB2  ARG  21          2HB       ARG  21   7.914 -11.600 -17.046
  198    HB3  ARG  21          3HB       ARG  21   9.519 -10.988 -16.670
  199    HG2  ARG  21          2HG       ARG  21   9.284 -13.865 -17.332
  200    HG3  ARG  21          3HG       ARG  21   9.070 -12.702 -18.642
  201    HD2  ARG  21          2HD       ARG  21  11.307 -11.845 -17.168
  202    HD3  ARG  21          3HD       ARG  21  11.484 -13.587 -17.376
  203    HE   ARG  21           HE       ARG  21  11.746 -11.587 -19.391
  204   HH11  ARG  21          1HH1      ARG  21  10.772 -14.880 -18.821
  205   HH12  ARG  21          2HH1      ARG  21  11.102 -15.396 -20.442
  206   HH21  ARG  21          1HH2      ARG  21  12.185 -12.253 -21.528
  207   HH22  ARG  21          2HH2      ARG  21  11.907 -13.901 -21.980
  208    H    ASN  22           H        ASN  22   6.759 -11.277 -14.226
  209    HA   ASN  22           HA       ASN  22   7.802  -8.848 -13.383
  210    HB2  ASN  22          2HB       ASN  22   5.333 -10.190 -13.196
  211    HB3  ASN  22          3HB       ASN  22   5.767  -9.747 -11.547
  212   HD21  ASN  22          1HD2      ASN  22   5.419  -7.731 -10.904
  213   HD22  ASN  22          2HD2      ASN  22   4.983  -6.413 -11.933
  214    H    PHE  23           H        PHE  23   8.027 -11.990 -11.931
  215    HA   PHE  23           HA       PHE  23   8.540 -11.395  -9.283
  216    HB2  PHE  23          2HB       PHE  23   9.051 -13.620 -11.081
  217    HB3  PHE  23          3HB       PHE  23  10.332 -13.444  -9.886
  218    HD1  PHE  23           HD1      PHE  23  10.022 -15.118  -8.331
  219    HD2  PHE  23           HD2      PHE  23   6.668 -12.839  -9.625
  220    HE1  PHE  23           HE1      PHE  23   8.614 -16.246  -6.657
  221    HE2  PHE  23           HE2      PHE  23   5.255 -13.962  -7.953
  222    HZ   PHE  23           HZ       PHE  23   6.228 -15.667  -6.466
  223    H    GLY  24           H        GLY  24  10.565 -10.937 -12.082
  224    HA2  GLY  24          2HA       GLY  24  13.087 -10.745 -10.963
  225    HA3  GLY  24          3HA       GLY  24  12.543  -9.799 -12.341
  226    H    TYR  25           H        TYR  25  10.419  -8.516 -10.704
  227    HA   TYR  25           HA       TYR  25  12.009  -6.321  -9.761
  228    HB2  TYR  25          2HB       TYR  25   9.098  -6.868 -10.102
  229    HB3  TYR  25          3HB       TYR  25   9.571  -5.588  -8.990
  230    HD1  TYR  25           HD1      TYR  25   8.978  -3.613 -10.078
  231    HD2  TYR  25           HD2      TYR  25  11.128  -6.594 -12.221
  232    HE1  TYR  25           HE1      TYR  25   9.233  -2.061 -11.969
  233    HE2  TYR  25           HE2      TYR  25  11.390  -5.050 -14.117
  234    HH   TYR  25           HH       TYR  25   9.642  -2.539 -14.698
  235    H    THR  26           H        THR  26  10.234  -8.968  -8.320
  236    HA   THR  26           HA       THR  26  10.461  -7.916  -5.636
  237    HB   THR  26           HB       THR  26   9.764 -10.516  -5.265
  238    HG1  THR  26           HG1      THR  26   9.803 -10.794  -7.609
  239   HG21  THR  26          1HG2      THR  26   8.516  -8.650  -4.390
  240   HG22  THR  26          2HG2      THR  26   7.410  -9.698  -5.278
  241   HG23  THR  26          3HG2      THR  26   7.980  -8.197  -6.007
  242    H    LEU  27           H        LEU  27  12.142 -10.200  -7.685
  243    HA   LEU  27           HA       LEU  27  13.686 -11.402  -5.611
  244    HB2  LEU  27          2HB       LEU  27  13.682 -11.420  -8.575
  245    HB3  LEU  27          3HB       LEU  27  15.179 -11.882  -7.768
  246    HG   LEU  27           HG       LEU  27  13.723 -13.795  -8.415
  247   HD11  LEU  27          1HD1      LEU  27  13.619 -14.445  -5.725
  248   HD12  LEU  27          2HD1      LEU  27  14.918 -13.258  -5.835
  249   HD13  LEU  27          3HD1      LEU  27  14.972 -14.716  -6.824
  250   HD21  LEU  27          1HD2      LEU  27  11.550 -12.812  -8.048
  251   HD22  LEU  27          2HD2      LEU  27  11.893 -12.612  -6.329
  252   HD23  LEU  27          3HD2      LEU  27  11.733 -14.230  -7.015
  253    H    ARG  28           H        ARG  28  14.029  -8.565  -7.605
  254    HA   ARG  28           HA       ARG  28  16.807  -8.153  -7.113
  255    HB2  ARG  28          2HB       ARG  28  14.830  -6.987  -8.733
  256    HB3  ARG  28          3HB       ARG  28  15.379  -5.705  -7.662
  257    HG2  ARG  28          2HG       ARG  28  17.330  -5.510  -8.720
  258    HG3  ARG  28          3HG       ARG  28  17.567  -7.258  -8.791
  259    HD2  ARG  28          2HD       ARG  28  16.798  -7.385 -10.888
  260    HD3  ARG  28          3HD       ARG  28  15.440  -6.314 -10.546
  261    HE   ARG  28           HE       ARG  28  16.627  -4.618 -11.492
  262   HH11  ARG  28          1HH1      ARG  28  18.856  -7.095 -10.485
  263   HH12  ARG  28          2HH1      ARG  28  20.242  -6.305 -11.161
  264   HH21  ARG  28          1HH2      ARG  28  18.443  -3.569 -12.388
  265   HH22  ARG  28          2HH2      ARG  28  20.006  -4.299 -12.243
  Start of MODEL   19
    1    H1   LYS   1           H        LYS   1 -10.777   1.966   6.084
    2    HA   LYS   1           HA       LYS   1  -8.595   1.097   6.441
    3    HB2  LYS   1          2HB       LYS   1 -10.826  -0.484   6.960
    4    HB3  LYS   1          3HB       LYS   1  -9.699  -1.581   6.171
    5    HG2  LYS   1          2HG       LYS   1  -9.016  -1.864   8.308
    6    HG3  LYS   1          3HG       LYS   1  -8.012  -0.472   7.895
    7    HD2  LYS   1          2HD       LYS   1 -10.178   0.832   8.734
    8    HD3  LYS   1          3HD       LYS   1 -10.387  -0.652   9.666
    9    HE2  LYS   1          2HE       LYS   1  -7.758   0.786   9.623
   10    HE3  LYS   1          3HE       LYS   1  -9.051   1.300  10.705
   11    HZ1  LYS   1          1HZ       LYS   1  -7.329  -0.386  11.547
   12    HZ2  LYS   1          2HZ       LYS   1  -8.194  -1.520  10.637
   13    HZ3  LYS   1          3HZ       LYS   1  -8.962  -0.671  11.882
   14    H    TYR   2           H        TYR   2  -7.609  -1.417   5.801
   15    HA   TYR   2           HA       TYR   2  -6.968  -1.044   2.957
   16    HB2  TYR   2          2HB       TYR   2  -5.150  -0.970   4.767
   17    HB3  TYR   2          3HB       TYR   2  -5.387  -2.708   4.910
   18    HD1  TYR   2           HD1      TYR   2  -4.647  -0.077   2.370
   19    HD2  TYR   2           HD2      TYR   2  -4.173  -4.139   3.542
   20    HE1  TYR   2           HE1      TYR   2  -3.105  -0.434   0.487
   21    HE2  TYR   2           HE2      TYR   2  -2.628  -4.507   1.664
   22    HH   TYR   2           HH       TYR   2  -2.265  -3.375  -0.668
   23    H    GLU   3           H        GLU   3  -6.907  -3.833   5.176
   24    HA   GLU   3           HA       GLU   3  -7.329  -5.791   3.267
   25    HB2  GLU   3          2HB       GLU   3  -8.105  -5.741   6.185
   26    HB3  GLU   3          3HB       GLU   3  -8.201  -7.180   5.179
   27    HG2  GLU   3          2HG       GLU   3  -5.866  -7.274   4.909
   28    HG3  GLU   3          3HG       GLU   3  -5.651  -5.640   5.534
   29    H    ILE   4           H        ILE   4  -9.552  -3.521   4.561
   30    HA   ILE   4           HA       ILE   4 -11.974  -4.906   4.219
   31    HB   ILE   4           HB       ILE   4 -13.036  -2.677   4.116
   32   HG12  ILE   4          2HG1      ILE   4 -11.248  -0.781   4.639
   33   HG13  ILE   4          3HG1      ILE   4 -10.197  -1.850   3.716
   34   HG21  ILE   4          1HG2      ILE   4 -10.959  -3.170   6.232
   35   HG22  ILE   4          2HG2      ILE   4 -12.139  -1.865   6.339
   36   HG23  ILE   4          3HG2      ILE   4 -12.682  -3.542   6.284
   37   HD11  ILE   4          1HD1      ILE   4 -12.474  -1.687   2.172
   38   HD12  ILE   4          2HD1      ILE   4 -12.278  -0.056   2.813
   39   HD13  ILE   4          3HD1      ILE   4 -10.964  -0.814   1.913
   40    H    THR   5           H        THR   5  -9.853  -3.341   1.959
   41    HA   THR   5           HA       THR   5 -11.821  -3.765  -0.191
   42    HB   THR   5           HB       THR   5 -11.245  -1.470  -0.192
   43    HG1  THR   5           HG1      THR   5  -9.482  -2.635  -2.101
   44   HG21  THR   5          1HG2      THR   5  -8.343  -2.303  -0.068
   45   HG22  THR   5          2HG2      THR   5  -9.273  -1.609   1.260
   46   HG23  THR   5          3HG2      THR   5  -8.941  -0.648  -0.181
   47    H    THR   6           H        THR   6 -11.460  -5.450  -1.462
   48    HA   THR   6           HA       THR   6  -8.732  -6.533  -1.641
   49    HB   THR   6           HB       THR   6 -10.553  -8.340  -2.825
   50    HG1  THR   6           HG1      THR   6 -12.114  -8.585  -1.256
   51   HG21  THR   6          1HG2      THR   6  -9.988  -9.386  -0.359
   52   HG22  THR   6          2HG2      THR   6  -8.677  -8.228  -0.579
   53   HG23  THR   6          3HG2      THR   6  -8.941  -9.499  -1.772
   54    H    ILE   7           H        ILE   7  -7.677  -5.868  -3.392
   55    HA   ILE   7           HA       ILE   7  -9.175  -5.608  -5.917
   56    HB   ILE   7           HB       ILE   7  -6.513  -4.320  -5.629
   57   HG12  ILE   7          2HG1      ILE   7  -7.998  -2.270  -4.788
   58   HG13  ILE   7          3HG1      ILE   7  -8.945  -3.572  -4.077
   59   HG21  ILE   7          1HG2      ILE   7  -8.501  -4.357  -7.534
   60   HG22  ILE   7          2HG2      ILE   7  -8.726  -2.798  -6.743
   61   HG23  ILE   7          3HG2      ILE   7  -7.164  -3.209  -7.452
   62   HD11  ILE   7          1HD1      ILE   7  -6.157  -3.975  -3.547
   63   HD12  ILE   7          2HD1      ILE   7  -6.658  -2.362  -3.038
   64   HD13  ILE   7          3HD1      ILE   7  -7.499  -3.783  -2.420
   65    H    HIS   8           H        HIS   8  -5.752  -6.008  -4.996
   66    HA   HIS   8           HA       HIS   8  -5.599  -8.234  -6.922
   67    HB2  HIS   8          2HB       HIS   8  -3.833  -5.887  -6.496
   68    HB3  HIS   8          3HB       HIS   8  -3.039  -7.422  -6.832
   69    HD1  HIS   8           HD1      HIS   8  -6.315  -6.784  -8.461
   70    HD2  HIS   8           HD2      HIS   8  -2.277  -6.427  -9.371
   71    HE1  HIS   8           HE1      HIS   8  -6.215  -6.429 -10.948
   72    H    ASN   9           H        ASN   9  -5.920  -7.873  -3.840
   73    HA   ASN   9           HA       ASN   9  -3.822  -8.730  -2.370
   74    HB2  ASN   9          2HB       ASN   9  -6.454  -8.498  -1.863
   75    HB3  ASN   9          3HB       ASN   9  -6.325 -10.254  -1.895
   76   HD21  ASN   9          1HD2      ASN   9  -6.740  -8.165   0.261
   77   HD22  ASN   9          2HD2      ASN   9  -5.596  -8.596   1.482
   78    H    LEU  10           H        LEU  10  -5.722 -10.684  -4.594
   79    HA   LEU  10           HA       LEU  10  -4.449 -13.153  -3.886
   80    HB2  LEU  10          2HB       LEU  10  -6.326 -12.265  -6.032
   81    HB3  LEU  10          3HB       LEU  10  -5.507 -13.818  -6.180
   82    HG   LEU  10           HG       LEU  10  -7.925 -13.510  -5.056
   83   HD11  LEU  10          1HD1      LEU  10  -7.332 -15.653  -3.774
   84   HD12  LEU  10          2HD1      LEU  10  -5.735 -15.480  -4.501
   85   HD13  LEU  10          3HD1      LEU  10  -7.157 -15.657  -5.529
   86   HD21  LEU  10          1HD2      LEU  10  -7.008 -12.091  -3.252
   87   HD22  LEU  10          2HD2      LEU  10  -5.999 -13.441  -2.735
   88   HD23  LEU  10          3HD2      LEU  10  -7.757 -13.570  -2.650
   89    H    PHE  11           H        PHE  11  -2.317 -11.753  -4.164
   90    HA   PHE  11           HA       PHE  11  -1.310 -11.482  -6.816
   91    HB2  PHE  11          2HB       PHE  11  -0.118 -11.309  -4.071
   92    HB3  PHE  11          3HB       PHE  11   0.938 -11.361  -5.479
   93    HD1  PHE  11           HD1      PHE  11  -1.191  -9.331  -3.434
   94    HD2  PHE  11           HD2      PHE  11   0.673  -9.592  -7.252
   95    HE1  PHE  11           HE1      PHE  11  -1.502  -6.910  -3.748
   96    HE2  PHE  11           HE2      PHE  11   0.366  -7.172  -7.571
   97    HZ   PHE  11           HZ       PHE  11  -0.721  -5.828  -5.818
   98    H    ARG  12           H        ARG  12  -1.536 -14.089  -4.591
   99    HA   ARG  12           HA       ARG  12   0.472 -15.658  -6.032
  100    HB2  ARG  12          2HB       ARG  12  -1.047 -16.211  -3.479
  101    HB3  ARG  12          3HB       ARG  12   0.087 -17.335  -4.217
  102    HG2  ARG  12          2HG       ARG  12   1.909 -16.125  -3.597
  103    HG3  ARG  12          3HG       ARG  12   1.045 -14.587  -3.654
  104    HD2  ARG  12          2HD       ARG  12   0.053 -16.440  -1.618
  105    HD3  ARG  12          3HD       ARG  12   1.726 -15.938  -1.377
  106    HE   ARG  12           HE       ARG  12   0.174 -13.670  -1.932
  107   HH11  ARG  12          1HH1      ARG  12   0.613 -16.061   0.561
  108   HH12  ARG  12          2HH1      ARG  12   0.128 -15.002   1.843
  109   HH21  ARG  12          1HH2      ARG  12  -0.466 -12.266  -0.252
  110   HH22  ARG  12          2HH2      ARG  12  -0.486 -12.844   1.380
  111    H    LYS  13           H        LYS  13  -2.293 -14.889  -6.999
  112    HA   LYS  13           HA       LYS  13  -3.542 -17.520  -7.257
  113    HB2  LYS  13          2HB       LYS  13  -5.029 -15.696  -6.675
  114    HB3  LYS  13          3HB       LYS  13  -4.484 -14.763  -8.063
  115    HG2  LYS  13          2HG       LYS  13  -6.696 -15.817  -8.380
  116    HG3  LYS  13          3HG       LYS  13  -5.502 -16.314  -9.582
  117    HD2  LYS  13          2HD       LYS  13  -5.692 -18.454  -8.990
  118    HD3  LYS  13          3HD       LYS  13  -5.459 -18.064  -7.284
  119    HE2  LYS  13          2HE       LYS  13  -7.723 -17.835  -6.892
  120    HE3  LYS  13          3HE       LYS  13  -8.087 -17.493  -8.583
  121    HZ1  LYS  13          1HZ       LYS  13  -8.769 -19.611  -8.593
  122    HZ2  LYS  13          2HZ       LYS  13  -7.881 -20.033  -7.217
  123    HZ3  LYS  13          3HZ       LYS  13  -7.125 -19.987  -8.730
  124    H    LEU  14           H        LEU  14  -3.323 -14.872  -9.609
  125    HA   LEU  14           HA       LEU  14  -2.247 -16.805 -11.555
  126    HB2  LEU  14          2HB       LEU  14  -3.458 -15.585 -13.297
  127    HB3  LEU  14          3HB       LEU  14  -4.541 -16.273 -12.088
  128    HG   LEU  14           HG       LEU  14  -4.262 -13.787 -11.095
  129   HD11  LEU  14          1HD1      LEU  14  -4.354 -13.270 -14.042
  130   HD12  LEU  14          2HD1      LEU  14  -2.820 -13.298 -13.173
  131   HD13  LEU  14          3HD1      LEU  14  -4.069 -12.140 -12.718
  132   HD21  LEU  14          1HD2      LEU  14  -6.295 -13.575 -13.033
  133   HD22  LEU  14          2HD2      LEU  14  -6.455 -14.020 -11.333
  134   HD23  LEU  14          3HD2      LEU  14  -6.221 -15.271 -12.555
  135    H    THR  15           H        THR  15  -2.175 -13.545 -10.299
  136    HA   THR  15           HA       THR  15  -0.490 -12.343 -12.179
  137    HB   THR  15           HB       THR  15  -0.047 -10.649 -10.565
  138    HG1  THR  15           HG1      THR  15  -0.245 -12.739  -8.807
  139   HG21  THR  15          1HG2      THR  15  -2.552 -11.297 -11.275
  140   HG22  THR  15          2HG2      THR  15  -2.175  -9.921 -10.237
  141   HG23  THR  15          3HG2      THR  15  -2.702 -11.446  -9.525
  142    H    HIS  16           H        HIS  16   0.216 -14.424  -9.443
  143    HA   HIS  16           HA       HIS  16   3.016 -13.977  -9.386
  144    HB2  HIS  16          2HB       HIS  16   1.140 -15.486  -7.907
  145    HB3  HIS  16          3HB       HIS  16   2.349 -16.626  -8.491
  146    HD1  HIS  16           HD1      HIS  16   4.939 -15.731  -7.989
  147    HD2  HIS  16           HD2      HIS  16   1.863 -14.288  -5.599
  148    HE1  HIS  16           HE1      HIS  16   6.055 -14.857  -5.911
  149    H    ARG  17           H        ARG  17   1.054 -15.536 -11.623
  150    HA   ARG  17           HA       ARG  17   2.796 -17.646 -12.414
  151    HB2  ARG  17          2HB       ARG  17   0.257 -17.308 -12.894
  152    HB3  ARG  17          3HB       ARG  17   0.817 -16.359 -14.264
  153    HG2  ARG  17          2HG       ARG  17   1.671 -18.183 -15.357
  154    HG3  ARG  17          3HG       ARG  17   1.918 -19.095 -13.867
  155    HD2  ARG  17          2HD       ARG  17  -0.547 -19.303 -13.653
  156    HD3  ARG  17          3HD       ARG  17  -0.713 -18.514 -15.221
  157    HE   ARG  17           HE       ARG  17   1.002 -20.707 -15.507
  158   HH11  ARG  17          1HH1      ARG  17  -2.343 -20.020 -14.834
  159   HH12  ARG  17          2HH1      ARG  17  -2.921 -21.500 -15.524
  160   HH21  ARG  17          1HH2      ARG  17   0.254 -22.659 -16.418
  161   HH22  ARG  17          2HH2      ARG  17  -1.443 -23.001 -16.424
  162    H    LEU  18           H        LEU  18   2.610 -14.259 -13.109
  163    HA   LEU  18           HA       LEU  18   4.781 -14.564 -15.078
  164    HB2  LEU  18          2HB       LEU  18   3.942 -12.246 -15.852
  165    HB3  LEU  18          3HB       LEU  18   3.071 -13.694 -16.353
  166    HG   LEU  18           HG       LEU  18   2.070 -12.430 -13.893
  167   HD11  LEU  18          1HD1      LEU  18   1.796 -11.046 -16.557
  168   HD12  LEU  18          2HD1      LEU  18   2.664 -10.432 -15.150
  169   HD13  LEU  18          3HD1      LEU  18   0.914 -10.637 -15.085
  170   HD21  LEU  18          1HD2      LEU  18   1.057 -14.365 -15.149
  171   HD22  LEU  18          2HD2      LEU  18   0.637 -13.216 -16.420
  172   HD23  LEU  18          3HD2      LEU  18  -0.036 -13.025 -14.801
  173    H    PHE  19           H        PHE  19   3.537 -12.802 -12.322
  174    HA   PHE  19           HA       PHE  19   5.460 -10.770 -12.183
  175    HB2  PHE  19          2HB       PHE  19   3.639 -12.074 -10.203
  176    HB3  PHE  19          3HB       PHE  19   4.896 -10.991  -9.616
  177    HD1  PHE  19           HD1      PHE  19   3.989  -8.970  -9.030
  178    HD2  PHE  19           HD2      PHE  19   2.616 -10.898 -12.568
  179    HE1  PHE  19           HE1      PHE  19   2.551  -7.035  -9.523
  180    HE2  PHE  19           HE2      PHE  19   1.177  -8.965 -13.067
  181    HZ   PHE  19           HZ       PHE  19   1.144  -7.030 -11.544
  182    H    ARG  20           H        ARG  20   5.631 -14.135 -11.419
  183    HA   ARG  20           HA       ARG  20   7.825 -14.066  -9.634
  184    HB2  ARG  20          2HB       ARG  20   6.241 -16.068 -10.982
  185    HB3  ARG  20          3HB       ARG  20   7.947 -16.490 -11.047
  186    HG2  ARG  20          2HG       ARG  20   7.184 -15.589  -8.411
  187    HG3  ARG  20          3HG       ARG  20   6.195 -16.947  -8.951
  188    HD2  ARG  20          2HD       ARG  20   9.197 -16.943  -9.136
  189    HD3  ARG  20          3HD       ARG  20   8.332 -17.521  -7.712
  190    HE   ARG  20           HE       ARG  20   7.212 -18.880  -9.801
  191   HH11  ARG  20          1HH1      ARG  20  10.438 -18.484  -8.555
  192   HH12  ARG  20          2HH1      ARG  20  10.971 -20.049  -9.075
  193   HH21  ARG  20          1HH2      ARG  20   7.901 -20.942 -10.490
  194   HH22  ARG  20          2HH2      ARG  20   9.527 -21.446 -10.176
  195    H    ARG  21           H        ARG  21   7.564 -13.942 -13.103
  196    HA   ARG  21           HA       ARG  21  10.505 -13.919 -13.291
  197    HB2  ARG  21          2HB       ARG  21   9.190 -15.815 -14.448
  198    HB3  ARG  21          3HB       ARG  21   8.685 -14.579 -15.592
  199    HG2  ARG  21          2HG       ARG  21  10.756 -14.388 -16.518
  200    HG3  ARG  21          3HG       ARG  21  11.585 -14.844 -15.029
  201    HD2  ARG  21          2HD       ARG  21  11.587 -17.018 -15.565
  202    HD3  ARG  21          3HD       ARG  21   9.917 -16.970 -16.130
  203    HE   ARG  21           HE       ARG  21  11.776 -15.726 -17.932
  204   HH11  ARG  21          1HH1      ARG  21  10.313 -18.731 -16.959
  205   HH12  ARG  21          2HH1      ARG  21  10.561 -19.499 -18.492
  206   HH21  ARG  21          1HH2      ARG  21  12.109 -16.727 -19.955
  207   HH22  ARG  21          2HH2      ARG  21  11.584 -18.358 -20.195
  208    H    ASN  22           H        ASN  22   8.557 -11.714 -12.788
  209    HA   ASN  22           HA       ASN  22   9.164 -10.061 -15.151
  210    HB2  ASN  22          2HB       ASN  22   6.704 -10.475 -13.719
  211    HB3  ASN  22          3HB       ASN  22   7.176  -8.782 -13.603
  212   HD21  ASN  22          1HD2      ASN  22   6.459  -7.538 -15.161
  213   HD22  ASN  22          2HD2      ASN  22   6.061  -8.036 -16.766
  214    H    PHE  23           H        PHE  23   9.635 -10.505 -11.799
  215    HA   PHE  23           HA       PHE  23  10.028  -7.969 -10.804
  216    HB2  PHE  23          2HB       PHE  23  11.479  -8.956  -9.150
  217    HB3  PHE  23          3HB       PHE  23  10.182 -10.094  -9.499
  218    HD1  PHE  23           HD1      PHE  23  13.740  -9.502  -9.552
  219    HD2  PHE  23           HD2      PHE  23  10.641 -12.081 -10.917
  220    HE1  PHE  23           HE1      PHE  23  15.409 -11.241 -10.046
  221    HE2  PHE  23           HE2      PHE  23  12.305 -13.824 -11.412
  222    HZ   PHE  23           HZ       PHE  23  14.692 -13.406 -10.977
  223    H    GLY  24           H        GLY  24  12.184  -9.900 -12.815
  224    HA2  GLY  24          2HA       GLY  24  14.536  -8.469 -12.620
  225    HA3  GLY  24          3HA       GLY  24  14.000  -9.285 -14.082
  226    H    TYR  25           H        TYR  25  11.587  -7.566 -14.247
  227    HA   TYR  25           HA       TYR  25  12.789  -5.453 -15.778
  228    HB2  TYR  25          2HB       TYR  25  10.012  -6.441 -15.309
  229    HB3  TYR  25          3HB       TYR  25  10.223  -4.807 -15.927
  230    HD1  TYR  25           HD1      TYR  25  11.994  -8.023 -16.633
  231    HD2  TYR  25           HD2      TYR  25   9.726  -4.773 -18.181
  232    HE1  TYR  25           HE1      TYR  25  12.265  -8.925 -18.906
  233    HE2  TYR  25           HE2      TYR  25   9.989  -5.666 -20.457
  234    HH   TYR  25           HH       TYR  25  10.767  -7.330 -21.704
  235    H    THR  26           H        THR  26  11.169  -5.755 -12.688
  236    HA   THR  26           HA       THR  26  10.942  -2.914 -12.275
  237    HB   THR  26           HB       THR  26  10.687  -4.057  -9.777
  238    HG1  THR  26           HG1      THR  26  10.859  -6.151 -10.802
  239   HG21  THR  26          1HG2      THR  26   8.423  -3.534  -9.978
  240   HG22  THR  26          2HG2      THR  26   8.378  -3.956 -11.689
  241   HG23  THR  26          3HG2      THR  26   9.183  -2.477 -11.167
  242    H    LEU  27           H        LEU  27  13.097  -5.500 -11.204
  243    HA   LEU  27           HA       LEU  27  14.572  -4.006  -9.334
  244    HB2  LEU  27          2HB       LEU  27  14.652  -6.605 -10.474
  245    HB3  LEU  27          3HB       LEU  27  16.266  -5.908 -10.601
  246    HG   LEU  27           HG       LEU  27  14.879  -5.770  -7.972
  247   HD11  LEU  27          1HD1      LEU  27  14.563  -7.970  -7.880
  248   HD12  LEU  27          2HD1      LEU  27  16.319  -8.122  -7.852
  249   HD13  LEU  27          3HD1      LEU  27  15.448  -8.241  -9.381
  250   HD21  LEU  27          1HD2      LEU  27  16.980  -4.707  -8.062
  251   HD22  LEU  27          2HD2      LEU  27  17.709  -6.045  -8.950
  252   HD23  LEU  27          3HD2      LEU  27  17.263  -6.249  -7.255
  253    H    ARG  28           H        ARG  28  14.781  -4.280 -12.814
  254    HA   ARG  28           HA       ARG  28  17.132  -2.510 -12.804
  255    HB2  ARG  28          2HB       ARG  28  16.223  -4.687 -14.590
  256    HB3  ARG  28          3HB       ARG  28  16.937  -3.290 -15.384
  257    HG2  ARG  28          2HG       ARG  28  18.816  -4.511 -15.068
  258    HG3  ARG  28          3HG       ARG  28  18.791  -3.659 -13.522
  259    HD2  ARG  28          2HD       ARG  28  18.560  -5.567 -12.402
  260    HD3  ARG  28          3HD       ARG  28  17.181  -6.041 -13.393
  261    HE   ARG  28           HE       ARG  28  19.701  -6.428 -14.705
  262   HH11  ARG  28          1HH1      ARG  28  17.406  -7.815 -12.485
  263   HH12  ARG  28          2HH1      ARG  28  17.904  -9.447 -12.785
  264   HH21  ARG  28          1HH2      ARG  28  20.366  -8.573 -15.108
  265   HH22  ARG  28          2HH2      ARG  28  19.589  -9.877 -14.276
  Start of MODEL   20
    1    H1   LYS   1           H        LYS   1  -4.866 -10.577   2.360
    2    HA   LYS   1           HA       LYS   1  -5.736 -12.288   0.765
    3    HB2  LYS   1          2HB       LYS   1  -5.615 -13.962   2.753
    4    HB3  LYS   1          3HB       LYS   1  -7.228 -13.373   3.134
    5    HG2  LYS   1          2HG       LYS   1  -7.363 -13.928   0.433
    6    HG3  LYS   1          3HG       LYS   1  -6.362 -15.228   1.083
    7    HD2  LYS   1          2HD       LYS   1  -8.074 -15.747   2.732
    8    HD3  LYS   1          3HD       LYS   1  -9.065 -14.408   2.148
    9    HE2  LYS   1          2HE       LYS   1  -9.769 -15.552   0.333
   10    HE3  LYS   1          3HE       LYS   1  -8.214 -16.351   0.104
   11    HZ1  LYS   1          1HZ       LYS   1  -8.738 -17.931   1.769
   12    HZ2  LYS   1          2HZ       LYS   1 -10.083 -17.846   0.746
   13    HZ3  LYS   1          3HZ       LYS   1 -10.118 -17.082   2.256
   14    H    TYR   2           H        TYR   2  -6.539  -9.845   2.733
   15    HA   TYR   2           HA       TYR   2  -9.304  -9.681   1.729
   16    HB2  TYR   2          2HB       TYR   2  -8.897  -9.717   4.258
   17    HB3  TYR   2          3HB       TYR   2  -8.215  -8.106   4.057
   18    HD1  TYR   2           HD1      TYR   2  -9.627  -6.207   3.596
   19    HD2  TYR   2           HD2      TYR   2 -11.288 -10.113   3.895
   20    HE1  TYR   2           HE1      TYR   2 -11.881  -5.232   3.733
   21    HE2  TYR   2           HE2      TYR   2 -13.546  -9.148   4.031
   22    HH   TYR   2           HH       TYR   2 -14.179  -6.045   4.756
   23    H    GLU   3           H        GLU   3  -6.855  -7.360   2.884
   24    HA   GLU   3           HA       GLU   3  -7.711  -5.298   1.153
   25    HB2  GLU   3          2HB       GLU   3  -5.677  -5.674   3.178
   26    HB3  GLU   3          3HB       GLU   3  -5.043  -4.764   1.813
   27    HG2  GLU   3          2HG       GLU   3  -6.411  -2.983   2.179
   28    HG3  GLU   3          3HG       GLU   3  -7.682  -3.966   2.905
   29    H    ILE   4           H        ILE   4  -5.987  -8.097   0.520
   30    HA   ILE   4           HA       ILE   4  -4.048  -7.331  -1.321
   31    HB   ILE   4           HB       ILE   4  -3.967  -9.540  -2.044
   32   HG12  ILE   4          2HG1      ILE   4  -6.261  -9.672  -2.909
   33   HG13  ILE   4          3HG1      ILE   4  -5.860 -11.102  -1.965
   34   HG21  ILE   4          1HG2      ILE   4  -5.329  -9.907   0.609
   35   HG22  ILE   4          2HG2      ILE   4  -4.013 -10.850  -0.089
   36   HG23  ILE   4          3HG2      ILE   4  -3.720  -9.200   0.461
   37   HD11  ILE   4          1HD1      ILE   4  -7.821 -10.745  -0.973
   38   HD12  ILE   4          2HD1      ILE   4  -6.976  -9.478  -0.084
   39   HD13  ILE   4          3HD1      ILE   4  -7.905  -9.073  -1.527
   40    H    THR   5           H        THR   5  -7.458  -7.190  -1.561
   41    HA   THR   5           HA       THR   5  -7.432  -7.069  -4.478
   42    HB   THR   5           HB       THR   5  -9.990  -6.523  -3.903
   43    HG1  THR   5           HG1      THR   5  -9.418  -6.633  -1.585
   44   HG21  THR   5          1HG2      THR   5  -8.452  -8.938  -4.431
   45   HG22  THR   5          2HG2      THR   5  -9.986  -8.404  -5.118
   46   HG23  THR   5          3HG2      THR   5  -9.961  -9.268  -3.581
   47    H    THR   6           H        THR   6  -6.273  -4.995  -2.572
   48    HA   THR   6           HA       THR   6  -7.743  -2.667  -2.478
   49    HB   THR   6           HB       THR   6  -5.208  -1.734  -3.053
   50    HG1  THR   6           HG1      THR   6  -4.659  -4.088  -3.155
   51   HG21  THR   6          1HG2      THR   6  -6.071  -2.756  -0.352
   52   HG22  THR   6          2HG2      THR   6  -6.719  -1.286  -1.079
   53   HG23  THR   6          3HG2      THR   6  -5.000  -1.402  -0.708
   54    H    ILE   7           H        ILE   7  -5.153  -3.074  -4.883
   55    HA   ILE   7           HA       ILE   7  -6.896  -1.735  -6.848
   56    HB   ILE   7           HB       ILE   7  -4.456  -1.183  -7.830
   57   HG12  ILE   7          2HG1      ILE   7  -3.978  -0.712  -4.916
   58   HG13  ILE   7          3HG1      ILE   7  -3.613  -2.297  -5.589
   59   HG21  ILE   7          1HG2      ILE   7  -5.340   0.680  -5.714
   60   HG22  ILE   7          2HG2      ILE   7  -5.001   0.975  -7.418
   61   HG23  ILE   7          3HG2      ILE   7  -6.534   0.248  -6.938
   62   HD11  ILE   7          1HD1      ILE   7  -2.042   0.048  -5.644
   63   HD12  ILE   7          2HD1      ILE   7  -1.677  -1.537  -6.325
   64   HD13  ILE   7          3HD1      ILE   7  -2.506  -0.328  -7.304
   65    H    HIS   8           H        HIS   8  -3.693  -3.038  -7.436
   66    HA   HIS   8           HA       HIS   8  -4.903  -5.171  -9.070
   67    HB2  HIS   8          2HB       HIS   8  -3.000  -3.065  -9.808
   68    HB3  HIS   8          3HB       HIS   8  -2.478  -4.681 -10.274
   69    HD1  HIS   8           HD1      HIS   8  -3.613  -5.736 -12.261
   70    HD2  HIS   8           HD2      HIS   8  -5.484  -2.247 -11.001
   71    HE1  HIS   8           HE1      HIS   8  -5.309  -5.203 -14.039
   72    H    ASN   9           H        ASN   9  -3.201  -4.613  -6.372
   73    HA   ASN   9           HA       ASN   9  -1.094  -6.549  -6.673
   74    HB2  ASN   9          2HB       ASN   9  -0.845  -6.206  -4.178
   75    HB3  ASN   9          3HB       ASN   9  -0.664  -4.755  -5.160
   76   HD21  ASN   9          1HD2      ASN   9  -1.148  -3.478  -3.352
   77   HD22  ASN   9          2HD2      ASN   9  -2.770  -3.303  -2.782
   78    H    LEU  10           H        LEU  10  -3.112  -7.971  -7.466
   79    HA   LEU  10           HA       LEU  10  -4.632  -9.260  -5.438
   80    HB2  LEU  10          2HB       LEU  10  -5.328 -10.782  -7.158
   81    HB3  LEU  10          3HB       LEU  10  -5.315  -9.142  -7.803
   82    HG   LEU  10           HG       LEU  10  -2.801 -10.308  -8.394
   83   HD11  LEU  10          1HD1      LEU  10  -3.344 -12.272  -9.607
   84   HD12  LEU  10          2HD1      LEU  10  -5.073 -12.033  -9.353
   85   HD13  LEU  10          3HD1      LEU  10  -4.033 -12.462  -7.994
   86   HD21  LEU  10          1HD2      LEU  10  -5.107  -9.874 -10.277
   87   HD22  LEU  10          2HD2      LEU  10  -3.380  -9.776 -10.623
   88   HD23  LEU  10          3HD2      LEU  10  -4.149  -8.550  -9.613
   89    H    PHE  11           H        PHE  11  -1.445  -9.692  -6.678
   90    HA   PHE  11           HA       PHE  11  -0.958 -12.375  -6.193
   91    HB2  PHE  11          2HB       PHE  11   1.402 -11.757  -5.963
   92    HB3  PHE  11          3HB       PHE  11   0.653 -10.884  -7.295
   93    HD1  PHE  11           HD1      PHE  11   2.351 -10.623  -4.130
   94    HD2  PHE  11           HD2      PHE  11   0.039  -8.487  -6.996
   95    HE1  PHE  11           HE1      PHE  11   3.113  -8.496  -3.155
   96    HE2  PHE  11           HE2      PHE  11   0.798  -6.358  -6.026
   97    HZ   PHE  11           HZ       PHE  11   2.338  -6.360  -4.104
   98    H    ARG  12           H        ARG  12  -1.084 -13.566  -4.419
   99    HA   ARG  12           HA       ARG  12  -1.109 -12.239  -1.811
  100    HB2  ARG  12          2HB       ARG  12  -2.028 -14.942  -2.765
  101    HB3  ARG  12          3HB       ARG  12  -1.863 -14.576  -1.053
  102    HG2  ARG  12          2HG       ARG  12  -3.434 -12.682  -1.359
  103    HG3  ARG  12          3HG       ARG  12  -3.668 -13.202  -3.029
  104    HD2  ARG  12          2HD       ARG  12  -4.079 -15.112  -0.760
  105    HD3  ARG  12          3HD       ARG  12  -5.347 -13.975  -1.216
  106    HE   ARG  12           HE       ARG  12  -4.600 -16.349  -2.603
  107   HH11  ARG  12          1HH1      ARG  12  -5.829 -13.122  -3.044
  108   HH12  ARG  12          2HH1      ARG  12  -6.651 -13.497  -4.523
  109   HH21  ARG  12          1HH2      ARG  12  -5.677 -16.855  -4.549
  110   HH22  ARG  12          2HH2      ARG  12  -6.565 -15.621  -5.377
  111    H    LYS  13           H        LYS  13  -0.004 -15.477  -2.774
  112    HA   LYS  13           HA       LYS  13   2.525 -14.937  -1.359
  113    HB2  LYS  13          2HB       LYS  13   2.347 -17.630  -1.225
  114    HB3  LYS  13          3HB       LYS  13   1.764 -16.550   0.035
  115    HG2  LYS  13          2HG       LYS  13  -0.442 -16.862  -0.525
  116    HG3  LYS  13          3HG       LYS  13  -0.066 -17.320  -2.188
  117    HD2  LYS  13          2HD       LYS  13  -0.402 -19.423  -1.495
  118    HD3  LYS  13          3HD       LYS  13   1.187 -19.280  -0.740
  119    HE2  LYS  13          2HE       LYS  13   0.172 -18.599   1.347
  120    HE3  LYS  13          3HE       LYS  13  -1.427 -18.603   0.604
  121    HZ1  LYS  13          1HZ       LYS  13  -0.448 -21.101   0.111
  122    HZ2  LYS  13          2HZ       LYS  13  -1.573 -20.691   1.306
  123    HZ3  LYS  13          3HZ       LYS  13   0.072 -20.779   1.689
  124    H    LEU  14           H        LEU  14   1.399 -17.616  -3.405
  125    HA   LEU  14           HA       LEU  14   3.664 -17.068  -5.210
  126    HB2  LEU  14          2HB       LEU  14   3.811 -19.467  -5.619
  127    HB3  LEU  14          3HB       LEU  14   4.052 -19.082  -3.916
  128    HG   LEU  14           HG       LEU  14   1.285 -19.743  -4.531
  129   HD11  LEU  14          1HD1      LEU  14   1.963 -21.264  -6.139
  130   HD12  LEU  14          2HD1      LEU  14   1.935 -22.242  -4.672
  131   HD13  LEU  14          3HD1      LEU  14   3.468 -21.638  -5.300
  132   HD21  LEU  14          1HD2      LEU  14   1.401 -20.874  -2.515
  133   HD22  LEU  14          2HD2      LEU  14   2.589 -19.589  -2.298
  134   HD23  LEU  14          3HD2      LEU  14   3.120 -21.224  -2.691
  135    H    THR  15           H        THR  15   0.908 -16.100  -5.388
  136    HA   THR  15           HA       THR  15  -0.264 -17.613  -7.575
  137    HB   THR  15           HB       THR  15  -2.190 -16.346  -7.320
  138    HG1  THR  15           HG1      THR  15  -1.340 -14.279  -7.564
  139   HG21  THR  15          1HG2      THR  15  -1.549 -17.608  -5.227
  140   HG22  THR  15          2HG2      THR  15  -2.702 -16.293  -4.998
  141   HG23  THR  15          3HG2      THR  15  -1.008 -16.068  -4.562
  142    H    HIS  16           H        HIS  16   1.831 -14.946  -7.128
  143    HA   HIS  16           HA       HIS  16   1.350 -13.258  -9.223
  144    HB2  HIS  16          2HB       HIS  16   3.857 -12.940  -9.321
  145    HB3  HIS  16          3HB       HIS  16   3.135 -12.754  -7.725
  146    HD1  HIS  16           HD1      HIS  16   5.618 -14.720  -9.601
  147    HD2  HIS  16           HD2      HIS  16   3.659 -14.948  -5.944
  148    HE1  HIS  16           HE1      HIS  16   6.909 -16.403  -8.250
  149    H    ARG  17           H        ARG  17   0.640 -14.038 -11.140
  150    HA   ARG  17           HA       ARG  17   2.380 -15.951 -12.551
  151    HB2  ARG  17          2HB       ARG  17  -0.490 -15.842 -12.187
  152    HB3  ARG  17          3HB       ARG  17  -0.073 -15.840 -13.896
  153    HG2  ARG  17          2HG       ARG  17   1.214 -17.877 -13.609
  154    HG3  ARG  17          3HG       ARG  17   0.873 -17.865 -11.878
  155    HD2  ARG  17          2HD       ARG  17  -1.531 -18.051 -12.375
  156    HD3  ARG  17          3HD       ARG  17  -1.154 -18.120 -14.096
  157    HE   ARG  17           HE       ARG  17   0.215 -20.129 -12.591
  158   HH11  ARG  17          1HH1      ARG  17  -2.810 -19.308 -14.107
  159   HH12  ARG  17          2HH1      ARG  17  -3.290 -20.956 -14.340
  160   HH21  ARG  17          1HH2      ARG  17  -0.407 -22.303 -12.892
  161   HH22  ARG  17          2HH2      ARG  17  -1.923 -22.659 -13.647
  162    H    LEU  18           H        LEU  18   0.672 -12.905 -12.738
  163    HA   LEU  18           HA       LEU  18   1.958 -12.393 -15.340
  164    HB2  LEU  18          2HB       LEU  18  -0.644 -11.364 -14.229
  165    HB3  LEU  18          3HB       LEU  18   0.131 -10.697 -15.665
  166    HG   LEU  18           HG       LEU  18  -0.065 -13.453 -16.128
  167   HD11  LEU  18          1HD1      LEU  18  -1.698 -13.411 -14.203
  168   HD12  LEU  18          2HD1      LEU  18  -2.317 -14.040 -15.729
  169   HD13  LEU  18          3HD1      LEU  18  -2.732 -12.405 -15.217
  170   HD21  LEU  18          1HD2      LEU  18  -1.860 -11.244 -17.123
  171   HD22  LEU  18          2HD2      LEU  18  -1.527 -12.783 -17.918
  172   HD23  LEU  18          3HD2      LEU  18  -0.245 -11.584 -17.746
  173    H    PHE  19           H        PHE  19   1.245 -11.176 -12.139
  174    HA   PHE  19           HA       PHE  19   2.261  -8.560 -12.500
  175    HB2  PHE  19          2HB       PHE  19   1.027  -9.984 -10.434
  176    HB3  PHE  19          3HB       PHE  19   2.611  -9.552  -9.799
  177    HD1  PHE  19           HD1      PHE  19   2.637  -7.638  -8.552
  178    HD2  PHE  19           HD2      PHE  19  -0.021  -7.892 -11.866
  179    HE1  PHE  19           HE1      PHE  19   1.824  -5.367  -8.069
  180    HE2  PHE  19           HE2      PHE  19  -0.837  -5.620 -11.390
  181    HZ   PHE  19           HZ       PHE  19   0.086  -4.354  -9.490
  182    H    ARG  20           H        ARG  20   3.756 -11.632 -11.903
  183    HA   ARG  20           HA       ARG  20   6.204 -10.784 -10.830
  184    HB2  ARG  20          2HB       ARG  20   5.470 -13.134 -10.857
  185    HB3  ARG  20          3HB       ARG  20   5.651 -13.168 -12.606
  186    HG2  ARG  20          2HG       ARG  20   8.067 -12.284 -11.263
  187    HG3  ARG  20          3HG       ARG  20   7.551 -13.893 -10.752
  188    HD2  ARG  20          2HD       ARG  20   7.292 -14.384 -13.259
  189    HD3  ARG  20          3HD       ARG  20   8.255 -12.927 -13.505
  190    HE   ARG  20           HE       ARG  20  10.109 -14.091 -12.848
  191   HH11  ARG  20          1HH1      ARG  20   7.266 -15.830 -11.842
  192   HH12  ARG  20          2HH1      ARG  20   8.147 -17.224 -11.310
  193   HH21  ARG  20          1HH2      ARG  20  11.281 -15.921 -12.151
  194   HH22  ARG  20          2HH2      ARG  20  10.431 -17.274 -11.486
  195    H    ARG  21           H        ARG  21   4.957 -10.721 -14.070
  196    HA   ARG  21           HA       ARG  21   7.437 -10.460 -15.429
  197    HB2  ARG  21          2HB       ARG  21   5.144 -11.075 -16.404
  198    HB3  ARG  21          3HB       ARG  21   4.813  -9.348 -16.401
  199    HG2  ARG  21          2HG       ARG  21   7.299  -9.590 -17.624
  200    HG3  ARG  21          3HG       ARG  21   6.341 -10.926 -18.264
  201    HD2  ARG  21          2HD       ARG  21   4.503  -9.124 -18.579
  202    HD3  ARG  21          3HD       ARG  21   5.838  -7.981 -18.435
  203    HE   ARG  21           HE       ARG  21   5.227  -9.629 -20.682
  204   HH11  ARG  21          1HH1      ARG  21   7.833  -8.119 -18.936
  205   HH12  ARG  21          2HH1      ARG  21   8.882  -8.038 -20.313
  206   HH21  ARG  21          1HH2      ARG  21   6.599  -9.529 -22.502
  207   HH22  ARG  21          2HH2      ARG  21   8.179  -8.839 -22.340
  208    H    ASN  22           H        ASN  22   5.275  -8.206 -13.856
  209    HA   ASN  22           HA       ASN  22   6.768  -5.911 -14.858
  210    HB2  ASN  22          2HB       ASN  22   4.099  -6.336 -13.980
  211    HB3  ASN  22          3HB       ASN  22   4.836  -5.177 -12.878
  212   HD21  ASN  22          1HD2      ASN  22   5.833  -3.282 -13.816
  213   HD22  ASN  22          2HD2      ASN  22   5.200  -2.634 -15.288
  214    H    PHE  23           H        PHE  23   6.299  -7.764 -11.927
  215    HA   PHE  23           HA       PHE  23   7.387  -6.028 -10.047
  216    HB2  PHE  23          2HB       PHE  23   6.702  -8.817 -10.186
  217    HB3  PHE  23          3HB       PHE  23   8.243  -8.630  -9.354
  218    HD1  PHE  23           HD1      PHE  23   7.896  -8.840  -7.094
  219    HD2  PHE  23           HD2      PHE  23   5.150  -6.548  -9.400
  220    HE1  PHE  23           HE1      PHE  23   6.708  -8.201  -5.037
  221    HE2  PHE  23           HE2      PHE  23   3.957  -5.904  -7.347
  222    HZ   PHE  23           HZ       PHE  23   4.736  -6.730  -5.161
  223    H    GLY  24           H        GLY  24   8.929  -7.887 -12.535
  224    HA2  GLY  24          2HA       GLY  24  11.522  -8.120 -11.569
  225    HA3  GLY  24          3HA       GLY  24  11.104  -7.938 -13.267
  226    H    TYR  25           H        TYR  25   9.835  -5.284 -12.640
  227    HA   TYR  25           HA       TYR  25  12.235  -3.721 -13.005
  228    HB2  TYR  25          2HB       TYR  25   9.307  -3.239 -13.256
  229    HB3  TYR  25          3HB       TYR  25  10.343  -1.844 -12.978
  230    HD1  TYR  25           HD1      TYR  25  10.382  -0.702 -15.007
  231    HD2  TYR  25           HD2      TYR  25  10.986  -4.914 -14.990
  232    HE1  TYR  25           HE1      TYR  25  10.928  -0.628 -17.404
  233    HE2  TYR  25           HE2      TYR  25  11.535  -4.851 -17.387
  234    HH   TYR  25           HH       TYR  25  10.883  -3.148 -19.378
  235    H    THR  26           H        THR  26   9.979  -4.406 -10.462
  236    HA   THR  26           HA       THR  26  10.891  -2.197  -8.809
  237    HB   THR  26           HB       THR  26   9.396  -3.718  -7.124
  238    HG1  THR  26           HG1      THR  26   9.010  -5.184  -8.956
  239   HG21  THR  26          1HG2      THR  26   8.151  -1.859  -9.143
  240   HG22  THR  26          2HG2      THR  26   9.154  -1.292  -7.808
  241   HG23  THR  26          3HG2      THR  26   7.649  -2.150  -7.479
  242    H    LEU  27           H        LEU  27  11.358  -5.651  -9.121
  243    HA   LEU  27           HA       LEU  27  12.888  -5.798  -6.652
  244    HB2  LEU  27          2HB       LEU  27  12.980  -8.141  -7.010
  245    HB3  LEU  27          3HB       LEU  27  11.339  -7.613  -7.377
  246    HG   LEU  27           HG       LEU  27  12.389  -7.551  -9.847
  247   HD11  LEU  27          1HD1      LEU  27  13.651 -10.048  -8.877
  248   HD12  LEU  27          2HD1      LEU  27  14.520  -8.539  -8.601
  249   HD13  LEU  27          3HD1      LEU  27  14.077  -9.014 -10.240
  250   HD21  LEU  27          1HD2      LEU  27  10.353  -8.694  -9.244
  251   HD22  LEU  27          2HD2      LEU  27  11.265  -9.952  -8.408
  252   HD23  LEU  27          3HD2      LEU  27  11.388  -9.790 -10.161
  253    H    ARG  28           H        ARG  28  13.397  -5.636 -10.097
  254    HA   ARG  28           HA       ARG  28  16.305  -5.776  -9.639
  255    HB2  ARG  28          2HB       ARG  28  14.666  -7.207 -11.479
  256    HB3  ARG  28          3HB       ARG  28  15.694  -6.119 -12.401
  257    HG2  ARG  28          2HG       ARG  28  17.247  -7.409 -10.376
  258    HG3  ARG  28          3HG       ARG  28  16.358  -8.616 -11.307
  259    HD2  ARG  28          2HD       ARG  28  18.471  -8.254 -12.372
  260    HD3  ARG  28          3HD       ARG  28  17.213  -7.547 -13.386
  261    HE   ARG  28           HE       ARG  28  18.211  -5.520 -13.102
  262   HH11  ARG  28          1HH1      ARG  28  19.219  -7.621 -10.515
  263   HH12  ARG  28          2HH1      ARG  28  20.340  -6.480  -9.850
  264   HH21  ARG  28          1HH2      ARG  28  19.684  -4.009 -12.235
  265   HH22  ARG  28          2HH2      ARG  28  20.603  -4.425 -10.828