*HEADER    CELL CYCLE                              21-MAY-03   1PE3              
*TITLE     SOLUTION STRUCTURE OF THE DISULPHIDE-LINKED DIMER OF HUMAN            
*TITLE    2 INTESTINAL TREFOIL FACTOR (TFF3)                                     
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: TREFOIL FACTOR 3;                                          
*COMPND   3 CHAIN: 1, 2;                                                         
*COMPND   4 SYNONYM: INTESTINAL TREFOIL FACTOR, HP1.B;                           
*COMPND   5 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 GENE: TFF3 OR ITF OR TFI;                                            
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: BL21                                       
*KEYWDS    INTESTINAL TREFOIL FACTOR, ITF, TREFOIL FACTOR FAMILY, TFF3,          
*KEYWDS   2 TFF3 DIMER, TREFOIL MOTIF, SOLUTION STRUCTURE, NMR                   
*KEYWDS   3 SPECTROSCOPY                                                         
*EXPDTA    NMR, 47 STRUCTURES                                                    
*AUTHOR    F.W.MUSKETT, F.E.B.MAY, B.R.WESTLEY, J.FEENEY                         
*REVDAT   1   09-MAR-04 1PE3    0                                                
  2 GLU- HN      3 TYR  HN      3.80                
  2 GLU- HN      3 TYR  QD      8.14                
  2 GLU- HN      4 VAL  QQG     8.12                
  2 GLU- HA      3 TYR  HN      3.30                
  2 GLU- HA      4 VAL  HN      5.00                
  3 TYR  HN      3 TYR  HB2     3.30                
  3 TYR  HN      3 TYR  HB3     3.30                
  3 TYR  HN      3 TYR  QB      3.05                
  3 TYR  HN      4 VAL  HN      4.63                
  3 TYR  HN      4 VAL  HA      5.96                
  3 TYR  HN      4 VAL  QQG     6.07                
  3 TYR  HN      6 LEU  HN      6.00                
  3 TYR  HA      4 VAL  HN      2.47                
  3 TYR  HA      6 LEU  HN      4.75                
  3 TYR  HA      7 SER  HN      6.00                
  3 TYR  QB      6 LEU  HN      5.28                
  3 TYR  QD      4 VAL  HN      8.14                
  4 VAL  HN      4 VAL  HA      2.90                
  4 VAL  HN      4 VAL  HB      3.80                
  4 VAL  HN      6 LEU  QB      5.51                
  4 VAL  HN      6 LEU  QQD     4.33                
  4 VAL  HA      6 LEU  HN      3.30                
  4 VAL  HA      7 SER  HN      3.50                
  4 VAL  HA      8 ALA  HN      6.00                
  4 VAL  HA     10 GLN  HN      6.00                
  4 VAL  QQG     6 LEU  HN      6.56                
  4 VAL  O       7 SER  N       3.00                
  4 VAL  O       7 SER  HN      2.00                
  6 LEU  HN      6 LEU  QB      3.68                
  6 LEU  HN      6 LEU  QQD     6.92                
  6 LEU  HN      7 SER  HN      3.64                
  6 LEU  HN      9 ASN  QB      6.88                
  6 LEU  HN     10 GLN  HN      6.00                
  6 LEU  HN     10 GLN  QB      4.79                
  6 LEU  HN    159 PHE  HA      6.00                
  6 LEU  QB      7 SER  HN      4.22                
  6 LEU  QB     52 LEU  HA      5.36                
  6 LEU  QB    159 PHE  HN      6.88                
  6 LEU  QQD     7 SER  HN      7.60                
  6 LEU  QQD    10 GLN  HN      8.13                
  6 LEU  QQD    10 GLN  HE21    7.98                
  6 LEU  QQD    10 GLN  HE22    7.98                
  6 LEU  QQD    10 GLN  QE2     7.63                
  7 SER  HN      8 ALA  HA      6.00                
  7 SER  HN     10 GLN  HN      6.00                
  7 SER  HN     10 GLN  HB2     4.00                
  7 SER  HN     10 GLN  HB3     4.00                
  7 SER  HN     10 GLN  QB      3.65                
  7 SER  HN     10 GLN  HE21    6.03                
  7 SER  HN     10 GLN  HE22    6.03                
  7 SER  HN     11 CYSS HN      6.00                
  7 SER  HA      7 SER  HB2     3.04                
  7 SER  HA      7 SER  HB3     3.04                
  7 SER  HA     10 GLN  HN      5.00                
  7 SER  O      10 GLN  N       3.00                
  7 SER  O      10 GLN  HN      2.00                
  8 ALA  HA     10 GLN  HN      5.00                
  8 ALA  HA     11 CYSS HN      5.00                
  8 ALA  HA     12 ALA  HN      6.00                
  8 ALA  QB     52 LEU  HA      7.03                
  9 ASN  HN     10 GLN  HN      5.00                
  9 ASN  HN     12 ALA  HN      6.00                
  9 ASN  HA     11 CYSS HN      5.00                
  9 ASN  HD21   13 VAL  QG1    10.15                
  9 ASN  HD21   13 VAL  QG2    10.15                
  9 ASN  HD22   13 VAL  QG1    10.15                
  9 ASN  HD22   13 VAL  QG2    10.15                
  9 ASN  QD2    10 GLN  QB      7.74                
  9 ASN  QD2    11 CYSS HN      6.87                
  9 ASN  QD2    12 ALA  QB      4.10                
  9 ASN  QD2    13 VAL  QQG     8.55                
  9 ASN  O      12 ALA  N       3.00                
  9 ASN  O      12 ALA  HN      2.00                
 10 GLN  HN     10 GLN  HB2     3.30                
 10 GLN  HN     10 GLN  HB3     3.30                
 10 GLN  HN     10 GLN  QB      2.98                
 10 GLN  HN     10 GLN  QG      5.09                
 10 GLN  HN     11 CYSS HN      2.96                
 10 GLN  HN     11 CYSS HA      6.00                
 10 GLN  HN     11 CYSS QB      5.88                
 10 GLN  HN     12 ALA  HN      3.87                
 10 GLN  HN     12 ALA  QB      6.03                
 10 GLN  HN     52 LEU  HN      6.00                
 10 GLN  HN     52 LEU  QB      4.03                
 10 GLN  HN     52 LEU  QQD     8.13                
 10 GLN  HA     10 GLN  HE21    6.00                
 10 GLN  HA     10 GLN  HE22    6.00                
 10 GLN  HA     12 ALA  HN      4.00                
 10 GLN  HB2    10 GLN  HE21    5.00                
 10 GLN  HB2    10 GLN  HE22    5.00                
 10 GLN  HB2    11 CYSS HN      4.00                
 10 GLN  HB2    12 ALA  HN      5.00                
 10 GLN  HB2    52 LEU  HN      6.00                
 10 GLN  HB3    10 GLN  HE21    5.00                
 10 GLN  HB3    10 GLN  HE22    5.00                
 10 GLN  HB3    11 CYSS HN      4.00                
 10 GLN  HB3    12 ALA  HN      5.00                
 10 GLN  HB3    52 LEU  HN      6.00                
 10 GLN  QB     10 GLN  QE2     3.76                
 10 GLN  QB     13 VAL  HN      6.88                
 10 GLN  QB     52 LEU  HN      5.45                
 10 GLN  QG     12 ALA  HN      6.00                
 10 GLN  HE21   13 VAL  QG1    10.15                
 10 GLN  HE21   13 VAL  QG2    10.15                
 10 GLN  HE21   50 LYS+ QG      7.03                
 10 GLN  HE21   52 LEU  HN      6.00                
 10 GLN  HE21   52 LEU  QB      5.85                
 10 GLN  HE21   53 GLN  HN      6.00                
 10 GLN  HE21  159 PHE  HA      6.00                
 10 GLN  HE22   13 VAL  QG1    10.15                
 10 GLN  HE22   13 VAL  QG2    10.15                
 10 GLN  HE22   50 LYS+ QG      7.03                
 10 GLN  HE22   52 LEU  HN      6.00                
 10 GLN  HE22   52 LEU  QB      5.85                
 10 GLN  HE22   53 GLN  HN      6.00                
 10 GLN  HE22  159 PHE  HA      6.00                
 10 GLN  QE2    13 VAL  HN      6.87                
 10 GLN  QE2    13 VAL  QQG     8.55                
 10 GLN  QE2    50 LYS+ QG      6.90                
 10 GLN  QE2    52 LEU  QB      5.47                
 10 GLN  QE2   158 THR  HA      6.87                
 10 GLN  O      13 VAL  N       3.00                
 10 GLN  O      13 VAL  HN      2.00                
 11 CYSS HN     11 CYSS HB2     3.30                
 11 CYSS HN     11 CYSS HB3     3.30                
 11 CYSS HN     11 CYSS QB      2.98                
 11 CYSS HN     12 ALA  HN      2.90                
 11 CYSS HN     12 ALA  QB      5.03                
 11 CYSS HN     13 VAL  QQG     7.59                
 11 CYSS HN     52 LEU  HN      6.00                
 11 CYSS HN     52 LEU  HA      5.00                
 11 CYSS HN     52 LEU  QB      5.88                
 11 CYSS HN     52 LEU  QQD     8.06                
 11 CYSS HA     12 ALA  HN      3.15                
 11 CYSS HA     12 ALA  HA      6.00                
 11 CYSS HA     13 VAL  HN      4.00                
 11 CYSS HA     13 VAL  QQG     6.80                
 11 CYSS HA     37 CYSS QB      6.88                
 11 CYSS HA     52 LEU  HN      4.00                
 11 CYSS HA     52 LEU  HA      6.00                
 11 CYSS HA     52 LEU  QQD     8.13                
 11 CYSS HA     53 GLN  QG      6.88                
 11 CYSS CB     37 CYSS SG      3.10                
 11 CYSS HB2    12 ALA  HN      5.00                
 11 CYSS HB2    13 VAL  HN      6.00                
 11 CYSS HB3    12 ALA  HN      5.00                
 11 CYSS HB3    13 VAL  HN      6.00                
 11 CYSS QB     12 ALA  HN      4.35                
 11 CYSS QB     12 ALA  HA      5.88                
 11 CYSS QB     13 VAL  HN      5.45                
 11 CYSS QB     37 CYSS HN      6.80                
 11 CYSS QB     38 PHE  HN      6.88                
 11 CYSS QB     52 LEU  HN      6.88                
 11 CYSS SG     37 CYSS CB      3.10                
 11 CYSS SG     37 CYSS SG      2.10                
 12 ALA  HN     12 ALA  HA      2.90                
 12 ALA  HN     12 ALA  QB      3.34                
 12 ALA  HN     13 VAL  HN      3.50                
 12 ALA  HN     13 VAL  QG1     7.03                
 12 ALA  HN     13 VAL  QG2     7.03                
 12 ALA  HN     13 VAL  QQG     5.91                
 12 ALA  HN     52 LEU  HN      6.00                
 12 ALA  HN     52 LEU  QB      5.96                
 12 ALA  HA     13 VAL  HN      3.30                
 12 ALA  HA     41 ARG+ QD      5.88                
 12 ALA  HA     52 LEU  QQD     8.13                
 12 ALA  QB     13 VAL  HN      4.44                
 13 VAL  HN     13 VAL  HA      2.85                
 13 VAL  HN     13 VAL  HB      3.30                
 13 VAL  HN     13 VAL  QG1     4.52                
 13 VAL  HN     13 VAL  QG2     4.52                
 13 VAL  HN     13 VAL  QQG     3.85                
 13 VAL  HN     14 PRO  HD2     5.43                
 13 VAL  HN     14 PRO  HD3     5.43                
 13 VAL  HN     14 PRO  QD      5.01                
 13 VAL  HN     18 ARG+ HG2     5.35                
 13 VAL  HN     18 ARG+ HG3     5.35                
 13 VAL  HN     18 ARG+ QG      5.10                
 13 VAL  HN     18 ARG+ QD      6.80                
 13 VAL  HN     18 ARG+ HE      4.00                
 13 VAL  HN     49 PHE  HD2     6.00                
 13 VAL  HN     51 PRO  HA      6.00                
 13 VAL  HA     15 ALA  HN      4.00                
 13 VAL  HA     16 LYS+ HN      6.00                
 13 VAL  HA     18 ARG+ HE      6.00                
 13 VAL  HB     15 ALA  HA      6.00                
 13 VAL  HB     18 ARG+ HE      3.64                
 13 VAL  QG1    16 LYS+ HN      6.19                
 13 VAL  QG1    16 LYS+ HA      7.03                
 13 VAL  QG1    17 ASP- HN      5.03                
 13 VAL  QG2    16 LYS+ HN      6.19                
 13 VAL  QG2    16 LYS+ HA      7.03                
 13 VAL  QG2    17 ASP- HN      5.03                
 13 VAL  QQG    15 ALA  HN      7.59                
 13 VAL  QQG    15 ALA  HA      8.59                
 13 VAL  QQG    16 LYS+ HN      4.75                
 13 VAL  QQG    16 LYS+ HA      6.36                
 13 VAL  QQG    16 LYS+ QD      8.47                
 13 VAL  QQG    17 ASP- HA      8.59                
 13 VAL  QQG    18 ARG+ HN      6.16                
 13 VAL  QQG    18 ARG+ HE      8.06                
 14 PRO  QD     17 ASP- HN      6.88                
 15 ALA  HN     15 ALA  HA      2.90                
 15 ALA  HN     16 LYS+ HN      3.80                
 15 ALA  HN     17 ASP- HN      6.00                
 15 ALA  HN     17 ASP- QB      6.88                
 15 ALA  HN     18 ARG+ HN      6.00                
 15 ALA  HN     18 ARG+ QG      6.88                
 15 ALA  HN     18 ARG+ HD2     6.00                
 15 ALA  HN     18 ARG+ HD3     6.00                
 15 ALA  HN     18 ARG+ QD      5.45                
 15 ALA  HN     18 ARG+ HE      6.00                
 15 ALA  HA     16 LYS+ QD      6.88                
 15 ALA  HA     17 ASP- QB      5.88                
 15 ALA  HA     18 ARG+ HN      5.00                
 15 ALA  HA     42 ILE  QG1     5.93                
 15 ALA  HA     42 ILE  QD1     6.31                
 15 ALA  HA     45 VAL  QG1     6.61                
 15 ALA  HA     45 VAL  QG2     6.61                
 15 ALA  HA     45 VAL  QQG     5.23                
 15 ALA  QB     16 LYS+ HA      5.81                
 15 ALA  QB     18 ARG+ HE      6.03                
 15 ALA  QB     42 ILE  QD1     7.30                
 15 ALA  QB     45 VAL  HN      7.03                
 15 ALA  QB     45 VAL  QG1     7.94                
 15 ALA  QB     45 VAL  QG2     7.94                
 15 ALA  QB     45 VAL  QQG     7.47                
 16 LYS+ HN     16 LYS+ HA      2.77                
 16 LYS+ HN     16 LYS+ QG      3.72                
 16 LYS+ HN     17 ASP- HN      2.81                
 16 LYS+ HN     17 ASP- HB2     3.68                
 16 LYS+ HN     17 ASP- HB3     3.68                
 16 LYS+ HN     17 ASP- QB      3.48                
 16 LYS+ HN     18 ARG+ HN      4.06                
 16 LYS+ HN     18 ARG+ QG      5.88                
 16 LYS+ HN     18 ARG+ QD      5.88                
 16 LYS+ HN     42 ILE  QD1     7.03                
 16 LYS+ HN     45 VAL  QQG     7.59                
 16 LYS+ HN     46 PRO  QD      6.88                
 16 LYS+ HA     16 LYS+ HD2     6.00                
 16 LYS+ HA     16 LYS+ HD3     6.00                
 16 LYS+ HA     16 LYS+ QD      5.69                
 16 LYS+ HA     16 LYS+ HE2     6.00                
 16 LYS+ HA     16 LYS+ HE3     6.00                
 16 LYS+ HA     17 ASP- HN      3.11                
 16 LYS+ HA     17 ASP- HA      6.00                
 16 LYS+ HA     18 ARG+ HN      4.00                
 16 LYS+ HA     45 VAL  QQG     8.17                
 16 LYS+ HB2    16 LYS+ HE2     6.00                
 16 LYS+ HB2    16 LYS+ HE3     6.00                
 16 LYS+ HB3    16 LYS+ HE2     6.00                
 16 LYS+ HB3    16 LYS+ HE3     6.00                
 16 LYS+ QB     16 LYS+ QE      5.56                
 16 LYS+ QB     17 ASP- HN      4.88                
 16 LYS+ QB     45 VAL  HA      6.88                
 16 LYS+ QG     17 ASP- HN      4.67                
 16 LYS+ QG     18 ARG+ HN      6.03                
 16 LYS+ QG     42 ILE  QD1     5.86                
 17 ASP- HN     17 ASP- HA      2.81                
 17 ASP- HN     17 ASP- HB2     3.30                
 17 ASP- HN     17 ASP- HB3     3.30                
 17 ASP- HN     17 ASP- QB      2.98                
 17 ASP- HN     18 ARG+ HN      2.47                
 17 ASP- HN     18 ARG+ HA      5.00                
 17 ASP- HN     18 ARG+ HB2     6.00                
 17 ASP- HN     18 ARG+ HB3     6.00                
 17 ASP- HN     18 ARG+ QB      5.45                
 17 ASP- HN     18 ARG+ HG2     5.16                
 17 ASP- HN     18 ARG+ HG3     5.16                
 17 ASP- HN     18 ARG+ QG      4.53                
 17 ASP- HN     18 ARG+ QD      5.88                
 17 ASP- HN     18 ARG+ HE      6.00                
 17 ASP- HN     45 VAL  QG1     7.03                
 17 ASP- HN     45 VAL  QG2     7.03                
 17 ASP- HN     46 PRO  HD2     6.00                
 17 ASP- HN     46 PRO  HD3     6.00                
 17 ASP- HA     17 ASP- HB2     3.04                
 17 ASP- HA     17 ASP- HB3     3.04                
 17 ASP- HA     18 ARG+ HN      3.30                
 18 ARG+ HN     18 ARG+ HB2     3.50                
 18 ARG+ HN     18 ARG+ HB3     3.50                
 18 ARG+ HN     18 ARG+ QB      2.96                
 18 ARG+ HN     18 ARG+ HG2     3.53                
 18 ARG+ HN     18 ARG+ HG3     3.53                
 18 ARG+ HN     18 ARG+ QG      3.07                
 18 ARG+ HN     18 ARG+ HD2     4.00                
 18 ARG+ HN     18 ARG+ HD3     4.00                
 18 ARG+ HN     18 ARG+ QD      3.69                
 18 ARG+ HN     18 ARG+ HE      5.62                
 18 ARG+ HN     19 VAL  HN      5.00                
 18 ARG+ HN     46 PRO  QG      6.88                
 18 ARG+ HN     46 PRO  HD2     6.00                
 18 ARG+ HN     46 PRO  HD3     6.00                
 18 ARG+ HN     46 PRO  QD      5.45                
 18 ARG+ HN     49 PHE  HB2     6.00                
 18 ARG+ HN     49 PHE  HB3     6.00                
 18 ARG+ HA     19 VAL  HN      2.90                
 18 ARG+ HA     50 LYS+ HN      5.00                
 18 ARG+ HB2    19 VAL  HN      3.76                
 18 ARG+ HB3    19 VAL  HN      3.76                
 18 ARG+ QB     18 ARG+ HE      6.88                
 18 ARG+ QB     19 VAL  HN      3.12                
 18 ARG+ QB     20 ASP- HN      6.88                
 18 ARG+ QB     49 PHE  HN      6.88                
 18 ARG+ QB     50 LYS+ HN      5.88                
 18 ARG+ HG2    19 VAL  HN      4.86                
 18 ARG+ HG3    19 VAL  HN      4.86                
 18 ARG+ QG     18 ARG+ HE      3.90                
 18 ARG+ QG     20 ASP- HN      6.31                
 18 ARG+ QG     21 CYSS HN      6.88                
 18 ARG+ QG     49 PHE  HN      6.88                
 18 ARG+ QG     50 LYS+ HN      6.88                
 18 ARG+ HD2    19 VAL  HN      5.77                
 18 ARG+ HD2    20 ASP- HN      5.00                
 18 ARG+ HD3    19 VAL  HN      5.77                
 18 ARG+ HD3    20 ASP- HN      5.00                
 18 ARG+ QD     19 VAL  HN      5.35                
 18 ARG+ QD     20 ASP- HN      4.83                
 18 ARG+ QD     21 CYSS HN      6.88                
 18 ARG+ QD     39 ASP- HN      6.88                
 18 ARG+ QD     45 VAL  HN      6.88                
 18 ARG+ QD     49 PHE  HN      6.88                
 18 ARG+ QD     50 LYS+ HN      6.88                
 18 ARG+ HE     42 ILE  QD1     7.03                
 18 ARG+ HE     46 PRO  QD      5.82                
 18 ARG+ HE     49 PHE  HD1     6.00                
 19 VAL  HN     19 VAL  HA      2.90                
 19 VAL  HN     19 VAL  HB      2.69                
 19 VAL  HN     20 ASP- HN      3.95                
 19 VAL  HN     20 ASP- HA      6.00                
 19 VAL  HN     49 PHE  HN      6.00                
 19 VAL  HN     49 PHE  HA      6.00                
 19 VAL  HN     49 PHE  HB2     4.78                
 19 VAL  HN     49 PHE  HB3     4.78                
 19 VAL  HN     49 PHE  QB      4.38                
 19 VAL  HN     49 PHE  HD1     6.00                
 19 VAL  HN     50 LYS+ HN      3.49                
 19 VAL  HN    159 PHE  QB      6.88                
 19 VAL  HA     20 ASP- HN      3.30                
 19 VAL  HB     20 ASP- HN      4.00                
 19 VAL  HB     21 CYSS HN      6.00                
 19 VAL  QQG    20 ASP- HN      5.61                
 19 VAL  QQG    21 CYSS HN      7.93                
 19 VAL  QQG    50 LYS+ HN      5.03                
 20 ASP- HN     20 ASP- HB2     2.90                
 20 ASP- HN     20 ASP- HB3     2.90                
 20 ASP- HN     21 CYSS HN      3.91                
 20 ASP- HN     22 GLY  HN      6.00                
 20 ASP- HN     46 PRO  QG      6.88                
 20 ASP- HN     46 PRO  HD2     6.00                
 20 ASP- HN     46 PRO  HD3     6.00                
 20 ASP- HN     48 CYSS HN      6.00                
 20 ASP- HN     49 PHE  HA      5.00                
 20 ASP- HN     50 LYS+ HN      6.00                
 20 ASP- HA     21 CYSS HN      2.39                
 20 ASP- HA     22 GLY  HN      3.30                
 20 ASP- HA     47 TRP  HN      6.00                
 20 ASP- HA     48 CYSS HN      5.00                
 20 ASP- HA     49 PHE  HA      4.00                
 20 ASP- QB     22 GLY  HN      4.88                
 20 ASP- QB     47 TRP  HN      6.88                
 21 CYSS N      48 CYSS O       3.00                
 21 CYSS HN     21 CYSS HA      2.90                
 21 CYSS HN     21 CYSS HB2     2.85                
 21 CYSS HN     21 CYSS HB3     2.85                
 21 CYSS HN     22 GLY  HN      4.90                
 21 CYSS HN     22 GLY  QA      5.88                
 21 CYSS HN     23 TYR  HN      6.00                
 21 CYSS HN     23 TYR  QD      8.00                
 21 CYSS HN     36 CYSS HA      6.00                
 21 CYSS HN     46 PRO  HA      6.00                
 21 CYSS HN     46 PRO  HB2     4.86                
 21 CYSS HN     46 PRO  HB3     4.86                
 21 CYSS HN     46 PRO  QB      4.50                
 21 CYSS HN     48 CYSS HN      5.00                
 21 CYSS HN     48 CYSS HA      6.00                
 21 CYSS HN     48 CYSS QB      6.88                
 21 CYSS HN     48 CYSS O       2.00                
 21 CYSS HN     49 PHE  HN      4.00                
 21 CYSS HN     49 PHE  HA      2.81                
 21 CYSS HN     49 PHE  HB2     5.00                
 21 CYSS HN     49 PHE  HB3     5.00                
 21 CYSS HN     50 LYS+ HN      5.00                
 21 CYSS HA     23 TYR  QD      8.14                
 21 CYSS HA     23 TYR  QE      8.13                
 21 CYSS HA     49 PHE  HA      6.00                
 21 CYSS HA     50 LYS+ HN      6.00                
 21 CYSS HA     50 LYS+ HG2     6.00                
 21 CYSS HA     50 LYS+ HG3     6.00                
 21 CYSS HA     50 LYS+ QE      6.27                
 21 CYSS CB     36 CYSS SG      3.10                
 21 CYSS HB2    22 GLY  HN      3.80                
 21 CYSS HB2    23 TYR  HN      5.00                
 21 CYSS HB2    23 TYR  QD      7.61                
 21 CYSS HB2    23 TYR  QE      7.64                
 21 CYSS HB2    49 PHE  HN      5.00                
 21 CYSS HB2    49 PHE  HA      6.00                
 21 CYSS HB2    50 LYS+ HN      6.00                
 21 CYSS HB3    22 GLY  HN      3.80                
 21 CYSS HB3    23 TYR  HN      5.00                
 21 CYSS HB3    23 TYR  QD      7.61                
 21 CYSS HB3    23 TYR  QE      7.64                
 21 CYSS HB3    49 PHE  HN      5.00                
 21 CYSS HB3    49 PHE  HA      6.00                
 21 CYSS HB3    50 LYS+ HN      6.00                
 21 CYSS QB     22 GLY  HN      3.52                
 21 CYSS QB     23 TYR  HN      4.44                
 21 CYSS QB     23 TYR  QD      7.31                
 21 CYSS QB     34 ARG+ QD      7.75                
 21 CYSS QB     36 CYSS HN      6.88                
 21 CYSS QB     37 CYSS HN      5.88                
 21 CYSS QB     48 CYSS HN      6.88                
 21 CYSS QB     49 PHE  HN      4.44                
 21 CYSS QB     50 LYS+ HN      5.46                
 21 CYSS SG     36 CYSS CB      3.10                
 21 CYSS SG     36 CYSS SG      2.10                
 22 GLY  HN     23 TYR  HN      3.23                
 22 GLY  HN     23 TYR  HA      6.00                
 22 GLY  HN     23 TYR  QD      8.14                
 22 GLY  HN     26 VAL  QQG     8.15                
 22 GLY  HN     46 PRO  QG      6.88                
 22 GLY  HN     48 CYSS HN      6.00                
 22 GLY  HN     48 CYSS HB2     5.00                
 22 GLY  HN     48 CYSS HB3     5.00                
 22 GLY  HN     49 PHE  HA      5.00                
 22 GLY  HN     49 PHE  QB      6.88                
 22 GLY  QA     48 CYSS HN      6.88                
 23 TYR  HN     26 VAL  HN      5.00                
 23 TYR  HN     26 VAL  HA      6.00                
 23 TYR  HN     26 VAL  HB      4.00                
 23 TYR  HN     26 VAL  QQG     6.26                
 23 TYR  HN     31 CYSS QB      6.88                
 23 TYR  HN     47 TRP  HE3     6.00                
 23 TYR  HN     48 CYSS HB2     5.00                
 23 TYR  HN     48 CYSS HB3     5.00                
 23 TYR  HN     48 CYSS QB      4.22                
 23 TYR  HA     23 TYR  QB      2.59                
 23 TYR  HA     23 TYR  QE      5.81                
 23 TYR  HA     26 VAL  HB      6.00                
 23 TYR  HA     26 VAL  QQG     8.59                
 23 TYR  QD     26 VAL  HN      7.99                
 23 TYR  QD     26 VAL  HA      7.99                
 23 TYR  QD     26 VAL  HB      7.68                
 23 TYR  QD     26 VAL  QG1     9.17                
 23 TYR  QD     26 VAL  QG2     9.17                
 23 TYR  QD     31 CYSS HA      8.14                
 23 TYR  QD     34 ARG+ HB2     8.14                
 23 TYR  QD     34 ARG+ HB3     8.14                
 23 TYR  QD     34 ARG+ QG      9.02                
 23 TYR  QD     34 ARG+ QD      7.20                
 23 TYR  QD     35 GLY  QA      9.02                
 23 TYR  QD     49 PHE  HN      8.14                
 23 TYR  QE     26 VAL  HA      7.75                
 23 TYR  QE     26 VAL  HB      7.75                
 23 TYR  QE     26 VAL  QG1     9.16                
 23 TYR  QE     26 VAL  QG2     9.16                
 23 TYR  QE     31 CYSS HA      8.13                
 23 TYR  QE     34 ARG+ HB2     7.37                
 23 TYR  QE     34 ARG+ HB3     7.37                
 23 TYR  QE     34 ARG+ HG2     8.13                
 23 TYR  QE     34 ARG+ HG3     8.13                
 23 TYR  QE     34 ARG+ HD2     7.98                
 23 TYR  QE     34 ARG+ HD3     7.98                
 23 TYR  QE     34 ARG+ QD      7.60                
 23 TYR  QE     35 GLY  QA      9.01                
 24 PRO  QD     26 VAL  HN      5.88                
 25 HIS+ HN     26 VAL  HN      4.02                
 25 HIS+ HN     26 VAL  HA      4.00                
 25 HIS+ HN     34 ARG+ QB      6.88                
 25 HIS+ HN     34 ARG+ QG      6.88                
 25 HIS+ HA     26 VAL  HN      3.19                
 25 HIS+ HA     27 THR  HN      6.00                
 25 HIS+ QB     26 VAL  HN      5.00                
 26 VAL  HN     26 VAL  HA      2.88                
 26 VAL  HN     26 VAL  HB      3.30                
 26 VAL  HN     27 THR  HN      5.00                
 26 VAL  HN     27 THR  HA      6.00                
 26 VAL  HN     30 GLU- QB      6.88                
 26 VAL  HN     31 CYSS QB      6.88                
 26 VAL  HN     47 TRP  HZ3     6.00                
 26 VAL  HN     48 CYSS QB      6.88                
 26 VAL  HB     27 THR  HN      4.00                
 26 VAL  QG1    38 PHE  QD      9.15                
 26 VAL  QG2    38 PHE  QD      9.15                
 26 VAL  QQG    38 PHE  QD      8.55                
 26 VAL  QQG    39 ASP- HN      8.05                
 26 VAL  QQG    47 TRP  HN      8.12                
 26 VAL  QQG    47 TRP  HE3     8.59                
 26 VAL  QQG    47 TRP  HZ2     8.59                
 26 VAL  QQG    48 CYSS HN      7.17                
 26 VAL  QQG    48 CYSS HA      8.59                
 27 THR  HN     27 THR  HA      2.90                
 27 THR  HN     27 THR  HB      2.90                
 27 THR  HN     27 THR  QG2     4.00                
 27 THR  HN     28 PRO  HA      5.00                
 27 THR  HN     28 PRO  QD      6.27                
 27 THR  HN     29 LYS+ QB      6.88                
 27 THR  HN     30 GLU- HN      5.00                
 27 THR  HN     30 GLU- HA      6.00                
 27 THR  HN     30 GLU- HB2     5.00                
 27 THR  HN     30 GLU- HB3     5.00                
 27 THR  HN     30 GLU- QB      4.23                
 27 THR  HN     30 GLU- QG      6.19                
 27 THR  HN     31 CYSS HN      4.00                
 27 THR  HN     31 CYSS HA      6.00                
 27 THR  HN     31 CYSS HB2     6.00                
 27 THR  HN     31 CYSS HB3     6.00                
 27 THR  HN     48 CYSS QB      6.88                
 27 THR  HA     29 LYS+ HN      5.00                
 27 THR  HA     30 GLU- HN      6.00                
 27 THR  HB     30 GLU- HN      6.00                
 27 THR  HB     31 CYSS HN      6.00                
 27 THR  QG2    29 LYS+ HN      7.03                
 27 THR  QG2    30 GLU- HN      5.47                
 27 THR  QG2    31 CYSS HN      4.25                
 27 THR  QG2    32 ASN  HN      6.31                
 27 THR  QG2    33 ASN  HN      7.03                
 27 THR  O      30 GLU- N       3.00                
 27 THR  O      30 GLU- HN      2.00                
 27 THR  O      31 CYSS N       3.00                
 27 THR  O      31 CYSS HN      2.00                
 28 PRO  HA     30 GLU- HN      6.00                
 28 PRO  HA     31 CYSS HN      5.00                
 28 PRO  HA     32 ASN  HN      5.00                
 28 PRO  HA     38 PHE  HN      5.00                
 28 PRO  QD     29 LYS+ HN      5.02                
 28 PRO  QD     30 GLU- HN      6.88                
 28 PRO  QD     31 CYSS HN      6.88                
 29 LYS+ HN     29 LYS+ HB2     3.50                
 29 LYS+ HN     29 LYS+ HB3     3.50                
 29 LYS+ HN     29 LYS+ QB      3.05                
 29 LYS+ HN     29 LYS+ QG      5.39                
 29 LYS+ HN     30 GLU- HN      4.00                
 29 LYS+ HN     30 GLU- HB2     6.00                
 29 LYS+ HN     30 GLU- HB3     6.00                
 29 LYS+ HN     30 GLU- QG      6.00                
 29 LYS+ HN     31 CYSS HN      6.00                
 29 LYS+ HN     31 CYSS QB      6.88                
 29 LYS+ HN     32 ASN  HN      6.00                
 29 LYS+ HN     32 ASN  QB      6.88                
 29 LYS+ HN     33 ASN  QB      6.88                
 29 LYS+ HA     29 LYS+ QD      4.37                
 29 LYS+ HA     29 LYS+ QE      6.88                
 29 LYS+ HA     31 CYSS QB      6.88                
 29 LYS+ HA     32 ASN  HA      6.00                
 29 LYS+ HA     33 ASN  HN      5.00                
 29 LYS+ HB2    29 LYS+ QE      6.88                
 29 LYS+ HB2    30 GLU- HN      4.00                
 29 LYS+ HB3    29 LYS+ QE      6.88                
 29 LYS+ HB3    30 GLU- HN      4.00                
 29 LYS+ QB     29 LYS+ QE      6.60                
 29 LYS+ QB     30 GLU- HN      3.65                
 29 LYS+ QB     31 CYSS HN      6.88                
 29 LYS+ QB     32 ASN  HN      6.88                
 29 LYS+ QG     30 GLU- HN      5.43                
 29 LYS+ QG     31 CYSS HN      6.88                
 29 LYS+ QG     32 ASN  HN      6.88                
 29 LYS+ QG     33 ASN  HN      6.88                
 29 LYS+ QG     33 ASN  HD21    6.61                
 29 LYS+ QG     33 ASN  HD22    6.61                
 29 LYS+ QG     33 ASN  QD2     6.46                
 30 GLU- HN     30 GLU- HA      2.77                
 30 GLU- HN     30 GLU- HB2     3.30                
 30 GLU- HN     30 GLU- HB3     3.30                
 30 GLU- HN     30 GLU- QB      2.92                
 30 GLU- HN     30 GLU- QG      4.71                
 30 GLU- HN     31 CYSS HN      2.77                
 30 GLU- HN     31 CYSS HA      5.00                
 30 GLU- HN     31 CYSS HB2     6.00                
 30 GLU- HN     31 CYSS HB3     6.00                
 30 GLU- HN     31 CYSS QB      5.45                
 30 GLU- HN     32 ASN  HN      5.00                
 30 GLU- HN     32 ASN  QB      6.88                
 30 GLU- HN     33 ASN  HN      5.00                
 30 GLU- HN     33 ASN  QB      5.88                
 30 GLU- HA     31 CYSS HN      3.50                
 30 GLU- HA     33 ASN  HN      3.50                
 30 GLU- HA     33 ASN  HB2     5.00                
 30 GLU- HA     33 ASN  HB3     5.00                
 30 GLU- HA     33 ASN  QB      4.44                
 30 GLU- HA     33 ASN  HD21    5.09                
 30 GLU- HA     33 ASN  HD22    5.09                
 30 GLU- HA     33 ASN  QD2     4.81                
 30 GLU- HA     34 ARG+ HN      4.00                
 30 GLU- HB2    31 CYSS HN      3.11                
 30 GLU- HB2    32 ASN  HN      6.00                
 30 GLU- HB3    31 CYSS HN      3.11                
 30 GLU- HB3    32 ASN  HN      6.00                
 30 GLU- QB     31 CYSS HN      2.91                
 30 GLU- QB     32 ASN  HN      5.45                
 30 GLU- QB     33 ASN  HN      6.88                
 30 GLU- QB     33 ASN  QD2     6.30                
 30 GLU- QG     31 CYSS HN      5.00                
 30 GLU- QG     33 ASN  HN      6.00                
 30 GLU- QG     33 ASN  HD21    6.76                
 30 GLU- QG     33 ASN  HD22    6.76                
 30 GLU- QG     34 ARG+ HN      6.88                
 30 GLU- O      33 ASN  N       3.00                
 30 GLU- O      33 ASN  HN      2.00                
 30 GLU- O      34 ARG+ N       3.00                
 30 GLU- O      34 ARG+ HN      2.00                
 31 CYSS HN     31 CYSS HA      2.73                
 31 CYSS HN     31 CYSS HB2     3.50                
 31 CYSS HN     31 CYSS HB3     3.50                
 31 CYSS HN     32 ASN  HN      5.00                
 31 CYSS HN     32 ASN  HA      6.00                
 31 CYSS HN     32 ASN  HB2     6.00                
 31 CYSS HN     32 ASN  HB3     6.00                
 31 CYSS HN     32 ASN  QB      5.45                
 31 CYSS HN     33 ASN  HN      6.00                
 31 CYSS HN     33 ASN  QB      5.88                
 31 CYSS HN     34 ARG+ HN      5.00                
 31 CYSS HN     34 ARG+ QG      6.88                
 31 CYSS HN     38 PHE  HN      6.00                
 31 CYSS HN     38 PHE  QB      6.88                
 31 CYSS HN     38 PHE  QD      8.12                
 31 CYSS HA     33 ASN  HN      6.00                
 31 CYSS HA     34 ARG+ HN      3.64                
 31 CYSS HA     35 GLY  HN      4.48                
 31 CYSS HA     36 CYSS HN      5.00                
 31 CYSS HA     37 CYSS HN      6.00                
 31 CYSS HA     38 PHE  QD      8.12                
 31 CYSS CB     48 CYSS SG      3.10                
 31 CYSS HB2    32 ASN  HN      3.61                
 31 CYSS HB2    32 ASN  HD21    6.00                
 31 CYSS HB2    32 ASN  HD22    6.00                
 31 CYSS HB2    33 ASN  HN      4.82                
 31 CYSS HB2    34 ARG+ HN      6.00                
 31 CYSS HB2    35 GLY  HN      6.00                
 31 CYSS HB2    36 CYSS HN      5.00                
 31 CYSS HB2    37 CYSS HN      5.00                
 31 CYSS HB3    32 ASN  HN      3.61                
 31 CYSS HB3    32 ASN  HD21    6.00                
 31 CYSS HB3    32 ASN  HD22    6.00                
 31 CYSS HB3    33 ASN  HN      4.82                
 31 CYSS HB3    34 ARG+ HN      6.00                
 31 CYSS HB3    35 GLY  HN      6.00                
 31 CYSS HB3    36 CYSS HN      5.00                
 31 CYSS HB3    37 CYSS HN      5.00                
 31 CYSS QB     32 ASN  HN      3.06                
 31 CYSS QB     32 ASN  QD2     5.35                
 31 CYSS QB     33 ASN  HN      4.48                
 31 CYSS QB     34 ARG+ HN      5.45                
 31 CYSS QB     35 GLY  HN      5.45                
 31 CYSS QB     37 CYSS HN      4.44                
 31 CYSS QB     38 PHE  HN      6.42                
 31 CYSS QB     38 PHE  QD      8.01                
 31 CYSS QB     48 CYSS HN      6.88                
 31 CYSS SG     48 CYSS CB      3.10                
 31 CYSS SG     48 CYSS SG      2.10                
 31 CYSS O      35 GLY  N       3.00                
 31 CYSS O      35 GLY  HN      2.00                
 31 CYSS O      36 CYSS N       3.00                
 31 CYSS O      36 CYSS HN      2.00                
 32 ASN  HN     32 ASN  HA      2.90                
 32 ASN  HN     32 ASN  HB2     3.50                
 32 ASN  HN     32 ASN  HB3     3.50                
 32 ASN  HN     32 ASN  QB      2.88                
 32 ASN  HN     33 ASN  HN      2.92                
 32 ASN  HN     33 ASN  HA      6.00                
 32 ASN  HN     33 ASN  QB      4.88                
 32 ASN  HN     34 ARG+ HN      5.00                
 32 ASN  HN     34 ARG+ HG2     6.00                
 32 ASN  HN     34 ARG+ HG3     6.00                
 32 ASN  HN     35 GLY  HN      5.00                
 32 ASN  HN     36 CYSS HN      5.00                
 32 ASN  HN     37 CYSS HA      6.00                
 32 ASN  HN     38 PHE  HN      5.24                
 32 ASN  HN     38 PHE  QB      6.65                
 32 ASN  HN     38 PHE  QD      7.97                
 32 ASN  HA     32 ASN  HD21    3.50                
 32 ASN  HA     32 ASN  HD22    3.50                
 32 ASN  HA     32 ASN  QD2     3.14                
 32 ASN  HA     33 ASN  HN      3.50                
 32 ASN  HA     33 ASN  HA      6.00                
 32 ASN  HA     34 ARG+ HN      5.00                
 32 ASN  HA     35 GLY  HN      3.64                
 32 ASN  HA     36 CYSS HN      3.50                
 32 ASN  HA     37 CYSS HN      6.00                
 32 ASN  HA     37 CYSS HA      6.00                
 32 ASN  HB2    36 CYSS HN      6.00                
 32 ASN  HB3    36 CYSS HN      6.00                
 32 ASN  QB     36 CYSS HN      5.45                
 32 ASN  QB     38 PHE  HN      6.88                
 32 ASN  ND2    38 PHE  N       3.00                
 32 ASN  ND2    38 PHE  HN      2.00                
 32 ASN  HD21   33 ASN  HN      6.00                
 32 ASN  HD21   37 CYSS HA      4.67                
 32 ASN  HD21   37 CYSS HB2     7.75                
 32 ASN  HD21   37 CYSS HB3     7.75                
 32 ASN  HD21   38 PHE  HB2     5.39                
 32 ASN  HD21   38 PHE  HB3     5.39                
 32 ASN  HD22   33 ASN  HN      6.00                
 32 ASN  HD22   37 CYSS HA      4.67                
 32 ASN  HD22   37 CYSS HB2     7.75                
 32 ASN  HD22   37 CYSS HB3     7.75                
 32 ASN  HD22   38 PHE  HB2     5.39                
 32 ASN  HD22   38 PHE  HB3     5.39                
 32 ASN  QD2    33 ASN  HN      5.45                
 32 ASN  QD2    36 CYSS HN      6.87                
 32 ASN  QD2    37 CYSS HN      5.87                
 32 ASN  QD2    37 CYSS HA      4.42                
 32 ASN  QD2    37 CYSS QB      6.82                
 32 ASN  QD2    38 PHE  QB      4.28                
 33 ASN  HN     33 ASN  HA      2.90                
 33 ASN  HN     33 ASN  HB2     2.90                
 33 ASN  HN     33 ASN  HB3     2.90                
 33 ASN  HN     33 ASN  QB      2.56                
 33 ASN  HN     33 ASN  HD21    6.00                
 33 ASN  HN     33 ASN  HD22    6.00                
 33 ASN  HN     34 ARG+ HN      2.90                
 33 ASN  HN     34 ARG+ HA      6.00                
 33 ASN  HN     34 ARG+ HB2     6.00                
 33 ASN  HN     34 ARG+ HB3     6.00                
 33 ASN  HN     34 ARG+ QB      5.45                
 33 ASN  HN     34 ARG+ HG2     5.00                
 33 ASN  HN     34 ARG+ HG3     5.00                
 33 ASN  HN     35 GLY  HN      4.25                
 33 ASN  HN     35 GLY  QA      6.88                
 33 ASN  HN     36 CYSS HN      6.00                
 33 ASN  HN     38 PHE  QB      6.88                
 33 ASN  HA     33 ASN  HD21    6.00                
 33 ASN  HA     33 ASN  HD22    6.00                
 33 ASN  HA     34 ARG+ HN      3.50                
 33 ASN  HA     35 GLY  HN      5.00                
 33 ASN  HA     36 CYSS HN      6.00                
 33 ASN  HB2    34 ARG+ HN      4.00                
 33 ASN  HB2    35 GLY  HN      6.00                
 33 ASN  HB3    34 ARG+ HN      4.00                
 33 ASN  HB3    35 GLY  HN      6.00                
 33 ASN  QB     34 ARG+ HN      3.34                
 33 ASN  QB     35 GLY  HN      5.45                
 33 ASN  HD21   34 ARG+ HG2     7.75                
 33 ASN  HD21   34 ARG+ HG3     7.75                
 33 ASN  HD22   34 ARG+ HG2     7.75                
 33 ASN  HD22   34 ARG+ HG3     7.75                
 33 ASN  QD2    34 ARG+ QB      7.74                
 33 ASN  QD2    34 ARG+ QG      6.82                
 34 ARG+ HN     34 ARG+ HA      2.88                
 34 ARG+ HN     34 ARG+ HB2     3.50                
 34 ARG+ HN     34 ARG+ HB3     3.50                
 34 ARG+ HN     34 ARG+ QB      3.29                
 34 ARG+ HN     34 ARG+ HG2     4.00                
 34 ARG+ HN     34 ARG+ HG3     4.00                
 34 ARG+ HN     34 ARG+ QD      4.67                
 34 ARG+ HN     35 GLY  HN      2.85                
 34 ARG+ HN     35 GLY  HA1     5.00                
 34 ARG+ HN     35 GLY  HA2     5.00                
 34 ARG+ HN     36 CYSS HN      3.50                
 34 ARG+ HN     36 CYSS HA      6.00                
 34 ARG+ HA     34 ARG+ HD2     4.78                
 34 ARG+ HA     34 ARG+ HD3     4.78                
 34 ARG+ HA     34 ARG+ QD      4.42                
 34 ARG+ HA     35 GLY  HN      3.30                
 34 ARG+ HA     36 CYSS HN      5.00                
 34 ARG+ HB2    34 ARG+ HD2     4.22                
 34 ARG+ HB2    34 ARG+ HD3     4.22                
 34 ARG+ HB2    35 GLY  HN      4.00                
 34 ARG+ HB2    36 CYSS HN      5.00                
 34 ARG+ HB3    34 ARG+ HD2     4.22                
 34 ARG+ HB3    34 ARG+ HD3     4.22                
 34 ARG+ HB3    35 GLY  HN      4.00                
 34 ARG+ HB3    36 CYSS HN      5.00                
 34 ARG+ QB     34 ARG+ QD      3.65                
 34 ARG+ QB     35 GLY  HN      3.84                
 34 ARG+ QB     36 CYSS HN      4.72                
 34 ARG+ HG2    35 GLY  HN      6.00                
 34 ARG+ HG2    36 CYSS HN      5.85                
 34 ARG+ HG3    35 GLY  HN      6.00                
 34 ARG+ HG3    36 CYSS HN      5.85                
 34 ARG+ QG     35 GLY  HN      5.60                
 34 ARG+ QG     36 CYSS HN      5.46                
 34 ARG+ QG     50 LYS+ QE      7.76                
 35 GLY  HN     35 GLY  HA1     2.77                
 35 GLY  HN     35 GLY  HA2     2.77                
 35 GLY  HN     35 GLY  QA      2.53                
 35 GLY  HN     36 CYSS HN      2.88                
 35 GLY  HN     36 CYSS HA      5.00                
 35 GLY  HN     37 CYSS HN      6.00                
 35 GLY  HA1    36 CYSS HN      3.50                
 35 GLY  HA2    36 CYSS HN      3.50                
 35 GLY  QA     36 CYSS HN      3.19                
 35 GLY  QA     36 CYSS HA      4.88                
 35 GLY  QA     37 CYSS HN      6.88                
 35 GLY  QA     50 LYS+ HA      5.88                
 36 CYSS HN     37 CYSS HN      5.00                
 36 CYSS HN     37 CYSS QB      6.88                
 36 CYSS HN     49 PHE  HN      6.00                
 36 CYSS HA     37 CYSS HN      2.90                
 36 CYSS HA     37 CYSS HA      6.00                
 36 CYSS HA     38 PHE  HN      6.00                
 36 CYSS HA     48 CYSS QB      6.88                
 36 CYSS HA     49 PHE  HN      6.00                
 36 CYSS HA     50 LYS+ HN      6.00                
 36 CYSS HB2    37 CYSS HN      3.53                
 36 CYSS HB2    49 PHE  HN      6.00                
 36 CYSS HB3    37 CYSS HN      3.53                
 36 CYSS HB3    49 PHE  HN      6.00                
 36 CYSS QB     37 CYSS HN      3.30                
 37 CYSS N      49 PHE  O       3.00                
 37 CYSS HN     37 CYSS HA      2.90                
 37 CYSS HN     37 CYSS HB2     3.50                
 37 CYSS HN     37 CYSS HB3     3.50                
 37 CYSS HN     38 PHE  HA      5.00                
 37 CYSS HN     38 PHE  QD      7.13                
 37 CYSS HN     39 ASP- HN      6.00                
 37 CYSS HN     48 CYSS HA      4.71                
 37 CYSS HN     48 CYSS QB      6.88                
 37 CYSS HN     49 PHE  HN      2.85                
 37 CYSS HN     49 PHE  HA      5.00                
 37 CYSS HN     49 PHE  HD1     6.00                
 37 CYSS HN     49 PHE  HD2     5.43                
 37 CYSS HN     49 PHE  O       2.00                
 37 CYSS HN     50 LYS+ HN      6.00                
 37 CYSS HN     50 LYS+ HA      3.68                
 37 CYSS HN     50 LYS+ QG      6.88                
 37 CYSS HN     51 PRO  HD2     5.20                
 37 CYSS HN     51 PRO  HD3     5.20                
 37 CYSS HN     51 PRO  QD      4.55                
 37 CYSS HN     53 GLN  QB      6.88                
 37 CYSS HN     53 GLN  QG      5.82                
 37 CYSS HA     37 CYSS QB      2.65                
 37 CYSS HA     38 PHE  HN      2.90                
 37 CYSS HA     38 PHE  HA      6.00                
 37 CYSS HA     39 ASP- HN      6.00                
 37 CYSS HA     49 PHE  HN      5.00                
 37 CYSS HA     53 GLN  QB      6.88                
 37 CYSS HA     53 GLN  QG      5.88                
 37 CYSS HB2    38 PHE  HN      5.00                
 37 CYSS HB2    49 PHE  HN      4.10                
 37 CYSS HB3    38 PHE  HN      5.00                
 37 CYSS HB3    49 PHE  HN      4.10                
 37 CYSS QB     38 PHE  HN      4.18                
 37 CYSS QB     39 ASP- HN      6.88                
 37 CYSS QB     49 PHE  HN      3.89                
 37 CYSS QB     49 PHE  HA      6.88                
 37 CYSS O      49 PHE  N       3.00                
 37 CYSS O      49 PHE  HN      2.00                
 38 PHE  HN     38 PHE  HB2     2.88                
 38 PHE  HN     38 PHE  HB3     2.88                
 38 PHE  HN     38 PHE  QB      2.69                
 38 PHE  HN     38 PHE  QE      7.97                
 38 PHE  HN     39 ASP- HN      5.00                
 38 PHE  HN     39 ASP- QB      6.88                
 38 PHE  HA     39 ASP- HN      2.90                
 38 PHE  HA     40 SER  HN      6.00                
 38 PHE  HA     48 CYSS QB      6.88                
 38 PHE  HB2    39 ASP- HN      5.00                
 38 PHE  HB3    39 ASP- HN      5.00                
 38 PHE  QB     39 ASP- HN      4.44                
 38 PHE  QB     48 CYSS HA      6.88                
 38 PHE  QD     39 ASP- HN      5.80                
 38 PHE  QD     39 ASP- HA      8.05                
 38 PHE  QD     39 ASP- QB      6.08                
 38 PHE  QD     41 ARG+ HN      8.12                
 38 PHE  QD     47 TRP  HE3     6.72                
 38 PHE  QD     48 CYSS HN      7.89                
 38 PHE  QD     48 CYSS QB      8.66                
 38 PHE  QD     49 PHE  HN      7.41                
 38 PHE  QE     39 ASP- HN      7.59                
 38 PHE  QE     40 SER  HN      5.00                
 38 PHE  QE     41 ARG+ HN      7.59                
 38 PHE  QE     47 TRP  HE3     5.99                
 38 PHE  QE     48 CYSS HN      7.74                
 38 PHE  HZ     47 TRP  HE3     6.00                
 39 ASP- HN     39 ASP- HB2     3.04                
 39 ASP- HN     39 ASP- HB3     3.04                
 39 ASP- HN     40 SER  HN      5.00                
 39 ASP- HN     41 ARG+ HN      6.00                
 39 ASP- HN     46 PRO  QB      6.88                
 39 ASP- HN     47 TRP  HN      6.00                
 39 ASP- HN     47 TRP  HA      3.42                
 39 ASP- HN     48 CYSS HA      5.89                
 39 ASP- HN     48 CYSS QB      6.88                
 39 ASP- HN     49 PHE  HN      5.00                
 39 ASP- HN     49 PHE  HD1     6.00                
 39 ASP- HA     40 SER  HN      3.50                
 39 ASP- HA     41 ARG+ HN      4.00                
 39 ASP- HB2    47 TRP  HN      6.00                
 39 ASP- HB3    47 TRP  HN      6.00                
 39 ASP- QB     41 ARG+ HN      4.49                
 39 ASP- QB     42 ILE  HN      6.88                
 39 ASP- QB     47 TRP  HN      5.45                
 39 ASP- OD1    41 ARG+ N       3.00                
 39 ASP- OD1    41 ARG+ HN      2.00                
 39 ASP- OD1    42 ILE  N       3.00                
 39 ASP- OD1    42 ILE  HN      2.00                
 40 SER  HN     41 ARG+ HN      3.50                
 40 SER  HN     41 ARG+ HA      5.00                
 40 SER  HN     41 ARG+ QG      5.88                
 40 SER  HN     45 VAL  HN      6.00                
 41 ARG+ HN     41 ARG+ HA      2.81                
 41 ARG+ HN     41 ARG+ QB      3.87                
 41 ARG+ HN     41 ARG+ HG2     2.77                
 41 ARG+ HN     41 ARG+ HG3     2.77                
 41 ARG+ HN     41 ARG+ QD      6.69                
 41 ARG+ HN     42 ILE  HN      2.92                
 41 ARG+ HN     42 ILE  HG12    5.01                
 41 ARG+ HN     42 ILE  HG13    5.01                
 41 ARG+ HN     42 ILE  QG1     4.76                
 41 ARG+ HA     41 ARG+ QB      2.67                
 41 ARG+ HA     41 ARG+ QG      3.58                
 41 ARG+ HA     41 ARG+ HD2     5.54                
 41 ARG+ HA     41 ARG+ HD3     5.54                
 41 ARG+ HA     41 ARG+ QD      4.96                
 41 ARG+ HA     42 ILE  HN      3.50                
 41 ARG+ QB     45 VAL  QQG     7.68                
 41 ARG+ QG     42 ILE  HN      4.88                
 41 ARG+ QD     42 ILE  HN      6.88                
 42 ILE  HN     42 ILE  HA      2.90                
 42 ILE  HN     42 ILE  HB      2.90                
 42 ILE  HN     42 ILE  QG2     4.52                
 42 ILE  HN     42 ILE  HG12    3.80                
 42 ILE  HN     42 ILE  HG13    3.80                
 42 ILE  HN     42 ILE  QG1     3.38                
 42 ILE  HN     42 ILE  QD1     4.90                
 42 ILE  HN     43 PRO  QG      6.88                
 42 ILE  HN     45 VAL  HN      6.00                
 42 ILE  HN     47 TRP  HE1     5.70                
 42 ILE  HA     42 ILE  HG12    3.64                
 42 ILE  HA     42 ILE  HG13    3.64                
 42 ILE  HA     42 ILE  QG1     3.46                
 42 ILE  HA     43 PRO  QG      5.08                
 42 ILE  HA     43 PRO  HD2     3.38                
 42 ILE  HA     43 PRO  HD3     3.38                
 42 ILE  HA     43 PRO  QD      3.15                
 42 ILE  HB     43 PRO  HA      6.00                
 42 ILE  HB     45 VAL  HN      5.00                
 42 ILE  HB     45 VAL  QG1     6.12                
 42 ILE  HB     45 VAL  QG2     6.12                
 42 ILE  HB     45 VAL  QQG     5.10                
 42 ILE  HB     47 TRP  HE1     6.00                
 42 ILE  QG2    43 PRO  HA      6.46                
 42 ILE  QG2    44 GLY  HN      7.03                
 42 ILE  QG2    45 VAL  HA      7.03                
 42 ILE  QG2    45 VAL  QQG     8.63                
 42 ILE  QG2    47 TRP  HE1     7.03                
 42 ILE  QG1    43 PRO  HA      6.88                
 42 ILE  O      45 VAL  N       3.00                
 42 ILE  O      45 VAL  HN      2.00                
 43 PRO  HA     44 GLY  QA      6.88                
 43 PRO  HA     45 VAL  QQG     8.59                
 43 PRO  HA     47 TRP  HE1     5.00                
 43 PRO  HA     47 TRP  HZ2     4.75                
 43 PRO  HB2    47 TRP  HE1     6.00                
 43 PRO  HB3    47 TRP  HE1     6.00                
 43 PRO  QB     45 VAL  HN      5.88                
 43 PRO  QB     47 TRP  HE1     5.62                
 43 PRO  QG     45 VAL  HN      5.88                
 43 PRO  QG     47 TRP  HE1     6.88                
 43 PRO  O      47 TRP  NE1     3.00                
 43 PRO  O      47 TRP  HE1     2.00                
 44 GLY  HN     45 VAL  HN      3.45                
 44 GLY  HN     45 VAL  HA      5.00                
 44 GLY  HN     45 VAL  QQG     8.59                
 44 GLY  HN     47 TRP  HE1     6.00                
 44 GLY  HA1    45 VAL  HN      3.19                
 44 GLY  HA2    45 VAL  HN      3.19                
 44 GLY  QA     45 VAL  HA      4.88                
 45 VAL  HN     45 VAL  HA      2.90                
 45 VAL  HN     45 VAL  QG1     3.99                
 45 VAL  HN     45 VAL  QG2     3.99                
 45 VAL  HN     45 VAL  QQG     3.43                
 45 VAL  HN     46 PRO  QB      6.85                
 45 VAL  HN     46 PRO  HD2     5.01                
 45 VAL  HN     46 PRO  HD3     5.01                
 45 VAL  HN     46 PRO  QD      4.72                
 45 VAL  HN     47 TRP  HE1     4.97                
 45 VAL  HA     47 TRP  HN      6.00                
 45 VAL  QQG    47 TRP  HN      8.59                
 45 VAL  QQG    47 TRP  QB      9.47                
 45 VAL  QQG    47 TRP  HE1     7.37                
 46 PRO  HA     47 TRP  HN      2.90                
 46 PRO  HA     48 CYSS HN      3.26                
 46 PRO  HB2    48 CYSS HN      4.00                
 46 PRO  HB3    48 CYSS HN      4.00                
 46 PRO  QB     47 TRP  HN      4.30                
 46 PRO  QB     48 CYSS HN      3.65                
 46 PRO  HG2    48 CYSS HN      6.00                
 46 PRO  HG3    48 CYSS HN      6.00                
 46 PRO  QG     47 TRP  HN      5.37                
 46 PRO  QD     47 TRP  HN      5.47                
 47 TRP  HN     47 TRP  HD1     3.99                
 47 TRP  HN     47 TRP  HE3     5.28                
 47 TRP  HN     47 TRP  HE1     6.00                
 47 TRP  HN     47 TRP  HZ3     6.00                
 47 TRP  HN     48 CYSS HN      3.50                
 47 TRP  HN     48 CYSS HA      6.00                
 47 TRP  HN     48 CYSS HB2     5.00                
 47 TRP  HN     48 CYSS HB3     5.00                
 47 TRP  HN     48 CYSS QB      4.44                
 47 TRP  HA     47 TRP  HE3     6.00                
 47 TRP  HA     47 TRP  HE1     6.00                
 47 TRP  HA     48 CYSS HN      3.57                
 47 TRP  HA     48 CYSS QB      6.88                
 47 TRP  HE3    48 CYSS HN      6.00                
 47 TRP  HE3    48 CYSS QB      6.88                
 47 TRP  HZ3    48 CYSS QB      6.04                
 48 CYSS HN     48 CYSS HB2     3.30                
 48 CYSS HN     48 CYSS HB3     3.30                
 48 CYSS HN     49 PHE  HN      5.00                
 48 CYSS HN     49 PHE  HA      5.00                
 48 CYSS HN     49 PHE  QB      5.88                
 48 CYSS HN     49 PHE  HD2     6.00                
 48 CYSS HA     49 PHE  HN      2.31                
 48 CYSS HA     49 PHE  HA      6.00                
 48 CYSS HB2    49 PHE  HN      5.00                
 48 CYSS HB3    49 PHE  HN      5.00                
 48 CYSS QB     49 PHE  HN      4.44                
 49 PHE  HN     49 PHE  HA      2.90                
 49 PHE  HN     49 PHE  HB2     3.50                
 49 PHE  HN     49 PHE  HB3     3.50                
 49 PHE  HN     49 PHE  HD1     3.38                
 49 PHE  HN     49 PHE  HD2     4.06                
 49 PHE  HN     50 LYS+ HN      5.00                
 49 PHE  HN     50 LYS+ HA      5.00                
 49 PHE  HA     49 PHE  HB2     3.07                
 49 PHE  HA     49 PHE  HB3     3.07                
 49 PHE  HA     50 LYS+ HN      2.90                
 49 PHE  HA     50 LYS+ QG      6.88                
 49 PHE  QB     50 LYS+ HN      4.49                
 49 PHE  HD1    50 LYS+ HN      5.09                
 49 PHE  HD2    50 LYS+ HN      5.54                
 50 LYS+ HN     50 LYS+ QB      3.50                
 50 LYS+ HN     50 LYS+ QG      5.00                
 50 LYS+ HN     50 LYS+ QD      4.00                
 50 LYS+ HN     50 LYS+ QE      4.60                
 50 LYS+ HN     51 PRO  HD2     5.54                
 50 LYS+ HN     51 PRO  HD3     5.54                
 50 LYS+ HN     51 PRO  QD      5.27                
 50 LYS+ HN    157 CYSS HA      6.00                
 50 LYS+ HN    159 PHE  QB      6.88                
 50 LYS+ HA     50 LYS+ QG      3.71                
 50 LYS+ HA     50 LYS+ HD2     6.00                
 50 LYS+ HA     50 LYS+ HD3     6.00                
 50 LYS+ HA     50 LYS+ QE      6.88                
 50 LYS+ HA     53 GLN  QB      5.88                
 50 LYS+ QB     50 LYS+ QE      5.89                
 50 LYS+ QB     50 LYS+ QE      5.89                
 50 LYS+ QG     53 GLN  QE2     7.75                
 50 LYS+ QG    159 PHE  HN      6.88                
 51 PRO  HA     52 LEU  HN      3.30                
 52 LEU  HN     52 LEU  HA      2.90                
 52 LEU  HN     52 LEU  QB      2.90                
 52 LEU  HN     52 LEU  QQD     4.00                
 52 LEU  HN     53 GLN  HN      3.50                
 52 LEU  HN     53 GLN  QB      6.88                
 52 LEU  HN     53 GLN  QG      5.88                
 52 LEU  HN     54 GLU- HN      5.00                
 52 LEU  HN     55 ALA  HN      6.00                
 52 LEU  HN     55 ALA  QB      7.03                
 52 LEU  HA     55 ALA  QB      7.03                
 52 LEU  QB     53 GLN  HN      5.88                
 52 LEU  QB     54 GLU- HN      5.88                
 52 LEU  QB     55 ALA  HN      6.88                
 52 LEU  QQD    53 GLN  HN      8.13                
 52 LEU  QQD    53 GLN  HE21    8.13                
 52 LEU  QQD    53 GLN  HE22    8.13                
 52 LEU  QQD    54 GLU- HN      6.13                
 52 LEU  QQD    55 ALA  HN      8.13                
 52 LEU  O      55 ALA  N       3.00                
 52 LEU  O      55 ALA  HN      2.00                
 53 GLN  HN     53 GLN  HB2     3.50                
 53 GLN  HN     53 GLN  HB3     3.50                
 53 GLN  HN     53 GLN  HG2     3.50                
 53 GLN  HN     53 GLN  HG3     3.50                
 53 GLN  HN     53 GLN  HE21    6.00                
 53 GLN  HN     53 GLN  HE22    6.00                
 53 GLN  HN     54 GLU- HA      6.00                
 53 GLN  HN     55 ALA  HN      5.00                
 53 GLN  HN     55 ALA  QB      6.88                
 53 GLN  HN    157 CYSS HA      6.00                
 53 GLN  HN    158 THR  HA      6.00                
 53 GLN  HB2    53 GLN  HE21    7.10                
 53 GLN  HB2    53 GLN  HE22    7.10                
 53 GLN  HB2    55 ALA  HN      5.00                
 53 GLN  HB2    58 THR  HN      6.00                
 53 GLN  HB3    53 GLN  HE21    7.10                
 53 GLN  HB3    53 GLN  HE22    7.10                
 53 GLN  HB3    55 ALA  HN      5.00                
 53 GLN  HB3    58 THR  HN      6.00                
 53 GLN  QB     57 CYSS HN      5.88                
 53 GLN  QG     54 GLU- HN      4.88                
 53 GLN  QG     55 ALA  HN      6.88                
 53 GLN  QG     58 THR  HN      6.88                
 53 GLN  QE2    54 GLU- HN      6.87                
 53 GLN  QE2    55 ALA  QB      7.90                
 53 GLN  QE2    56 GLU- HN      6.87                
 53 GLN  O      57 CYSS N       3.00                
 53 GLN  O      57 CYSS HN      2.00                
 54 GLU- HN     54 GLU- HA      2.90                
 54 GLU- HN     54 GLU- HB2     3.50                
 54 GLU- HN     54 GLU- HB3     3.50                
 54 GLU- HN     58 THR  HN      6.00                
 54 GLU- HN    157 CYSS HA      6.00                
 54 GLU- HN    158 THR  HN      6.00                
 54 GLU- HN    158 THR  HA      6.00                
 54 GLU- HN    158 THR  QG2     6.03                
 54 GLU- QB     57 CYSS HN      5.88                
 54 GLU- QB     59 PHE  HN      6.88                
 55 ALA  HN     55 ALA  HA      2.90                
 55 ALA  HN     57 CYSS HN      6.00                
 55 ALA  HN     58 THR  HN      6.00                
 55 ALA  HN     58 THR  HB      6.00                
 55 ALA  HN     58 THR  QG2     7.03                
 55 ALA  HN    158 THR  HA      6.00                
 55 ALA  QB     57 CYSS HN      6.03                
 55 ALA  QB     57 CYSS HA      7.03                
 55 ALA  QB     58 THR  HN      6.99                
 55 ALA  QB     59 PHE  HN      7.03                
 56 GLU- HN     57 CYSS HA      5.00                
 56 GLU- HN     57 CYSS QB      4.56                
 56 GLU- HN     58 THR  HN      5.00                
 57 CYSS HN     57 CYSS HA      2.90                
 57 CYSS HN     57 CYSS HB2     3.50                
 57 CYSS HN     57 CYSS HB3     3.50                
 57 CYSS HN     58 THR  HN      3.38                
 57 CYSS HN     58 THR  HA      5.00                
 57 CYSS HN     58 THR  QG2     6.00                
 57 CYSS HN    153 GLN  QG      6.88                
 57 CYSS HN    158 THR  HA      6.00                
 57 CYSS HA     58 THR  HA      6.00                
 57 CYSS HA     58 THR  QG2     7.03                
 57 CYSS HA     59 PHE  HN      6.00                
 57 CYSS CB    157 CYSS SG      3.10                
 57 CYSS HB2    58 THR  HN      3.49                
 57 CYSS HB3    58 THR  HN      3.49                
 57 CYSS SG    157 CYSS CB      3.10                
 57 CYSS SG    157 CYSS SG      2.10                
 58 THR  HN     58 THR  HB      3.49                
 58 THR  HN     59 PHE  HN      3.64                
 58 THR  HA     59 PHE  HN      3.50                
 58 THR  HB     59 PHE  HN      4.00                
 58 THR  QG2    59 PHE  HN      5.36                
 59 PHE  HN     59 PHE  HA      2.43                
 59 PHE  HN     59 PHE  HB2     3.34                
 59 PHE  HN     59 PHE  HB3     3.34                
 59 PHE  HN     59 PHE  QB      2.98                
102 GLU- HN    103 TYR  HN      3.80                
102 GLU- HN    103 TYR  QD      8.14                
102 GLU- HN    104 VAL  QQG     8.12                
102 GLU- HA    103 TYR  HN      3.30                
102 GLU- HA    104 VAL  HN      5.00                
103 TYR  HN    103 TYR  HB2     3.30                
103 TYR  HN    103 TYR  HB3     3.30                
103 TYR  HN    103 TYR  QB      3.05                
103 TYR  HN    104 VAL  HN      4.63                
103 TYR  HN    104 VAL  HA      5.96                
103 TYR  HN    104 VAL  QQG     6.07                
103 TYR  HN    106 LEU  HN      6.00                
103 TYR  HA    104 VAL  HN      2.47                
103 TYR  HA    106 LEU  HN      4.75                
103 TYR  HA    107 SER  HN      6.00                
103 TYR  QB    106 LEU  HN      5.28                
103 TYR  QD    104 VAL  HN      8.14                
104 VAL  HN    104 VAL  HA      2.90                
104 VAL  HN    104 VAL  HB      3.80                
104 VAL  HN    106 LEU  QB      5.51                
104 VAL  HN    106 LEU  QQD     4.33                
104 VAL  HA    106 LEU  HN      3.30                
104 VAL  HA    107 SER  HN      3.50                
104 VAL  HA    108 ALA  HN      6.00                
104 VAL  HA    110 GLN  HN      6.00                
104 VAL  QQG   106 LEU  HN      6.56                
104 VAL  O     107 SER  N       3.00                
104 VAL  O     107 SER  HN      2.00                
106 LEU  HN    106 LEU  QB      3.68                
106 LEU  HN    106 LEU  QQD     6.92                
106 LEU  HN    107 SER  HN      3.64                
106 LEU  HN    109 ASN  QB      6.88                
106 LEU  HN    110 GLN  HN      6.00                
106 LEU  HN    110 GLN  QB      4.79                
106 LEU  QB    107 SER  HN      4.22                
106 LEU  QB    152 LEU  HA      5.36                
106 LEU  QQD   107 SER  HN      7.60                
106 LEU  QQD   110 GLN  HN      8.13                
106 LEU  QQD   110 GLN  HE21    7.98                
106 LEU  QQD   110 GLN  HE22    7.98                
106 LEU  QQD   110 GLN  QE2     7.63                
107 SER  HN    108 ALA  HA      6.00                
107 SER  HN    110 GLN  HN      6.00                
107 SER  HN    110 GLN  HB2     4.00                
107 SER  HN    110 GLN  HB3     4.00                
107 SER  HN    110 GLN  QB      3.65                
107 SER  HN    110 GLN  HE21    6.03                
107 SER  HN    110 GLN  HE22    6.03                
107 SER  HN    111 CYSS HN      6.00                
107 SER  HA    107 SER  HB2     3.04                
107 SER  HA    107 SER  HB3     3.04                
107 SER  HA    110 GLN  HN      5.00                
107 SER  O     110 GLN  N       3.00                
107 SER  O     110 GLN  HN      2.00                
108 ALA  HA    110 GLN  HN      5.00                
108 ALA  HA    111 CYSS HN      5.00                
108 ALA  HA    112 ALA  HN      6.00                
108 ALA  QB    152 LEU  HA      7.03                
109 ASN  HN    110 GLN  HN      5.00                
109 ASN  HN    112 ALA  HN      6.00                
109 ASN  HA    111 CYSS HN      5.00                
109 ASN  HD21  113 VAL  QG1    10.15                
109 ASN  HD21  113 VAL  QG2    10.15                
109 ASN  HD22  113 VAL  QG1    10.15                
109 ASN  HD22  113 VAL  QG2    10.15                
109 ASN  QD2   110 GLN  QB      7.74                
109 ASN  QD2   111 CYSS HN      6.87                
109 ASN  QD2   112 ALA  QB      4.10                
109 ASN  QD2   113 VAL  QQG     8.55                
109 ASN  O     112 ALA  N       3.00                
109 ASN  O     112 ALA  HN      2.00                
110 GLN  HN    110 GLN  HB2     3.30                
110 GLN  HN    110 GLN  HB3     3.30                
110 GLN  HN    110 GLN  QB      2.98                
110 GLN  HN    110 GLN  QG      5.09                
110 GLN  HN    111 CYSS HN      2.96                
110 GLN  HN    111 CYSS HA      6.00                
110 GLN  HN    111 CYSS QB      5.88                
110 GLN  HN    112 ALA  HN      3.87                
110 GLN  HN    112 ALA  QB      6.03                
110 GLN  HN    152 LEU  HN      6.00                
110 GLN  HN    152 LEU  QB      4.03                
110 GLN  HN    152 LEU  QQD     8.13                
110 GLN  HA    110 GLN  HE21    6.00                
110 GLN  HA    110 GLN  HE22    6.00                
110 GLN  HA    112 ALA  HN      4.00                
110 GLN  HB2   110 GLN  HE21    5.00                
110 GLN  HB2   110 GLN  HE22    5.00                
110 GLN  HB2   111 CYSS HN      4.00                
110 GLN  HB2   112 ALA  HN      5.00                
110 GLN  HB2   152 LEU  HN      6.00                
110 GLN  HB3   110 GLN  HE21    5.00                
110 GLN  HB3   110 GLN  HE22    5.00                
110 GLN  HB3   111 CYSS HN      4.00                
110 GLN  HB3   112 ALA  HN      5.00                
110 GLN  HB3   152 LEU  HN      6.00                
110 GLN  QB    110 GLN  QE2     3.76                
110 GLN  QB    113 VAL  HN      6.88                
110 GLN  QB    152 LEU  HN      5.45                
110 GLN  QG    112 ALA  HN      6.00                
110 GLN  HE21  113 VAL  QG1    10.15                
110 GLN  HE21  113 VAL  QG2    10.15                
110 GLN  HE21  150 LYS+ QG      7.03                
110 GLN  HE21  152 LEU  HN      6.00                
110 GLN  HE21  152 LEU  QB      5.85                
110 GLN  HE21  153 GLN  HN      6.00                
110 GLN  HE22  113 VAL  QG1    10.15                
110 GLN  HE22  113 VAL  QG2    10.15                
110 GLN  HE22  150 LYS+ QG      7.03                
110 GLN  HE22  152 LEU  HN      6.00                
110 GLN  HE22  152 LEU  QB      5.85                
110 GLN  HE22  153 GLN  HN      6.00                
110 GLN  QE2   113 VAL  HN      6.87                
110 GLN  QE2   113 VAL  QQG     8.55                
110 GLN  QE2   150 LYS+ QG      6.90                
110 GLN  QE2   152 LEU  QB      5.47                
110 GLN  O     113 VAL  N       3.00                
110 GLN  O     113 VAL  HN      2.00                
111 CYSS HN    111 CYSS HB2     3.30                
111 CYSS HN    111 CYSS HB3     3.30                
111 CYSS HN    111 CYSS QB      2.98                
111 CYSS HN    112 ALA  HN      2.90                
111 CYSS HN    112 ALA  QB      5.03                
111 CYSS HN    113 VAL  QQG     7.59                
111 CYSS HN    152 LEU  HN      6.00                
111 CYSS HN    152 LEU  HA      5.00                
111 CYSS HN    152 LEU  QB      5.88                
111 CYSS HN    152 LEU  QQD     8.06                
111 CYSS HA    112 ALA  HN      3.15                
111 CYSS HA    112 ALA  HA      6.00                
111 CYSS HA    113 VAL  HN      4.00                
111 CYSS HA    113 VAL  QQG     6.80                
111 CYSS HA    137 CYSS QB      6.88                
111 CYSS HA    152 LEU  HN      4.00                
111 CYSS HA    152 LEU  HA      6.00                
111 CYSS HA    152 LEU  QQD     8.13                
111 CYSS HA    153 GLN  QG      6.88                
111 CYSS CB    137 CYSS SG      3.10                
111 CYSS HB2   112 ALA  HN      5.00                
111 CYSS HB2   113 VAL  HN      6.00                
111 CYSS HB3   112 ALA  HN      5.00                
111 CYSS HB3   113 VAL  HN      6.00                
111 CYSS QB    112 ALA  HN      4.35                
111 CYSS QB    112 ALA  HA      5.88                
111 CYSS QB    113 VAL  HN      5.45                
111 CYSS QB    137 CYSS HN      6.80                
111 CYSS QB    138 PHE  HN      6.88                
111 CYSS QB    152 LEU  HN      6.88                
111 CYSS SG    137 CYSS CB      3.10                
111 CYSS SG    137 CYSS SG      2.10                
112 ALA  HN    112 ALA  HA      2.90                
112 ALA  HN    112 ALA  QB      3.34                
112 ALA  HN    113 VAL  HN      3.50                
112 ALA  HN    113 VAL  QG1     7.03                
112 ALA  HN    113 VAL  QG2     7.03                
112 ALA  HN    113 VAL  QQG     5.91                
112 ALA  HN    152 LEU  HN      6.00                
112 ALA  HN    152 LEU  QB      5.96                
112 ALA  HA    113 VAL  HN      3.30                
112 ALA  HA    141 ARG+ QD      5.88                
112 ALA  HA    152 LEU  QQD     8.13                
112 ALA  QB    113 VAL  HN      4.44                
113 VAL  HN    113 VAL  HA      2.85                
113 VAL  HN    113 VAL  HB      3.30                
113 VAL  HN    113 VAL  QG1     4.52                
113 VAL  HN    113 VAL  QG2     4.52                
113 VAL  HN    113 VAL  QQG     3.85                
113 VAL  HN    114 PRO  HD2     5.43                
113 VAL  HN    114 PRO  HD3     5.43                
113 VAL  HN    114 PRO  QD      5.01                
113 VAL  HN    118 ARG+ HG2     5.35                
113 VAL  HN    118 ARG+ HG3     5.35                
113 VAL  HN    118 ARG+ QG      5.10                
113 VAL  HN    118 ARG+ QD      6.80                
113 VAL  HN    118 ARG+ HE      4.00                
113 VAL  HN    149 PHE  HD2     6.00                
113 VAL  HN    151 PRO  HA      6.00                
113 VAL  HA    115 ALA  HN      4.00                
113 VAL  HA    116 LYS+ HN      6.00                
113 VAL  HA    118 ARG+ HE      6.00                
113 VAL  HB    115 ALA  HA      6.00                
113 VAL  HB    118 ARG+ HE      3.64                
113 VAL  QG1   116 LYS+ HN      6.19                
113 VAL  QG1   116 LYS+ HA      7.03                
113 VAL  QG1   117 ASP- HN      5.03                
113 VAL  QG2   116 LYS+ HN      6.19                
113 VAL  QG2   116 LYS+ HA      7.03                
113 VAL  QG2   117 ASP- HN      5.03                
113 VAL  QQG   115 ALA  HN      7.59                
113 VAL  QQG   115 ALA  HA      8.59                
113 VAL  QQG   116 LYS+ HN      4.75                
113 VAL  QQG   116 LYS+ HA      6.36                
113 VAL  QQG   116 LYS+ QD      8.47                
113 VAL  QQG   117 ASP- HA      8.59                
113 VAL  QQG   118 ARG+ HN      6.16                
113 VAL  QQG   118 ARG+ HE      8.06                
114 PRO  QD    117 ASP- HN      6.88                
115 ALA  HN    115 ALA  HA      2.90                
115 ALA  HN    116 LYS+ HN      3.80                
115 ALA  HN    117 ASP- HN      6.00                
115 ALA  HN    117 ASP- QB      6.88                
115 ALA  HN    118 ARG+ HN      6.00                
115 ALA  HN    118 ARG+ QG      6.88                
115 ALA  HN    118 ARG+ HD2     6.00                
115 ALA  HN    118 ARG+ HD3     6.00                
115 ALA  HN    118 ARG+ QD      5.45                
115 ALA  HN    118 ARG+ HE      6.00                
115 ALA  HA    116 LYS+ QD      6.88                
115 ALA  HA    117 ASP- QB      5.88                
115 ALA  HA    118 ARG+ HN      5.00                
115 ALA  HA    142 ILE  QG1     5.93                
115 ALA  HA    142 ILE  QD1     6.31                
115 ALA  HA    145 VAL  QG1     6.61                
115 ALA  HA    145 VAL  QG2     6.61                
115 ALA  HA    145 VAL  QQG     5.23                
115 ALA  QB    116 LYS+ HA      5.81                
115 ALA  QB    118 ARG+ HE      6.03                
115 ALA  QB    142 ILE  QD1     7.30                
115 ALA  QB    145 VAL  HN      7.03                
115 ALA  QB    145 VAL  QG1     7.94                
115 ALA  QB    145 VAL  QG2     7.94                
115 ALA  QB    145 VAL  QQG     7.47                
116 LYS+ HN    116 LYS+ HA      2.77                
116 LYS+ HN    116 LYS+ QG      3.72                
116 LYS+ HN    117 ASP- HN      2.81                
116 LYS+ HN    117 ASP- HB2     3.68                
116 LYS+ HN    117 ASP- HB3     3.68                
116 LYS+ HN    117 ASP- QB      3.48                
116 LYS+ HN    118 ARG+ HN      4.06                
116 LYS+ HN    118 ARG+ QG      5.88                
116 LYS+ HN    118 ARG+ QD      5.88                
116 LYS+ HN    142 ILE  QD1     7.03                
116 LYS+ HN    145 VAL  QQG     7.59                
116 LYS+ HN    146 PRO  QD      5.88                
116 LYS+ HA    116 LYS+ HD2     6.00                
116 LYS+ HA    116 LYS+ HD3     6.00                
116 LYS+ HA    116 LYS+ QD      5.69                
116 LYS+ HA    116 LYS+ HE2     6.00                
116 LYS+ HA    116 LYS+ HE3     6.00                
116 LYS+ HA    117 ASP- HN      3.11                
116 LYS+ HA    117 ASP- HA      6.00                
116 LYS+ HA    118 ARG+ HN      5.00                
116 LYS+ HA    145 VAL  QQG     8.17                
116 LYS+ HB2   116 LYS+ HE2     6.00                
116 LYS+ HB2   116 LYS+ HE3     6.00                
116 LYS+ HB3   116 LYS+ HE2     6.00                
116 LYS+ HB3   116 LYS+ HE3     6.00                
116 LYS+ QB    116 LYS+ QE      5.56                
116 LYS+ QB    117 ASP- HN      4.88                
116 LYS+ QB    145 VAL  HA      6.88                
116 LYS+ QG    117 ASP- HN      4.67                
116 LYS+ QG    118 ARG+ HN      6.03                
116 LYS+ QG    142 ILE  QD1     5.86                
117 ASP- HN    117 ASP- HA      2.81                
117 ASP- HN    117 ASP- HB2     3.30                
117 ASP- HN    117 ASP- HB3     3.30                
117 ASP- HN    117 ASP- QB      2.98                
117 ASP- HN    118 ARG+ HN      2.47                
117 ASP- HN    118 ARG+ HA      5.00                
117 ASP- HN    118 ARG+ HB2     6.00                
117 ASP- HN    118 ARG+ HB3     6.00                
117 ASP- HN    118 ARG+ QB      5.45                
117 ASP- HN    118 ARG+ HG2     5.16                
117 ASP- HN    118 ARG+ HG3     5.16                
117 ASP- HN    118 ARG+ QG      4.53                
117 ASP- HN    118 ARG+ QD      5.88                
117 ASP- HN    118 ARG+ HE      6.00                
117 ASP- HN    145 VAL  QG1     7.03                
117 ASP- HN    145 VAL  QG2     7.03                
117 ASP- HN    146 PRO  HD2     6.00                
117 ASP- HN    146 PRO  HD3     6.00                
117 ASP- HA    117 ASP- HB2     3.04                
117 ASP- HA    117 ASP- HB3     3.04                
117 ASP- HA    118 ARG+ HN      3.30                
118 ARG+ HN    118 ARG+ HB2     3.50                
118 ARG+ HN    118 ARG+ HB3     3.50                
118 ARG+ HN    118 ARG+ QB      2.96                
118 ARG+ HN    118 ARG+ HG2     3.53                
118 ARG+ HN    118 ARG+ HG3     3.53                
118 ARG+ HN    118 ARG+ QG      3.07                
118 ARG+ HN    118 ARG+ HD2     4.00                
118 ARG+ HN    118 ARG+ HD3     4.00                
118 ARG+ HN    118 ARG+ QD      3.69                
118 ARG+ HN    118 ARG+ HE      5.62                
118 ARG+ HN    119 VAL  HN      5.00                
118 ARG+ HN    146 PRO  QG      6.88                
118 ARG+ HN    146 PRO  HD2     6.00                
118 ARG+ HN    146 PRO  HD3     6.00                
118 ARG+ HN    146 PRO  QD      5.45                
118 ARG+ HN    149 PHE  HB2     6.00                
118 ARG+ HN    149 PHE  HB3     6.00                
118 ARG+ HA    119 VAL  HN      2.90                
118 ARG+ HA    150 LYS+ HN      5.00                
118 ARG+ HB2   119 VAL  HN      3.76                
118 ARG+ HB3   119 VAL  HN      3.76                
118 ARG+ QB    118 ARG+ HE      6.88                
118 ARG+ QB    119 VAL  HN      3.12                
118 ARG+ QB    120 ASP- HN      6.88                
118 ARG+ QB    149 PHE  HN      6.88                
118 ARG+ QB    150 LYS+ HN      5.88                
118 ARG+ HG2   119 VAL  HN      4.86                
118 ARG+ HG3   119 VAL  HN      4.86                
118 ARG+ QG    118 ARG+ HE      3.90                
118 ARG+ QG    120 ASP- HN      6.31                
118 ARG+ QG    121 CYSS HN      6.88                
118 ARG+ QG    149 PHE  HN      6.88                
118 ARG+ QG    150 LYS+ HN      6.88                
118 ARG+ HD2   119 VAL  HN      5.77                
118 ARG+ HD2   120 ASP- HN      5.00                
118 ARG+ HD3   119 VAL  HN      5.77                
118 ARG+ HD3   120 ASP- HN      5.00                
118 ARG+ QD    119 VAL  HN      5.35                
118 ARG+ QD    120 ASP- HN      4.83                
118 ARG+ QD    121 CYSS HN      6.88                
118 ARG+ QD    139 ASP- HN      6.88                
118 ARG+ QD    145 VAL  HN      6.88                
118 ARG+ QD    149 PHE  HN      6.88                
118 ARG+ QD    150 LYS+ HN      6.88                
118 ARG+ HE    142 ILE  QD1     7.03                
118 ARG+ HE    146 PRO  QD      5.82                
118 ARG+ HE    149 PHE  HD1     6.00                
119 VAL  HN    119 VAL  HA      2.90                
119 VAL  HN    119 VAL  HB      2.69                
119 VAL  HN    120 ASP- HN      3.95                
119 VAL  HN    120 ASP- HA      6.00                
119 VAL  HN    149 PHE  HN      6.00                
119 VAL  HN    149 PHE  HA      6.00                
119 VAL  HN    149 PHE  HB2     4.78                
119 VAL  HN    149 PHE  HB3     4.78                
119 VAL  HN    149 PHE  QB      4.38                
119 VAL  HN    149 PHE  HD1     6.00                
119 VAL  HN    150 LYS+ HN      3.49                
119 VAL  HA    120 ASP- HN      3.30                
119 VAL  HB    120 ASP- HN      4.00                
119 VAL  HB    121 CYSS HN      6.00                
119 VAL  QQG   120 ASP- HN      5.61                
119 VAL  QQG   121 CYSS HN      7.93                
119 VAL  QQG   150 LYS+ HN      5.03                
120 ASP- HN    120 ASP- HB2     2.90                
120 ASP- HN    120 ASP- HB3     2.90                
120 ASP- HN    121 CYSS HN      3.91                
120 ASP- HN    122 GLY  HN      6.00                
120 ASP- HN    146 PRO  QG      6.88                
120 ASP- HN    146 PRO  HD2     6.00                
120 ASP- HN    146 PRO  HD3     6.00                
120 ASP- HN    148 CYSS HN      6.00                
120 ASP- HN    149 PHE  HA      5.00                
120 ASP- HN    150 LYS+ HN      5.00                
120 ASP- HA    121 CYSS HN      2.39                
120 ASP- HA    122 GLY  HN      3.30                
120 ASP- HA    147 TRP  HN      6.00                
120 ASP- HA    148 CYSS HN      5.00                
120 ASP- HA    149 PHE  HA      4.00                
120 ASP- QB    122 GLY  HN      4.88                
120 ASP- QB    147 TRP  HN      6.88                
121 CYSS N     148 CYSS O       3.00                
121 CYSS HN    121 CYSS HA      2.90                
121 CYSS HN    121 CYSS HB2     2.85                
121 CYSS HN    121 CYSS HB3     2.85                
121 CYSS HN    122 GLY  HN      4.90                
121 CYSS HN    122 GLY  QA      5.88                
121 CYSS HN    123 TYR  HN      6.00                
121 CYSS HN    123 TYR  QD      8.00                
121 CYSS HN    136 CYSS HA      6.00                
121 CYSS HN    146 PRO  HA      6.00                
121 CYSS HN    146 PRO  HB2     4.86                
121 CYSS HN    146 PRO  HB3     4.86                
121 CYSS HN    146 PRO  QB      4.50                
121 CYSS HN    148 CYSS HN      5.00                
121 CYSS HN    148 CYSS HA      6.00                
121 CYSS HN    148 CYSS QB      6.88                
121 CYSS HN    148 CYSS O       2.00                
121 CYSS HN    149 PHE  HN      4.00                
121 CYSS HN    149 PHE  HA      2.81                
121 CYSS HN    149 PHE  HB2     5.00                
121 CYSS HN    149 PHE  HB3     5.00                
121 CYSS HN    150 LYS+ HN      5.00                
121 CYSS HA    123 TYR  QD      8.14                
121 CYSS HA    123 TYR  QE      8.13                
121 CYSS HA    149 PHE  HA      6.00                
121 CYSS HA    150 LYS+ HN      6.00                
121 CYSS HA    150 LYS+ HG2     6.00                
121 CYSS HA    150 LYS+ HG3     6.00                
121 CYSS HA    150 LYS+ QE      6.27                
121 CYSS CB    136 CYSS SG      3.10                
121 CYSS HB2   122 GLY  HN      3.80                
121 CYSS HB2   123 TYR  HN      5.00                
121 CYSS HB2   123 TYR  QD      7.61                
121 CYSS HB2   123 TYR  QE      7.64                
121 CYSS HB2   149 PHE  HN      5.00                
121 CYSS HB2   149 PHE  HA      6.00                
121 CYSS HB2   150 LYS+ HN      6.00                
121 CYSS HB3   122 GLY  HN      3.80                
121 CYSS HB3   123 TYR  HN      5.00                
121 CYSS HB3   123 TYR  QD      7.61                
121 CYSS HB3   123 TYR  QE      7.64                
121 CYSS HB3   149 PHE  HN      5.00                
121 CYSS HB3   149 PHE  HA      6.00                
121 CYSS HB3   150 LYS+ HN      6.00                
121 CYSS QB    122 GLY  HN      3.52                
121 CYSS QB    123 TYR  HN      4.44                
121 CYSS QB    123 TYR  QD      7.31                
121 CYSS QB    134 ARG+ QD      7.75                
121 CYSS QB    136 CYSS HN      6.88                
121 CYSS QB    137 CYSS HN      5.88                
121 CYSS QB    148 CYSS HN      6.88                
121 CYSS QB    149 PHE  HN      4.44                
121 CYSS QB    150 LYS+ HN      5.46                
121 CYSS SG    136 CYSS CB      3.10                
121 CYSS SG    136 CYSS SG      2.10                
122 GLY  HN    123 TYR  HN      3.23                
122 GLY  HN    123 TYR  HA      6.00                
122 GLY  HN    123 TYR  QD      8.14                
122 GLY  HN    126 VAL  QQG     8.15                
122 GLY  HN    146 PRO  QG      6.88                
122 GLY  HN    148 CYSS HN      6.00                
122 GLY  HN    148 CYSS HB2     5.00                
122 GLY  HN    148 CYSS HB3     5.00                
122 GLY  HN    149 PHE  HA      5.00                
122 GLY  HN    149 PHE  QB      6.88                
122 GLY  QA    148 CYSS HN      6.88                
123 TYR  HN    126 VAL  HN      5.00                
123 TYR  HN    126 VAL  HA      6.00                
123 TYR  HN    126 VAL  HB      4.00                
123 TYR  HN    126 VAL  QQG     6.26                
123 TYR  HN    131 CYSS QB      6.88                
123 TYR  HN    147 TRP  HE3     6.00                
123 TYR  HN    148 CYSS HB2     5.00                
123 TYR  HN    148 CYSS HB3     5.00                
123 TYR  HN    148 CYSS QB      4.22                
123 TYR  HA    123 TYR  QB      2.59                
123 TYR  HA    123 TYR  QE      5.81                
123 TYR  HA    126 VAL  HB      6.00                
123 TYR  HA    126 VAL  QQG     8.59                
123 TYR  QD    126 VAL  HN      7.99                
123 TYR  QD    126 VAL  HA      7.99                
123 TYR  QD    126 VAL  HB      7.68                
123 TYR  QD    126 VAL  QG1     9.17                
123 TYR  QD    126 VAL  QG2     9.17                
123 TYR  QD    131 CYSS HA      8.14                
123 TYR  QD    134 ARG+ HB2     8.14                
123 TYR  QD    134 ARG+ HB3     8.14                
123 TYR  QD    134 ARG+ QG      9.02                
123 TYR  QD    134 ARG+ QD      7.20                
123 TYR  QD    135 GLY  QA      9.02                
123 TYR  QD    149 PHE  HN      8.14                
123 TYR  QE    126 VAL  HA      7.75                
123 TYR  QE    126 VAL  HB      7.75                
123 TYR  QE    126 VAL  QG1     9.16                
123 TYR  QE    126 VAL  QG2     9.16                
123 TYR  QE    131 CYSS HA      8.13                
123 TYR  QE    134 ARG+ HB2     7.37                
123 TYR  QE    134 ARG+ HB3     7.37                
123 TYR  QE    134 ARG+ HG2     8.13                
123 TYR  QE    134 ARG+ HG3     8.13                
123 TYR  QE    134 ARG+ HD2     7.98                
123 TYR  QE    134 ARG+ HD3     7.98                
123 TYR  QE    134 ARG+ QD      7.60                
123 TYR  QE    135 GLY  QA      9.01                
124 PRO  QD    126 VAL  HN      5.88                
125 HIS+ HN    126 VAL  HN      4.02                
125 HIS+ HN    126 VAL  HA      4.00                
125 HIS+ HN    134 ARG+ QB      6.88                
125 HIS+ HN    134 ARG+ QG      6.88                
125 HIS+ HA    126 VAL  HN      3.19                
125 HIS+ HA    127 THR  HN      6.00                
125 HIS+ QB    126 VAL  HN      5.00                
126 VAL  HN    126 VAL  HA      2.88                
126 VAL  HN    126 VAL  HB      3.30                
126 VAL  HN    127 THR  HN      5.00                
126 VAL  HN    127 THR  HA      6.00                
126 VAL  HN    130 GLU- QB      6.88                
126 VAL  HN    131 CYSS QB      6.88                
126 VAL  HN    147 TRP  HZ3     6.00                
126 VAL  HN    148 CYSS QB      6.88                
126 VAL  HB    127 THR  HN      4.00                
126 VAL  QG1   138 PHE  QD      9.15                
126 VAL  QG2   138 PHE  QD      9.15                
126 VAL  QQG   138 PHE  QD      8.55                
126 VAL  QQG   139 ASP- HN      8.05                
126 VAL  QQG   147 TRP  HN      8.12                
126 VAL  QQG   147 TRP  HE3     8.59                
126 VAL  QQG   147 TRP  HZ2     8.59                
126 VAL  QQG   148 CYSS HN      7.17                
126 VAL  QQG   148 CYSS HA      8.59                
127 THR  HN    127 THR  HA      2.90                
127 THR  HN    127 THR  HB      2.90                
127 THR  HN    127 THR  QG2     4.00                
127 THR  HN    128 PRO  HA      5.00                
127 THR  HN    128 PRO  QD      6.27                
127 THR  HN    129 LYS+ QB      6.88                
127 THR  HN    130 GLU- HN      5.00                
127 THR  HN    130 GLU- HA      6.00                
127 THR  HN    130 GLU- HB2     5.00                
127 THR  HN    130 GLU- HB3     5.00                
127 THR  HN    130 GLU- QB      4.23                
127 THR  HN    130 GLU- QG      6.19                
127 THR  HN    131 CYSS HN      4.00                
127 THR  HN    131 CYSS HA      6.00                
127 THR  HN    131 CYSS HB2     6.00                
127 THR  HN    131 CYSS HB3     6.00                
127 THR  HN    148 CYSS QB      6.88                
127 THR  HA    129 LYS+ HN      4.00                
127 THR  HA    130 GLU- HN      6.00                
127 THR  HB    130 GLU- HN      6.00                
127 THR  HB    131 CYSS HN      6.00                
127 THR  QG2   129 LYS+ HN      7.03                
127 THR  QG2   130 GLU- HN      5.47                
127 THR  QG2   131 CYSS HN      4.25                
127 THR  QG2   132 ASN  HN      6.31                
127 THR  QG2   133 ASN  HN      7.03                
127 THR  O     130 GLU- N       3.00                
127 THR  O     130 GLU- HN      2.00                
127 THR  O     131 CYSS N       3.00                
127 THR  O     131 CYSS HN      2.00                
128 PRO  HA    130 GLU- HN      6.00                
128 PRO  HA    131 CYSS HN      5.00                
128 PRO  HA    132 ASN  HN      5.00                
128 PRO  HA    138 PHE  HN      5.00                
128 PRO  QD    129 LYS+ HN      5.02                
128 PRO  QD    130 GLU- HN      6.88                
128 PRO  QD    131 CYSS HN      6.88                
129 LYS+ HN    129 LYS+ HB2     3.50                
129 LYS+ HN    129 LYS+ HB3     3.50                
129 LYS+ HN    129 LYS+ QB      3.05                
129 LYS+ HN    129 LYS+ QG      5.39                
129 LYS+ HN    130 GLU- HN      4.00                
129 LYS+ HN    130 GLU- HB2     6.00                
129 LYS+ HN    130 GLU- HB3     6.00                
129 LYS+ HN    130 GLU- QG      6.00                
129 LYS+ HN    131 CYSS HN      6.00                
129 LYS+ HN    131 CYSS QB      6.88                
129 LYS+ HN    132 ASN  HN      6.00                
129 LYS+ HN    132 ASN  QB      6.88                
129 LYS+ HN    133 ASN  QB      6.88                
129 LYS+ HA    129 LYS+ QD      4.37                
129 LYS+ HA    129 LYS+ QE      6.88                
129 LYS+ HA    131 CYSS QB      6.88                
129 LYS+ HA    132 ASN  HA      6.00                
129 LYS+ HA    133 ASN  HN      5.00                
129 LYS+ HB2   129 LYS+ QE      6.88                
129 LYS+ HB2   130 GLU- HN      4.00                
129 LYS+ HB3   129 LYS+ QE      6.88                
129 LYS+ HB3   130 GLU- HN      4.00                
129 LYS+ QB    129 LYS+ QE      6.60                
129 LYS+ QB    130 GLU- HN      3.65                
129 LYS+ QB    131 CYSS HN      6.88                
129 LYS+ QB    132 ASN  HN      6.88                
129 LYS+ QG    130 GLU- HN      5.43                
129 LYS+ QG    131 CYSS HN      6.88                
129 LYS+ QG    132 ASN  HN      6.88                
129 LYS+ QG    133 ASN  HN      6.88                
129 LYS+ QG    133 ASN  HD21    6.61                
129 LYS+ QG    133 ASN  HD22    6.61                
129 LYS+ QG    133 ASN  QD2     6.46                
130 GLU- HN    130 GLU- HA      2.77                
130 GLU- HN    130 GLU- HB2     3.30                
130 GLU- HN    130 GLU- HB3     3.30                
130 GLU- HN    130 GLU- QB      2.92                
130 GLU- HN    130 GLU- QG      4.71                
130 GLU- HN    131 CYSS HN      2.77                
130 GLU- HN    131 CYSS HA      5.00                
130 GLU- HN    131 CYSS HB2     6.00                
130 GLU- HN    131 CYSS HB3     6.00                
130 GLU- HN    131 CYSS QB      5.45                
130 GLU- HN    132 ASN  HN      5.00                
130 GLU- HN    132 ASN  QB      6.88                
130 GLU- HN    133 ASN  HN      5.00                
130 GLU- HN    133 ASN  QB      5.88                
130 GLU- HA    131 CYSS HN      3.50                
130 GLU- HA    133 ASN  HN      3.50                
130 GLU- HA    133 ASN  HB2     5.00                
130 GLU- HA    133 ASN  HB3     5.00                
130 GLU- HA    133 ASN  QB      4.44                
130 GLU- HA    133 ASN  HD21    5.09                
130 GLU- HA    133 ASN  HD22    5.09                
130 GLU- HA    133 ASN  QD2     4.81                
130 GLU- HA    134 ARG+ HN      4.00                
130 GLU- HB2   131 CYSS HN      3.11                
130 GLU- HB2   132 ASN  HN      6.00                
130 GLU- HB3   131 CYSS HN      3.11                
130 GLU- HB3   132 ASN  HN      6.00                
130 GLU- QB    131 CYSS HN      2.91                
130 GLU- QB    132 ASN  HN      5.45                
130 GLU- QB    133 ASN  HN      6.88                
130 GLU- QB    133 ASN  QD2     6.30                
130 GLU- QG    131 CYSS HN      5.00                
130 GLU- QG    133 ASN  HN      6.00                
130 GLU- QG    133 ASN  HD21    6.76                
130 GLU- QG    133 ASN  HD22    6.76                
130 GLU- QG    134 ARG+ HN      6.88                
130 GLU- O     133 ASN  N       3.00                
130 GLU- O     133 ASN  HN      2.00                
130 GLU- O     134 ARG+ N       3.00                
130 GLU- O     134 ARG+ HN      2.00                
131 CYSS HN    131 CYSS HA      2.73                
131 CYSS HN    131 CYSS HB2     3.50                
131 CYSS HN    131 CYSS HB3     3.50                
131 CYSS HN    132 ASN  HN      5.00                
131 CYSS HN    132 ASN  HA      6.00                
131 CYSS HN    132 ASN  HB2     6.00                
131 CYSS HN    132 ASN  HB3     6.00                
131 CYSS HN    132 ASN  QB      5.45                
131 CYSS HN    133 ASN  HN      6.00                
131 CYSS HN    133 ASN  QB      5.88                
131 CYSS HN    134 ARG+ HN      5.00                
131 CYSS HN    134 ARG+ QG      6.88                
131 CYSS HN    138 PHE  HN      6.00                
131 CYSS HN    138 PHE  QB      6.88                
131 CYSS HN    138 PHE  QD      8.12                
131 CYSS HA    133 ASN  HN      6.00                
131 CYSS HA    134 ARG+ HN      3.64                
131 CYSS HA    135 GLY  HN      4.48                
131 CYSS HA    136 CYSS HN      5.00                
131 CYSS HA    137 CYSS HN      6.00                
131 CYSS HA    138 PHE  QD      8.12                
131 CYSS CB    148 CYSS SG      3.10                
131 CYSS HB2   132 ASN  HN      3.61                
131 CYSS HB2   132 ASN  HD21    6.00                
131 CYSS HB2   132 ASN  HD22    6.00                
131 CYSS HB2   133 ASN  HN      4.82                
131 CYSS HB2   134 ARG+ HN      6.00                
131 CYSS HB2   135 GLY  HN      6.00                
131 CYSS HB2   137 CYSS HN      5.00                
131 CYSS HB3   132 ASN  HN      3.61                
131 CYSS HB3   132 ASN  HD21    6.00                
131 CYSS HB3   132 ASN  HD22    6.00                
131 CYSS HB3   133 ASN  HN      4.82                
131 CYSS HB3   134 ARG+ HN      6.00                
131 CYSS HB3   135 GLY  HN      6.00                
131 CYSS HB3   137 CYSS HN      5.00                
131 CYSS QB    132 ASN  HN      3.06                
131 CYSS QB    132 ASN  QD2     5.35                
131 CYSS QB    133 ASN  HN      4.48                
131 CYSS QB    134 ARG+ HN      5.45                
131 CYSS QB    135 GLY  HN      5.45                
131 CYSS QB    136 CYSS HN      5.88                
131 CYSS QB    137 CYSS HN      4.44                
131 CYSS QB    138 PHE  HN      6.42                
131 CYSS QB    138 PHE  QD      8.01                
131 CYSS QB    148 CYSS HN      6.88                
131 CYSS SG    148 CYSS CB      3.10                
131 CYSS SG    148 CYSS SG      2.10                
131 CYSS O     135 GLY  N       3.00                
131 CYSS O     135 GLY  HN      2.00                
131 CYSS O     136 CYSS N       3.00                
131 CYSS O     136 CYSS HN      2.00                
132 ASN  HN    132 ASN  HA      2.90                
132 ASN  HN    132 ASN  HB2     3.50                
132 ASN  HN    132 ASN  HB3     3.50                
132 ASN  HN    132 ASN  QB      2.88                
132 ASN  HN    133 ASN  HN      2.92                
132 ASN  HN    133 ASN  HA      6.00                
132 ASN  HN    133 ASN  QB      4.88                
132 ASN  HN    134 ARG+ HN      5.00                
132 ASN  HN    134 ARG+ HG2     6.00                
132 ASN  HN    134 ARG+ HG3     6.00                
132 ASN  HN    135 GLY  HN      5.00                
132 ASN  HN    136 CYSS HN      5.00                
132 ASN  HN    137 CYSS HA      6.00                
132 ASN  HN    138 PHE  HN      5.24                
132 ASN  HN    138 PHE  QB      6.65                
132 ASN  HN    138 PHE  QD      7.97                
132 ASN  HA    132 ASN  HD21    3.50                
132 ASN  HA    132 ASN  HD22    3.50                
132 ASN  HA    132 ASN  QD2     3.14                
132 ASN  HA    133 ASN  HN      3.50                
132 ASN  HA    133 ASN  HA      6.00                
132 ASN  HA    134 ARG+ HN      5.00                
132 ASN  HA    135 GLY  HN      3.64                
132 ASN  HA    136 CYSS HN      3.50                
132 ASN  HA    137 CYSS HN      6.00                
132 ASN  HA    137 CYSS HA      6.00                
132 ASN  HB2   136 CYSS HN      6.00                
132 ASN  HB3   136 CYSS HN      6.00                
132 ASN  QB    136 CYSS HN      5.45                
132 ASN  QB    138 PHE  HN      6.88                
132 ASN  HD21  133 ASN  HN      6.00                
132 ASN  HD21  137 CYSS HA      4.67                
132 ASN  HD21  137 CYSS HB2     7.75                
132 ASN  HD21  137 CYSS HB3     7.75                
132 ASN  HD21  138 PHE  HB2     5.39                
132 ASN  HD21  138 PHE  HB3     5.39                
132 ASN  HD22  133 ASN  HN      6.00                
132 ASN  HD22  137 CYSS HA      4.67                
132 ASN  HD22  137 CYSS HB2     7.75                
132 ASN  HD22  137 CYSS HB3     7.75                
132 ASN  HD22  138 PHE  HB2     5.39                
132 ASN  HD22  138 PHE  HB3     5.39                
132 ASN  QD2   133 ASN  HN      5.45                
132 ASN  QD2   136 CYSS HN      6.87                
132 ASN  QD2   137 CYSS HN      5.87                
132 ASN  QD2   137 CYSS HA      4.42                
132 ASN  QD2   137 CYSS QB      6.82                
132 ASN  QD2   138 PHE  QB      4.28                
133 ASN  HN    133 ASN  HA      2.90                
133 ASN  HN    133 ASN  HB2     2.90                
133 ASN  HN    133 ASN  HB3     2.90                
133 ASN  HN    133 ASN  QB      2.56                
133 ASN  HN    133 ASN  HD21    6.00                
133 ASN  HN    133 ASN  HD22    6.00                
133 ASN  HN    134 ARG+ HN      2.90                
133 ASN  HN    134 ARG+ HA      6.00                
133 ASN  HN    134 ARG+ HB2     6.00                
133 ASN  HN    134 ARG+ HB3     6.00                
133 ASN  HN    134 ARG+ QB      5.45                
133 ASN  HN    134 ARG+ HG2     5.00                
133 ASN  HN    134 ARG+ HG3     5.00                
133 ASN  HN    135 GLY  HN      4.25                
133 ASN  HN    135 GLY  QA      6.88                
133 ASN  HN    136 CYSS HN      6.00                
133 ASN  HN    138 PHE  QB      6.88                
133 ASN  HA    133 ASN  HD21    6.00                
133 ASN  HA    133 ASN  HD22    6.00                
133 ASN  HA    134 ARG+ HN      3.50                
133 ASN  HA    135 GLY  HN      5.00                
133 ASN  HA    136 CYSS HN      6.00                
133 ASN  HB2   134 ARG+ HN      4.00                
133 ASN  HB2   135 GLY  HN      6.00                
133 ASN  HB3   134 ARG+ HN      4.00                
133 ASN  HB3   135 GLY  HN      6.00                
133 ASN  QB    134 ARG+ HN      3.34                
133 ASN  QB    135 GLY  HN      5.45                
133 ASN  HD21  134 ARG+ HG2     7.75                
133 ASN  HD21  134 ARG+ HG3     7.75                
133 ASN  HD22  134 ARG+ HG2     7.75                
133 ASN  HD22  134 ARG+ HG3     7.75                
133 ASN  QD2   134 ARG+ QB      7.74                
133 ASN  QD2   134 ARG+ QG      6.82                
134 ARG+ HN    134 ARG+ HA      2.88                
134 ARG+ HN    134 ARG+ HB2     3.50                
134 ARG+ HN    134 ARG+ HB3     3.50                
134 ARG+ HN    134 ARG+ QB      3.29                
134 ARG+ HN    134 ARG+ HG2     4.00                
134 ARG+ HN    134 ARG+ HG3     4.00                
134 ARG+ HN    134 ARG+ QD      4.67                
134 ARG+ HN    135 GLY  HN      2.85                
134 ARG+ HN    135 GLY  HA1     5.00                
134 ARG+ HN    135 GLY  HA2     5.00                
134 ARG+ HN    136 CYSS HN      3.50                
134 ARG+ HN    136 CYSS HA      6.00                
134 ARG+ HA    134 ARG+ HD2     4.78                
134 ARG+ HA    134 ARG+ HD3     4.78                
134 ARG+ HA    134 ARG+ QD      4.42                
134 ARG+ HA    135 GLY  HN      3.30                
134 ARG+ HA    136 CYSS HN      6.00                
134 ARG+ HB2   134 ARG+ HD2     4.22                
134 ARG+ HB2   134 ARG+ HD3     4.22                
134 ARG+ HB2   135 GLY  HN      4.00                
134 ARG+ HB2   136 CYSS HN      5.00                
134 ARG+ HB3   134 ARG+ HD2     4.22                
134 ARG+ HB3   134 ARG+ HD3     4.22                
134 ARG+ HB3   135 GLY  HN      4.00                
134 ARG+ HB3   136 CYSS HN      5.00                
134 ARG+ QB    134 ARG+ QD      3.65                
134 ARG+ QB    135 GLY  HN      3.84                
134 ARG+ QB    136 CYSS HN      4.72                
134 ARG+ HG2   135 GLY  HN      6.00                
134 ARG+ HG2   136 CYSS HN      5.85                
134 ARG+ HG3   135 GLY  HN      6.00                
134 ARG+ HG3   136 CYSS HN      5.85                
134 ARG+ QG    135 GLY  HN      5.60                
134 ARG+ QG    136 CYSS HN      5.46                
134 ARG+ QG    150 LYS+ QE      7.76                
135 GLY  HN    135 GLY  HA1     2.77                
135 GLY  HN    135 GLY  HA2     2.77                
135 GLY  HN    135 GLY  QA      2.53                
135 GLY  HN    136 CYSS HN      2.88                
135 GLY  HN    136 CYSS HA      5.00                
135 GLY  HN    137 CYSS HN      6.00                
135 GLY  HA1   136 CYSS HN      3.50                
135 GLY  HA2   136 CYSS HN      3.50                
135 GLY  QA    136 CYSS HN      3.19                
135 GLY  QA    136 CYSS HA      4.88                
135 GLY  QA    137 CYSS HN      6.88                
135 GLY  QA    150 LYS+ HA      5.88                
136 CYSS HN    137 CYSS HN      5.00                
136 CYSS HN    137 CYSS QB      6.88                
136 CYSS HN    149 PHE  HN      6.00                
136 CYSS HA    137 CYSS HN      3.19                
136 CYSS HA    137 CYSS HA      6.00                
136 CYSS HA    138 PHE  HN      6.00                
136 CYSS HA    148 CYSS QB      6.88                
136 CYSS HA    149 PHE  HN      6.00                
136 CYSS HA    150 LYS+ HN      6.00                
136 CYSS HB2   137 CYSS HN      3.53                
136 CYSS HB2   149 PHE  HN      6.00                
136 CYSS HB3   137 CYSS HN      3.53                
136 CYSS HB3   149 PHE  HN      6.00                
136 CYSS QB    137 CYSS HN      3.30                
137 CYSS N     149 PHE  O       3.00                
137 CYSS HN    137 CYSS HA      2.90                
137 CYSS HN    137 CYSS HB2     3.50                
137 CYSS HN    137 CYSS HB3     3.50                
137 CYSS HN    138 PHE  HA      5.00                
137 CYSS HN    138 PHE  QD      7.13                
137 CYSS HN    139 ASP- HN      6.00                
137 CYSS HN    148 CYSS HA      4.71                
137 CYSS HN    148 CYSS QB      6.88                
137 CYSS HN    149 PHE  HN      2.85                
137 CYSS HN    149 PHE  HA      5.00                
137 CYSS HN    149 PHE  HD1     6.00                
137 CYSS HN    149 PHE  HD2     5.43                
137 CYSS HN    149 PHE  O       2.00                
137 CYSS HN    150 LYS+ HN      6.00                
137 CYSS HN    150 LYS+ HA      3.68                
137 CYSS HN    150 LYS+ QG      6.88                
137 CYSS HN    151 PRO  HD2     5.20                
137 CYSS HN    151 PRO  HD3     5.20                
137 CYSS HN    151 PRO  QD      4.55                
137 CYSS HN    153 GLN  QB      6.88                
137 CYSS HN    153 GLN  QG      5.82                
137 CYSS HA    137 CYSS QB      2.65                
137 CYSS HA    138 PHE  HN      2.90                
137 CYSS HA    138 PHE  HA      6.00                
137 CYSS HA    139 ASP- HN      6.00                
137 CYSS HA    149 PHE  HN      5.00                
137 CYSS HA    153 GLN  QB      6.88                
137 CYSS HA    153 GLN  QG      5.88                
137 CYSS HB2   138 PHE  HN      5.00                
137 CYSS HB2   149 PHE  HN      4.10                
137 CYSS HB3   138 PHE  HN      5.00                
137 CYSS HB3   149 PHE  HN      4.10                
137 CYSS QB    138 PHE  HN      4.18                
137 CYSS QB    139 ASP- HN      6.88                
137 CYSS QB    149 PHE  HN      3.89                
137 CYSS QB    149 PHE  HA      6.88                
137 CYSS O     149 PHE  N       3.00                
137 CYSS O     149 PHE  HN      2.00                
138 PHE  HN    138 PHE  HB2     2.88                
138 PHE  HN    138 PHE  HB3     2.88                
138 PHE  HN    138 PHE  QB      2.69                
138 PHE  HN    138 PHE  QE      7.97                
138 PHE  HN    139 ASP- HN      5.00                
138 PHE  HN    139 ASP- QB      6.88                
138 PHE  HA    139 ASP- HN      2.90                
138 PHE  HA    140 SER  HN      6.00                
138 PHE  HA    148 CYSS QB      6.88                
138 PHE  HB2   139 ASP- HN      5.00                
138 PHE  HB3   139 ASP- HN      5.00                
138 PHE  QB    139 ASP- HN      4.44                
138 PHE  QB    148 CYSS HA      6.88                
138 PHE  QD    139 ASP- HN      5.80                
138 PHE  QD    139 ASP- HA      8.05                
138 PHE  QD    139 ASP- QB      6.08                
138 PHE  QD    141 ARG+ HN      8.12                
138 PHE  QD    147 TRP  HE3     6.72                
138 PHE  QD    148 CYSS HN      7.89                
138 PHE  QD    148 CYSS QB      8.66                
138 PHE  QD    149 PHE  HN      7.41                
138 PHE  QE    139 ASP- HN      7.59                
138 PHE  QE    140 SER  HN      5.00                
138 PHE  QE    141 ARG+ HN      7.59                
138 PHE  QE    147 TRP  HE3     5.99                
138 PHE  QE    148 CYSS HN      7.74                
138 PHE  HZ    147 TRP  HE3     6.00                
139 ASP- HN    139 ASP- HB2     3.04                
139 ASP- HN    139 ASP- HB3     3.04                
139 ASP- HN    140 SER  HN      5.00                
139 ASP- HN    141 ARG+ HN      6.00                
139 ASP- HN    146 PRO  QB      6.88                
139 ASP- HN    147 TRP  HN      6.00                
139 ASP- HN    147 TRP  HA      3.42                
139 ASP- HN    148 CYSS HA      5.89                
139 ASP- HN    148 CYSS QB      6.88                
139 ASP- HN    149 PHE  HN      5.00                
139 ASP- HN    149 PHE  HD1     6.00                
139 ASP- HA    140 SER  HN      3.50                
139 ASP- HA    141 ARG+ HN      4.00                
139 ASP- HB2   147 TRP  HN      6.00                
139 ASP- HB3   147 TRP  HN      6.00                
139 ASP- QB    141 ARG+ HN      4.49                
139 ASP- QB    142 ILE  HN      6.88                
139 ASP- QB    147 TRP  HN      5.45                
139 ASP- OD1   141 ARG+ N       3.00                
139 ASP- OD1   141 ARG+ HN      2.00                
139 ASP- OD1   142 ILE  N       3.00                
139 ASP- OD1   142 ILE  HN      2.00                
140 SER  HN    141 ARG+ HN      3.50                
140 SER  HN    141 ARG+ HA      5.00                
140 SER  HN    141 ARG+ QG      5.88                
140 SER  HN    145 VAL  HN      6.00                
141 ARG+ HN    141 ARG+ HA      2.81                
141 ARG+ HN    141 ARG+ QB      3.87                
141 ARG+ HN    141 ARG+ HG2     2.77                
141 ARG+ HN    141 ARG+ HG3     2.77                
141 ARG+ HN    141 ARG+ QD      6.69                
141 ARG+ HN    142 ILE  HN      2.92                
141 ARG+ HN    142 ILE  HG12    5.01                
141 ARG+ HN    142 ILE  HG13    5.01                
141 ARG+ HN    142 ILE  QG1     4.76                
141 ARG+ HA    141 ARG+ QB      2.67                
141 ARG+ HA    141 ARG+ QG      3.58                
141 ARG+ HA    141 ARG+ HD2     5.54                
141 ARG+ HA    141 ARG+ HD3     5.54                
141 ARG+ HA    141 ARG+ QD      4.96                
141 ARG+ HA    142 ILE  HN      3.50                
141 ARG+ QB    145 VAL  QQG     7.68                
141 ARG+ QG    142 ILE  HN      4.88                
141 ARG+ QD    142 ILE  HN      6.88                
142 ILE  HN    142 ILE  HA      2.90                
142 ILE  HN    142 ILE  HB      2.90                
142 ILE  HN    142 ILE  QG2     4.52                
142 ILE  HN    142 ILE  HG12    3.80                
142 ILE  HN    142 ILE  HG13    3.80                
142 ILE  HN    142 ILE  QG1     3.38                
142 ILE  HN    142 ILE  QD1     4.90                
142 ILE  HN    143 PRO  QG      6.88                
142 ILE  HN    145 VAL  HN      6.00                
142 ILE  HN    147 TRP  HE1     5.70                
142 ILE  HA    142 ILE  HG12    3.64                
142 ILE  HA    142 ILE  HG13    3.64                
142 ILE  HA    142 ILE  QG1     3.46                
142 ILE  HA    143 PRO  QG      5.08                
142 ILE  HA    143 PRO  HD2     3.38                
142 ILE  HA    143 PRO  HD3     3.38                
142 ILE  HA    143 PRO  QD      3.15                
142 ILE  HB    143 PRO  HA      6.00                
142 ILE  HB    145 VAL  HN      5.00                
142 ILE  HB    145 VAL  QG1     6.12                
142 ILE  HB    145 VAL  QG2     6.12                
142 ILE  HB    145 VAL  QQG     5.10                
142 ILE  HB    147 TRP  HE1     6.00                
142 ILE  QG2   143 PRO  HA      6.46                
142 ILE  QG2   144 GLY  HN      7.03                
142 ILE  QG2   145 VAL  HA      7.03                
142 ILE  QG2   145 VAL  QQG     8.63                
142 ILE  QG2   147 TRP  HE1     7.03                
142 ILE  QG1   143 PRO  HA      6.88                
142 ILE  O     145 VAL  N       3.00                
142 ILE  O     145 VAL  HN      2.00                
143 PRO  HA    144 GLY  QA      6.88                
143 PRO  HA    145 VAL  QQG     8.59                
143 PRO  HA    147 TRP  HE1     5.00                
143 PRO  HA    147 TRP  HZ2     4.75                
143 PRO  HB2   147 TRP  HE1     6.00                
143 PRO  HB3   147 TRP  HE1     6.00                
143 PRO  QB    145 VAL  HN      5.88                
143 PRO  QB    147 TRP  HE1     5.62                
143 PRO  QG    145 VAL  HN      5.88                
143 PRO  QG    147 TRP  HE1     6.88                
143 PRO  O     147 TRP  NE1     3.00                
143 PRO  O     147 TRP  HE1     2.00                
144 GLY  HN    145 VAL  HN      3.45                
144 GLY  HN    145 VAL  HA      5.00                
144 GLY  HN    145 VAL  QQG     8.59                
144 GLY  HN    147 TRP  HE1     6.00                
144 GLY  HA1   145 VAL  HN      3.19                
144 GLY  HA2   145 VAL  HN      3.19                
144 GLY  QA    145 VAL  HA      4.88                
145 VAL  HN    145 VAL  HA      2.90                
145 VAL  HN    145 VAL  QG1     3.99                
145 VAL  HN    145 VAL  QG2     3.99                
145 VAL  HN    145 VAL  QQG     3.43                
145 VAL  HN    146 PRO  QB      6.85                
145 VAL  HN    146 PRO  HD2     5.01                
145 VAL  HN    146 PRO  HD3     5.01                
145 VAL  HN    146 PRO  QD      4.72                
145 VAL  HN    147 TRP  HE1     4.97                
145 VAL  HA    147 TRP  HN      6.00                
145 VAL  QQG   147 TRP  HN      7.60                
145 VAL  QQG   147 TRP  QB      9.47                
145 VAL  QQG   147 TRP  HE1     7.37                
146 PRO  HA    147 TRP  HN      2.90                
146 PRO  HA    148 CYSS HN      3.26                
146 PRO  HB2   148 CYSS HN      4.00                
146 PRO  HB3   148 CYSS HN      4.00                
146 PRO  QB    147 TRP  HN      4.30                
146 PRO  QB    148 CYSS HN      3.65                
146 PRO  HG2   148 CYSS HN      6.00                
146 PRO  HG3   148 CYSS HN      6.00                
146 PRO  QG    147 TRP  HN      5.37                
146 PRO  QD    147 TRP  HN      5.47                
147 TRP  HN    147 TRP  HD1     3.99                
147 TRP  HN    147 TRP  HE3     5.28                
147 TRP  HN    147 TRP  HE1     6.00                
147 TRP  HN    147 TRP  HZ3     6.00                
147 TRP  HN    148 CYSS HN      3.50                
147 TRP  HN    148 CYSS HA      6.00                
147 TRP  HN    148 CYSS HB2     5.00                
147 TRP  HN    148 CYSS HB3     5.00                
147 TRP  HN    148 CYSS QB      4.44                
147 TRP  HA    147 TRP  HE3     6.00                
147 TRP  HA    147 TRP  HE1     6.00                
147 TRP  HA    148 CYSS HN      3.57                
147 TRP  HA    148 CYSS QB      6.88                
147 TRP  HE3   148 CYSS HN      6.00                
147 TRP  HE3   148 CYSS QB      6.88                
147 TRP  HZ3   148 CYSS QB      6.04                
148 CYSS HN    148 CYSS HB2     3.30                
148 CYSS HN    148 CYSS HB3     3.30                
148 CYSS HN    149 PHE  HN      5.00                
148 CYSS HN    149 PHE  HA      5.00                
148 CYSS HN    149 PHE  QB      5.88                
148 CYSS HN    149 PHE  HD2     6.00                
148 CYSS HA    149 PHE  HN      2.31                
148 CYSS HA    149 PHE  HA      6.00                
148 CYSS HB2   149 PHE  HN      5.00                
148 CYSS HB3   149 PHE  HN      5.00                
148 CYSS QB    149 PHE  HN      4.44                
149 PHE  HN    149 PHE  HA      2.90                
149 PHE  HN    149 PHE  HB2     3.50                
149 PHE  HN    149 PHE  HB3     3.50                
149 PHE  HN    149 PHE  HD1     3.38                
149 PHE  HN    149 PHE  HD2     4.06                
149 PHE  HN    150 LYS+ HN      5.00                
149 PHE  HN    150 LYS+ HA      5.00                
149 PHE  HA    149 PHE  HB2     3.07                
149 PHE  HA    149 PHE  HB3     3.07                
149 PHE  HA    150 LYS+ HN      2.90                
149 PHE  HA    150 LYS+ QG      6.88                
149 PHE  QB    150 LYS+ HN      4.49                
149 PHE  HD1   150 LYS+ HN      5.09                
149 PHE  HD2   150 LYS+ HN      5.54                
150 LYS+ HN    150 LYS+ QB      3.50                
150 LYS+ HN    150 LYS+ QG      5.00                
150 LYS+ HN    150 LYS+ QD      4.00                
150 LYS+ HN    150 LYS+ QE      4.60                
150 LYS+ HN    151 PRO  HD2     5.54                
150 LYS+ HN    151 PRO  HD3     5.54                
150 LYS+ HN    151 PRO  QD      5.27                
150 LYS+ HA    150 LYS+ QG      3.71                
150 LYS+ HA    150 LYS+ HD2     6.00                
150 LYS+ HA    150 LYS+ HD3     6.00                
150 LYS+ HA    150 LYS+ QE      6.88                
150 LYS+ HA    153 GLN  QB      5.88                
150 LYS+ QB    150 LYS+ QE      5.89                
150 LYS+ QG    153 GLN  QE2     7.75                
151 PRO  HA    152 LEU  HN      3.30                
152 LEU  HN    152 LEU  HA      2.90                
152 LEU  HN    152 LEU  QB      2.90                
152 LEU  HN    152 LEU  QQD     4.00                
152 LEU  HN    153 GLN  HN      3.50                
152 LEU  HN    153 GLN  QB      6.88                
152 LEU  HN    153 GLN  QG      5.88                
152 LEU  HN    154 GLU- HN      5.00                
152 LEU  HN    155 ALA  HN      6.00                
152 LEU  HN    155 ALA  QB      7.03                
152 LEU  HA    155 ALA  QB      7.03                
152 LEU  QB    153 GLN  HN      5.88                
152 LEU  QB    154 GLU- HN      5.88                
152 LEU  QB    155 ALA  HN      6.88                
152 LEU  QQD   153 GLN  HN      8.13                
152 LEU  QQD   153 GLN  HE21    8.13                
152 LEU  QQD   153 GLN  HE22    8.13                
152 LEU  QQD   154 GLU- HN      6.13                
152 LEU  QQD   155 ALA  HN      8.13                
152 LEU  O     155 ALA  N       3.00                
152 LEU  O     155 ALA  HN      2.00                
153 GLN  HN    153 GLN  HB2     3.50                
153 GLN  HN    153 GLN  HB3     3.50                
153 GLN  HN    153 GLN  HG2     3.50                
153 GLN  HN    153 GLN  HG3     3.50                
153 GLN  HN    153 GLN  HE21    6.00                
153 GLN  HN    153 GLN  HE22    6.00                
153 GLN  HN    154 GLU- HA      6.00                
153 GLN  HN    155 ALA  HN      5.00                
153 GLN  HN    155 ALA  QB      6.88                
153 GLN  HB2   153 GLN  HE21    7.10                
153 GLN  HB2   153 GLN  HE22    7.10                
153 GLN  HB2   155 ALA  HN      6.00                
153 GLN  HB2   158 THR  HN      6.00                
153 GLN  HB3   153 GLN  HE21    7.10                
153 GLN  HB3   153 GLN  HE22    7.10                
153 GLN  HB3   155 ALA  HN      6.00                
153 GLN  HB3   158 THR  HN      6.00                
153 GLN  QB    155 ALA  HN      5.45                
153 GLN  QB    157 CYSS HN      5.88                
153 GLN  QG    154 GLU- HN      4.88                
153 GLN  QG    155 ALA  HN      6.88                
153 GLN  QG    158 THR  HN      6.88                
153 GLN  QE2   154 GLU- HN      6.87                
153 GLN  QE2   155 ALA  QB      7.90                
153 GLN  QE2   156 GLU- HN      6.87                
153 GLN  O     157 CYSS N       3.00                
153 GLN  O     157 CYSS HN      2.00                
154 GLU- HN    154 GLU- HA      2.90                
154 GLU- HN    154 GLU- HB2     3.50                
154 GLU- HN    154 GLU- HB3     3.50                
154 GLU- HN    158 THR  HN      6.00                
154 GLU- QB    157 CYSS HN      5.88                
154 GLU- QB    159 PHE  HN      6.88                
155 ALA  HN    155 ALA  HA      2.90                
155 ALA  HN    157 CYSS HN      6.00                
155 ALA  HN    158 THR  HN      6.00                
155 ALA  HN    158 THR  HB      6.00                
155 ALA  HN    158 THR  QG2     7.03                
155 ALA  QB    157 CYSS HN      6.03                
155 ALA  QB    157 CYSS HA      7.03                
155 ALA  QB    158 THR  HN      6.99                
155 ALA  QB    159 PHE  HN      7.03                
156 GLU- HN    157 CYSS HA      5.00                
156 GLU- HN    157 CYSS QB      4.56                
156 GLU- HN    158 THR  HN      5.00                
157 CYSS HN    157 CYSS HA      2.90                
157 CYSS HN    157 CYSS HB2     3.50                
157 CYSS HN    157 CYSS HB3     3.50                
157 CYSS HN    158 THR  HN      3.38                
157 CYSS HN    158 THR  HA      5.00                
157 CYSS HN    158 THR  QG2     6.00                
157 CYSS HA    158 THR  HA      6.00                
157 CYSS HA    158 THR  QG2     7.03                
157 CYSS HA    159 PHE  HN      6.00                
157 CYSS HB2   158 THR  HN      3.49                
157 CYSS HB3   158 THR  HN      3.49                
158 THR  HN    158 THR  HB      3.49                
158 THR  HN    159 PHE  HN      3.64                
158 THR  HA    159 PHE  HN      3.50                
158 THR  HB    159 PHE  HN      4.00                
158 THR  QG2   159 PHE  HN      5.36                
159 PHE  HN    159 PHE  HA      2.43                
159 PHE  HN    159 PHE  HB2     3.34                
159 PHE  HN    159 PHE  HB3     3.34                
159 PHE  HN    159 PHE  QB      2.98                

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    GLU   1           H1       GLU   1 -16.736  -7.102  -5.378
    2    HA   GLU   1           HA       GLU   1 -16.666  -9.112  -4.465
    3   1HB   GLU   1          1HB       GLU   1 -13.659  -8.845  -4.759
    4   2HB   GLU   1          2HB       GLU   1 -14.399 -10.224  -3.929
    5   1HG   GLU   1          1HG       GLU   1 -15.141 -11.149  -5.880
    6   2HG   GLU   1          2HG       GLU   1 -15.584  -9.585  -6.582
    7    H    GLU   2           H        GLU   2 -15.769 -10.125  -2.218
    8    HA   GLU   2           HA       GLU   2 -16.009  -7.923  -0.377
    9   1HB   GLU   2          1HB       GLU   2 -16.183 -10.937  -0.069
   10   2HB   GLU   2          2HB       GLU   2 -16.257  -9.835   1.317
   11   1HG   GLU   2          1HG       GLU   2 -18.489  -9.787   0.920
   12   2HG   GLU   2          2HG       GLU   2 -18.099  -8.715  -0.433
   13    H    TYR   3           H        TYR   3 -13.855  -7.012  -0.643
   14    HA   TYR   3           HA       TYR   3 -11.460  -8.045  -0.690
   15   1HB   TYR   3          1HB       TYR   3 -12.378  -6.113   1.518
   16   2HB   TYR   3          2HB       TYR   3 -10.796  -6.110   0.734
   17    HD1  TYR   3           HD1      TYR   3 -12.009  -6.534  -2.128
   18    HD2  TYR   3           HD2      TYR   3 -12.843  -3.791   1.047
   19    HE1  TYR   3           HE1      TYR   3 -12.868  -4.835  -3.812
   20    HE2  TYR   3           HE2      TYR   3 -13.700  -2.101  -0.648
   21    HH   TYR   3           HH       TYR   3 -13.964  -2.952  -4.066
   22    H    VAL   4           H        VAL   4 -11.407 -10.240   0.101
   23    HA   VAL   4           HA       VAL   4 -10.905 -10.316   2.980
   24    HB   VAL   4           HB       VAL   4 -12.092 -12.466   3.116
   25   1HG1  VAL   4          1HG1      VAL   4 -13.675 -11.128   3.949
   26   2HG1  VAL   4          2HG1      VAL   4 -13.295  -9.844   2.776
   27   3HG1  VAL   4          3HG1      VAL   4 -14.436 -11.139   2.339
   28   1HG2  VAL   4          1HG2      VAL   4 -12.610 -11.899   0.216
   29   2HG2  VAL   4          2HG2      VAL   4 -12.204 -13.432   1.026
   30   3HG2  VAL   4          3HG2      VAL   4 -13.847 -12.760   1.163
   31    H    GLY   5           H        GLY   5 -10.712 -11.996  -0.223
   32   1HA   GLY   5          1HA       GLY   5  -8.634 -13.762   0.545
   33   2HA   GLY   5          2HA       GLY   5  -9.143 -13.363  -1.084
   34    H    LEU   6           H        LEU   6  -8.627 -10.379   0.258
   35    HA   LEU   6           HA       LEU   6  -5.756 -10.431  -0.362
   36   1HB   LEU   6          1HB       LEU   6  -6.336  -8.001  -1.178
   37   2HB   LEU   6          2HB       LEU   6  -6.433  -9.409  -2.250
   38    HG   LEU   6           HG       LEU   6  -8.826  -9.466  -2.053
   39   1HD1  LEU   6          1HD1      LEU   6  -9.760  -8.881  -0.122
   40   2HD1  LEU   6          2HD1      LEU   6  -8.343  -7.919   0.359
   41   3HD1  LEU   6          3HD1      LEU   6  -9.609  -7.190  -0.655
   42   1HD2  LEU   6          1HD2      LEU   6  -7.472  -6.950  -2.833
   43   2HD2  LEU   6          2HD2      LEU   6  -8.519  -8.039  -3.773
   44   3HD2  LEU   6          3HD2      LEU   6  -9.240  -6.867  -2.644
   45    H    SER   7           H        SER   7  -8.075 -10.085   1.987
   46    HA   SER   7           HA       SER   7  -6.586  -7.953   3.297
   47   1HB   SER   7          1HB       SER   7  -8.976  -7.497   3.056
   48   2HB   SER   7          2HB       SER   7  -9.386  -9.036   3.834
   49    HG   SER   7           HG       SER   7  -8.563  -6.584   4.950
   50    H    ALA   8           H        ALA   8  -8.011  -8.940   5.889
   51    HA   ALA   8           HA       ALA   8  -5.982 -10.188   7.118
   52   1HB   ALA   8          1HB       ALA   8  -7.455 -10.316   8.836
   53   2HB   ALA   8          2HB       ALA   8  -8.583  -9.500   7.727
   54   3HB   ALA   8          3HB       ALA   8  -8.619 -11.273   7.887
   55    H    ASN   9           H        ASN   9  -5.208 -12.301   7.442
   56    HA   ASN   9           HA       ASN   9  -5.193 -14.520   7.233
   57   1HB   ASN   9          1HB       ASN   9  -7.735 -14.274   6.481
   58   2HB   ASN   9          2HB       ASN   9  -7.079 -14.527   4.856
   59   1HD2  ASN   9          1HD2      ASN   9  -5.183 -16.310   5.054
   60   2HD2  ASN   9          2HD2      ASN   9  -5.716 -17.818   5.722
   61    H    GLN  10           H        GLN  10  -5.436 -12.299   4.430
   62    HA   GLN  10           HA       GLN  10  -4.056 -13.863   2.604
   63   1HB   GLN  10          1HB       GLN  10  -5.451 -11.723   2.244
   64   2HB   GLN  10          2HB       GLN  10  -3.982 -10.826   2.663
   65   1HG   GLN  10          1HG       GLN  10  -3.400 -12.932   0.735
   66   2HG   GLN  10          2HG       GLN  10  -4.695 -11.889   0.130
   67   1HE2  GLN  10          1HE2      GLN  10  -4.298  -9.500   0.486
   68   2HE2  GLN  10          2HE2      GLN  10  -2.720  -8.890   0.116
   69    H    CYS  11           H        CYS  11  -2.966 -11.415   5.022
   70    HA   CYS  11           HA       CYS  11  -0.302 -11.363   4.207
   71   1HB   CYS  11          1HB       CYS  11  -1.117  -9.621   5.568
   72   2HB   CYS  11          2HB       CYS  11  -1.652 -10.735   6.830
   73    H    ALA  12           H        ALA  12  -2.177 -13.919   5.368
   74    HA   ALA  12           HA       ALA  12   0.113 -15.182   6.701
   75   1HB   ALA  12          1HB       ALA  12  -2.234 -16.740   7.014
   76   2HB   ALA  12          2HB       ALA  12  -1.426 -15.735   8.242
   77   3HB   ALA  12          3HB       ALA  12  -2.730 -15.046   7.246
   78    H    VAL  13           H        VAL  13  -0.476 -14.754   3.706
   79    HA   VAL  13           HA       VAL  13  -1.388 -16.903   2.394
   80    HB   VAL  13           HB       VAL  13   0.803 -16.383   0.921
   81   1HG1  VAL  13          1HG1      VAL  13  -1.342 -16.007   0.022
   82   2HG1  VAL  13          2HG1      VAL  13  -1.745 -14.791   1.258
   83   3HG1  VAL  13          3HG1      VAL  13  -0.555 -14.410  -0.009
   84   1HG2  VAL  13          1HG2      VAL  13   1.715 -14.249   1.262
   85   2HG2  VAL  13          2HG2      VAL  13   0.413 -13.765   2.375
   86   3HG2  VAL  13          3HG2      VAL  13   1.639 -14.946   2.898
   87    HA   PRO  14           HA       PRO  14   1.141 -20.310   3.214
   88   1HB   PRO  14          1HB       PRO  14   1.379 -21.577   0.807
   89   2HB   PRO  14          2HB       PRO  14  -0.058 -21.693   1.819
   90   1HG   PRO  14          1HG       PRO  14   0.411 -20.123  -0.634
   91   2HG   PRO  14          2HG       PRO  14  -1.157 -20.613   0.102
   92   1HD   PRO  14          1HD       PRO  14   0.099 -18.041   0.135
   93   2HD   PRO  14          2HD       PRO  14  -1.364 -18.511   1.011
   94    H    ALA  15           H        ALA  15   2.358 -17.746   1.697
   95    HA   ALA  15           HA       ALA  15   4.496 -17.052   1.699
   96   1HB   ALA  15          1HB       ALA  15   4.806 -19.133   3.332
   97   2HB   ALA  15          2HB       ALA  15   5.630 -19.826   1.915
   98   3HB   ALA  15          3HB       ALA  15   6.211 -18.301   2.623
   99    H    LYS  16           H        LYS  16   3.075 -17.239  -0.572
  100    HA   LYS  16           HA       LYS  16   4.923 -17.337  -2.564
  101   1HB   LYS  16          1HB       LYS  16   3.951 -19.567  -3.656
  102   2HB   LYS  16          2HB       LYS  16   5.406 -19.552  -2.647
  103   1HG   LYS  16          1HG       LYS  16   4.373 -20.655  -0.930
  104   2HG   LYS  16          2HG       LYS  16   2.830 -19.819  -1.169
  105   1HD   LYS  16          1HD       LYS  16   2.395 -22.076  -1.753
  106   2HD   LYS  16          2HD       LYS  16   2.591 -21.260  -3.313
  107   1HE   LYS  16          1HE       LYS  16   4.510 -22.403  -3.798
  108   2HE   LYS  16          2HE       LYS  16   5.110 -22.323  -2.135
  109   1HZ   LYS  16          1HZ       LYS  16   3.715 -24.111  -1.557
  110   2HZ   LYS  16          2HZ       LYS  16   2.921 -24.082  -2.985
  111   3HZ   LYS  16          3HZ       LYS  16   4.482 -24.558  -2.927
  112    H    ASP  17           H        ASP  17   2.856 -15.671  -1.788
  113    HA   ASP  17           HA       ASP  17   1.306 -15.733  -4.192
  114   1HB   ASP  17          1HB       ASP  17  -0.053 -17.051  -2.554
  115   2HB   ASP  17          2HB       ASP  17  -0.040 -15.668  -1.450
  116    H    ARG  18           H        ARG  18   3.336 -14.192  -2.236
  117    HA   ARG  18           HA       ARG  18   1.849 -11.755  -1.900
  118   1HB   ARG  18          1HB       ARG  18   4.787 -12.268  -1.269
  119   2HB   ARG  18          2HB       ARG  18   3.764 -10.982  -0.605
  120   1HG   ARG  18          1HG       ARG  18   2.816 -12.371   0.938
  121   2HG   ARG  18          2HG       ARG  18   2.740 -13.746  -0.180
  122   1HD   ARG  18          1HD       ARG  18   5.174 -14.124   0.141
  123   2HD   ARG  18          2HD       ARG  18   5.252 -12.750   1.253
  124    HE   ARG  18           HE       ARG  18   3.340 -14.934   1.889
  125   1HH1  ARG  18          1HH1      ARG  18   6.407 -13.347   2.563
  126   2HH1  ARG  18          2HH1      ARG  18   6.602 -14.097   4.112
  127   1HH2  ARG  18          1HH2      ARG  18   3.596 -15.924   3.934
  128   2HH2  ARG  18          2HH2      ARG  18   4.991 -15.572   4.897
  129    H    VAL  19           H        VAL  19   3.587  -9.707  -2.347
  130    HA   VAL  19           HA       VAL  19   4.402 -10.087  -5.146
  131    HB   VAL  19           HB       VAL  19   3.519  -7.496  -3.884
  132   1HG1  VAL  19          1HG1      VAL  19   2.913  -7.621  -6.638
  133   2HG1  VAL  19          2HG1      VAL  19   4.180  -6.659  -5.842
  134   3HG1  VAL  19          3HG1      VAL  19   4.554  -8.285  -6.462
  135   1HG2  VAL  19          1HG2      VAL  19   1.675  -9.103  -3.659
  136   2HG2  VAL  19          2HG2      VAL  19   1.298  -7.852  -4.867
  137   3HG2  VAL  19          3HG2      VAL  19   1.785  -9.481  -5.394
  138    H    ASP  20           H        ASP  20   5.831 -10.448  -2.431
  139    HA   ASP  20           HA       ASP  20   7.634  -9.735  -1.376
  140   1HB   ASP  20          1HB       ASP  20   8.867 -11.026  -2.835
  141   2HB   ASP  20          2HB       ASP  20   8.304 -10.149  -4.266
  142    H    CYS  21           H        CYS  21   7.028  -7.594  -0.593
  143    HA   CYS  21           HA       CYS  21   6.882  -5.308  -2.057
  144   1HB   CYS  21          1HB       CYS  21   6.607  -5.945   0.553
  145   2HB   CYS  21          2HB       CYS  21   8.108  -5.017   0.618
  146    H    GLY  22           H        GLY  22   9.724  -7.091  -0.816
  147   1HA   GLY  22          1HA       GLY  22  11.927  -6.865  -1.185
  148   2HA   GLY  22          2HA       GLY  22  11.507  -6.053  -2.679
  149    H    TYR  23           H        TYR  23  11.212  -5.267   0.867
  150    HA   TYR  23           HA       TYR  23  12.029  -2.544   0.261
  151   1HB   TYR  23          1HB       TYR  23  10.221  -3.837   1.973
  152   2HB   TYR  23          2HB       TYR  23  11.573  -3.522   3.063
  153    HD1  TYR  23           HD1      TYR  23  10.519  -1.349   0.233
  154    HD2  TYR  23           HD2      TYR  23  10.555  -1.899   4.475
  155    HE1  TYR  23           HE1      TYR  23   9.690   1.033   0.556
  156    HE2  TYR  23           HE2      TYR  23   9.726   0.485   4.784
  157    HH   TYR  23           HH       TYR  23   8.632   2.374   2.095
  158    HA   PRO  24           HA       PRO  24  16.078  -3.226   1.654
  159   1HB   PRO  24          1HB       PRO  24  16.888  -0.634   1.948
  160   2HB   PRO  24          2HB       PRO  24  16.875  -1.470   0.396
  161   1HG   PRO  24          1HG       PRO  24  15.012   0.545   1.483
  162   2HG   PRO  24          2HG       PRO  24  15.275   0.068  -0.233
  163   1HD   PRO  24          1HD       PRO  24  13.095  -0.619   1.493
  164   2HD   PRO  24          2HD       PRO  24  13.388  -1.243  -0.135
  165    H    HIS  25           H        HIS  25  13.638  -1.940   3.522
  166    HA   HIS  25           HA       HIS  25  15.337  -2.335   5.870
  167   1HB   HIS  25          1HB       HIS  25  13.170  -0.242   5.709
  168   2HB   HIS  25          2HB       HIS  25  14.375  -0.465   6.981
  169    HD1  HIS  25           HD1      HIS  25  13.677   1.611   4.143
  170    HD2  HIS  25           HD2      HIS  25  17.159  -0.051   5.789
  171    HE1  HIS  25           HE1      HIS  25  15.626   2.976   3.222
  172    HE2  HIS  25           HE2      HIS  25  17.733   1.944   4.311
  173    H    VAL  26           H        VAL  26  13.906  -4.418   4.716
  174    HA   VAL  26           HA       VAL  26  11.263  -4.623   5.611
  175    HB   VAL  26           HB       VAL  26  11.866  -6.061   3.911
  176   1HG1  VAL  26          1HG1      VAL  26  14.406  -6.433   5.456
  177   2HG1  VAL  26          2HG1      VAL  26  13.879  -7.729   4.356
  178   3HG1  VAL  26          3HG1      VAL  26  14.158  -6.087   3.729
  179   1HG2  VAL  26          1HG2      VAL  26  10.654  -7.157   5.903
  180   2HG2  VAL  26          2HG2      VAL  26  11.377  -8.228   4.678
  181   3HG2  VAL  26          3HG2      VAL  26  12.205  -7.966   6.231
  182    H    THR  27           H        THR  27  10.448  -4.839   7.629
  183    HA   THR  27           HA       THR  27  11.651  -6.504   9.567
  184    HB   THR  27           HB       THR  27  12.795  -3.907   9.353
  185    HG1  THR  27           HG1      THR  27  14.065  -5.054  10.774
  186   1HG2  THR  27          1HG2      THR  27  10.510  -3.875  11.172
  187   2HG2  THR  27          2HG2      THR  27  12.025  -3.764  12.101
  188   3HG2  THR  27          3HG2      THR  27  11.673  -2.570  10.829
  189    HA   PRO  28           HA       PRO  28   7.628  -6.240  11.031
  190   1HB   PRO  28          1HB       PRO  28   7.903  -7.186  13.579
  191   2HB   PRO  28          2HB       PRO  28   7.830  -8.234  12.164
  192   1HG   PRO  28          1HG       PRO  28  10.144  -7.413  13.802
  193   2HG   PRO  28          2HG       PRO  28   9.996  -8.826  12.694
  194   1HD   PRO  28          1HD       PRO  28  11.394  -6.364  12.265
  195   2HD   PRO  28          2HD       PRO  28  11.144  -7.655  11.082
  196    H    LYS  29           H        LYS  29   8.443  -3.760  10.800
  197    HA   LYS  29           HA       LYS  29   6.951  -2.446  12.728
  198   1HB   LYS  29          1HB       LYS  29   8.752  -3.116  14.261
  199   2HB   LYS  29          2HB       LYS  29   9.930  -2.246  13.262
  200   1HG   LYS  29          1HG       LYS  29   9.318  -0.241  14.120
  201   2HG   LYS  29          2HG       LYS  29   7.588  -0.594  13.965
  202   1HD   LYS  29          1HD       LYS  29   9.281  -1.883  16.125
  203   2HD   LYS  29          2HD       LYS  29   8.589  -0.267  16.359
  204   1HE   LYS  29          1HE       LYS  29   6.464  -1.829  15.367
  205   2HE   LYS  29          2HE       LYS  29   7.296  -2.897  16.507
  206   1HZ   LYS  29          1HZ       LYS  29   5.555  -0.942  17.141
  207   2HZ   LYS  29          2HZ       LYS  29   6.583  -1.668  18.183
  208   3HZ   LYS  29          3HZ       LYS  29   6.996  -0.251  17.482
  209    H    GLU  30           H        GLU  30   9.421  -2.587  10.217
  210    HA   GLU  30           HA       GLU  30   8.983   0.207   9.614
  211   1HB   GLU  30          1HB       GLU  30  11.105  -1.755   9.140
  212   2HB   GLU  30          2HB       GLU  30  10.708  -0.850   7.670
  213   1HG   GLU  30          1HG       GLU  30  11.502   1.121   8.523
  214   2HG   GLU  30          2HG       GLU  30  10.922   0.781  10.159
  215    H    CYS  31           H        CYS  31   8.679  -3.081   8.128
  216    HA   CYS  31           HA       CYS  31   7.615  -2.184   5.712
  217   1HB   CYS  31          1HB       CYS  31   7.759  -4.774   7.162
  218   2HB   CYS  31          2HB       CYS  31   6.586  -4.643   5.849
  219    H    ASN  32           H        ASN  32   6.039  -3.577   8.689
  220    HA   ASN  32           HA       ASN  32   3.459  -3.198   7.807
  221   1HB   ASN  32          1HB       ASN  32   4.838  -3.715  10.394
  222   2HB   ASN  32          2HB       ASN  32   3.248  -2.954  10.564
  223   1HD2  ASN  32          1HD2      ASN  32   4.805  -5.425   8.515
  224   2HD2  ASN  32          2HD2      ASN  32   3.574  -6.635   8.657
  225    H    ASN  33           H        ASN  33   5.861  -0.903   8.480
  226    HA   ASN  33           HA       ASN  33   3.938   1.049   9.447
  227   1HB   ASN  33          1HB       ASN  33   5.924   0.993  10.815
  228   2HB   ASN  33          2HB       ASN  33   6.992   0.970   9.404
  229   1HD2  ASN  33          1HD2      ASN  33   8.018   2.788   9.153
  230   2HD2  ASN  33          2HD2      ASN  33   7.416   4.390   9.425
  231    H    ARG  34           H        ARG  34   6.018   0.034   6.766
  232    HA   ARG  34           HA       ARG  34   5.849   2.572   5.466
  233   1HB   ARG  34          1HB       ARG  34   7.356   1.684   3.887
  234   2HB   ARG  34          2HB       ARG  34   7.795   0.794   5.356
  235   1HG   ARG  34          1HG       ARG  34   7.629  -0.939   3.818
  236   2HG   ARG  34          2HG       ARG  34   5.980  -0.937   4.465
  237   1HD   ARG  34          1HD       ARG  34   5.218  -0.617   2.365
  238   2HD   ARG  34          2HD       ARG  34   6.010   0.967   2.340
  239    HE   ARG  34           HE       ARG  34   8.032  -0.897   1.792
  240   1HH1  ARG  34          1HH1      ARG  34   4.966   0.020   0.329
  241   2HH1  ARG  34          2HH1      ARG  34   5.459  -0.406  -1.276
  242   1HH2  ARG  34          1HH2      ARG  34   8.683  -1.459  -0.326
  243   2HH2  ARG  34          2HH2      ARG  34   7.587  -1.252  -1.651
  244    H    GLY  35           H        GLY  35   4.232  -0.592   5.471
  245   1HA   GLY  35          1HA       GLY  35   1.874  -0.348   4.664
  246   2HA   GLY  35          2HA       GLY  35   2.572   0.260   3.176
  247    H    CYS  36           H        CYS  36   4.337  -2.231   4.954
  248    HA   CYS  36           HA       CYS  36   3.396  -4.187   2.983
  249   1HB   CYS  36          1HB       CYS  36   6.185  -3.833   4.086
  250   2HB   CYS  36          2HB       CYS  36   5.663  -5.191   3.084
  251    H    CYS  37           H        CYS  37   4.147  -6.537   3.919
  252    HA   CYS  37           HA       CYS  37   3.440  -6.524   6.763
  253   1HB   CYS  37          1HB       CYS  37   1.677  -7.334   5.072
  254   2HB   CYS  37          2HB       CYS  37   2.700  -8.761   4.892
  255    H    PHE  38           H        PHE  38   4.969  -7.518   8.053
  256    HA   PHE  38           HA       PHE  38   7.191  -8.790   6.695
  257   1HB   PHE  38          1HB       PHE  38   7.402  -7.018   8.514
  258   2HB   PHE  38          2HB       PHE  38   6.598  -8.117   9.640
  259    HD1  PHE  38           HD1      PHE  38   9.632  -7.688   7.554
  260    HD2  PHE  38           HD2      PHE  38   7.837  -9.745  10.803
  261    HE1  PHE  38           HE1      PHE  38  11.861  -8.666   8.166
  262    HE2  PHE  38           HE2      PHE  38  10.065 -10.723  11.416
  263    HZ   PHE  38           HZ       PHE  38  12.051 -10.171  10.090
  264    H    ASP  39           H        ASP  39   7.400 -10.968   6.510
  265    HA   ASP  39           HA       ASP  39   5.515 -12.582   7.959
  266   1HB   ASP  39          1HB       ASP  39   5.789 -13.094   5.620
  267   2HB   ASP  39          2HB       ASP  39   7.552 -13.151   5.767
  268    H    SER  40           H        SER  40   8.909 -13.399   6.996
  269    HA   SER  40           HA       SER  40  10.718 -13.706   8.247
  270   1HB   SER  40          1HB       SER  40   9.394 -12.298  10.080
  271   2HB   SER  40          2HB       SER  40   9.237 -13.879  10.865
  272    HG   SER  40           HG       SER  40  11.816 -13.186   9.917
  273    H    ARG  41           H        ARG  41   7.712 -15.412   8.326
  274    HA   ARG  41           HA       ARG  41   8.303 -17.623   9.791
  275   1HB   ARG  41          1HB       ARG  41   6.650 -17.230   7.270
  276   2HB   ARG  41          2HB       ARG  41   6.708 -18.799   8.093
  277   1HG   ARG  41          1HG       ARG  41   6.241 -16.918  10.138
  278   2HG   ARG  41          2HG       ARG  41   5.221 -16.373   8.793
  279   1HD   ARG  41          1HD       ARG  41   3.833 -17.889   9.939
  280   2HD   ARG  41          2HD       ARG  41   4.495 -18.893   8.640
  281    HE   ARG  41           HE       ARG  41   5.579 -20.172  10.263
  282   1HH1  ARG  41          1HH1      ARG  41   4.771 -17.040  11.649
  283   2HH1  ARG  41          2HH1      ARG  41   5.302 -17.466  13.242
  284   1HH2  ARG  41          1HH2      ARG  41   6.279 -20.733  12.365
  285   2HH2  ARG  41          2HH2      ARG  41   6.165 -19.580  13.651
  286    H    ILE  42           H        ILE  42   8.709 -17.171   6.195
  287    HA   ILE  42           HA       ILE  42  10.735 -19.298   6.300
  288    HB   ILE  42           HB       ILE  42   9.485 -18.642   3.714
  289   1HG1  ILE  42          1HG1      ILE  42   7.906 -19.890   5.965
  290   2HG1  ILE  42          2HG1      ILE  42   7.487 -18.454   5.015
  291   1HG2  ILE  42          1HG2      ILE  42  11.163 -20.430   4.043
  292   2HG2  ILE  42          2HG2      ILE  42  10.021 -21.273   5.118
  293   3HG2  ILE  42          3HG2      ILE  42   9.617 -21.034   3.402
  294   1HD1  ILE  42          1HD1      ILE  42   7.648 -21.340   4.037
  295   2HD1  ILE  42          2HD1      ILE  42   6.185 -20.337   4.187
  296   3HD1  ILE  42          3HD1      ILE  42   7.414 -19.940   2.962
  297    HA   PRO  43           HA       PRO  43  13.437 -16.106   5.137
  298   1HB   PRO  43          1HB       PRO  43  15.701 -17.608   4.854
  299   2HB   PRO  43          2HB       PRO  43  15.141 -16.993   6.406
  300   1HG   PRO  43          1HG       PRO  43  14.975 -19.711   5.271
  301   2HG   PRO  43          2HG       PRO  43  14.853 -19.205   6.994
  302   1HD   PRO  43          1HD       PRO  43  12.754 -20.010   5.220
  303   2HD   PRO  43          2HD       PRO  43  12.564 -19.369   6.857
  304    H    GLY  44           H        GLY  44  12.514 -18.718   3.218
  305   1HA   GLY  44          1HA       GLY  44  14.003 -17.776   0.895
  306   2HA   GLY  44          2HA       GLY  44  12.974 -19.190   1.008
  307    H    VAL  45           H        VAL  45  11.097 -16.979   2.530
  308    HA   VAL  45           HA       VAL  45   9.810 -16.200   0.011
  309    HB   VAL  45           HB       VAL  45   8.849 -17.585   2.208
  310   1HG1  VAL  45          1HG1      VAL  45   7.955 -14.691   2.350
  311   2HG1  VAL  45          2HG1      VAL  45   7.061 -16.039   3.094
  312   3HG1  VAL  45          3HG1      VAL  45   8.717 -15.667   3.630
  313   1HG2  VAL  45          1HG2      VAL  45   7.404 -18.020   0.566
  314   2HG2  VAL  45          2HG2      VAL  45   6.613 -16.462   0.905
  315   3HG2  VAL  45          3HG2      VAL  45   7.899 -16.558  -0.321
  316    HA   PRO  46           HA       PRO  46  10.269 -12.022   1.028
  317   1HB   PRO  46          1HB       PRO  46   7.888 -10.866   0.357
  318   2HB   PRO  46          2HB       PRO  46   9.114 -11.303  -0.830
  319   1HG   PRO  46          1HG       PRO  46   6.576 -12.643  -0.144
  320   2HG   PRO  46          2HG       PRO  46   7.563 -12.805  -1.641
  321   1HD   PRO  46          1HD       PRO  46   7.331 -14.640   0.544
  322   2HD   PRO  46          2HD       PRO  46   8.436 -14.771  -0.831
  323    H    TRP  47           H        TRP  47  10.716 -11.349   3.023
  324    HA   TRP  47           HA       TRP  47   8.637 -11.727   4.999
  325   1HB   TRP  47          1HB       TRP  47  11.015 -10.314   5.874
  326   2HB   TRP  47          2HB       TRP  47  10.295 -11.812   6.469
  327    HD1  TRP  47           HD1      TRP  47  11.017 -14.094   4.888
  328    HE1  TRP  47           HE1      TRP  47  13.323 -14.755   3.788
  329    HE3  TRP  47           HE3      TRP  47  12.979  -9.403   4.934
  330    HZ2  TRP  47           HZ2      TRP  47  15.657 -13.274   3.077
  331    HZ3  TRP  47           HZ3      TRP  47  15.278  -9.097   4.018
  332    HH2  TRP  47           HH2      TRP  47  16.606 -10.938   3.112
  333    H    CYS  48           H        CYS  48   8.247  -9.850   2.695
  334    HA   CYS  48           HA       CYS  48   7.232  -7.692   4.177
  335   1HB   CYS  48          1HB       CYS  48   9.606  -7.039   4.215
  336   2HB   CYS  48          2HB       CYS  48   9.623  -7.023   2.449
  337    H    PHE  49           H        PHE  49   5.289  -7.857   3.067
  338    HA   PHE  49           HA       PHE  49   5.426  -7.397   0.190
  339   1HB   PHE  49          1HB       PHE  49   3.337  -9.150   0.377
  340   2HB   PHE  49          2HB       PHE  49   4.989  -9.708   0.082
  341    HD1  PHE  49           HD1      PHE  49   6.377 -10.040   2.364
  342    HD2  PHE  49           HD2      PHE  49   2.152 -10.225   2.012
  343    HE1  PHE  49           HE1      PHE  49   6.264 -11.431   4.451
  344    HE2  PHE  49           HE2      PHE  49   2.039 -11.615   4.098
  345    HZ   PHE  49           HZ       PHE  49   4.097 -12.201   5.293
  346    H    LYS  50           H        LYS  50   2.717  -7.509  -0.410
  347    HA   LYS  50           HA       LYS  50   1.568  -5.574   1.480
  348   1HB   LYS  50          1HB       LYS  50   0.483  -4.553  -0.559
  349   2HB   LYS  50          2HB       LYS  50   2.229  -4.286  -0.387
  350   1HG   LYS  50          1HG       LYS  50   1.706  -6.750  -1.842
  351   2HG   LYS  50          2HG       LYS  50   0.853  -5.399  -2.610
  352   1HD   LYS  50          1HD       LYS  50   3.825  -5.629  -1.995
  353   2HD   LYS  50          2HD       LYS  50   3.068  -5.542  -3.597
  354   1HE   LYS  50          1HE       LYS  50   2.178  -3.256  -2.153
  355   2HE   LYS  50          2HE       LYS  50   3.916  -3.382  -1.840
  356   1HZ   LYS  50          1HZ       LYS  50   3.629  -3.885  -4.488
  357   2HZ   LYS  50          2HZ       LYS  50   2.568  -2.672  -4.217
  358   3HZ   LYS  50          3HZ       LYS  50   4.143  -2.483  -3.827
  359    HA   PRO  51           HA       PRO  51  -1.172  -9.152   0.978
  360   1HB   PRO  51          1HB       PRO  51  -1.389  -9.824   3.618
  361   2HB   PRO  51          2HB       PRO  51  -0.243 -10.589   2.518
  362   1HG   PRO  51          1HG       PRO  51   0.201  -8.549   4.602
  363   2HG   PRO  51          2HG       PRO  51   1.400  -9.654   3.840
  364   1HD   PRO  51          1HD       PRO  51   1.006  -6.858   3.368
  365   2HD   PRO  51          2HD       PRO  51   2.089  -7.935   2.478
  366    H    LEU  52           H        LEU  52  -2.013  -8.284   4.182
  367    HA   LEU  52           HA       LEU  52  -4.463  -7.143   3.109
  368   1HB   LEU  52          1HB       LEU  52  -5.484  -7.864   4.948
  369   2HB   LEU  52          2HB       LEU  52  -4.102  -8.974   5.012
  370    HG   LEU  52           HG       LEU  52  -4.722  -6.573   6.705
  371   1HD1  LEU  52          1HD1      LEU  52  -4.193  -9.486   7.120
  372   2HD1  LEU  52          2HD1      LEU  52  -3.767  -8.343   8.417
  373   3HD1  LEU  52          3HD1      LEU  52  -5.443  -8.433   7.825
  374   1HD2  LEU  52          1HD2      LEU  52  -2.622  -5.866   6.753
  375   2HD2  LEU  52          2HD2      LEU  52  -2.133  -7.446   7.411
  376   3HD2  LEU  52          3HD2      LEU  52  -2.115  -7.170   5.653
  377    H    GLN  53           H        GLN  53  -1.928  -5.684   2.830
  378    HA   GLN  53           HA       GLN  53  -1.531  -3.830   4.792
  379   1HB   GLN  53          1HB       GLN  53  -1.262  -3.537   1.775
  380   2HB   GLN  53          2HB       GLN  53  -0.565  -2.408   2.951
  381   1HG   GLN  53          1HG       GLN  53   0.082  -5.364   2.600
  382   2HG   GLN  53          2HG       GLN  53   1.160  -3.996   2.277
  383   1HE2  GLN  53          1HE2      GLN  53  -0.220  -6.122   4.609
  384   2HE2  GLN  53          2HE2      GLN  53   0.647  -5.587   6.010
  385    H    GLU  54           H        GLU  54  -4.203  -4.178   2.550
  386    HA   GLU  54           HA       GLU  54  -5.115  -1.744   2.088
  387   1HB   GLU  54          1HB       GLU  54  -6.551  -3.350   1.304
  388   2HB   GLU  54          2HB       GLU  54  -6.450  -4.334   2.774
  389   1HG   GLU  54          1HG       GLU  54  -7.981  -2.901   3.940
  390   2HG   GLU  54          2HG       GLU  54  -7.864  -1.636   2.708
  391    H    ALA  55           H        ALA  55  -4.790  -3.252   5.265
  392    HA   ALA  55           HA       ALA  55  -6.555  -1.982   6.836
  393   1HB   ALA  55          1HB       ALA  55  -4.735  -2.032   8.581
  394   2HB   ALA  55          2HB       ALA  55  -4.934  -3.562   7.692
  395   3HB   ALA  55          3HB       ALA  55  -3.587  -2.471   7.294
  396    H    GLU  56           H        GLU  56  -3.216  -0.606   6.454
  397    HA   GLU  56           HA       GLU  56  -4.511   2.010   6.457
  398   1HB   GLU  56          1HB       GLU  56  -1.914   1.091   7.732
  399   2HB   GLU  56          2HB       GLU  56  -2.292   2.806   7.491
  400   1HG   GLU  56          1HG       GLU  56  -3.653   2.820   9.291
  401   2HG   GLU  56          2HG       GLU  56  -4.552   1.411   8.707
  402    H    CYS  57           H        CYS  57  -3.789   0.180   4.171
  403    HA   CYS  57           HA       CYS  57  -1.655   1.763   2.955
  404   1HB   CYS  57          1HB       CYS  57  -1.585  -0.805   3.115
  405   2HB   CYS  57          2HB       CYS  57  -2.785  -0.783   1.820
  406    H    THR  58           H        THR  58  -4.743   0.069   2.002
  407    HA   THR  58           HA       THR  58  -5.215   1.609  -0.264
  408    HB   THR  58           HB       THR  58  -6.267  -0.636   0.718
  409    HG1  THR  58           HG1      THR  58  -8.277   0.184  -0.598
  410   1HG2  THR  58          1HG2      THR  58  -8.595  -0.213   1.529
  411   2HG2  THR  58          2HG2      THR  58  -7.398   0.420   2.684
  412   3HG2  THR  58          3HG2      THR  58  -8.251   1.532   1.587
  413    H    PHE  59           H        PHE  59  -6.314   2.101   3.141
  414    HA   PHE  59           HA       PHE  59  -8.057   4.050   2.996
  415   1HB   PHE  59          1HB       PHE  59  -6.166   3.095   4.821
  416   2HB   PHE  59          2HB       PHE  59  -5.662   4.779   4.648
  417    HD1  PHE  59           HD1      PHE  59  -9.043   3.199   4.724
  418    HD2  PHE  59           HD2      PHE  59  -6.330   5.900   6.555
  419    HE1  PHE  59           HE1      PHE  59 -10.824   3.881   6.356
  420    HE2  PHE  59           HE2      PHE  59  -8.111   6.582   8.186
  421    HZ   PHE  59           HZ       PHE  59 -10.336   5.565   8.068
  422   1H    GLU   1           H1       GLU   1 -18.471  -1.483   3.617
  423    HA   GLU   1           HA       GLU   1 -19.159  -1.706   1.571
  424   1HB   GLU   1          1HB       GLU   1 -21.573  -1.366   1.028
  425   2HB   GLU   1          2HB       GLU   1 -21.330  -2.324   2.499
  426   1HG   GLU   1          1HG       GLU   1 -21.724   0.681   2.601
  427   2HG   GLU   1          2HG       GLU   1 -23.111  -0.417   2.542
  428    H    GLU   2           H        GLU   2 -18.914   1.300   3.095
  429    HA   GLU   2           HA       GLU   2 -19.573   2.827   0.751
  430   1HB   GLU   2          1HB       GLU   2 -18.695   3.496   3.564
  431   2HB   GLU   2          2HB       GLU   2 -18.687   4.741   2.304
  432   1HG   GLU   2          1HG       GLU   2 -21.132   4.024   1.845
  433   2HG   GLU   2          2HG       GLU   2 -21.052   3.158   3.387
  434    H    TYR   3           H        TYR   3 -17.649   1.073  -0.018
  435    HA   TYR   3           HA       TYR   3 -15.053   2.327   0.340
  436   1HB   TYR   3          1HB       TYR   3 -14.469   0.265  -1.123
  437   2HB   TYR   3          2HB       TYR   3 -15.211  -0.127   0.432
  438    HD1  TYR   3           HD1      TYR   3 -17.578  -0.880   0.519
  439    HD2  TYR   3           HD2      TYR   3 -15.575  -0.199  -3.199
  440    HE1  TYR   3           HE1      TYR   3 -19.378  -2.199  -0.700
  441    HE2  TYR   3           HE2      TYR   3 -17.381  -1.520  -4.406
  442    HH   TYR   3           HH       TYR   3 -19.086  -3.540  -3.433
  443    H    VAL   4           H        VAL   4 -15.929   4.351  -0.800
  444    HA   VAL   4           HA       VAL   4 -15.564   3.970  -3.690
  445    HB   VAL   4           HB       VAL   4 -17.897   4.356  -3.271
  446   1HG1  VAL   4          1HG1      VAL   4 -17.125   6.905  -1.814
  447   2HG1  VAL   4          2HG1      VAL   4 -18.766   6.265  -2.071
  448   3HG1  VAL   4          3HG1      VAL   4 -17.626   5.394  -1.017
  449   1HG2  VAL   4          1HG2      VAL   4 -17.914   5.597  -5.122
  450   2HG2  VAL   4          2HG2      VAL   4 -17.580   7.053  -4.154
  451   3HG2  VAL   4          3HG2      VAL   4 -16.232   6.095  -4.814
  452    H    GLY   5           H        GLY   5 -15.470   6.296  -0.907
  453   1HA   GLY   5          1HA       GLY   5 -13.810   8.171  -2.246
  454   2HA   GLY   5          2HA       GLY   5 -14.161   8.092  -0.531
  455    H    LEU   6           H        LEU   6 -13.140   5.006  -1.311
  456    HA   LEU   6           HA       LEU   6 -10.304   5.671  -1.047
  457   1HB   LEU   6          1HB       LEU   6 -11.169   3.357   0.513
  458   2HB   LEU   6          2HB       LEU   6 -10.009   4.640   0.906
  459    HG   LEU   6           HG       LEU   6 -11.950   6.120   1.454
  460   1HD1  LEU   6          1HD1      LEU   6 -13.429   3.881   0.352
  461   2HD1  LEU   6          2HD1      LEU   6 -13.989   4.294   1.990
  462   3HD1  LEU   6          3HD1      LEU   6 -13.965   5.538   0.718
  463   1HD2  LEU   6          1HD2      LEU   6 -11.121   5.419   3.425
  464   2HD2  LEU   6          2HD2      LEU   6 -12.630   4.478   3.499
  465   3HD2  LEU   6          3HD2      LEU   6 -11.126   3.705   2.945
  466    H    SER   7           H        SER   7 -12.381   4.652  -3.147
  467    HA   SER   7           HA       SER   7 -11.040   2.128  -3.695
  468   1HB   SER   7          1HB       SER   7 -12.932   1.582  -5.122
  469   2HB   SER   7          2HB       SER   7 -13.539   2.086  -3.536
  470    HG   SER   7           HG       SER   7 -14.227   3.060  -5.922
  471    H    ALA   8           H        ALA   8 -11.757   2.092  -6.532
  472    HA   ALA   8           HA       ALA   8  -9.559   3.526  -7.554
  473   1HB   ALA   8          1HB       ALA   8 -11.901   2.080  -8.851
  474   2HB   ALA   8          2HB       ALA   8 -10.515   2.733  -9.755
  475   3HB   ALA   8          3HB       ALA   8 -10.265   1.444  -8.554
  476    H    ASN   9           H        ASN   9  -9.891   5.739  -6.901
  477    HA   ASN   9           HA       ASN   9 -10.869   7.359  -8.796
  478   1HB   ASN   9          1HB       ASN   9 -13.150   6.750  -8.497
  479   2HB   ASN   9          2HB       ASN   9 -12.996   6.653  -6.736
  480   1HD2  ASN   9          1HD2      ASN   9 -12.469   8.977  -9.389
  481   2HD2  ASN   9          2HD2      ASN   9 -13.195  10.351  -8.624
  482    H    GLN  10           H        GLN  10 -10.352   6.595  -5.372
  483    HA   GLN  10           HA       GLN  10 -10.336   9.152  -4.336
  484   1HB   GLN  10          1HB       GLN  10 -10.374   7.101  -2.974
  485   2HB   GLN  10          2HB       GLN  10  -8.719   6.712  -3.475
  486   1HG   GLN  10          1HG       GLN  10  -7.859   8.690  -2.362
  487   2HG   GLN  10          2HG       GLN  10  -9.491   9.288  -2.032
  488   1HE2  GLN  10          1HE2      GLN  10  -7.893   6.117  -1.739
  489   2HE2  GLN  10          2HE2      GLN  10  -8.241   5.849  -0.065
  490    H    CYS  11           H        CYS  11  -7.934   7.335  -6.223
  491    HA   CYS  11           HA       CYS  11  -5.757   9.015  -5.578
  492   1HB   CYS  11          1HB       CYS  11  -5.448   6.738  -6.353
  493   2HB   CYS  11          2HB       CYS  11  -6.182   7.135  -7.909
  494    H    ALA  12           H        ALA  12  -8.652   9.643  -7.119
  495    HA   ALA  12           HA       ALA  12  -7.398  11.644  -8.875
  496   1HB   ALA  12          1HB       ALA  12  -8.995   9.522  -9.649
  497   2HB   ALA  12          2HB       ALA  12 -10.170  10.850  -9.493
  498   3HB   ALA  12          3HB       ALA  12  -8.765  11.027 -10.570
  499    H    VAL  13           H        VAL  13  -8.642  11.303  -5.906
  500    HA   VAL  13           HA       VAL  13 -10.867  12.784  -5.595
  501    HB   VAL  13           HB       VAL  13  -8.826  11.811  -4.007
  502   1HG1  VAL  13          1HG1      VAL  13  -8.273  13.676  -2.468
  503   2HG1  VAL  13          2HG1      VAL  13  -7.594  13.905  -4.097
  504   3HG1  VAL  13          3HG1      VAL  13  -9.043  14.813  -3.601
  505   1HG2  VAL  13          1HG2      VAL  13 -10.641  11.544  -2.741
  506   2HG2  VAL  13          2HG2      VAL  13 -10.618  13.280  -2.349
  507   3HG2  VAL  13          3HG2      VAL  13 -11.538  12.699  -3.757
  508    HA   PRO  14           HA       PRO  14 -10.037  16.874  -6.721
  509   1HB   PRO  14          1HB       PRO  14 -11.293  18.379  -4.819
  510   2HB   PRO  14          2HB       PRO  14 -12.147  17.595  -6.146
  511   1HG   PRO  14          1HG       PRO  14 -11.958  16.837  -3.301
  512   2HG   PRO  14          2HG       PRO  14 -13.186  16.334  -4.518
  513   1HD   PRO  14          1HD       PRO  14 -10.994  14.818  -3.468
  514   2HD   PRO  14          2HD       PRO  14 -12.078  14.336  -4.781
  515    H    ALA  15           H        ALA  15  -8.019  15.541  -5.032
  516    HA   ALA  15           HA       ALA  15  -6.195  16.055  -3.874
  517   1HB   ALA  15          1HB       ALA  15  -5.519  17.078  -5.928
  518   2HB   ALA  15          2HB       ALA  15  -6.529  18.513  -5.629
  519   3HB   ALA  15          3HB       ALA  15  -5.080  18.223  -4.637
  520    H    LYS  16           H        LYS  16  -7.672  16.047  -1.916
  521    HA   LYS  16           HA       LYS  16  -6.991  17.889  -0.100
  522   1HB   LYS  16          1HB       LYS  16  -9.223  19.260  -0.027
  523   2HB   LYS  16          2HB       LYS  16  -7.865  19.792  -1.035
  524   1HG   LYS  16          1HG       LYS  16  -9.122  19.604  -2.893
  525   2HG   LYS  16          2HG       LYS  16  -9.508  17.914  -2.522
  526   1HD   LYS  16          1HD       LYS  16 -11.601  19.052  -2.608
  527   2HD   LYS  16          2HD       LYS  16 -11.269  18.839  -0.880
  528   1HE   LYS  16          1HE       LYS  16 -10.198  21.201  -1.003
  529   2HE   LYS  16          2HE       LYS  16 -11.012  21.359  -2.567
  530   1HZ   LYS  16          1HZ       LYS  16 -12.104  21.871  -0.170
  531   2HZ   LYS  16          2HZ       LYS  16 -12.945  21.616  -1.547
  532   3HZ   LYS  16          3HZ       LYS  16 -12.702  20.388  -0.498
  533    H    ASP  17           H        ASP  17  -7.511  15.133  -0.317
  534    HA   ASP  17           HA       ASP  17  -9.278  14.875   1.886
  535   1HB   ASP  17          1HB       ASP  17 -10.733  14.800  -0.255
  536   2HB   ASP  17          2HB       ASP  17  -9.945  13.254  -0.603
  537    H    ARG  18           H        ARG  18  -6.452  14.321   0.518
  538    HA   ARG  18           HA       ARG  18  -6.352  11.464   0.790
  539   1HB   ARG  18          1HB       ARG  18  -4.093  13.424   0.183
  540   2HB   ARG  18          2HB       ARG  18  -4.057  11.672  -0.077
  541   1HG   ARG  18          1HG       ARG  18  -5.248  11.816  -2.018
  542   2HG   ARG  18          2HG       ARG  18  -6.322  13.082  -1.395
  543   1HD   ARG  18          1HD       ARG  18  -4.713  14.799  -1.867
  544   2HD   ARG  18          2HD       ARG  18  -3.416  13.625  -2.135
  545    HE   ARG  18           HE       ARG  18  -5.712  13.323  -3.941
  546   1HH1  ARG  18          1HH1      ARG  18  -2.603  14.894  -3.440
  547   2HH1  ARG  18          2HH1      ARG  18  -2.336  15.188  -5.127
  548   1HH2  ARG  18          1HH2      ARG  18  -5.361  13.711  -6.165
  549   2HH2  ARG  18          2HH2      ARG  18  -3.916  14.511  -6.687
  550    H    VAL  19           H        VAL  19  -4.062  10.743   1.943
  551    HA   VAL  19           HA       VAL  19  -4.164  12.016   4.583
  552    HB   VAL  19           HB       VAL  19  -3.044   9.300   3.925
  553   1HG1  VAL  19          1HG1      VAL  19  -3.432  10.891   6.329
  554   2HG1  VAL  19          2HG1      VAL  19  -4.248   9.314   6.450
  555   3HG1  VAL  19          3HG1      VAL  19  -2.505   9.390   6.093
  556   1HG2  VAL  19          1HG2      VAL  19  -5.201   8.304   4.467
  557   2HG2  VAL  19          2HG2      VAL  19  -5.918   9.918   4.689
  558   3HG2  VAL  19          3HG2      VAL  19  -5.367   9.403   3.077
  559    H    ASP  20           H        ASP  20  -2.631  12.778   1.990
  560    HA   ASP  20           HA       ASP  20  -0.561  13.172   1.328
  561   1HB   ASP  20          1HB       ASP  20  -0.720  15.163   2.490
  562   2HB   ASP  20          2HB       ASP  20  -0.946  14.365   4.053
  563    H    CYS  21           H        CYS  21   0.352  10.991   1.134
  564    HA   CYS  21           HA       CYS  21   1.193   9.333   3.051
  565   1HB   CYS  21          1HB       CYS  21   1.287   9.004   0.575
  566   2HB   CYS  21          2HB       CYS  21   2.804   9.906   0.559
  567    H    GLY  22           H        GLY  22   2.822  12.309   1.840
  568   1HA   GLY  22          1HA       GLY  22   4.506  13.543   2.668
  569   2HA   GLY  22          2HA       GLY  22   4.102  12.890   4.242
  570    H    TYR  23           H        TYR  23   5.410  11.373   1.204
  571    HA   TYR  23           HA       TYR  23   7.389  10.006   2.842
  572   1HB   TYR  23          1HB       TYR  23   5.922   9.746   0.276
  573   2HB   TYR  23          2HB       TYR  23   7.643   9.413   0.061
  574    HD1  TYR  23           HD1      TYR  23   7.955   8.256   2.965
  575    HD2  TYR  23           HD2      TYR  23   5.227   7.488  -0.240
  576    HE1  TYR  23           HE1      TYR  23   7.589   5.896   3.834
  577    HE2  TYR  23           HE2      TYR  23   4.869   5.130   0.641
  578    HH   TYR  23           HH       TYR  23   5.043   3.971   2.799
  579    HA   PRO  24           HA       PRO  24  10.497  12.778   1.604
  580   1HB   PRO  24          1HB       PRO  24  12.658  11.432   2.594
  581   2HB   PRO  24          2HB       PRO  24  11.642  12.480   3.580
  582   1HG   PRO  24          1HG       PRO  24  11.743   9.535   3.425
  583   2HG   PRO  24          2HG       PRO  24  11.077  10.570   4.742
  584   1HD   PRO  24          1HD       PRO  24   9.650   9.080   2.754
  585   2HD   PRO  24          2HD       PRO  24   8.958  10.208   3.926
  586    H    HIS  25           H        HIS  25   9.894   9.834   0.281
  587    HA   HIS  25           HA       HIS  25  11.946  10.363  -1.742
  588   1HB   HIS  25          1HB       HIS  25  11.906   8.185  -0.076
  589   2HB   HIS  25          2HB       HIS  25  11.058   7.569  -1.499
  590    HD1  HIS  25           HD1      HIS  25  14.392   8.070  -0.152
  591    HD2  HIS  25           HD2      HIS  25  12.686   8.014  -3.983
  592    HE1  HIS  25           HE1      HIS  25  16.319   7.723  -1.788
  593    HE2  HIS  25           HE2      HIS  25  15.203   7.642  -4.120
  594    H    VAL  26           H        VAL  26   9.085  11.267  -1.425
  595    HA   VAL  26           HA       VAL  26   7.337   9.799  -2.951
  596    HB   VAL  26           HB       VAL  26   6.485  11.589  -1.744
  597   1HG1  VAL  26          1HG1      VAL  26   7.574  13.964  -2.870
  598   2HG1  VAL  26          2HG1      VAL  26   7.758  13.340  -1.213
  599   3HG1  VAL  26          3HG1      VAL  26   8.937  12.892  -2.469
  600   1HG2  VAL  26          1HG2      VAL  26   5.213  12.828  -3.293
  601   2HG2  VAL  26          2HG2      VAL  26   6.513  12.811  -4.510
  602   3HG2  VAL  26          3HG2      VAL  26   5.614  11.317  -4.146
  603    H    THR  27           H        THR  27   7.122   9.319  -5.093
  604    HA   THR  27           HA       THR  27   8.103  10.992  -7.144
  605    HB   THR  27           HB       THR  27  10.026   9.211  -5.901
  606    HG1  THR  27           HG1      THR  27  11.261  10.627  -7.159
  607   1HG2  THR  27          1HG2      THR  27  10.803   8.396  -8.311
  608   2HG2  THR  27          2HG2      THR  27   9.648   7.405  -7.388
  609   3HG2  THR  27          3HG2      THR  27   9.063   8.475  -8.685
  610    HA   PRO  28           HA       PRO  28   5.328   8.532  -9.299
  611   1HB   PRO  28          1HB       PRO  28   6.058   8.993 -11.890
  612   2HB   PRO  28          2HB       PRO  28   5.083  10.119 -10.950
  613   1HG   PRO  28          1HG       PRO  28   7.939  10.233 -11.678
  614   2HG   PRO  28          2HG       PRO  28   6.859  11.575 -11.155
  615   1HD   PRO  28          1HD       PRO  28   8.891  10.234  -9.647
  616   2HD   PRO  28          2HD       PRO  28   7.747  11.438  -9.039
  617    H    LYS  29           H        LYS  29   7.179   6.954  -8.110
  618    HA   LYS  29           HA       LYS  29   6.997   4.667  -9.665
  619   1HB   LYS  29          1HB       LYS  29   8.716   6.065 -10.991
  620   2HB   LYS  29          2HB       LYS  29   9.848   5.639  -9.695
  621   1HG   LYS  29          1HG       LYS  29  10.094   3.553 -10.512
  622   2HG   LYS  29          2HG       LYS  29   8.341   3.295 -10.578
  623   1HD   LYS  29          1HD       LYS  29   8.777   5.049 -12.680
  624   2HD   LYS  29          2HD       LYS  29  10.239   4.049 -12.726
  625   1HE   LYS  29          1HE       LYS  29   8.604   2.975 -14.128
  626   2HE   LYS  29          2HE       LYS  29   8.703   2.005 -12.650
  627   1HZ   LYS  29          1HZ       LYS  29   6.574   2.388 -12.349
  628   2HZ   LYS  29          2HZ       LYS  29   6.806   4.004 -12.303
  629   3HZ   LYS  29          3HZ       LYS  29   6.491   3.264 -13.724
  630    H    GLU  30           H        GLU  30   8.083   6.598  -7.007
  631    HA   GLU  30           HA       GLU  30   9.028   4.227  -5.625
  632   1HB   GLU  30          1HB       GLU  30   9.572   7.120  -5.458
  633   2HB   GLU  30          2HB       GLU  30   9.365   6.355  -3.873
  634   1HG   GLU  30          1HG       GLU  30  11.700   6.213  -4.434
  635   2HG   GLU  30          2HG       GLU  30  11.038   4.583  -4.628
  636    H    CYS  31           H        CYS  31   6.675   6.964  -5.357
  637    HA   CYS  31           HA       CYS  31   5.557   6.225  -2.947
  638   1HB   CYS  31          1HB       CYS  31   4.631   7.804  -5.303
  639   2HB   CYS  31          2HB       CYS  31   3.455   7.371  -4.061
  640    H    ASN  32           H        ASN  32   4.473   5.493  -6.349
  641    HA   ASN  32           HA       ASN  32   2.398   3.851  -5.632
  642   1HB   ASN  32          1HB       ASN  32   4.092   4.281  -8.062
  643   2HB   ASN  32          2HB       ASN  32   3.190   2.760  -8.026
  644   1HD2  ASN  32          1HD2      ASN  32   2.496   6.024  -6.792
  645   2HD2  ASN  32          2HD2      ASN  32   1.014   6.277  -7.654
  646    H    ASN  33           H        ASN  33   5.806   3.437  -5.285
  647    HA   ASN  33           HA       ASN  33   5.637   0.557  -5.447
  648   1HB   ASN  33          1HB       ASN  33   7.585   1.822  -6.453
  649   2HB   ASN  33          2HB       ASN  33   8.049   2.342  -4.826
  650   1HD2  ASN  33          1HD2      ASN  33  10.056   1.258  -5.497
  651   2HD2  ASN  33          2HD2      ASN  33  10.239  -0.439  -5.206
  652    H    ARG  34           H        ARG  34   5.739   3.289  -3.210
  653    HA   ARG  34           HA       ARG  34   6.551   1.661  -1.005
  654   1HB   ARG  34          1HB       ARG  34   5.525   4.536  -1.075
  655   2HB   ARG  34          2HB       ARG  34   6.313   3.762   0.312
  656   1HG   ARG  34          1HG       ARG  34   8.043   3.371  -1.905
  657   2HG   ARG  34          2HG       ARG  34   7.510   5.059  -2.006
  658   1HD   ARG  34          1HD       ARG  34   8.762   5.644  -0.209
  659   2HD   ARG  34          2HD       ARG  34   8.176   4.277   0.751
  660    HE   ARG  34           HE       ARG  34  10.007   3.333  -1.249
  661   1HH1  ARG  34          1HH1      ARG  34   9.971   5.156   1.761
  662   2HH1  ARG  34          2HH1      ARG  34  11.589   4.716   2.195
  663   1HH2  ARG  34          1HH2      ARG  34  12.142   2.752  -0.676
  664   2HH2  ARG  34          2HH2      ARG  34  12.833   3.340   0.800
  665    H    GLY  35           H        GLY  35   3.611   2.750  -2.595
  666   1HA   GLY  35          1HA       GLY  35   1.641   1.413  -2.059
  667   2HA   GLY  35          2HA       GLY  35   2.010   1.649  -0.361
  668    H    CYS  36           H        CYS  36   2.624   4.316  -2.597
  669    HA   CYS  36           HA       CYS  36   0.189   5.605  -1.593
  670   1HB   CYS  36          1HB       CYS  36   2.726   7.074  -2.267
  671   2HB   CYS  36          2HB       CYS  36   1.311   7.668  -1.394
  672    H    CYS  37           H        CYS  37  -0.155   7.714  -3.170
  673    HA   CYS  37           HA       CYS  37   0.202   6.714  -5.902
  674   1HB   CYS  37          1HB       CYS  37  -2.162   6.657  -4.802
  675   2HB   CYS  37          2HB       CYS  37  -2.159   8.392  -5.132
  676    H    PHE  38           H        PHE  38   1.150   8.196  -7.302
  677    HA   PHE  38           HA       PHE  38   1.860  10.760  -6.138
  678   1HB   PHE  38          1HB       PHE  38   3.464   9.119  -7.303
  679   2HB   PHE  38          2HB       PHE  38   2.585   9.410  -8.807
  680    HD1  PHE  38           HD1      PHE  38   3.154  11.230 -10.167
  681    HD2  PHE  38           HD2      PHE  38   4.603  11.090  -6.182
  682    HE1  PHE  38           HE1      PHE  38   4.644  13.193 -10.640
  683    HE2  PHE  38           HE2      PHE  38   6.094  13.053  -6.654
  684    HZ   PHE  38           HZ       PHE  38   6.097  14.081  -8.878
  685    H    ASP  39           H        ASP  39   0.692  12.567  -6.561
  686    HA   ASP  39           HA       ASP  39  -1.298  12.452  -8.585
  687   1HB   ASP  39          1HB       ASP  39  -2.118  13.743  -6.882
  688   2HB   ASP  39          2HB       ASP  39  -0.510  14.260  -6.357
  689    H    SER  40           H        SER  40   0.880  15.252  -7.855
  690    HA   SER  40           HA       SER  40   2.439  16.227  -9.085
  691   1HB   SER  40          1HB       SER  40   2.486  13.861 -10.363
  692   2HB   SER  40          2HB       SER  40   1.783  14.839 -11.664
  693    HG   SER  40           HG       SER  40   4.136  15.706 -10.251
  694    H    ARG  41           H        ARG  41  -0.870  15.624 -10.087
  695    HA   ARG  41           HA       ARG  41  -1.053  17.546 -12.073
  696   1HB   ARG  41          1HB       ARG  41  -3.305  16.793 -10.171
  697   2HB   ARG  41          2HB       ARG  41  -3.442  17.255 -11.877
  698   1HG   ARG  41          1HG       ARG  41  -1.876  15.123 -12.215
  699   2HG   ARG  41          2HG       ARG  41  -2.562  14.640 -10.655
  700   1HD   ARG  41          1HD       ARG  41  -4.439  13.957 -11.704
  701   2HD   ARG  41          2HD       ARG  41  -4.715  15.598 -12.309
  702    HE   ARG  41           HE       ARG  41  -2.698  14.279 -13.888
  703   1HH1  ARG  41          1HH1      ARG  41  -6.172  14.300 -13.329
  704   2HH1  ARG  41          2HH1      ARG  41  -6.559  13.726 -14.917
  705   1HH2  ARG  41          1HH2      ARG  41  -3.208  13.522 -15.983
  706   2HH2  ARG  41          2HH2      ARG  41  -4.862  13.281 -16.436
  707    H    ILE  42           H        ILE  42  -1.556  17.640  -8.496
  708    HA   ILE  42           HA       ILE  42  -1.639  20.570  -8.708
  709    HB   ILE  42           HB       ILE  42  -2.922  19.106  -6.440
  710   1HG1  ILE  42          1HG1      ILE  42  -4.056  19.419  -9.214
  711   2HG1  ILE  42          2HG1      ILE  42  -3.939  17.947  -8.234
  712   1HG2  ILE  42          1HG2      ILE  42  -2.509  21.681  -6.710
  713   2HG2  ILE  42          2HG2      ILE  42  -3.944  21.596  -7.759
  714   3HG2  ILE  42          3HG2      ILE  42  -4.051  21.073  -6.061
  715   1HD1  ILE  42          1HD1      ILE  42  -6.055  18.375  -7.544
  716   2HD1  ILE  42          2HD1      ILE  42  -5.402  19.766  -6.645
  717   3HD1  ILE  42          3HD1      ILE  42  -6.033  19.989  -8.296
  718    HA   PRO  43           HA       PRO  43   2.037  19.865  -6.395
  719   1HB   PRO  43          1HB       PRO  43   3.159  22.309  -6.868
  720   2HB   PRO  43          2HB       PRO  43   3.383  20.923  -7.933
  721   1HG   PRO  43          1HG       PRO  43   1.664  23.300  -8.249
  722   2HG   PRO  43          2HG       PRO  43   2.249  22.161  -9.516
  723   1HD   PRO  43          1HD       PRO  43  -0.362  22.342  -8.351
  724   2HD   PRO  43          2HD       PRO  43   0.209  21.102  -9.476
  725    H    GLY  44           H        GLY  44  -0.614  21.692  -5.816
  726   1HA   GLY  44          1HA       GLY  44   0.492  23.013  -3.455
  727   2HA   GLY  44          2HA       GLY  44  -1.113  23.205  -4.136
  728    H    VAL  45           H        VAL  45  -0.717  19.936  -4.289
  729    HA   VAL  45           HA       VAL  45  -1.664  19.549  -1.534
  730    HB   VAL  45           HB       VAL  45  -3.379  18.202  -2.244
  731   1HG1  VAL  45          1HG1      VAL  45  -3.681  19.628  -4.766
  732   2HG1  VAL  45          2HG1      VAL  45  -4.638  19.738  -3.270
  733   3HG1  VAL  45          3HG1      VAL  45  -3.157  20.709  -3.452
  734   1HG2  VAL  45          1HG2      VAL  45  -3.537  17.030  -4.339
  735   2HG2  VAL  45          2HG2      VAL  45  -2.141  17.914  -4.999
  736   3HG2  VAL  45          3HG2      VAL  45  -1.910  16.752  -3.671
  737    HA   PRO  46           HA       PRO  46   1.033  16.153  -1.314
  738   1HB   PRO  46          1HB       PRO  46  -0.409  13.951  -0.583
  739   2HB   PRO  46          2HB       PRO  46   0.060  15.218   0.551
  740   1HG   PRO  46          1HG       PRO  46  -2.549  14.675  -0.713
  741   2HG   PRO  46          2HG       PRO  46  -2.198  15.634   0.770
  742   1HD   PRO  46          1HD       PRO  46  -2.870  16.584  -1.847
  743   2HD   PRO  46          2HD       PRO  46  -2.378  17.567  -0.461
  744    H    TRP  47           H        TRP  47   2.269  15.413  -2.909
  745    HA   TRP  47           HA       TRP  47   0.845  14.201  -5.133
  746   1HB   TRP  47          1HB       TRP  47   3.747  14.356  -5.316
  747   2HB   TRP  47          2HB       TRP  47   2.500  14.942  -6.419
  748    HD1  TRP  47           HD1      TRP  47   1.488  17.484  -5.785
  749    HE1  TRP  47           HE1      TRP  47   2.599  19.607  -4.681
  750    HE3  TRP  47           HE3      TRP  47   5.397  14.997  -3.691
  751    HZ2  TRP  47           HZ2      TRP  47   4.937  19.999  -3.091
  752    HZ3  TRP  47           HZ3      TRP  47   7.050  16.324  -2.379
  753    HH2  TRP  47           HH2      TRP  47   6.866  18.742  -2.064
  754    H    CYS  48           H        CYS  48   1.024  12.901  -2.430
  755    HA   CYS  48           HA       CYS  48   1.755  10.339  -3.343
  756   1HB   CYS  48          1HB       CYS  48   4.013  11.257  -2.917
  757   2HB   CYS  48          2HB       CYS  48   3.572  11.507  -1.225
  758    H    PHE  49           H        PHE  49  -0.225   9.583  -2.574
  759    HA   PHE  49           HA       PHE  49  -0.572   9.716   0.319
  760   1HB   PHE  49          1HB       PHE  49  -3.146   9.948  -0.560
  761   2HB   PHE  49          2HB       PHE  49  -2.154  11.371  -0.232
  762    HD1  PHE  49           HD1      PHE  49  -0.637  12.066  -2.346
  763    HD2  PHE  49           HD2      PHE  49  -4.289   9.913  -2.541
  764    HE1  PHE  49           HE1      PHE  49  -0.951  12.815  -4.720
  765    HE2  PHE  49           HE2      PHE  49  -4.604  10.663  -4.917
  766    HZ   PHE  49           HZ       PHE  49  -2.931  12.104  -5.978
  767    H    LYS  50           H        LYS  50  -2.980   8.371   0.560
  768    HA   LYS  50           HA       LYS  50  -2.412   5.849  -0.838
  769   1HB   LYS  50          1HB       LYS  50  -2.995   6.466   2.018
  770   2HB   LYS  50          2HB       LYS  50  -3.642   4.958   1.348
  771   1HG   LYS  50          1HG       LYS  50  -1.612   4.009   1.534
  772   2HG   LYS  50          2HG       LYS  50  -0.917   5.235   0.459
  773   1HD   LYS  50          1HD       LYS  50  -1.220   6.597   2.869
  774   2HD   LYS  50          2HD       LYS  50  -0.751   4.972   3.398
  775   1HE   LYS  50          1HE       LYS  50   1.128   5.146   1.622
  776   2HE   LYS  50          2HE       LYS  50   0.758   6.876   1.565
  777   1HZ   LYS  50          1HZ       LYS  50   2.461   5.834   3.249
  778   2HZ   LYS  50          2HZ       LYS  50   1.586   7.163   3.616
  779   3HZ   LYS  50          3HZ       LYS  50   1.121   5.700   4.172
  780    HA   PRO  51           HA       PRO  51  -6.567   7.294  -1.946
  781   1HB   PRO  51          1HB       PRO  51  -6.252   7.295  -4.659
  782   2HB   PRO  51          2HB       PRO  51  -6.056   8.738  -3.665
  783   1HG   PRO  51          1HG       PRO  51  -4.024   7.005  -4.917
  784   2HG   PRO  51          2HG       PRO  51  -3.848   8.699  -4.331
  785   1HD   PRO  51          1HD       PRO  51  -2.913   6.285  -3.103
  786   2HD   PRO  51          2HD       PRO  51  -2.857   7.912  -2.412
  787    H    LEU  52           H        LEU  52  -6.068   5.719  -4.884
  788    HA   LEU  52           HA       LEU  52  -7.598   3.473  -3.836
  789   1HB   LEU  52          1HB       LEU  52  -8.507   3.264  -5.860
  790   2HB   LEU  52          2HB       LEU  52  -8.053   4.974  -5.979
  791    HG   LEU  52           HG       LEU  52  -6.834   2.563  -7.296
  792   1HD1  LEU  52          1HD1      LEU  52  -8.285   4.986  -8.107
  793   2HD1  LEU  52          2HD1      LEU  52  -6.847   4.628  -9.094
  794   3HD1  LEU  52          3HD1      LEU  52  -8.131   3.407  -8.914
  795   1HD2  LEU  52          1HD2      LEU  52  -5.232   4.847  -7.875
  796   2HD2  LEU  52          2HD2      LEU  52  -5.299   4.648  -6.108
  797   3HD2  LEU  52          3HD2      LEU  52  -4.752   3.301  -7.134
  798    H    GLN  53           H        GLN  53  -4.935   3.604  -2.909
  799    HA   GLN  53           HA       GLN  53  -3.021   2.436  -4.388
  800   1HB   GLN  53          1HB       GLN  53  -3.696   2.049  -1.451
  801   2HB   GLN  53          2HB       GLN  53  -2.183   1.478  -2.174
  802   1HG   GLN  53          1HG       GLN  53  -3.189   4.355  -2.123
  803   2HG   GLN  53          2HG       GLN  53  -1.893   3.702  -1.111
  804   1HE2  GLN  53          1HE2      GLN  53  -0.429   2.197  -2.747
  805   2HE2  GLN  53          2HE2      GLN  53   0.272   3.113  -4.038
  806    H    GLU  54           H        GLU  54  -6.034   1.027  -3.322
  807    HA   GLU  54           HA       GLU  54  -5.613  -1.543  -2.951
  808   1HB   GLU  54          1HB       GLU  54  -7.726   0.050  -4.227
  809   2HB   GLU  54          2HB       GLU  54  -7.717  -1.633  -4.783
  810   1HG   GLU  54          1HG       GLU  54  -8.273  -2.459  -2.702
  811   2HG   GLU  54          2HG       GLU  54  -7.417  -1.175  -1.833
  812    H    ALA  55           H        ALA  55  -4.953   0.225  -5.940
  813    HA   ALA  55           HA       ALA  55  -4.998  -1.443  -7.953
  814   1HB   ALA  55          1HB       ALA  55  -2.316  -0.531  -7.980
  815   2HB   ALA  55          2HB       ALA  55  -3.734   0.247  -8.724
  816   3HB   ALA  55          3HB       ALA  55  -3.242   0.686  -7.070
  817    H    GLU  56           H        GLU  56  -2.034  -1.489  -5.848
  818    HA   GLU  56           HA       GLU  56  -2.141  -4.386  -6.030
  819   1HB   GLU  56          1HB       GLU  56  -0.073  -2.585  -7.136
  820   2HB   GLU  56          2HB       GLU  56   0.577  -3.909  -6.153
  821   1HG   GLU  56          1HG       GLU  56   0.430  -5.068  -8.119
  822   2HG   GLU  56          2HG       GLU  56  -1.265  -5.270  -7.650
  823    H    CYS  57           H        CYS  57  -2.684  -2.152  -3.972
  824    HA   CYS  57           HA       CYS  57  -0.584  -2.696  -2.050
  825   1HB   CYS  57          1HB       CYS  57  -2.035  -0.450  -2.610
  826   2HB   CYS  57          2HB       CYS  57  -2.885  -1.077  -1.195
  827    H    THR  58           H        THR  58  -4.233  -2.669  -2.110
  828    HA   THR  58           HA       THR  58  -4.547  -4.244   0.166
  829    HB   THR  58           HB       THR  58  -6.259  -2.767  -1.026
  830    HG1  THR  58           HG1      THR  58  -7.921  -4.361  -0.455
  831   1HG2  THR  58          1HG2      THR  58  -6.319  -3.361  -3.312
  832   2HG2  THR  58          2HG2      THR  58  -6.072  -5.090  -2.967
  833   3HG2  THR  58          3HG2      THR  58  -7.658  -4.339  -2.668
  834    H    PHE  59           H        PHE  59  -3.882  -5.127  -3.216
  835    HA   PHE  59           HA       PHE  59  -4.667  -7.642  -3.445
  836   1HB   PHE  59          1HB       PHE  59  -2.664  -5.932  -4.478
  837   2HB   PHE  59          2HB       PHE  59  -1.748  -7.347  -3.949
  838    HD1  PHE  59           HD1      PHE  59  -2.989  -9.651  -4.683
  839    HD2  PHE  59           HD2      PHE  59  -3.313  -5.915  -6.667
  840    HE1  PHE  59           HE1      PHE  59  -3.623 -10.833  -6.805
  841    HE2  PHE  59           HE2      PHE  59  -3.945  -7.097  -8.790
  842    HZ   PHE  59           HZ       PHE  59  -4.093  -9.542  -8.833
  Start of MODEL    2
    1   1H    GLU   1           H1       GLU   1 -14.960 -15.133  -2.393
    2    HA   GLU   1           HA       GLU   1 -12.969 -14.136  -3.165
    3   1HB   GLU   1          1HB       GLU   1 -13.054 -12.635  -5.171
    4   2HB   GLU   1          2HB       GLU   1 -13.348 -14.337  -5.559
    5   1HG   GLU   1          1HG       GLU   1 -15.735 -12.653  -4.908
    6   2HG   GLU   1          2HG       GLU   1 -14.930 -12.318  -6.449
    7    H    GLU   2           H        GLU   2 -14.493 -13.574  -1.040
    8    HA   GLU   2           HA       GLU   2 -15.550 -10.918  -1.293
    9   1HB   GLU   2          1HB       GLU   2 -15.289 -12.695   1.164
   10   2HB   GLU   2          2HB       GLU   2 -16.267 -11.220   1.043
   11   1HG   GLU   2          1HG       GLU   2 -17.755 -12.244  -0.543
   12   2HG   GLU   2          2HG       GLU   2 -16.673 -13.624  -0.788
   13    H    TYR   3           H        TYR   3 -14.484 -10.971   1.819
   14    HA   TYR   3           HA       TYR   3 -12.232  -9.265   1.168
   15   1HB   TYR   3          1HB       TYR   3 -13.953 -10.060   3.561
   16   2HB   TYR   3          2HB       TYR   3 -12.431  -9.211   3.857
   17    HD1  TYR   3           HD1      TYR   3 -12.678  -6.947   4.248
   18    HD2  TYR   3           HD2      TYR   3 -15.340  -8.855   1.495
   19    HE1  TYR   3           HE1      TYR   3 -13.861  -4.732   3.846
   20    HE2  TYR   3           HE2      TYR   3 -16.514  -6.634   1.103
   21    HH   TYR   3           HH       TYR   3 -16.346  -4.134   3.075
   22    H    VAL   4           H        VAL   4 -10.786 -10.972   0.355
   23    HA   VAL   4           HA       VAL   4  -9.593 -12.451   2.595
   24    HB   VAL   4           HB       VAL   4  -9.040 -14.216   0.922
   25   1HG1  VAL   4          1HG1      VAL   4 -11.005 -15.377   1.296
   26   2HG1  VAL   4          2HG1      VAL   4 -11.127 -14.092   2.520
   27   3HG1  VAL   4          3HG1      VAL   4 -12.033 -13.956   0.993
   28   1HG2  VAL   4          1HG2      VAL   4 -10.793 -12.489  -0.827
   29   2HG2  VAL   4          2HG2      VAL   4  -9.198 -13.193  -1.181
   30   3HG2  VAL   4          3HG2      VAL   4 -10.636 -14.238  -1.111
   31    H    GLY   5           H        GLY   5  -9.039 -11.310  -0.814
   32   1HA   GLY   5          1HA       GLY   5  -6.220 -11.220  -0.539
   33   2HA   GLY   5          2HA       GLY   5  -7.190 -10.492  -1.805
   34    H    LEU   6           H        LEU   6  -8.491  -9.439   1.128
   35    HA   LEU   6           HA       LEU   6  -6.588  -7.283   1.501
   36   1HB   LEU   6          1HB       LEU   6  -8.555  -5.658   1.397
   37   2HB   LEU   6          2HB       LEU   6  -7.801  -6.188  -0.117
   38    HG   LEU   6           HG       LEU   6 -10.270  -6.040  -0.218
   39   1HD1  LEU   6          1HD1      LEU   6  -8.627  -7.966  -1.281
   40   2HD1  LEU   6          2HD1      LEU   6  -9.927  -8.935  -0.548
   41   3HD1  LEU   6          3HD1      LEU   6 -10.321  -7.676  -1.741
   42   1HD2  LEU   6          1HD2      LEU   6 -10.493  -6.834   2.237
   43   2HD2  LEU   6          2HD2      LEU   6 -11.724  -7.331   1.051
   44   3HD2  LEU   6          3HD2      LEU   6 -10.450  -8.472   1.543
   45    H    SER   7           H        SER   7  -7.561  -9.722   2.956
   46    HA   SER   7           HA       SER   7  -8.969  -8.412   5.135
   47   1HB   SER   7          1HB       SER   7  -9.431 -10.831   3.902
   48   2HB   SER   7          2HB       SER   7  -8.489 -11.334   5.318
   49    HG   SER   7           HG       SER   7 -10.417 -11.237   6.273
   50    H    ALA   8           H        ALA   8  -8.243  -9.146   7.419
   51    HA   ALA   8           HA       ALA   8  -5.490  -8.583   7.686
   52   1HB   ALA   8          1HB       ALA   8  -7.846  -8.736   9.316
   53   2HB   ALA   8          2HB       ALA   8  -6.580  -9.731  10.075
   54   3HB   ALA   8          3HB       ALA   8  -6.267  -8.016   9.714
   55    H    ASN   9           H        ASN   9  -7.066 -11.370   6.654
   56    HA   ASN   9           HA       ASN   9  -5.261 -13.154   8.018
   57   1HB   ASN   9          1HB       ASN   9  -7.883 -13.374   6.980
   58   2HB   ASN   9          2HB       ASN   9  -6.897 -14.362   5.891
   59   1HD2  ASN   9          1HD2      ASN   9  -5.242 -15.757   7.063
   60   2HD2  ASN   9          2HD2      ASN   9  -5.794 -16.641   8.447
   61    H    GLN  10           H        GLN  10  -5.368 -11.173   5.243
   62    HA   GLN  10           HA       GLN  10  -4.280 -12.864   3.320
   63   1HB   GLN  10          1HB       GLN  10  -5.135 -10.189   3.494
   64   2HB   GLN  10          2HB       GLN  10  -3.431 -10.083   3.019
   65   1HG   GLN  10          1HG       GLN  10  -4.997 -12.169   1.601
   66   2HG   GLN  10          2HG       GLN  10  -5.535 -10.513   1.281
   67   1HE2  GLN  10          1HE2      GLN  10  -3.622  -8.942   0.983
   68   2HE2  GLN  10          2HE2      GLN  10  -2.378  -9.447  -0.112
   69    H    CYS  11           H        CYS  11  -2.828 -10.726   5.827
   70    HA   CYS  11           HA       CYS  11  -0.180 -11.152   4.902
   71   1HB   CYS  11          1HB       CYS  11  -0.799  -9.139   6.096
   72   2HB   CYS  11          2HB       CYS  11  -1.226 -10.077   7.529
   73    H    ALA  12           H        ALA  12  -2.420 -13.255   6.132
   74    HA   ALA  12           HA       ALA  12  -0.442 -14.707   7.749
   75   1HB   ALA  12          1HB       ALA  12  -2.196 -14.567   9.204
   76   2HB   ALA  12          2HB       ALA  12  -3.384 -14.288   7.908
   77   3HB   ALA  12          3HB       ALA  12  -2.817 -15.940   8.256
   78    H    VAL  13           H        VAL  13  -1.164 -14.441   4.643
   79    HA   VAL  13           HA       VAL  13  -2.181 -16.809   3.729
   80    HB   VAL  13           HB       VAL  13  -1.011 -14.540   2.684
   81   1HG1  VAL  13          1HG1      VAL  13   1.215 -15.613   2.788
   82   2HG1  VAL  13          2HG1      VAL  13   0.613 -16.934   1.757
   83   3HG1  VAL  13          3HG1      VAL  13   0.705 -15.276   1.117
   84   1HG2  VAL  13          1HG2      VAL  13  -2.529 -15.105   1.152
   85   2HG2  VAL  13          2HG2      VAL  13  -1.430 -16.365   0.541
   86   3HG2  VAL  13          3HG2      VAL  13  -2.612 -16.756   1.813
   87    HA   PRO  14           HA       PRO  14   0.808 -19.843   4.464
   88   1HB   PRO  14          1HB       PRO  14   0.762 -21.388   2.211
   89   2HB   PRO  14          2HB       PRO  14  -0.457 -21.496   3.480
   90   1HG   PRO  14          1HG       PRO  14  -0.595 -20.227   0.821
   91   2HG   PRO  14          2HG       PRO  14  -1.949 -20.750   1.887
   92   1HD   PRO  14          1HD       PRO  14  -0.996 -18.095   1.396
   93   2HD   PRO  14          2HD       PRO  14  -2.223 -18.574   2.574
   94    H    ALA  15           H        ALA  15   1.778 -17.311   3.335
   95    HA   ALA  15           HA       ALA  15   3.589 -16.481   2.336
   96   1HB   ALA  15          1HB       ALA  15   5.558 -18.398   3.081
   97   2HB   ALA  15          2HB       ALA  15   5.126 -16.889   3.921
   98   3HB   ALA  15          3HB       ALA  15   4.315 -18.413   4.355
   99    H    LYS  16           H        LYS  16   2.230 -17.492   0.330
  100    HA   LYS  16           HA       LYS  16   4.209 -18.334  -1.482
  101   1HB   LYS  16          1HB       LYS  16   3.040 -20.539  -2.050
  102   2HB   LYS  16          2HB       LYS  16   4.122 -20.514  -0.647
  103   1HG   LYS  16          1HG       LYS  16   2.416 -21.275   0.609
  104   2HG   LYS  16          2HG       LYS  16   1.549 -19.758   0.315
  105   1HD   LYS  16          1HD       LYS  16   0.038 -20.843  -0.950
  106   2HD   LYS  16          2HD       LYS  16   1.313 -21.447  -2.024
  107   1HE   LYS  16          1HE       LYS  16   1.532 -23.455  -0.837
  108   2HE   LYS  16          2HE       LYS  16   0.875 -22.775   0.660
  109   1HZ   LYS  16          1HZ       LYS  16  -0.517 -24.283  -0.959
  110   2HZ   LYS  16          2HZ       LYS  16  -1.210 -23.118  -0.048
  111   3HZ   LYS  16          3HZ       LYS  16  -0.883 -22.837  -1.624
  112    H    ASP  17           H        ASP  17   2.197 -16.233  -1.033
  113    HA   ASP  17           HA       ASP  17   1.019 -16.408  -3.623
  114   1HB   ASP  17          1HB       ASP  17  -0.627 -17.499  -1.987
  115   2HB   ASP  17          2HB       ASP  17  -0.798 -15.910  -1.226
  116    H    ARG  18           H        ARG  18   2.902 -14.832  -1.647
  117    HA   ARG  18           HA       ARG  18   1.539 -12.321  -1.488
  118   1HB   ARG  18          1HB       ARG  18   4.416 -13.067  -0.789
  119   2HB   ARG  18          2HB       ARG  18   3.615 -11.550  -0.344
  120   1HG   ARG  18          1HG       ARG  18   2.398 -12.538   1.332
  121   2HG   ARG  18          2HG       ARG  18   2.204 -14.065   0.451
  122   1HD   ARG  18          1HD       ARG  18   4.421 -14.783   1.055
  123   2HD   ARG  18          2HD       ARG  18   4.863 -13.176   1.654
  124    HE   ARG  18           HE       ARG  18   2.558 -14.361   3.022
  125   1HH1  ARG  18          1HH1      ARG  18   6.069 -14.126   2.964
  126   2HH1  ARG  18          2HH1      ARG  18   6.252 -14.542   4.635
  127   1HH2  ARG  18          1HH2      ARG  18   2.799 -14.910   5.227
  128   2HH2  ARG  18          2HH2      ARG  18   4.379 -14.993   5.931
  129    H    VAL  19           H        VAL  19   3.079 -10.303  -2.148
  130    HA   VAL  19           HA       VAL  19   3.848 -10.835  -4.923
  131    HB   VAL  19           HB       VAL  19   3.329  -8.173  -3.601
  132   1HG1  VAL  19          1HG1      VAL  19   4.421  -8.790  -6.061
  133   2HG1  VAL  19          2HG1      VAL  19   2.703  -8.530  -6.447
  134   3HG1  VAL  19          3HG1      VAL  19   3.633  -7.253  -5.627
  135   1HG2  VAL  19          1HG2      VAL  19   1.274  -9.236  -3.265
  136   2HG2  VAL  19          2HG2      VAL  19   1.056  -8.406  -4.824
  137   3HG2  VAL  19          3HG2      VAL  19   1.386 -10.155  -4.785
  138    H    ASP  20           H        ASP  20   5.420 -11.349  -2.311
  139    HA   ASP  20           HA       ASP  20   7.348 -10.766  -1.371
  140   1HB   ASP  20          1HB       ASP  20   8.283 -12.332  -2.794
  141   2HB   ASP  20          2HB       ASP  20   7.780 -11.470  -4.256
  142    H    CYS  21           H        CYS  21   7.024  -8.494  -0.767
  143    HA   CYS  21           HA       CYS  21   7.127  -6.341  -2.416
  144   1HB   CYS  21          1HB       CYS  21   6.908  -6.730   0.259
  145   2HB   CYS  21          2HB       CYS  21   8.499  -5.971   0.170
  146    H    GLY  22           H        GLY  22   9.769  -8.357  -1.077
  147   1HA   GLY  22          1HA       GLY  22  12.005  -8.318  -1.371
  148   2HA   GLY  22          2HA       GLY  22  11.601  -7.964  -3.039
  149    H    TYR  23           H        TYR  23  11.616  -6.182   0.139
  150    HA   TYR  23           HA       TYR  23  12.493  -3.795  -1.264
  151   1HB   TYR  23          1HB       TYR  23  11.077  -4.638   1.166
  152   2HB   TYR  23          2HB       TYR  23  12.401  -3.559   1.618
  153    HD1  TYR  23           HD1      TYR  23  12.380  -1.208   0.939
  154    HD2  TYR  23           HD2      TYR  23   9.182  -3.839  -0.136
  155    HE1  TYR  23           HE1      TYR  23  10.934   0.790   0.321
  156    HE2  TYR  23           HE2      TYR  23   7.746  -1.833  -0.749
  157    HH   TYR  23           HH       TYR  23   8.989   1.469  -0.325
  158    HA   PRO  24           HA       PRO  24  16.633  -4.281  -0.089
  159   1HB   PRO  24          1HB       PRO  24  17.521  -1.715  -0.374
  160   2HB   PRO  24          2HB       PRO  24  17.339  -2.827  -1.729
  161   1HG   PRO  24          1HG       PRO  24  15.634  -0.574  -0.884
  162   2HG   PRO  24          2HG       PRO  24  15.717  -1.377  -2.493
  163   1HD   PRO  24          1HD       PRO  24  13.702  -1.639  -0.474
  164   2HD   PRO  24          2HD       PRO  24  13.823  -2.572  -1.972
  165    H    HIS  25           H        HIS  25  14.402  -2.625   1.727
  166    HA   HIS  25           HA       HIS  25  16.333  -2.577   3.925
  167   1HB   HIS  25          1HB       HIS  25  14.233  -0.505   3.257
  168   2HB   HIS  25          2HB       HIS  25  15.091  -0.578   4.801
  169    HD1  HIS  25           HD1      HIS  25  15.434   0.522   1.257
  170    HD2  HIS  25           HD2      HIS  25  17.892   0.078   4.627
  171    HE1  HIS  25           HE1      HIS  25  17.584   1.798   0.747
  172    HE2  HIS  25           HE2      HIS  25  19.033   1.535   2.875
  173    H    VAL  26           H        VAL  26  14.466  -4.684   2.991
  174    HA   VAL  26           HA       VAL  26  12.082  -4.711   4.370
  175    HB   VAL  26           HB       VAL  26  12.448  -6.332   2.732
  176   1HG1  VAL  26          1HG1      VAL  26  14.476  -8.066   3.653
  177   2HG1  VAL  26          2HG1      VAL  26  14.523  -6.984   2.239
  178   3HG1  VAL  26          3HG1      VAL  26  15.124  -6.417   3.816
  179   1HG2  VAL  26          1HG2      VAL  26  11.727  -8.270   3.762
  180   2HG2  VAL  26          2HG2      VAL  26  12.862  -8.103   5.122
  181   3HG2  VAL  26          3HG2      VAL  26  11.414  -7.072   5.040
  182    H    THR  27           H        THR  27  11.512  -4.848   6.488
  183    HA   THR  27           HA       THR  27  13.049  -6.260   8.391
  184    HB   THR  27           HB       THR  27  13.921  -3.576   7.800
  185    HG1  THR  27           HG1      THR  27  15.443  -4.316   9.448
  186   1HG2  THR  27          1HG2      THR  27  12.473  -2.523   9.374
  187   2HG2  THR  27          2HG2      THR  27  12.447  -3.951  10.435
  188   3HG2  THR  27          3HG2      THR  27  13.900  -2.926  10.359
  189    HA   PRO  28           HA       PRO  28   9.251  -6.017  10.368
  190   1HB   PRO  28          1HB       PRO  28   9.913  -6.652  12.941
  191   2HB   PRO  28          2HB       PRO  28   9.724  -7.857  11.670
  192   1HG   PRO  28          1HG       PRO  28  12.175  -6.747  12.879
  193   2HG   PRO  28          2HG       PRO  28  11.973  -8.281  11.958
  194   1HD   PRO  28          1HD       PRO  28  13.145  -5.819  11.080
  195   2HD   PRO  28          2HD       PRO  28  12.825  -7.248  10.088
  196    H    LYS  29           H        LYS  29   9.877  -3.542   9.767
  197    HA   LYS  29           HA       LYS  29   8.540  -2.073  11.668
  198   1HB   LYS  29          1HB       LYS  29  10.823  -2.685  12.856
  199   2HB   LYS  29          2HB       LYS  29  11.415  -1.293  11.931
  200   1HG   LYS  29          1HG       LYS  29  10.466   0.098  13.423
  201   2HG   LYS  29          2HG       LYS  29   8.868  -0.591  13.080
  202   1HD   LYS  29          1HD       LYS  29   8.909  -1.285  15.237
  203   2HD   LYS  29          2HD       LYS  29  10.034  -2.538  14.686
  204   1HE   LYS  29          1HE       LYS  29  11.918  -1.348  15.447
  205   2HE   LYS  29          2HE       LYS  29  11.073   0.208  15.443
  206   1HZ   LYS  29          1HZ       LYS  29  11.394  -1.513  17.548
  207   2HZ   LYS  29          2HZ       LYS  29  10.490  -0.153  17.520
  208   3HZ   LYS  29          3HZ       LYS  29   9.807  -1.595  17.171
  209    H    GLU  30           H        GLU  30  10.677  -2.479   8.938
  210    HA   GLU  30           HA       GLU  30  10.174   0.257   8.119
  211   1HB   GLU  30          1HB       GLU  30  12.263  -1.754   7.597
  212   2HB   GLU  30          2HB       GLU  30  11.740  -0.902   6.135
  213   1HG   GLU  30          1HG       GLU  30  13.336   0.590   6.855
  214   2HG   GLU  30          2HG       GLU  30  11.969   1.226   7.783
  215    H    CYS  31           H        CYS  31   9.807  -3.171   7.014
  216    HA   CYS  31           HA       CYS  31   8.597  -2.649   4.602
  217   1HB   CYS  31          1HB       CYS  31   8.550  -4.937   6.518
  218   2HB   CYS  31          2HB       CYS  31   7.424  -4.944   5.158
  219    H    ASN  32           H        ASN  32   7.135  -3.231   7.883
  220    HA   ASN  32           HA       ASN  32   4.525  -2.831   7.029
  221   1HB   ASN  32          1HB       ASN  32   5.994  -3.029   9.609
  222   2HB   ASN  32          2HB       ASN  32   4.489  -2.104   9.709
  223   1HD2  ASN  32          1HD2      ASN  32   5.685  -5.008   8.018
  224   2HD2  ASN  32          2HD2      ASN  32   4.370  -6.058   8.432
  225    H    ASN  33           H        ASN  33   7.115  -0.688   7.095
  226    HA   ASN  33           HA       ASN  33   5.463   1.571   7.874
  227   1HB   ASN  33          1HB       ASN  33   7.786   1.222   8.890
  228   2HB   ASN  33          2HB       ASN  33   8.466   1.539   7.287
  229   1HD2  ASN  33          1HD2      ASN  33   9.459   3.190   8.863
  230   2HD2  ASN  33          2HD2      ASN  33   8.705   4.749   8.921
  231    H    ARG  34           H        ARG  34   7.174  -0.062   5.229
  232    HA   ARG  34           HA       ARG  34   7.037   2.212   3.514
  233   1HB   ARG  34          1HB       ARG  34   7.616  -0.652   2.674
  234   2HB   ARG  34          2HB       ARG  34   8.189   0.839   1.905
  235   1HG   ARG  34          1HG       ARG  34   9.097   1.001   4.564
  236   2HG   ARG  34          2HG       ARG  34   9.352  -0.696   4.118
  237   1HD   ARG  34          1HD       ARG  34  10.978  -0.174   2.593
  238   2HD   ARG  34          2HD       ARG  34  10.154   1.293   2.044
  239    HE   ARG  34           HE       ARG  34  11.013   1.860   4.647
  240   1HH1  ARG  34          1HH1      ARG  34  12.558   0.894   1.637
  241   2HH1  ARG  34          2HH1      ARG  34  14.053   1.691   2.000
  242   1HH2  ARG  34          1HH2      ARG  34  12.985   2.911   5.127
  243   2HH2  ARG  34          2HH2      ARG  34  14.297   2.846   3.998
  244    H    GLY  35           H        GLY  35   5.055  -0.533   4.413
  245   1HA   GLY  35          1HA       GLY  35   2.707  -0.299   3.789
  246   2HA   GLY  35          2HA       GLY  35   3.233   0.045   2.152
  247    H    CYS  36           H        CYS  36   4.978  -2.356   4.100
  248    HA   CYS  36           HA       CYS  36   3.707  -4.445   2.484
  249   1HB   CYS  36          1HB       CYS  36   6.568  -4.436   3.438
  250   2HB   CYS  36          2HB       CYS  36   5.797  -5.620   2.380
  251    H    CYS  37           H        CYS  37   4.525  -6.714   3.728
  252    HA   CYS  37           HA       CYS  37   3.976  -6.268   6.567
  253   1HB   CYS  37          1HB       CYS  37   2.014  -7.117   5.091
  254   2HB   CYS  37          2HB       CYS  37   2.872  -8.661   5.132
  255    H    PHE  38           H        PHE  38   5.593  -7.162   7.809
  256    HA   PHE  38           HA       PHE  38   7.515  -8.861   6.479
  257   1HB   PHE  38          1HB       PHE  38   8.071  -6.896   7.998
  258   2HB   PHE  38          2HB       PHE  38   7.280  -7.737   9.335
  259    HD1  PHE  38           HD1      PHE  38  10.163  -7.817   7.028
  260    HD2  PHE  38           HD2      PHE  38   8.428  -9.422  10.552
  261    HE1  PHE  38           HE1      PHE  38  12.338  -8.937   7.589
  262    HE2  PHE  38           HE2      PHE  38  10.603 -10.542  11.113
  263    HZ   PHE  38           HZ       PHE  38  12.532 -10.286   9.625
  264    H    ASP  39           H        ASP  39   7.479 -11.054   6.574
  265    HA   ASP  39           HA       ASP  39   5.625 -12.249   8.415
  266   1HB   ASP  39          1HB       ASP  39   5.572 -13.094   6.163
  267   2HB   ASP  39          2HB       ASP  39   7.330 -13.306   6.122
  268    H    SER  40           H        SER  40   8.792 -13.556   7.243
  269    HA   SER  40           HA       SER  40  10.692 -13.909   8.333
  270   1HB   SER  40          1HB       SER  40   9.720 -12.123  10.069
  271   2HB   SER  40          2HB       SER  40   9.545 -13.559  11.092
  272    HG   SER  40           HG       SER  40  11.968 -13.809  10.128
  273    H    ARG  41           H        ARG  41   7.556 -15.216   8.992
  274    HA   ARG  41           HA       ARG  41   8.199 -17.298  10.668
  275   1HB   ARG  41          1HB       ARG  41   6.100 -17.101   8.463
  276   2HB   ARG  41          2HB       ARG  41   6.121 -18.388   9.683
  277   1HG   ARG  41          1HG       ARG  41   6.289 -16.180  11.281
  278   2HG   ARG  41          2HG       ARG  41   5.351 -15.512   9.934
  279   1HD   ARG  41          1HD       ARG  41   3.711 -16.368  11.411
  280   2HD   ARG  41          2HD       ARG  41   3.862 -17.641  10.190
  281    HE   ARG  41           HE       ARG  41   4.791 -19.050  11.822
  282   1HH1  ARG  41          1HH1      ARG  41   4.769 -15.737  13.007
  283   2HH1  ARG  41          2HH1      ARG  41   5.234 -16.174  14.618
  284   1HH2  ARG  41          1HH2      ARG  41   5.404 -19.628  13.946
  285   2HH2  ARG  41          2HH2      ARG  41   5.597 -18.403  15.155
  286    H    ILE  42           H        ILE  42   8.254 -17.004   7.066
  287    HA   ILE  42           HA       ILE  42   9.743 -19.536   7.005
  288    HB   ILE  42           HB       ILE  42   8.196 -18.627   4.631
  289   1HG1  ILE  42          1HG1      ILE  42   6.964 -19.806   7.122
  290   2HG1  ILE  42          2HG1      ILE  42   6.498 -18.324   6.271
  291   1HG2  ILE  42          1HG2      ILE  42   9.758 -20.820   5.240
  292   2HG2  ILE  42          2HG2      ILE  42   8.101 -21.434   5.448
  293   3HG2  ILE  42          3HG2      ILE  42   8.590 -20.699   3.903
  294   1HD1  ILE  42          1HD1      ILE  42   6.067 -19.919   4.233
  295   2HD1  ILE  42          2HD1      ILE  42   6.078 -21.214   5.455
  296   3HD1  ILE  42          3HD1      ILE  42   4.883 -19.899   5.562
  297    HA   PRO  43           HA       PRO  43  12.733 -16.732   5.463
  298   1HB   PRO  43          1HB       PRO  43  14.872 -18.420   5.656
  299   2HB   PRO  43          2HB       PRO  43  14.321 -17.405   6.987
  300   1HG   PRO  43          1HG       PRO  43  13.963 -20.298   6.531
  301   2HG   PRO  43          2HG       PRO  43  13.834 -19.380   8.076
  302   1HD   PRO  43          1HD       PRO  43  11.725 -20.436   6.451
  303   2HD   PRO  43          2HD       PRO  43  11.543 -19.403   7.874
  304    H    GLY  44           H        GLY  44  11.452 -19.470   4.120
  305   1HA   GLY  44          1HA       GLY  44  13.163 -19.367   1.751
  306   2HA   GLY  44          2HA       GLY  44  11.923 -20.549   2.122
  307    H    VAL  45           H        VAL  45  10.457 -17.707   2.969
  308    HA   VAL  45           HA       VAL  45   9.474 -17.254   0.237
  309    HB   VAL  45           HB       VAL  45   7.298 -17.166   0.983
  310   1HG1  VAL  45          1HG1      VAL  45   7.358 -19.398   1.189
  311   2HG1  VAL  45          2HG1      VAL  45   8.905 -19.361   2.067
  312   3HG1  VAL  45          3HG1      VAL  45   7.376 -19.122   2.947
  313   1HG2  VAL  45          1HG2      VAL  45   8.507 -16.271   3.519
  314   2HG2  VAL  45          2HG2      VAL  45   6.969 -15.809   2.750
  315   3HG2  VAL  45          3HG2      VAL  45   7.070 -17.304   3.712
  316    HA   PRO  46           HA       PRO  46   9.976 -13.009   0.973
  317   1HB   PRO  46          1HB       PRO  46   7.613 -11.773   0.377
  318   2HB   PRO  46          2HB       PRO  46   8.742 -12.338  -0.851
  319   1HG   PRO  46          1HG       PRO  46   6.194 -13.509   0.065
  320   2HG   PRO  46          2HG       PRO  46   7.074 -13.803  -1.478
  321   1HD   PRO  46          1HD       PRO  46   6.895 -15.499   0.822
  322   2HD   PRO  46          2HD       PRO  46   7.904 -15.761  -0.606
  323    H    TRP  47           H        TRP  47  10.559 -12.157   2.859
  324    HA   TRP  47           HA       TRP  47   8.587 -12.334   4.983
  325   1HB   TRP  47          1HB       TRP  47  11.106 -11.038   5.627
  326   2HB   TRP  47          2HB       TRP  47  10.314 -12.428   6.373
  327    HD1  TRP  47           HD1      TRP  47  10.828 -14.882   5.055
  328    HE1  TRP  47           HE1      TRP  47  12.986 -15.793   3.841
  329    HE3  TRP  47           HE3      TRP  47  12.990 -10.335   4.346
  330    HZ2  TRP  47           HZ2      TRP  47  15.303 -14.539   2.745
  331    HZ3  TRP  47           HZ3      TRP  47  15.200 -10.266   3.196
  332    HH2  TRP  47           HH2      TRP  47  16.353 -12.271   2.406
  333    H    CYS  48           H        CYS  48   8.210 -10.565   2.582
  334    HA   CYS  48           HA       CYS  48   7.398  -8.269   3.976
  335   1HB   CYS  48          1HB       CYS  48   9.774  -7.727   3.919
  336   2HB   CYS  48          2HB       CYS  48   9.790  -7.891   2.162
  337    H    PHE  49           H        PHE  49   5.434  -8.131   2.937
  338    HA   PHE  49           HA       PHE  49   5.469  -7.875   0.053
  339   1HB   PHE  49          1HB       PHE  49   3.335  -9.532   0.311
  340   2HB   PHE  49          2HB       PHE  49   4.956 -10.181   0.048
  341    HD1  PHE  49           HD1      PHE  49   6.316 -10.682   2.233
  342    HD2  PHE  49           HD2      PHE  49   2.092 -10.296   2.092
  343    HE1  PHE  49           HE1      PHE  49   6.126 -11.985   4.370
  344    HE2  PHE  49           HE2      PHE  49   1.901 -11.599   4.230
  345    HZ   PHE  49           HZ       PHE  49   3.921 -12.428   5.343
  346    H    LYS  50           H        LYS  50   2.741  -7.876  -0.452
  347    HA   LYS  50           HA       LYS  50   1.768  -5.822   1.411
  348   1HB   LYS  50          1HB       LYS  50   0.527  -5.362  -1.030
  349   2HB   LYS  50          2HB       LYS  50   1.829  -4.406  -0.305
  350   1HG   LYS  50          1HG       LYS  50   2.527  -6.905  -1.834
  351   2HG   LYS  50          2HG       LYS  50   2.077  -5.456  -2.750
  352   1HD   LYS  50          1HD       LYS  50   4.336  -5.755  -0.733
  353   2HD   LYS  50          2HD       LYS  50   4.498  -5.471  -2.475
  354   1HE   LYS  50          1HE       LYS  50   3.626  -3.577  -0.287
  355   2HE   LYS  50          2HE       LYS  50   4.827  -3.318  -1.563
  356   1HZ   LYS  50          1HZ       LYS  50   1.949  -3.087  -1.668
  357   2HZ   LYS  50          2HZ       LYS  50   3.094  -2.178  -2.397
  358   3HZ   LYS  50          3HZ       LYS  50   2.690  -3.634  -3.016
  359    HA   PRO  51           HA       PRO  51  -1.137  -9.286   1.335
  360   1HB   PRO  51          1HB       PRO  51  -1.283  -9.689   4.033
  361   2HB   PRO  51          2HB       PRO  51  -0.204 -10.600   2.980
  362   1HG   PRO  51          1HG       PRO  51   0.383  -8.384   4.835
  363   2HG   PRO  51          2HG       PRO  51   1.516  -9.603   4.148
  364   1HD   PRO  51          1HD       PRO  51   1.201  -6.852   3.414
  365   2HD   PRO  51          2HD       PRO  51   2.215  -8.053   2.601
  366    H    LEU  52           H        LEU  52  -1.832  -8.076   4.462
  367    HA   LEU  52           HA       LEU  52  -4.273  -6.941   3.353
  368   1HB   LEU  52          1HB       LEU  52  -5.259  -7.352   5.334
  369   2HB   LEU  52          2HB       LEU  52  -4.038  -8.635   5.333
  370    HG   LEU  52           HG       LEU  52  -2.883  -6.352   6.573
  371   1HD1  LEU  52          1HD1      LEU  52  -4.721  -6.552   8.564
  372   2HD1  LEU  52          2HD1      LEU  52  -4.681  -5.251   7.349
  373   3HD1  LEU  52          3HD1      LEU  52  -5.767  -6.646   7.127
  374   1HD2  LEU  52          1HD2      LEU  52  -3.542  -9.158   7.229
  375   2HD2  LEU  52          2HD2      LEU  52  -2.025  -8.250   7.428
  376   3HD2  LEU  52          3HD2      LEU  52  -3.336  -8.066   8.619
  377    H    GLN  53           H        GLN  53  -1.706  -5.610   2.871
  378    HA   GLN  53           HA       GLN  53  -1.156  -3.625   4.653
  379   1HB   GLN  53          1HB       GLN  53  -1.017  -3.601   1.615
  380   2HB   GLN  53          2HB       GLN  53  -0.244  -2.385   2.648
  381   1HG   GLN  53          1HG       GLN  53   0.306  -5.383   2.632
  382   2HG   GLN  53          2HG       GLN  53   1.383  -4.124   2.007
  383   1HE2  GLN  53          1HE2      GLN  53   0.257  -5.875   4.723
  384   2HE2  GLN  53          2HE2      GLN  53   1.231  -5.140   5.952
  385    H    GLU  54           H        GLU  54  -3.988  -4.079   2.683
  386    HA   GLU  54           HA       GLU  54  -4.838  -1.663   2.007
  387   1HB   GLU  54          1HB       GLU  54  -7.000  -2.531   2.000
  388   2HB   GLU  54          2HB       GLU  54  -6.025  -4.011   1.990
  389   1HG   GLU  54          1HG       GLU  54  -7.366  -4.586   3.745
  390   2HG   GLU  54          2HG       GLU  54  -6.252  -3.582   4.686
  391    H    ALA  55           H        ALA  55  -4.288  -2.825   5.287
  392    HA   ALA  55           HA       ALA  55  -5.877  -1.407   6.884
  393   1HB   ALA  55          1HB       ALA  55  -3.420  -2.706   7.093
  394   2HB   ALA  55          2HB       ALA  55  -3.065  -1.053   7.652
  395   3HB   ALA  55          3HB       ALA  55  -4.351  -2.002   8.437
  396    H    GLU  56           H        GLU  56  -2.664   0.019   5.977
  397    HA   GLU  56           HA       GLU  56  -4.081   2.552   5.687
  398   1HB   GLU  56          1HB       GLU  56  -2.335   1.937   7.745
  399   2HB   GLU  56          2HB       GLU  56  -1.278   2.776   6.597
  400   1HG   GLU  56          1HG       GLU  56  -2.145   4.745   7.257
  401   2HG   GLU  56          2HG       GLU  56  -3.754   4.229   6.727
  402    H    CYS  57           H        CYS  57  -3.180   0.421   3.728
  403    HA   CYS  57           HA       CYS  57  -1.140   1.955   2.303
  404   1HB   CYS  57          1HB       CYS  57  -0.957  -0.586   2.908
  405   2HB   CYS  57          2HB       CYS  57  -1.990  -0.798   1.490
  406    H    THR  58           H        THR  58  -4.261   0.131   1.909
  407    HA   THR  58           HA       THR  58  -4.728   1.427  -0.644
  408    HB   THR  58           HB       THR  58  -5.228  -1.072   0.180
  409    HG1  THR  58           HG1      THR  58  -5.792   0.210  -1.867
  410   1HG2  THR  58          1HG2      THR  58  -7.720  -1.220   0.686
  411   2HG2  THR  58          2HG2      THR  58  -6.762  -0.559   2.033
  412   3HG2  THR  58          3HG2      THR  58  -7.707   0.534   0.992
  413    H    PHE  59           H        PHE  59  -5.884   1.581   2.741
  414    HA   PHE  59           HA       PHE  59  -8.143   2.906   2.666
  415   1HB   PHE  59          1HB       PHE  59  -6.309   2.484   4.537
  416   2HB   PHE  59          2HB       PHE  59  -5.735   4.105   4.129
  417    HD1  PHE  59           HD1      PHE  59  -6.322   5.541   5.831
  418    HD2  PHE  59           HD2      PHE  59  -9.163   2.671   4.529
  419    HE1  PHE  59           HE1      PHE  59  -8.028   6.523   7.390
  420    HE2  PHE  59           HE2      PHE  59 -10.868   3.652   6.088
  421    HZ   PHE  59           HZ       PHE  59 -10.280   5.566   7.499
  422   1H    GLU   1           H1       GLU   1 -21.426  -3.917  -1.084
  423    HA   GLU   1           HA       GLU   1 -18.903  -3.407  -1.762
  424   1HB   GLU   1          1HB       GLU   1 -19.620  -3.731  -4.143
  425   2HB   GLU   1          2HB       GLU   1 -20.295  -4.937  -3.035
  426   1HG   GLU   1          1HG       GLU   1 -22.174  -2.865  -2.997
  427   2HG   GLU   1          2HG       GLU   1 -21.663  -2.919  -4.691
  428    H    GLU   2           H        GLU   2 -19.113  -1.050  -0.632
  429    HA   GLU   2           HA       GLU   2 -19.826   0.918  -2.613
  430   1HB   GLU   2          1HB       GLU   2 -19.332   2.544  -0.774
  431   2HB   GLU   2          2HB       GLU   2 -20.560   1.345  -0.332
  432   1HG   GLU   2          1HG       GLU   2 -19.301   0.649   1.400
  433   2HG   GLU   2          2HG       GLU   2 -17.928   0.321   0.331
  434    H    TYR   3           H        TYR   3 -17.996  -0.029  -4.024
  435    HA   TYR   3           HA       TYR   3 -15.343   0.761  -3.145
  436   1HB   TYR   3          1HB       TYR   3 -14.814  -0.366  -5.387
  437   2HB   TYR   3          2HB       TYR   3 -15.706  -1.418  -4.284
  438    HD1  TYR   3           HD1      TYR   3 -18.129  -1.854  -4.680
  439    HD2  TYR   3           HD2      TYR   3 -15.754   0.361  -7.464
  440    HE1  TYR   3           HE1      TYR   3 -19.898  -2.199  -6.474
  441    HE2  TYR   3           HE2      TYR   3 -17.530   0.009  -9.249
  442    HH   TYR   3           HH       TYR   3 -19.321  -1.736  -9.683
  443    H    VAL   4           H        VAL   4 -15.714   3.102  -3.114
  444    HA   VAL   4           HA       VAL   4 -15.545   4.189  -5.828
  445    HB   VAL   4           HB       VAL   4 -16.818   6.167  -4.437
  446   1HG1  VAL   4          1HG1      VAL   4 -18.089   3.987  -6.128
  447   2HG1  VAL   4          2HG1      VAL   4 -18.796   5.583  -5.784
  448   3HG1  VAL   4          3HG1      VAL   4 -17.295   5.461  -6.732
  449   1HG2  VAL   4          1HG2      VAL   4 -18.606   5.315  -3.151
  450   2HG2  VAL   4          2HG2      VAL   4 -18.315   3.645  -3.693
  451   3HG2  VAL   4          3HG2      VAL   4 -17.168   4.433  -2.582
  452    H    GLY   5           H        GLY   5 -15.290   5.021  -2.295
  453   1HA   GLY   5          1HA       GLY   5 -13.337   7.033  -2.708
  454   2HA   GLY   5          2HA       GLY   5 -13.784   6.279  -1.190
  455    H    LEU   6           H        LEU   6 -13.076   3.761  -3.319
  456    HA   LEU   6           HA       LEU   6 -10.204   3.877  -2.915
  457   1HB   LEU   6          1HB       LEU   6 -10.160   1.652  -1.896
  458   2HB   LEU   6          2HB       LEU   6 -10.901   2.887  -0.863
  459    HG   LEU   6           HG       LEU   6 -12.088   0.786  -0.676
  460   1HD1  LEU   6          1HD1      LEU   6 -13.250   3.194  -0.978
  461   2HD1  LEU   6          2HD1      LEU   6 -14.056   2.305  -2.294
  462   3HD1  LEU   6          3HD1      LEU   6 -14.153   1.702  -0.621
  463   1HD2  LEU   6          1HD2      LEU   6 -13.083  -0.390  -2.468
  464   2HD2  LEU   6          2HD2      LEU   6 -12.781   0.939  -3.613
  465   3HD2  LEU   6          3HD2      LEU   6 -11.420  -0.020  -2.984
  466    H    SER   7           H        SER   7 -12.202   4.046  -5.163
  467    HA   SER   7           HA       SER   7 -11.510   1.567  -6.521
  468   1HB   SER   7          1HB       SER   7 -13.364   1.942  -7.972
  469   2HB   SER   7          2HB       SER   7 -13.952   2.311  -6.342
  470    HG   SER   7           HG       SER   7 -13.818   3.923  -8.566
  471    H    ALA   8           H        ALA   8 -11.332   2.054  -9.102
  472    HA   ALA   8           HA       ALA   8  -9.003   3.610  -9.385
  473   1HB   ALA   8          1HB       ALA   8  -9.489   1.618 -10.740
  474   2HB   ALA   8          2HB       ALA   8 -10.910   2.428 -11.445
  475   3HB   ALA   8          3HB       ALA   8  -9.275   3.043 -11.786
  476    H    ASN   9           H        ASN   9  -9.484   5.740  -8.626
  477    HA   ASN   9           HA       ASN   9 -10.036   7.577 -10.464
  478   1HB   ASN   9          1HB       ASN   9 -12.486   6.259  -9.819
  479   2HB   ASN   9          2HB       ASN   9 -12.575   7.848  -9.043
  480   1HD2  ASN   9          1HD2      ASN   9 -11.934   9.713 -10.407
  481   2HD2  ASN   9          2HD2      ASN   9 -12.418   9.732 -12.070
  482    H    GLN  10           H        GLN  10 -10.291   6.367  -7.160
  483    HA   GLN  10           HA       GLN  10 -10.715   8.722  -5.801
  484   1HB   GLN  10          1HB       GLN  10 -10.587   6.205  -5.030
  485   2HB   GLN  10          2HB       GLN  10  -8.888   6.585  -4.689
  486   1HG   GLN  10          1HG       GLN  10 -10.343   8.751  -3.630
  487   2HG   GLN  10          2HG       GLN  10 -11.310   7.330  -3.210
  488   1HE2  GLN  10          1HE2      GLN  10  -9.137   5.483  -3.131
  489   2HE2  GLN  10          2HE2      GLN  10  -8.192   5.801  -1.715
  490    H    CYS  11           H        CYS  11  -7.757   7.304  -7.226
  491    HA   CYS  11           HA       CYS  11  -5.957   9.018  -5.920
  492   1HB   CYS  11          1HB       CYS  11  -5.209   6.954  -6.866
  493   2HB   CYS  11          2HB       CYS  11  -5.734   7.435  -8.484
  494    H    ALA  12           H        ALA  12  -8.449   9.611  -8.139
  495    HA   ALA  12           HA       ALA  12  -7.024  11.866  -9.358
  496   1HB   ALA  12          1HB       ALA  12  -9.692  11.363 -10.389
  497   2HB   ALA  12          2HB       ALA  12  -8.129  11.328 -11.239
  498   3HB   ALA  12          3HB       ALA  12  -8.723   9.870 -10.409
  499    H    VAL  13           H        VAL  13  -8.491  11.316  -6.555
  500    HA   VAL  13           HA       VAL  13 -10.731  12.755  -6.259
  501    HB   VAL  13           HB       VAL  13  -8.611  11.825  -4.641
  502   1HG1  VAL  13          1HG1      VAL  13  -7.712  14.009  -4.330
  503   2HG1  VAL  13          2HG1      VAL  13  -9.328  14.720  -4.101
  504   3HG1  VAL  13          3HG1      VAL  13  -8.649  13.635  -2.863
  505   1HG2  VAL  13          1HG2      VAL  13 -11.274  11.683  -4.598
  506   2HG2  VAL  13          2HG2      VAL  13 -10.290  11.415  -3.140
  507   3HG2  VAL  13          3HG2      VAL  13 -11.073  12.991  -3.408
  508    HA   PRO  14           HA       PRO  14  -9.916  16.893  -7.193
  509   1HB   PRO  14          1HB       PRO  14 -11.517  18.256  -5.448
  510   2HB   PRO  14          2HB       PRO  14 -12.121  17.496  -6.919
  511   1HG   PRO  14          1HG       PRO  14 -12.324  16.618  -4.109
  512   2HG   PRO  14          2HG       PRO  14 -13.329  16.120  -5.517
  513   1HD   PRO  14          1HD       PRO  14 -11.248  14.654  -4.206
  514   2HD   PRO  14          2HD       PRO  14 -12.097  14.185  -5.685
  515    H    ALA  15           H        ALA  15  -8.079  15.590  -5.318
  516    HA   ALA  15           HA       ALA  15  -6.446  16.132  -3.919
  517   1HB   ALA  15          1HB       ALA  15  -5.738  17.441  -5.859
  518   2HB   ALA  15          2HB       ALA  15  -6.753  18.808  -5.340
  519   3HB   ALA  15          3HB       ALA  15  -5.344  18.325  -4.365
  520    H    LYS  16           H        LYS  16  -8.202  15.818  -2.209
  521    HA   LYS  16           HA       LYS  16  -7.899  17.463  -0.129
  522   1HB   LYS  16          1HB       LYS  16 -10.173  18.750  -0.237
  523   2HB   LYS  16          2HB       LYS  16  -8.719  19.429  -0.987
  524   1HG   LYS  16          1HG       LYS  16  -9.664  19.353  -3.034
  525   2HG   LYS  16          2HG       LYS  16 -10.117  17.651  -2.839
  526   1HD   LYS  16          1HD       LYS  16 -11.655  20.016  -1.689
  527   2HD   LYS  16          2HD       LYS  16 -12.088  19.180  -3.190
  528   1HE   LYS  16          1HE       LYS  16 -12.077  17.027  -1.681
  529   2HE   LYS  16          2HE       LYS  16 -12.200  18.166  -0.332
  530   1HZ   LYS  16          1HZ       LYS  16 -14.357  17.581  -0.999
  531   2HZ   LYS  16          2HZ       LYS  16 -14.132  19.107  -1.536
  532   3HZ   LYS  16          3HZ       LYS  16 -14.057  17.854  -2.581
  533    H    ASP  17           H        ASP  17  -8.250  14.732  -0.731
  534    HA   ASP  17           HA       ASP  17 -10.331  14.177   1.127
  535   1HB   ASP  17          1HB       ASP  17 -11.432  14.247  -1.190
  536   2HB   ASP  17          2HB       ASP  17 -10.453  12.834  -1.608
  537    H    ARG  18           H        ARG  18  -7.282  13.888   0.189
  538    HA   ARG  18           HA       ARG  18  -7.057  11.026   0.249
  539   1HB   ARG  18          1HB       ARG  18  -4.851  13.133   0.165
  540   2HB   ARG  18          2HB       ARG  18  -4.673  11.414  -0.224
  541   1HG   ARG  18          1HG       ARG  18  -5.562  11.671  -2.309
  542   2HG   ARG  18          2HG       ARG  18  -6.785  12.832  -1.768
  543   1HD   ARG  18          1HD       ARG  18  -5.177  14.642  -1.798
  544   2HD   ARG  18          2HD       ARG  18  -3.826  13.527  -2.050
  545    HE   ARG  18           HE       ARG  18  -5.899  13.403  -4.126
  546   1HH1  ARG  18          1HH1      ARG  18  -2.915  14.961  -3.099
  547   2HH1  ARG  18          2HH1      ARG  18  -2.474  15.458  -4.699
  548   1HH2  ARG  18          1HH2      ARG  18  -5.317  14.059  -6.236
  549   2HH2  ARG  18          2HH2      ARG  18  -3.850  14.942  -6.495
  550    H    VAL  19           H        VAL  19  -4.873  10.369   1.678
  551    HA   VAL  19           HA       VAL  19  -5.450  11.419   4.359
  552    HB   VAL  19           HB       VAL  19  -4.179   8.766   3.726
  553   1HG1  VAL  19          1HG1      VAL  19  -4.295   8.377   5.934
  554   2HG1  VAL  19          2HG1      VAL  19  -4.561  10.129   6.099
  555   3HG1  VAL  19          3HG1      VAL  19  -5.951   9.019   6.052
  556   1HG2  VAL  19          1HG2      VAL  19  -6.389   7.714   3.871
  557   2HG2  VAL  19          2HG2      VAL  19  -7.155   9.315   4.001
  558   3HG2  VAL  19          3HG2      VAL  19  -6.313   8.850   2.504
  559    H    ASP  20           H        ASP  20  -3.595  12.447   2.139
  560    HA   ASP  20           HA       ASP  20  -1.458  12.911   1.807
  561   1HB   ASP  20          1HB       ASP  20  -1.816  14.779   3.117
  562   2HB   ASP  20          2HB       ASP  20  -2.255  13.835   4.547
  563    H    CYS  21           H        CYS  21  -0.442  10.797   1.529
  564    HA   CYS  21           HA       CYS  21   0.172   9.008   3.471
  565   1HB   CYS  21          1HB       CYS  21   0.458   8.846   0.952
  566   2HB   CYS  21          2HB       CYS  21   2.033   9.613   1.176
  567    H    GLY  22           H        GLY  22   1.821  12.058   2.543
  568   1HA   GLY  22          1HA       GLY  22   3.430  13.264   3.543
  569   2HA   GLY  22          2HA       GLY  22   2.972  12.482   5.043
  570    H    TYR  23           H        TYR  23   4.501  11.309   1.953
  571    HA   TYR  23           HA       TYR  23   6.362   9.747   3.533
  572   1HB   TYR  23          1HB       TYR  23   4.980   9.527   1.099
  573   2HB   TYR  23          2HB       TYR  23   6.588  10.012   0.551
  574    HD1  TYR  23           HD1      TYR  23   7.335   8.029  -0.497
  575    HD2  TYR  23           HD2      TYR  23   5.770   7.855   3.481
  576    HE1  TYR  23           HE1      TYR  23   8.111   5.616  -0.289
  577    HE2  TYR  23           HE2      TYR  23   6.552   5.444   3.676
  578    HH   TYR  23           HH       TYR  23   8.580   4.101   2.400
  579    HA   PRO  24           HA       PRO  24   9.556  12.654   3.126
  580   1HB   PRO  24          1HB       PRO  24  11.658  11.099   3.914
  581   2HB   PRO  24          2HB       PRO  24  10.573  11.900   5.050
  582   1HG   PRO  24          1HG       PRO  24  10.705   9.069   4.230
  583   2HG   PRO  24          2HG       PRO  24   9.948   9.778   5.701
  584   1HD   PRO  24          1HD       PRO  24   8.666   8.796   3.337
  585   2HD   PRO  24          2HD       PRO  24   7.890   9.629   4.689
  586    H    HIS  25           H        HIS  25   9.198   9.944   1.213
  587    HA   HIS  25           HA       HIS  25  11.269  11.013  -0.562
  588   1HB   HIS  25          1HB       HIS  25  11.370   8.572   0.651
  589   2HB   HIS  25          2HB       HIS  25  10.578   8.161  -0.874
  590    HD1  HIS  25           HD1      HIS  25  13.007   6.816  -1.083
  591    HD2  HIS  25           HD2      HIS  25  13.034  10.988  -1.524
  592    HE1  HIS  25           HE1      HIS  25  15.195   7.396  -2.261
  593    HE2  HIS  25           HE2      HIS  25  15.129   9.967  -2.554
  594    H    VAL  26           H        VAL  26   8.428  11.779  -0.319
  595    HA   VAL  26           HA       VAL  26   6.751  10.514  -2.069
  596    HB   VAL  26           HB       VAL  26   5.826  12.175  -0.766
  597   1HG1  VAL  26          1HG1      VAL  26   7.203  13.704   0.109
  598   2HG1  VAL  26          2HG1      VAL  26   8.347  13.554  -1.246
  599   3HG1  VAL  26          3HG1      VAL  26   6.954  14.656  -1.374
  600   1HG2  VAL  26          1HG2      VAL  26   6.034  13.907  -3.195
  601   2HG2  VAL  26          2HG2      VAL  26   5.344  12.277  -3.382
  602   3HG2  VAL  26          3HG2      VAL  26   4.606  13.430  -2.245
  603    H    THR  27           H        THR  27   6.878  10.027  -4.194
  604    HA   THR  27           HA       THR  27   7.729  11.916  -6.113
  605    HB   THR  27           HB       THR  27   9.818  10.427  -4.809
  606    HG1  THR  27           HG1      THR  27  10.897  11.972  -6.056
  607   1HG2  THR  27          1HG2      THR  27   9.722   8.547  -6.266
  608   2HG2  THR  27          2HG2      THR  27   9.115   9.521  -7.627
  609   3HG2  THR  27          3HG2      THR  27  10.820   9.649  -7.130
  610    HA   PRO  28           HA       PRO  28   5.426   9.213  -8.517
  611   1HB   PRO  28          1HB       PRO  28   6.181   9.938 -11.041
  612   2HB   PRO  28          2HB       PRO  28   5.011  10.846 -10.087
  613   1HG   PRO  28          1HG       PRO  28   7.845  11.429 -10.667
  614   2HG   PRO  28          2HG       PRO  28   6.553  12.561 -10.124
  615   1HD   PRO  28          1HD       PRO  28   8.702  11.445  -8.595
  616   2HD   PRO  28          2HD       PRO  28   7.366  12.425  -7.977
  617    H    LYS  29           H        LYS  29   7.347   7.794  -7.326
  618    HA   LYS  29           HA       LYS  29   7.647   5.676  -9.113
  619   1HB   LYS  29          1HB       LYS  29   9.266   7.168 -10.206
  620   2HB   LYS  29          2HB       LYS  29  10.200   7.261  -8.703
  621   1HG   LYS  29          1HG       LYS  29  11.183   5.272  -9.113
  622   2HG   LYS  29          2HG       LYS  29   9.628   4.482  -9.429
  623   1HD   LYS  29          1HD       LYS  29   9.689   5.027 -11.726
  624   2HD   LYS  29          2HD       LYS  29  10.890   6.311 -11.497
  625   1HE   LYS  29          1HE       LYS  29  12.660   4.765 -11.242
  626   2HE   LYS  29          2HE       LYS  29  11.572   3.424 -10.852
  627   1HZ   LYS  29          1HZ       LYS  29  11.801   4.741 -13.469
  628   2HZ   LYS  29          2HZ       LYS  29  12.416   3.278 -13.086
  629   3HZ   LYS  29          3HZ       LYS  29  10.799   3.499 -13.122
  630    H    GLU  30           H        GLU  30   8.277   7.440  -6.157
  631    HA   GLU  30           HA       GLU  30   9.228   5.009  -4.896
  632   1HB   GLU  30          1HB       GLU  30   9.568   7.881  -4.444
  633   2HB   GLU  30          2HB       GLU  30   9.141   7.028  -2.950
  634   1HG   GLU  30          1HG       GLU  30  11.487   6.879  -2.999
  635   2HG   GLU  30          2HG       GLU  30  10.993   5.320  -3.675
  636    H    CYS  31           H        CYS  31   6.623   7.506  -4.695
  637    HA   CYS  31           HA       CYS  31   5.315   6.375  -2.511
  638   1HB   CYS  31          1HB       CYS  31   4.526   8.254  -4.702
  639   2HB   CYS  31          2HB       CYS  31   3.293   7.621  -3.608
  640    H    ASN  32           H        ASN  32   4.677   6.164  -6.092
  641    HA   ASN  32           HA       ASN  32   2.640   4.314  -5.854
  642   1HB   ASN  32          1HB       ASN  32   4.447   5.316  -8.020
  643   2HB   ASN  32          2HB       ASN  32   3.664   3.762  -8.343
  644   1HD2  ASN  32          1HD2      ASN  32   2.716   6.760  -6.663
  645   2HD2  ASN  32          2HD2      ASN  32   1.253   7.050  -7.540
  646    H    ASN  33           H        ASN  33   5.907   4.020  -5.056
  647    HA   ASN  33           HA       ASN  33   6.037   1.239  -5.880
  648   1HB   ASN  33          1HB       ASN  33   8.013   2.484  -6.505
  649   2HB   ASN  33          2HB       ASN  33   8.143   3.229  -4.906
  650   1HD2  ASN  33          1HD2      ASN  33   9.909   2.507  -3.994
  651   2HD2  ASN  33          2HD2      ASN  33  10.430   0.860  -3.876
  652    H    ARG  34           H        ARG  34   5.849   3.503  -3.145
  653    HA   ARG  34           HA       ARG  34   6.487   1.466  -1.242
  654   1HB   ARG  34          1HB       ARG  34   6.427   3.191   0.384
  655   2HB   ARG  34          2HB       ARG  34   7.020   4.019  -1.066
  656   1HG   ARG  34          1HG       ARG  34   5.362   5.484  -0.331
  657   2HG   ARG  34          2HG       ARG  34   4.448   4.500  -1.486
  658   1HD   ARG  34          1HD       ARG  34   3.000   4.100   0.209
  659   2HD   ARG  34          2HD       ARG  34   4.250   3.071   0.925
  660    HE   ARG  34           HE       ARG  34   4.539   5.929   1.534
  661   1HH1  ARG  34          1HH1      ARG  34   3.091   2.883   2.539
  662   2HH1  ARG  34          2HH1      ARG  34   2.902   3.370   4.191
  663   1HH2  ARG  34          1HH2      ARG  34   4.289   6.573   3.713
  664   2HH2  ARG  34          2HH2      ARG  34   3.588   5.483   4.863
  665    H    GLY  35           H        GLY  35   3.656   3.081  -2.677
  666   1HA   GLY  35          1HA       GLY  35   1.673   1.554  -2.610
  667   2HA   GLY  35          2HA       GLY  35   1.884   1.550  -0.870
  668    H    CYS  36           H        CYS  36   2.642   4.482  -2.717
  669    HA   CYS  36           HA       CYS  36   0.136   5.639  -1.732
  670   1HB   CYS  36          1HB       CYS  36   2.888   6.874  -1.805
  671   2HB   CYS  36          2HB       CYS  36   1.405   7.790  -1.518
  672    H    CYS  37           H        CYS  37  -0.350   7.767  -3.066
  673    HA   CYS  37           HA       CYS  37   0.318   7.188  -5.859
  674   1HB   CYS  37          1HB       CYS  37  -2.109   6.945  -4.972
  675   2HB   CYS  37          2HB       CYS  37  -2.134   8.710  -5.033
  676    H    PHE  38           H        PHE  38   1.367   8.832  -6.971
  677    HA   PHE  38           HA       PHE  38   1.868  11.269  -5.466
  678   1HB   PHE  38          1HB       PHE  38   3.643   9.767  -6.599
  679   2HB   PHE  38          2HB       PHE  38   2.955  10.245  -8.154
  680    HD1  PHE  38           HD1      PHE  38   4.667  11.525  -5.129
  681    HD2  PHE  38           HD2      PHE  38   3.576  12.286  -9.160
  682    HE1  PHE  38           HE1      PHE  38   6.165  13.539  -5.155
  683    HE2  PHE  38           HE2      PHE  38   5.073  14.300  -9.184
  684    HZ   PHE  38           HZ       PHE  38   6.351  14.903  -7.182
  685    H    ASP  39           H        ASP  39   0.698  13.084  -5.850
  686    HA   ASP  39           HA       ASP  39  -1.041  13.132  -8.090
  687   1HB   ASP  39          1HB       ASP  39  -2.062  14.246  -6.367
  688   2HB   ASP  39          2HB       ASP  39  -0.528  14.763  -5.648
  689    H    SER  40           H        SER  40   0.983  15.883  -6.883
  690    HA   SER  40           HA       SER  40   2.637  16.993  -7.842
  691   1HB   SER  40          1HB       SER  40   3.012  14.780  -9.229
  692   2HB   SER  40          2HB       SER  40   2.261  15.697 -10.546
  693    HG   SER  40           HG       SER  40   4.600  15.883 -10.519
  694    H    ARG  41           H        ARG  41  -0.514  16.409  -9.281
  695    HA   ARG  41           HA       ARG  41  -0.514  18.501 -11.100
  696   1HB   ARG  41          1HB       ARG  41  -2.967  17.532  -9.585
  697   2HB   ARG  41          2HB       ARG  41  -2.888  18.122 -11.254
  698   1HG   ARG  41          1HG       ARG  41  -1.143  16.016 -11.368
  699   2HG   ARG  41          2HG       ARG  41  -2.274  15.424 -10.138
  700   1HD   ARG  41          1HD       ARG  41  -3.478  14.727 -11.952
  701   2HD   ARG  41          2HD       ARG  41  -4.024  16.409 -12.016
  702    HE   ARG  41           HE       ARG  41  -1.514  15.992 -13.437
  703   1HH1  ARG  41          1HH1      ARG  41  -5.011  15.712 -13.710
  704   2HH1  ARG  41          2HH1      ARG  41  -5.014  15.830 -15.438
  705   1HH2  ARG  41          1HH2      ARG  41  -1.517  16.148 -15.717
  706   2HH2  ARG  41          2HH2      ARG  41  -3.013  16.080 -16.588
  707    H    ILE  42           H        ILE  42  -1.456  18.245  -7.623
  708    HA   ILE  42           HA       ILE  42  -1.618  21.179  -7.577
  709    HB   ILE  42           HB       ILE  42  -3.137  19.458  -5.659
  710   1HG1  ILE  42          1HG1      ILE  42  -3.900  20.077  -8.508
  711   2HG1  ILE  42          2HG1      ILE  42  -3.902  18.509  -7.679
  712   1HG2  ILE  42          1HG2      ILE  42  -2.745  22.074  -5.625
  713   2HG2  ILE  42          2HG2      ILE  42  -4.094  22.054  -6.785
  714   3HG2  ILE  42          3HG2      ILE  42  -4.306  21.356  -5.161
  715   1HD1  ILE  42          1HD1      ILE  42  -5.999  20.528  -7.835
  716   2HD1  ILE  42          2HD1      ILE  42  -6.090  18.862  -7.214
  717   3HD1  ILE  42          3HD1      ILE  42  -5.587  20.188  -6.137
  718    HA   PRO  43           HA       PRO  43   1.749  20.347  -4.873
  719   1HB   PRO  43          1HB       PRO  43   2.821  22.857  -4.950
  720   2HB   PRO  43          2HB       PRO  43   3.237  21.596  -6.108
  721   1HG   PRO  43          1HG       PRO  43   1.475  23.943  -6.411
  722   2HG   PRO  43          2HG       PRO  43   2.265  22.958  -7.696
  723   1HD   PRO  43          1HD       PRO  43  -0.479  22.944  -6.875
  724   2HD   PRO  43          2HD       PRO  43   0.283  21.843  -8.031
  725    H    GLY  44           H        GLY  44  -1.023  22.047  -4.476
  726   1HA   GLY  44          1HA       GLY  44  -0.293  23.160  -1.881
  727   2HA   GLY  44          2HA       GLY  44  -1.811  23.343  -2.735
  728    H    VAL  45           H        VAL  45  -1.237  20.129  -3.141
  729    HA   VAL  45           HA       VAL  45  -2.469  19.434  -0.565
  730    HB   VAL  45           HB       VAL  45  -4.027  18.109  -1.594
  731   1HG1  VAL  45          1HG1      VAL  45  -3.832  20.710  -2.497
  732   2HG1  VAL  45          2HG1      VAL  45  -4.009  19.785  -4.008
  733   3HG1  VAL  45          3HG1      VAL  45  -5.231  19.634  -2.722
  734   1HG2  VAL  45          1HG2      VAL  45  -2.363  16.815  -2.928
  735   2HG2  VAL  45          2HG2      VAL  45  -3.878  17.139  -3.804
  736   3HG2  VAL  45          3HG2      VAL  45  -2.418  18.090  -4.169
  737    HA   PRO  46           HA       PRO  46   0.354  16.141  -0.343
  738   1HB   PRO  46          1HB       PRO  46  -1.047  13.819  -0.017
  739   2HB   PRO  46          2HB       PRO  46  -0.785  14.978   1.284
  740   1HG   PRO  46          1HG       PRO  46  -3.192  14.464  -0.344
  741   2HG   PRO  46          2HG       PRO  46  -3.072  15.276   1.259
  742   1HD   PRO  46          1HD       PRO  46  -3.476  16.467  -1.315
  743   2HD   PRO  46          2HD       PRO  46  -3.206  17.319   0.211
  744    H    TRP  47           H        TRP  47   1.825  15.536  -1.790
  745    HA   TRP  47           HA       TRP  47   0.745  14.547  -4.305
  746   1HB   TRP  47          1HB       TRP  47   3.644  14.806  -4.059
  747   2HB   TRP  47          2HB       TRP  47   2.539  15.434  -5.284
  748    HD1  TRP  47           HD1      TRP  47   1.241  17.842  -4.519
  749    HE1  TRP  47           HE1      TRP  47   2.103  19.917  -3.134
  750    HE3  TRP  47           HE3      TRP  47   5.115  15.414  -2.292
  751    HZ2  TRP  47           HZ2      TRP  47   4.259  20.302  -1.305
  752    HZ3  TRP  47           HZ3      TRP  47   6.550  16.713  -0.720
  753    HH2  TRP  47           HH2      TRP  47   6.173  19.075  -0.214
  754    H    CYS  48           H        CYS  48   0.646  12.993  -1.723
  755    HA   CYS  48           HA       CYS  48   1.570  10.551  -2.782
  756   1HB   CYS  48          1HB       CYS  48   3.722  11.492  -1.987
  757   2HB   CYS  48          2HB       CYS  48   3.070  11.531  -0.346
  758    H    PHE  49           H        PHE  49  -0.453   9.663  -2.336
  759    HA   PHE  49           HA       PHE  49  -1.174   9.558   0.493
  760   1HB   PHE  49          1HB       PHE  49  -3.613   9.671  -0.765
  761   2HB   PHE  49          2HB       PHE  49  -2.802  11.120  -0.158
  762    HD1  PHE  49           HD1      PHE  49  -1.032  12.114  -1.929
  763    HD2  PHE  49           HD2      PHE  49  -4.420   9.752  -2.903
  764    HE1  PHE  49           HE1      PHE  49  -1.027  13.065  -4.251
  765    HE2  PHE  49           HE2      PHE  49  -4.417  10.704  -5.225
  766    HZ   PHE  49           HZ       PHE  49  -2.720  12.348  -5.872
  767    H    LYS  50           H        LYS  50  -3.531   8.075   0.262
  768    HA   LYS  50           HA       LYS  50  -2.637   5.702  -1.220
  769   1HB   LYS  50          1HB       LYS  50  -3.713   4.397   0.672
  770   2HB   LYS  50          2HB       LYS  50  -2.160   5.177   1.022
  771   1HG   LYS  50          1HG       LYS  50  -4.193   7.087   1.602
  772   2HG   LYS  50          2HG       LYS  50  -4.734   5.557   2.312
  773   1HD   LYS  50          1HD       LYS  50  -3.307   7.009   3.825
  774   2HD   LYS  50          2HD       LYS  50  -2.699   5.358   3.609
  775   1HE   LYS  50          1HE       LYS  50  -1.611   7.010   1.519
  776   2HE   LYS  50          2HE       LYS  50  -1.365   7.851   3.058
  777   1HZ   LYS  50          1HZ       LYS  50   0.208   6.409   3.530
  778   2HZ   LYS  50          2HZ       LYS  50  -0.797   5.134   3.350
  779   3HZ   LYS  50          3HZ       LYS  50   0.035   5.705   2.067
  780    HA   PRO  51           HA       PRO  51  -6.809   6.948  -2.486
  781   1HB   PRO  51          1HB       PRO  51  -6.330   7.182  -5.166
  782   2HB   PRO  51          2HB       PRO  51  -6.295   8.551  -4.057
  783   1HG   PRO  51          1HG       PRO  51  -4.074   7.054  -5.295
  784   2HG   PRO  51          2HG       PRO  51  -4.053   8.705  -4.576
  785   1HD   PRO  51          1HD       PRO  51  -3.029   6.270  -3.471
  786   2HD   PRO  51          2HD       PRO  51  -3.129   7.837  -2.659
  787    H    LEU  52           H        LEU  52  -5.803   5.559  -5.440
  788    HA   LEU  52           HA       LEU  52  -7.385   3.213  -4.741
  789   1HB   LEU  52          1HB       LEU  52  -7.983   3.091  -6.875
  790   2HB   LEU  52          2HB       LEU  52  -7.529   4.805  -6.882
  791    HG   LEU  52           HG       LEU  52  -6.090   2.432  -8.040
  792   1HD1  LEU  52          1HD1      LEU  52  -5.887   4.570  -9.770
  793   2HD1  LEU  52          2HD1      LEU  52  -7.097   3.266  -9.848
  794   3HD1  LEU  52          3HD1      LEU  52  -7.491   4.799  -9.033
  795   1HD2  LEU  52          1HD2      LEU  52  -4.803   4.557  -6.626
  796   2HD2  LEU  52          2HD2      LEU  52  -4.078   3.203  -7.526
  797   3HD2  LEU  52          3HD2      LEU  52  -4.453   4.728  -8.362
  798    H    GLN  53           H        GLN  53  -4.804   3.537  -3.483
  799    HA   GLN  53           HA       GLN  53  -2.751   2.326  -4.803
  800   1HB   GLN  53          1HB       GLN  53  -3.494   2.220  -1.857
  801   2HB   GLN  53          2HB       GLN  53  -1.914   1.728  -2.495
  802   1HG   GLN  53          1HG       GLN  53  -3.189   4.493  -2.666
  803   2HG   GLN  53          2HG       GLN  53  -1.794   4.040  -1.673
  804   1HE2  GLN  53          1HE2      GLN  53  -2.996   4.855  -4.804
  805   2HE2  GLN  53          2HE2      GLN  53  -1.489   4.941  -5.654
  806    H    GLU  54           H        GLU  54  -5.772   0.974  -3.754
  807    HA   GLU  54           HA       GLU  54  -5.216  -1.545  -3.049
  808   1HB   GLU  54          1HB       GLU  54  -7.391  -2.172  -4.041
  809   2HB   GLU  54          2HB       GLU  54  -7.495  -0.620  -3.193
  810   1HG   GLU  54          1HG       GLU  54  -8.061   0.467  -5.091
  811   2HG   GLU  54          2HG       GLU  54  -6.734  -0.264  -6.004
  812    H    ALA  55           H        ALA  55  -4.459  -0.027  -6.086
  813    HA   ALA  55           HA       ALA  55  -4.590  -1.818  -8.019
  814   1HB   ALA  55          1HB       ALA  55  -3.430   0.373  -8.128
  815   2HB   ALA  55          2HB       ALA  55  -2.055  -0.322  -7.237
  816   3HB   ALA  55          3HB       ALA  55  -2.461  -0.928  -8.861
  817    H    GLU  56           H        GLU  56  -1.793  -1.839  -5.688
  818    HA   GLU  56           HA       GLU  56  -1.940  -4.720  -5.729
  819   1HB   GLU  56          1HB       GLU  56   0.230  -3.098  -6.953
  820   2HB   GLU  56          2HB       GLU  56   0.775  -4.440  -5.932
  821   1HG   GLU  56          1HG       GLU  56  -0.294  -6.054  -7.286
  822   2HG   GLU  56          2HG       GLU  56  -1.377  -4.867  -8.028
  823    H    CYS  57           H        CYS  57  -2.282  -2.208  -3.902
  824    HA   CYS  57           HA       CYS  57  -0.230  -2.779  -1.932
  825   1HB   CYS  57          1HB       CYS  57  -1.482  -0.452  -2.732
  826   2HB   CYS  57          2HB       CYS  57  -2.269  -0.822  -1.196
  827    H    THR  58           H        THR  58  -3.853  -2.528  -2.217
  828    HA   THR  58           HA       THR  58  -4.346  -3.732   0.289
  829    HB   THR  58           HB       THR  58  -5.818  -2.213  -1.307
  830    HG1  THR  58           HG1      THR  58  -6.584  -4.625   0.167
  831   1HG2  THR  58          1HG2      THR  58  -5.909  -3.762  -3.253
  832   2HG2  THR  58          2HG2      THR  58  -6.533  -5.056  -2.200
  833   3HG2  THR  58          3HG2      THR  58  -7.522  -3.610  -2.516
  834    H    PHE  59           H        PHE  59  -3.946  -5.025  -3.027
  835    HA   PHE  59           HA       PHE  59  -4.952  -7.439  -2.992
  836   1HB   PHE  59          1HB       PHE  59  -2.832  -6.097  -4.232
  837   2HB   PHE  59          2HB       PHE  59  -1.993  -7.456  -3.476
  838    HD1  PHE  59           HD1      PHE  59  -2.998  -9.808  -3.958
  839    HD2  PHE  59           HD2      PHE  59  -3.822  -6.366  -6.300
  840    HE1  PHE  59           HE1      PHE  59  -3.683 -11.276  -5.875
  841    HE2  PHE  59           HE2      PHE  59  -4.508  -7.835  -8.216
  842    HZ   PHE  59           HZ       PHE  59  -4.431 -10.272  -7.981
  Start of MODEL    3
    1   1H    GLU   1           H1       GLU   1 -18.601  -7.213   2.176
    2    HA   GLU   1           HA       GLU   1 -15.857  -7.148   3.152
    3   1HB   GLU   1          1HB       GLU   1 -18.317  -8.648   3.946
    4   2HB   GLU   1          2HB       GLU   1 -16.776  -9.508   4.104
    5   1HG   GLU   1          1HG       GLU   1 -15.913  -7.465   5.371
    6   2HG   GLU   1          2HG       GLU   1 -17.576  -6.859   5.386
    7    H    GLU   2           H        GLU   2 -16.631  -7.298   0.294
    8    HA   GLU   2           HA       GLU   2 -16.406 -10.007  -0.477
    9   1HB   GLU   2          1HB       GLU   2 -16.606  -7.353  -1.810
   10   2HB   GLU   2          2HB       GLU   2 -15.814  -8.626  -2.756
   11   1HG   GLU   2          1HG       GLU   2 -17.759 -10.067  -2.538
   12   2HG   GLU   2          2HG       GLU   2 -18.526  -8.956  -1.394
   13    H    TYR   3           H        TYR   3 -14.186  -7.762   0.770
   14    HA   TYR   3           HA       TYR   3 -11.944  -8.714  -0.814
   15   1HB   TYR   3          1HB       TYR   3 -10.799  -7.053   0.826
   16   2HB   TYR   3          2HB       TYR   3 -12.032  -6.334  -0.216
   17    HD1  TYR   3           HD1      TYR   3 -11.155  -7.311   3.215
   18    HD2  TYR   3           HD2      TYR   3 -14.177  -5.602   0.718
   19    HE1  TYR   3           HE1      TYR   3 -12.372  -6.441   5.271
   20    HE2  TYR   3           HE2      TYR   3 -15.384  -4.737   2.781
   21    HH   TYR   3           HH       TYR   3 -13.965  -5.135   5.998
   22    H    VAL   4           H        VAL   4 -11.352 -10.793  -0.287
   23    HA   VAL   4           HA       VAL   4 -11.091 -11.370   2.580
   24    HB   VAL   4           HB       VAL   4 -10.843 -13.735   1.109
   25   1HG1  VAL   4          1HG1      VAL   4 -12.795 -14.411   2.287
   26   2HG1  VAL   4          2HG1      VAL   4 -11.947 -13.261   3.348
   27   3HG1  VAL   4          3HG1      VAL   4 -13.379 -12.736   2.430
   28   1HG2  VAL   4          1HG2      VAL   4 -12.989 -13.754  -0.192
   29   2HG2  VAL   4          2HG2      VAL   4 -13.060 -11.985  -0.001
   30   3HG2  VAL   4          3HG2      VAL   4 -11.713 -12.731  -0.895
   31    H    GLY   5           H        GLY   5  -9.529 -11.826  -0.662
   32   1HA   GLY   5          1HA       GLY   5  -7.056 -12.713   0.451
   33   2HA   GLY   5          2HA       GLY   5  -7.378 -12.248  -1.207
   34    H    LEU   6           H        LEU   6  -8.451  -9.837   1.016
   35    HA   LEU   6           HA       LEU   6  -5.877  -8.466   0.966
   36   1HB   LEU   6          1HB       LEU   6  -8.226  -6.823   0.278
   37   2HB   LEU   6          2HB       LEU   6  -6.538  -6.684  -0.240
   38    HG   LEU   6           HG       LEU   6  -6.919  -8.598  -1.789
   39   1HD1  LEU   6          1HD1      LEU   6  -8.659  -9.922  -1.324
   40   2HD1  LEU   6          2HD1      LEU   6  -9.496  -8.655  -0.394
   41   3HD1  LEU   6          3HD1      LEU   6  -9.641  -8.700  -2.167
   42   1HD2  LEU   6          1HD2      LEU   6  -8.885  -7.039  -3.017
   43   2HD2  LEU   6          2HD2      LEU   6  -7.965  -5.904  -2.000
   44   3HD2  LEU   6          3HD2      LEU   6  -7.121  -6.902  -3.208
   45    H    SER   7           H        SER   7  -7.943  -9.886   2.862
   46    HA   SER   7           HA       SER   7  -8.343  -7.597   4.614
   47   1HB   SER   7          1HB       SER   7 -10.021  -8.948   5.762
   48   2HB   SER   7          2HB       SER   7 -10.369  -8.931   4.023
   49    HG   SER   7           HG       SER   7  -9.408 -11.048   5.689
   50    H    ALA   8           H        ALA   8  -8.303  -8.452   7.108
   51    HA   ALA   8           HA       ALA   8  -5.629  -9.101   7.616
   52   1HB   ALA   8          1HB       ALA   8  -7.905  -9.470   9.578
   53   2HB   ALA   8          2HB       ALA   8  -6.243  -8.911   9.885
   54   3HB   ALA   8          3HB       ALA   8  -7.399  -7.848   9.045
   55    H    ASN   9           H        ASN   9  -5.219 -11.029   6.338
   56    HA   ASN   9           HA       ASN   9  -5.278 -13.322   7.803
   57   1HB   ASN   9          1HB       ASN   9  -7.661 -13.538   7.513
   58   2HB   ASN   9          2HB       ASN   9  -7.573 -13.108   5.797
   59   1HD2  ASN   9          1HD2      ASN   9  -5.795 -15.352   7.920
   60   2HD2  ASN   9          2HD2      ASN   9  -6.042 -16.786   6.980
   61    H    GLN  10           H        GLN  10  -5.453 -11.695   4.620
   62    HA   GLN  10           HA       GLN  10  -4.336 -13.698   3.082
   63   1HB   GLN  10          1HB       GLN  10  -5.466 -11.483   2.390
   64   2HB   GLN  10          2HB       GLN  10  -3.873 -10.735   2.598
   65   1HG   GLN  10          1HG       GLN  10  -3.472 -13.117   1.088
   66   2HG   GLN  10          2HG       GLN  10  -4.884 -12.318   0.380
   67   1HE2  GLN  10          1HE2      GLN  10  -4.192  -9.664   1.052
   68   2HE2  GLN  10          2HE2      GLN  10  -2.849  -9.162   0.079
   69    H    CYS  11           H        CYS  11  -2.898 -11.289   5.278
   70    HA   CYS  11           HA       CYS  11  -0.273 -11.498   4.335
   71   1HB   CYS  11          1HB       CYS  11  -0.959  -9.647   5.687
   72   2HB   CYS  11          2HB       CYS  11  -1.376 -10.709   7.036
   73    H    ALA  12           H        ALA  12  -2.338 -13.811   5.681
   74    HA   ALA  12           HA       ALA  12  -0.177 -15.215   7.065
   75   1HB   ALA  12          1HB       ALA  12  -2.734 -14.745   7.844
   76   2HB   ALA  12          2HB       ALA  12  -2.953 -16.297   7.000
   77   3HB   ALA  12          3HB       ALA  12  -1.803 -16.175   8.354
   78    H    VAL  13           H        VAL  13  -0.576 -14.795   4.032
   79    HA   VAL  13           HA       VAL  13  -1.517 -16.934   2.708
   80    HB   VAL  13           HB       VAL  13   0.803 -16.489   1.367
   81   1HG1  VAL  13          1HG1      VAL  13  -1.702 -14.773   1.420
   82   2HG1  VAL  13          2HG1      VAL  13  -0.468 -14.722   0.140
   83   3HG1  VAL  13          3HG1      VAL  13  -1.401 -16.211   0.416
   84   1HG2  VAL  13          1HG2      VAL  13   1.659 -14.335   1.694
   85   2HG2  VAL  13          2HG2      VAL  13   0.258 -13.818   2.662
   86   3HG2  VAL  13          3HG2      VAL  13   1.445 -14.953   3.349
   87    HA   PRO  14           HA       PRO  14   0.873 -20.406   3.667
   88   1HB   PRO  14          1HB       PRO  14   1.226 -21.686   1.281
   89   2HB   PRO  14          2HB       PRO  14  -0.274 -21.762   2.204
   90   1HG   PRO  14          1HG       PRO  14   0.386 -20.213  -0.220
   91   2HG   PRO  14          2HG       PRO  14  -1.236 -20.659   0.421
   92   1HD   PRO  14          1HD       PRO  14   0.083 -18.119   0.526
   93   2HD   PRO  14          2HD       PRO  14  -1.443 -18.549   1.310
   94    H    ALA  15           H        ALA  15   2.248 -17.880   2.217
   95    HA   ALA  15           HA       ALA  15   4.394 -17.237   2.322
   96   1HB   ALA  15          1HB       ALA  15   5.987 -18.469   3.438
   97   2HB   ALA  15          2HB       ALA  15   4.530 -19.314   4.014
   98   3HB   ALA  15          3HB       ALA  15   5.489 -20.001   2.682
   99    H    LYS  16           H        LYS  16   2.991 -17.683  -0.031
  100    HA   LYS  16           HA       LYS  16   4.979 -17.765  -1.913
  101   1HB   LYS  16          1HB       LYS  16   4.165 -20.074  -2.947
  102   2HB   LYS  16          2HB       LYS  16   5.539 -19.966  -1.833
  103   1HG   LYS  16          1HG       LYS  16   4.430 -21.077  -0.185
  104   2HG   LYS  16          2HG       LYS  16   2.905 -20.227  -0.490
  105   1HD   LYS  16          1HD       LYS  16   2.245 -22.281  -1.246
  106   2HD   LYS  16          2HD       LYS  16   3.050 -21.768  -2.740
  107   1HE   LYS  16          1HE       LYS  16   5.030 -23.002  -2.203
  108   2HE   LYS  16          2HE       LYS  16   4.533 -23.237  -0.521
  109   1HZ   LYS  16          1HZ       LYS  16   3.434 -24.486  -2.928
  110   2HZ   LYS  16          2HZ       LYS  16   4.061 -25.211  -1.605
  111   3HZ   LYS  16          3HZ       LYS  16   2.603 -24.477  -1.521
  112    H    ASP  17           H        ASP  17   2.744 -16.194  -1.267
  113    HA   ASP  17           HA       ASP  17   1.333 -16.446  -3.761
  114   1HB   ASP  17          1HB       ASP  17  -0.096 -17.660  -2.159
  115   2HB   ASP  17          2HB       ASP  17  -0.067 -16.278  -1.052
  116    H    ARG  18           H        ARG  18   3.275 -14.702  -1.909
  117    HA   ARG  18           HA       ARG  18   1.724 -12.289  -1.767
  118   1HB   ARG  18          1HB       ARG  18   4.677 -12.669  -1.113
  119   2HB   ARG  18          2HB       ARG  18   3.620 -11.366  -0.544
  120   1HG   ARG  18          1HG       ARG  18   2.796 -12.635   1.145
  121   2HG   ARG  18          2HG       ARG  18   2.600 -14.061   0.111
  122   1HD   ARG  18          1HD       ARG  18   5.035 -14.523   0.318
  123   2HD   ARG  18          2HD       ARG  18   5.224 -13.102   1.355
  124    HE   ARG  18           HE       ARG  18   3.243 -15.126   2.223
  125   1HH1  ARG  18          1HH1      ARG  18   6.489 -13.811   2.562
  126   2HH1  ARG  18          2HH1      ARG  18   6.757 -14.534   4.113
  127   1HH2  ARG  18          1HH2      ARG  18   3.595 -16.079   4.269
  128   2HH2  ARG  18          2HH2      ARG  18   5.100 -15.833   5.091
  129    H    VAL  19           H        VAL  19   3.350 -10.221  -2.395
  130    HA   VAL  19           HA       VAL  19   4.137 -10.780  -5.170
  131    HB   VAL  19           HB       VAL  19   3.368  -8.089  -4.070
  132   1HG1  VAL  19          1HG1      VAL  19   4.451  -8.028  -6.216
  133   2HG1  VAL  19          2HG1      VAL  19   3.402  -9.323  -6.843
  134   3HG1  VAL  19          3HG1      VAL  19   2.716  -7.724  -6.467
  135   1HG2  VAL  19          1HG2      VAL  19   1.536 -10.310  -4.996
  136   2HG2  VAL  19          2HG2      VAL  19   1.442  -9.330  -3.513
  137   3HG2  VAL  19          3HG2      VAL  19   1.068  -8.595  -5.090
  138    H    ASP  20           H        ASP  20   5.640 -10.985  -2.468
  139    HA   ASP  20           HA       ASP  20   7.483 -10.237  -1.518
  140   1HB   ASP  20          1HB       ASP  20   8.621 -11.645  -2.968
  141   2HB   ASP  20          2HB       ASP  20   8.083 -10.775  -4.414
  142    H    CYS  21           H        CYS  21   6.949  -8.053  -0.829
  143    HA   CYS  21           HA       CYS  21   6.771  -5.851  -2.426
  144   1HB   CYS  21          1HB       CYS  21   6.601  -6.355   0.244
  145   2HB   CYS  21          2HB       CYS  21   8.066  -5.370   0.175
  146    H    GLY  22           H        GLY  22   9.623  -7.597  -1.161
  147   1HA   GLY  22          1HA       GLY  22  11.823  -7.403  -1.573
  148   2HA   GLY  22          2HA       GLY  22  11.374  -6.706  -3.117
  149    H    TYR  23           H        TYR  23  11.203  -5.663   0.372
  150    HA   TYR  23           HA       TYR  23  11.973  -2.987  -0.457
  151   1HB   TYR  23          1HB       TYR  23  10.263  -4.166   1.426
  152   2HB   TYR  23          2HB       TYR  23  11.669  -3.783   2.425
  153    HD1  TYR  23           HD1      TYR  23  10.792  -2.050   3.779
  154    HD2  TYR  23           HD2      TYR  23  10.395  -1.816  -0.475
  155    HE1  TYR  23           HE1      TYR  23   9.973   0.349   3.980
  156    HE2  TYR  23           HE2      TYR  23   9.578   0.582  -0.260
  157    HH   TYR  23           HH       TYR  23   8.646   2.034   1.257
  158    HA   PRO  24           HA       PRO  24  16.089  -3.508   0.791
  159   1HB   PRO  24          1HB       PRO  24  16.848  -0.891   1.001
  160   2HB   PRO  24          2HB       PRO  24  16.780  -1.756  -0.534
  161   1HG   PRO  24          1HG       PRO  24  14.923   0.231   0.605
  162   2HG   PRO  24          2HG       PRO  24  15.114  -0.271  -1.112
  163   1HD   PRO  24          1HD       PRO  24  13.039  -0.978   0.730
  164   2HD   PRO  24          2HD       PRO  24  13.268  -1.624  -0.901
  165    H    HIS  25           H        HIS  25  13.725  -2.155   2.744
  166    HA   HIS  25           HA       HIS  25  15.527  -2.530   5.020
  167   1HB   HIS  25          1HB       HIS  25  14.179  -0.125   4.184
  168   2HB   HIS  25          2HB       HIS  25  13.575  -0.631   5.767
  169    HD1  HIS  25           HD1      HIS  25  16.106  -1.663   7.121
  170    HD2  HIS  25           HD2      HIS  25  16.017   1.800   4.754
  171    HE1  HIS  25           HE1      HIS  25  18.097  -0.244   7.854
  172    HE2  HIS  25           HE2      HIS  25  18.021   1.843   6.327
  173    H    VAL  26           H        VAL  26  14.038  -4.627   3.993
  174    HA   VAL  26           HA       VAL  26  11.431  -4.799   4.978
  175    HB   VAL  26           HB       VAL  26  12.009  -6.303   3.319
  176   1HG1  VAL  26          1HG1      VAL  26  14.598  -6.364   4.682
  177   2HG1  VAL  26          2HG1      VAL  26  14.068  -7.974   4.142
  178   3HG1  VAL  26          3HG1      VAL  26  14.197  -6.641   2.970
  179   1HG2  VAL  26          1HG2      VAL  26  11.423  -8.386   4.168
  180   2HG2  VAL  26          2HG2      VAL  26  12.380  -8.168   5.653
  181   3HG2  VAL  26          3HG2      VAL  26  10.849  -7.285   5.444
  182    H    THR  27           H        THR  27  10.680  -4.889   7.027
  183    HA   THR  27           HA       THR  27  11.883  -6.496   9.005
  184    HB   THR  27           HB       THR  27  13.116  -3.948   8.633
  185    HG1  THR  27           HG1      THR  27  14.420  -5.132   9.984
  186   1HG2  THR  27          1HG2      THR  27  12.781  -3.176  11.100
  187   2HG2  THR  27          2HG2      THR  27  11.501  -2.734   9.944
  188   3HG2  THR  27          3HG2      THR  27  11.264  -4.106  11.053
  189    HA   PRO  28           HA       PRO  28   7.930  -5.977  10.585
  190   1HB   PRO  28          1HB       PRO  28   8.250  -6.823  13.164
  191   2HB   PRO  28          2HB       PRO  28   8.079  -7.927  11.801
  192   1HG   PRO  28          1HG       PRO  28  10.484  -7.146  13.322
  193   2HG   PRO  28          2HG       PRO  28  10.233  -8.597  12.285
  194   1HD   PRO  28          1HD       PRO  28  11.727  -6.226  11.698
  195   2HD   PRO  28          2HD       PRO  28  11.376  -7.554  10.585
  196    H    LYS  29           H        LYS  29   8.751  -3.554  10.197
  197    HA   LYS  29           HA       LYS  29   7.434  -2.102  12.149
  198   1HB   LYS  29          1HB       LYS  29   9.280  -2.717  13.621
  199   2HB   LYS  29          2HB       LYS  29  10.448  -2.018  12.487
  200   1HG   LYS  29          1HG       LYS  29  10.014   0.094  13.189
  201   2HG   LYS  29          2HG       LYS  29   8.259  -0.160  13.191
  202   1HD   LYS  29          1HD       LYS  29   9.953  -1.453  15.326
  203   2HD   LYS  29          2HD       LYS  29   9.574   0.272  15.464
  204   1HE   LYS  29          1HE       LYS  29   7.831  -0.794  16.652
  205   2HE   LYS  29          2HE       LYS  29   7.098  -0.459  15.077
  206   1HZ   LYS  29          1HZ       LYS  29   6.807  -2.746  15.967
  207   2HZ   LYS  29          2HZ       LYS  29   7.420  -2.679  14.455
  208   3HZ   LYS  29          3HZ       LYS  29   8.400  -3.007  15.720
  209    H    GLU  30           H        GLU  30   9.732  -2.439   9.497
  210    HA   GLU  30           HA       GLU  30   9.285   0.331   8.770
  211   1HB   GLU  30          1HB       GLU  30  11.400  -1.644   8.330
  212   2HB   GLU  30          2HB       GLU  30  10.937  -0.837   6.822
  213   1HG   GLU  30          1HG       GLU  30  12.466   0.706   7.575
  214   2HG   GLU  30          2HG       GLU  30  11.055   1.330   8.442
  215    H    CYS  31           H        CYS  31   8.909  -3.042   7.515
  216    HA   CYS  31           HA       CYS  31   7.762  -2.293   5.084
  217   1HB   CYS  31          1HB       CYS  31   7.942  -4.789   6.690
  218   2HB   CYS  31          2HB       CYS  31   6.738  -4.731   5.400
  219    H    ASN  32           H        ASN  32   6.313  -3.451   8.220
  220    HA   ASN  32           HA       ASN  32   3.694  -3.116   7.401
  221   1HB   ASN  32          1HB       ASN  32   5.165  -3.521   9.956
  222   2HB   ASN  32          2HB       ASN  32   3.595  -2.730  10.151
  223   1HD2  ASN  32          1HD2      ASN  32   5.032  -5.323   8.166
  224   2HD2  ASN  32          2HD2      ASN  32   3.791  -6.504   8.417
  225    H    ASN  33           H        ASN  33   6.123  -0.810   7.801
  226    HA   ASN  33           HA       ASN  33   4.267   1.206   8.772
  227   1HB   ASN  33          1HB       ASN  33   6.325   1.188  10.040
  228   2HB   ASN  33          2HB       ASN  33   7.316   1.113   8.575
  229   1HD2  ASN  33          1HD2      ASN  33   8.326   2.921   8.211
  230   2HD2  ASN  33          2HD2      ASN  33   7.733   4.530   8.448
  231    H    ARG  34           H        ARG  34   6.226   0.038   6.058
  232    HA   ARG  34           HA       ARG  34   5.999   2.502   4.631
  233   1HB   ARG  34          1HB       ARG  34   7.410   1.507   3.014
  234   2HB   ARG  34          2HB       ARG  34   7.946   0.745   4.522
  235   1HG   ARG  34          1HG       ARG  34   7.723  -1.101   3.118
  236   2HG   ARG  34          2HG       ARG  34   6.131  -1.082   3.895
  237   1HD   ARG  34          1HD       ARG  34   5.219  -0.980   1.832
  238   2HD   ARG  34          2HD       ARG  34   5.896   0.646   1.656
  239    HE   ARG  34           HE       ARG  34   7.971  -1.192   1.075
  240   1HH1  ARG  34          1HH1      ARG  34   4.843  -0.280  -0.253
  241   2HH1  ARG  34          2HH1      ARG  34   5.265  -0.705  -1.878
  242   1HH2  ARG  34          1HH2      ARG  34   8.529  -1.753  -1.069
  243   2HH2  ARG  34          2HH2      ARG  34   7.377  -1.548  -2.345
  244    H    GLY  35           H        GLY  35   4.382  -0.654   4.875
  245   1HA   GLY  35          1HA       GLY  35   1.991  -0.445   4.164
  246   2HA   GLY  35          2HA       GLY  35   2.620   0.081   2.616
  247    H    CYS  36           H        CYS  36   4.439  -2.326   4.463
  248    HA   CYS  36           HA       CYS  36   3.430  -4.372   2.623
  249   1HB   CYS  36          1HB       CYS  36   6.250  -3.970   3.625
  250   2HB   CYS  36          2HB       CYS  36   5.698  -5.390   2.732
  251    H    CYS  37           H        CYS  37   4.210  -6.677   3.662
  252    HA   CYS  37           HA       CYS  37   3.579  -6.514   6.519
  253   1HB   CYS  37          1HB       CYS  37   1.755  -7.385   4.920
  254   2HB   CYS  37          2HB       CYS  37   2.754  -8.835   4.794
  255    H    PHE  38           H        PHE  38   5.198  -7.381   7.777
  256    HA   PHE  38           HA       PHE  38   7.316  -8.812   6.415
  257   1HB   PHE  38          1HB       PHE  38   7.622  -6.889   8.080
  258   2HB   PHE  38          2HB       PHE  38   6.916  -7.915   9.333
  259    HD1  PHE  38           HD1      PHE  38   8.209  -9.642  10.371
  260    HD2  PHE  38           HD2      PHE  38   9.831  -7.415   7.144
  261    HE1  PHE  38           HE1      PHE  38  10.488 -10.561  10.883
  262    HE2  PHE  38           HE2      PHE  38  12.111  -8.334   7.655
  263    HZ   PHE  38           HZ       PHE  38  12.412  -9.896   9.518
  264    H    ASP  39           H        ASP  39   7.419 -11.002   6.360
  265    HA   ASP  39           HA       ASP  39   5.601 -12.457   8.022
  266   1HB   ASP  39          1HB       ASP  39   5.859 -13.134   5.701
  267   2HB   ASP  39          2HB       ASP  39   7.614 -13.287   5.883
  268    H    SER  40           H        SER  40   8.976 -13.369   7.068
  269    HA   SER  40           HA       SER  40  10.802 -13.633   8.287
  270   1HB   SER  40          1HB       SER  40   9.477 -12.024  10.018
  271   2HB   SER  40          2HB       SER  40   9.510 -13.511  10.983
  272    HG   SER  40           HG       SER  40  11.386 -12.334  11.463
  273    H    ARG  41           H        ARG  41   7.774 -15.236   8.585
  274    HA   ARG  41           HA       ARG  41   8.475 -17.313  10.277
  275   1HB   ARG  41          1HB       ARG  41   6.511 -17.269   7.938
  276   2HB   ARG  41          2HB       ARG  41   6.536 -18.509   9.204
  277   1HG   ARG  41          1HG       ARG  41   6.444 -16.215  10.706
  278   2HG   ARG  41          2HG       ARG  41   5.522 -15.708   9.281
  279   1HD   ARG  41          1HD       ARG  41   3.922 -16.638  10.793
  280   2HD   ARG  41          2HD       ARG  41   4.175 -17.893   9.569
  281    HE   ARG  41           HE       ARG  41   5.973 -18.149  11.857
  282   1HH1  ARG  41          1HH1      ARG  41   2.750 -18.905  10.661
  283   2HH1  ARG  41          2HH1      ARG  41   2.533 -20.256  11.722
  284   1HH2  ARG  41          1HH2      ARG  41   5.687 -19.932  13.258
  285   2HH2  ARG  41          2HH2      ARG  41   4.216 -20.844  13.210
  286    H    ILE  42           H        ILE  42   8.667 -16.900   6.686
  287    HA   ILE  42           HA       ILE  42  10.406 -19.267   6.635
  288    HB   ILE  42           HB       ILE  42   8.785 -18.447   4.262
  289   1HG1  ILE  42          1HG1      ILE  42   7.765 -19.834   6.722
  290   2HG1  ILE  42          2HG1      ILE  42   7.007 -18.548   5.765
  291   1HG2  ILE  42          1HG2      ILE  42   9.365 -20.455   3.418
  292   2HG2  ILE  42          2HG2      ILE  42  10.697 -20.327   4.591
  293   3HG2  ILE  42          3HG2      ILE  42   9.248 -21.279   4.992
  294   1HD1  ILE  42          1HD1      ILE  42   5.785 -20.421   5.077
  295   2HD1  ILE  42          2HD1      ILE  42   7.065 -20.382   3.841
  296   3HD1  ILE  42          3HD1      ILE  42   7.184 -21.511   5.212
  297    HA   PRO  43           HA       PRO  43  13.164 -16.186   5.220
  298   1HB   PRO  43          1HB       PRO  43  15.424 -17.718   5.298
  299   2HB   PRO  43          2HB       PRO  43  14.807 -16.838   6.694
  300   1HG   PRO  43          1HG       PRO  43  14.666 -19.713   6.049
  301   2HG   PRO  43          2HG       PRO  43  14.477 -18.912   7.649
  302   1HD   PRO  43          1HD       PRO  43  12.446 -20.014   5.960
  303   2HD   PRO  43          2HD       PRO  43  12.194 -19.094   7.450
  304    H    GLY  44           H        GLY  44  12.111 -18.944   3.707
  305   1HA   GLY  44          1HA       GLY  44  13.781 -18.530   1.342
  306   2HA   GLY  44          2HA       GLY  44  12.659 -19.843   1.640
  307    H    VAL  45           H        VAL  45  10.989 -17.156   2.670
  308    HA   VAL  45           HA       VAL  45   9.899 -16.675  -0.018
  309    HB   VAL  45           HB       VAL  45   7.756 -16.809   0.772
  310   1HG1  VAL  45          1HG1      VAL  45   8.565 -19.037   0.862
  311   2HG1  VAL  45          2HG1      VAL  45   9.403 -18.755   2.406
  312   3HG1  VAL  45          3HG1      VAL  45   7.625 -18.801   2.355
  313   1HG2  VAL  45          1HG2      VAL  45   8.138 -15.165   2.629
  314   2HG2  VAL  45          2HG2      VAL  45   7.015 -16.484   3.037
  315   3HG2  VAL  45          3HG2      VAL  45   8.688 -16.519   3.645
  316    HA   PRO  46           HA       PRO  46  10.181 -12.436   0.833
  317   1HB   PRO  46          1HB       PRO  46   7.758 -11.331   0.222
  318   2HB   PRO  46          2HB       PRO  46   8.942 -11.795  -0.999
  319   1HG   PRO  46          1HG       PRO  46   6.453 -13.138  -0.161
  320   2HG   PRO  46          2HG       PRO  46   7.377 -13.342  -1.692
  321   1HD   PRO  46          1HD       PRO  46   7.259 -15.103   0.563
  322   2HD   PRO  46          2HD       PRO  46   8.308 -15.268  -0.851
  323    H    TRP  47           H        TRP  47  10.688 -11.639   2.767
  324    HA   TRP  47           HA       TRP  47   8.695 -11.979   4.843
  325   1HB   TRP  47          1HB       TRP  47  11.115 -10.532   5.553
  326   2HB   TRP  47          2HB       TRP  47  10.402 -11.983   6.262
  327    HD1  TRP  47           HD1      TRP  47  11.046 -14.365   4.819
  328    HE1  TRP  47           HE1      TRP  47  13.291 -15.117   3.654
  329    HE3  TRP  47           HE3      TRP  47  13.027  -9.697   4.436
  330    HZ2  TRP  47           HZ2      TRP  47  15.592 -13.707   2.723
  331    HZ3  TRP  47           HZ3      TRP  47  15.277  -9.473   3.387
  332    HH2  TRP  47           HH2      TRP  47  16.551 -11.382   2.546
  333    H    CYS  48           H        CYS  48   8.236 -10.178   2.479
  334    HA   CYS  48           HA       CYS  48   7.244  -7.980   3.913
  335   1HB   CYS  48          1HB       CYS  48   9.593  -7.292   3.906
  336   2HB   CYS  48          2HB       CYS  48   9.621  -7.377   2.142
  337    H    PHE  49           H        PHE  49   5.286  -8.046   2.844
  338    HA   PHE  49           HA       PHE  49   5.371  -7.729  -0.047
  339   1HB   PHE  49          1HB       PHE  49   3.264  -9.453   0.246
  340   2HB   PHE  49          2HB       PHE  49   4.900 -10.033  -0.081
  341    HD1  PHE  49           HD1      PHE  49   6.357 -10.396   2.116
  342    HD2  PHE  49           HD2      PHE  49   2.115 -10.387   1.996
  343    HE1  PHE  49           HE1      PHE  49   6.294 -11.726   4.243
  344    HE2  PHE  49           HE2      PHE  49   2.052 -11.718   4.123
  345    HZ   PHE  49           HZ       PHE  49   4.143 -12.371   5.222
  346    H    LYS  50           H        LYS  50   2.631  -7.858  -0.570
  347    HA   LYS  50           HA       LYS  50   1.551  -5.833   1.265
  348   1HB   LYS  50          1HB       LYS  50   0.420  -4.887  -0.782
  349   2HB   LYS  50          2HB       LYS  50   2.171  -4.629  -0.672
  350   1HG   LYS  50          1HG       LYS  50   1.592  -7.147  -2.007
  351   2HG   LYS  50          2HG       LYS  50   0.720  -5.827  -2.806
  352   1HD   LYS  50          1HD       LYS  50   3.709  -6.012  -2.255
  353   2HD   LYS  50          2HD       LYS  50   2.918  -6.050  -3.840
  354   1HE   LYS  50          1HE       LYS  50   2.050  -3.673  -2.499
  355   2HE   LYS  50          2HE       LYS  50   3.808  -3.762  -2.305
  356   1HZ   LYS  50          1HZ       LYS  50   2.638  -4.283  -4.914
  357   2HZ   LYS  50          2HZ       LYS  50   2.767  -2.736  -4.408
  358   3HZ   LYS  50          3HZ       LYS  50   4.103  -3.665  -4.543
  359    HA   PRO  51           HA       PRO  51  -1.228  -9.402   0.994
  360   1HB   PRO  51          1HB       PRO  51  -1.387  -9.948   3.666
  361   2HB   PRO  51          2HB       PRO  51  -0.273 -10.773   2.578
  362   1HG   PRO  51          1HG       PRO  51   0.234  -8.640   4.553
  363   2HG   PRO  51          2HG       PRO  51   1.407  -9.790   3.816
  364   1HD   PRO  51          1HD       PRO  51   1.022  -7.016   3.222
  365   2HD   PRO  51          2HD       PRO  51   2.076  -8.143   2.358
  366    H    LEU  52           H        LEU  52  -2.011  -8.415   4.171
  367    HA   LEU  52           HA       LEU  52  -4.462  -7.277   3.095
  368   1HB   LEU  52          1HB       LEU  52  -5.441  -7.735   5.102
  369   2HB   LEU  52          2HB       LEU  52  -4.296  -9.076   4.925
  370    HG   LEU  52           HG       LEU  52  -2.951  -7.021   6.339
  371   1HD1  LEU  52          1HD1      LEU  52  -4.676  -5.853   7.213
  372   2HD1  LEU  52          2HD1      LEU  52  -5.837  -7.185   7.002
  373   3HD1  LEU  52          3HD1      LEU  52  -4.702  -7.202   8.373
  374   1HD2  LEU  52          1HD2      LEU  52  -2.216  -8.923   7.216
  375   2HD2  LEU  52          2HD2      LEU  52  -3.715  -8.996   8.174
  376   3HD2  LEU  52          3HD2      LEU  52  -3.623  -9.822   6.600
  377    H    GLN  53           H        GLN  53  -1.943  -5.843   2.709
  378    HA   GLN  53           HA       GLN  53  -1.485  -3.939   4.616
  379   1HB   GLN  53          1HB       GLN  53  -1.257  -3.763   1.588
  380   2HB   GLN  53          2HB       GLN  53  -0.550  -2.579   2.702
  381   1HG   GLN  53          1HG       GLN  53   0.096  -5.551   2.510
  382   2HG   GLN  53          2HG       GLN  53   1.161  -4.211   2.061
  383   1HE2  GLN  53          1HE2      GLN  53  -0.108  -6.189   4.565
  384   2HE2  GLN  53          2HE2      GLN  53   0.787  -5.547   5.901
  385    H    GLU  54           H        GLU  54  -4.213  -4.345   2.466
  386    HA   GLU  54           HA       GLU  54  -5.105  -1.913   1.929
  387   1HB   GLU  54          1HB       GLU  54  -7.149  -2.892   1.600
  388   2HB   GLU  54          2HB       GLU  54  -6.202  -4.374   1.820
  389   1HG   GLU  54          1HG       GLU  54  -7.946  -4.749   3.306
  390   2HG   GLU  54          2HG       GLU  54  -6.779  -3.974   4.390
  391    H    ALA  55           H        ALA  55  -4.687  -3.298   5.139
  392    HA   ALA  55           HA       ALA  55  -6.401  -2.054   6.749
  393   1HB   ALA  55          1HB       ALA  55  -3.538  -1.749   7.529
  394   2HB   ALA  55          2HB       ALA  55  -4.886  -2.520   8.400
  395   3HB   ALA  55          3HB       ALA  55  -4.067  -3.389   7.081
  396    H    GLU  56           H        GLU  56  -3.211  -0.464   6.044
  397    HA   GLU  56           HA       GLU  56  -4.702   2.037   5.896
  398   1HB   GLU  56          1HB       GLU  56  -2.808   1.263   7.884
  399   2HB   GLU  56          2HB       GLU  56  -2.032   2.511   6.894
  400   1HG   GLU  56          1HG       GLU  56  -4.253   3.824   7.170
  401   2HG   GLU  56          2HG       GLU  56  -4.632   2.679   8.463
  402    H    CYS  57           H        CYS  57  -3.665   0.098   3.823
  403    HA   CYS  57           HA       CYS  57  -1.595   1.767   2.614
  404   1HB   CYS  57          1HB       CYS  57  -1.418  -0.817   2.999
  405   2HB   CYS  57          2HB       CYS  57  -2.398  -0.908   1.532
  406    H    THR  58           H        THR  58  -4.571  -0.163   1.765
  407    HA   THR  58           HA       THR  58  -4.973   1.200  -0.684
  408    HB   THR  58           HB       THR  58  -5.775  -1.160   0.223
  409    HG1  THR  58           HG1      THR  58  -7.731  -0.714  -1.245
  410   1HG2  THR  58          1HG2      THR  58  -8.031  -1.193   1.088
  411   2HG2  THR  58          2HG2      THR  58  -7.153  -0.037   2.117
  412   3HG2  THR  58          3HG2      THR  58  -8.227   0.558   0.829
  413    H    PHE  59           H        PHE  59  -6.269   1.637   2.643
  414    HA   PHE  59           HA       PHE  59  -8.295   3.286   2.360
  415   1HB   PHE  59          1HB       PHE  59  -6.587   2.627   4.352
  416   2HB   PHE  59          2HB       PHE  59  -5.938   4.239   4.035
  417    HD1  PHE  59           HD1      PHE  59  -7.335   6.223   4.449
  418    HD2  PHE  59           HD2      PHE  59  -8.699   2.324   5.423
  419    HE1  PHE  59           HE1      PHE  59  -9.124   7.213   5.905
  420    HE2  PHE  59           HE2      PHE  59 -10.487   3.314   6.879
  421    HZ   PHE  59           HZ       PHE  59 -10.678   5.746   7.103
  422   1H    GLU   1           H1       GLU   1 -18.612  -3.608   0.585
  423    HA   GLU   1           HA       GLU   1 -20.085  -1.975   2.349
  424   1HB   GLU   1          1HB       GLU   1 -17.603  -2.575   3.337
  425   2HB   GLU   1          2HB       GLU   1 -17.242  -1.102   2.422
  426   1HG   GLU   1          1HG       GLU   1 -18.357   0.210   3.903
  427   2HG   GLU   1          2HG       GLU   1 -19.725  -0.907   4.014
  428    H    GLU   2           H        GLU   2 -19.404   0.514   1.790
  429    HA   GLU   2           HA       GLU   2 -19.497   0.555  -1.086
  430   1HB   GLU   2          1HB       GLU   2 -20.200   2.440   1.132
  431   2HB   GLU   2          2HB       GLU   2 -19.807   3.149  -0.444
  432   1HG   GLU   2          1HG       GLU   2 -21.577   1.946  -1.522
  433   2HG   GLU   2          2HG       GLU   2 -21.813   0.879  -0.129
  434    H    TYR   3           H        TYR   3 -17.176  -0.144  -1.269
  435    HA   TYR   3           HA       TYR   3 -15.215   1.805  -0.412
  436   1HB   TYR   3          1HB       TYR   3 -15.423  -0.955  -1.639
  437   2HB   TYR   3          2HB       TYR   3 -13.928  -0.072  -1.964
  438    HD1  TYR   3           HD1      TYR   3 -15.959  -0.028   1.167
  439    HD2  TYR   3           HD2      TYR   3 -12.349  -1.319  -0.730
  440    HE1  TYR   3           HE1      TYR   3 -15.038  -0.780   3.416
  441    HE2  TYR   3           HE2      TYR   3 -11.440  -2.066   1.523
  442    HH   TYR   3           HH       TYR   3 -11.720  -1.781   3.758
  443    H    VAL   4           H        VAL   4 -16.061   3.621  -1.733
  444    HA   VAL   4           HA       VAL   4 -15.313   3.295  -4.557
  445    HB   VAL   4           HB       VAL   4 -17.385   5.064  -3.248
  446   1HG1  VAL   4          1HG1      VAL   4 -17.900   5.917  -5.472
  447   2HG1  VAL   4          2HG1      VAL   4 -16.199   6.253  -5.067
  448   3HG1  VAL   4          3HG1      VAL   4 -16.602   4.923  -6.180
  449   1HG2  VAL   4          1HG2      VAL   4 -17.471   2.426  -4.437
  450   2HG2  VAL   4          2HG2      VAL   4 -18.752   3.337  -3.603
  451   3HG2  VAL   4          3HG2      VAL   4 -18.497   3.558  -5.350
  452    H    GLY   5           H        GLY   5 -15.446   5.601  -1.760
  453   1HA   GLY   5          1HA       GLY   5 -13.689   7.486  -2.964
  454   2HA   GLY   5          2HA       GLY   5 -14.189   7.413  -1.285
  455    H    LEU   6           H        LEU   6 -13.064   4.331  -2.061
  456    HA   LEU   6           HA       LEU   6 -10.289   5.025  -1.433
  457   1HB   LEU   6          1HB       LEU   6 -11.472   2.628  -0.153
  458   2HB   LEU   6          2HB       LEU   6 -10.153   3.681   0.390
  459    HG   LEU   6           HG       LEU   6 -11.986   3.899   1.907
  460   1HD1  LEU   6          1HD1      LEU   6 -11.639   6.081   2.113
  461   2HD1  LEU   6          2HD1      LEU   6 -10.882   6.065   0.502
  462   3HD1  LEU   6          3HD1      LEU   6 -12.617   6.428   0.667
  463   1HD2  LEU   6          1HD2      LEU   6 -14.107   3.634   1.324
  464   2HD2  LEU   6          2HD2      LEU   6 -14.039   5.073   0.279
  465   3HD2  LEU   6          3HD2      LEU   6 -13.597   3.478  -0.375
  466    H    SER   7           H        SER   7 -12.180   4.032  -3.782
  467    HA   SER   7           HA       SER   7 -10.592   1.666  -4.385
  468   1HB   SER   7          1HB       SER   7 -13.388   2.281  -4.664
  469   2HB   SER   7          2HB       SER   7 -12.717   2.016  -6.284
  470    HG   SER   7           HG       SER   7 -13.111  -0.041  -5.720
  471    H    ALA   8           H        ALA   8 -10.920   1.607  -7.194
  472    HA   ALA   8           HA       ALA   8  -8.916   3.358  -8.019
  473   1HB   ALA   8          1HB       ALA   8 -10.847   1.455  -9.294
  474   2HB   ALA   8          2HB       ALA   8 -10.014   2.620 -10.351
  475   3HB   ALA   8          3HB       ALA   8  -9.068   1.488  -9.354
  476    H    ASN   9           H        ASN   9  -9.560   5.483  -7.276
  477    HA   ASN   9           HA       ASN   9 -10.618   7.052  -9.209
  478   1HB   ASN   9          1HB       ASN   9 -12.823   6.131  -8.919
  479   2HB   ASN   9          2HB       ASN   9 -12.697   6.170  -7.154
  480   1HD2  ASN   9          1HD2      ASN   9 -12.102   8.472  -9.811
  481   2HD2  ASN   9          2HD2      ASN   9 -13.078   9.766  -9.202
  482    H    GLN  10           H        GLN  10 -10.202   6.283  -5.751
  483    HA   GLN  10           HA       GLN  10 -10.387   8.846  -4.734
  484   1HB   GLN  10          1HB       GLN  10 -10.430   6.851  -3.327
  485   2HB   GLN  10          2HB       GLN  10  -8.760   6.454  -3.765
  486   1HG   GLN  10          1HG       GLN  10  -7.948   8.473  -2.665
  487   2HG   GLN  10          2HG       GLN  10  -9.600   9.035  -2.365
  488   1HE2  GLN  10          1HE2      GLN  10  -8.010   5.865  -2.057
  489   2HE2  GLN  10          2HE2      GLN  10  -8.355   5.606  -0.380
  490    H    CYS  11           H        CYS  11  -7.831   7.181  -6.526
  491    HA   CYS  11           HA       CYS  11  -5.754   8.934  -5.726
  492   1HB   CYS  11          1HB       CYS  11  -5.301   6.684  -6.502
  493   2HB   CYS  11          2HB       CYS  11  -5.974   7.060  -8.091
  494    H    ALA  12           H        ALA  12  -8.587   9.486  -7.381
  495    HA   ALA  12           HA       ALA  12  -7.327  11.492  -9.126
  496   1HB   ALA  12          1HB       ALA  12  -8.620   9.520 -10.178
  497   2HB   ALA  12          2HB       ALA  12 -10.082  10.286  -9.510
  498   3HB   ALA  12          3HB       ALA  12  -9.077  11.162 -10.689
  499    H    VAL  13           H        VAL  13  -8.633  11.142  -6.152
  500    HA   VAL  13           HA       VAL  13 -10.813  12.705  -5.885
  501    HB   VAL  13           HB       VAL  13  -8.879  11.608  -4.250
  502   1HG1  VAL  13          1HG1      VAL  13  -8.225  13.382  -2.679
  503   2HG1  VAL  13          2HG1      VAL  13  -7.561  13.677  -4.304
  504   3HG1  VAL  13          3HG1      VAL  13  -8.973  14.601  -3.740
  505   1HG2  VAL  13          1HG2      VAL  13 -10.767  11.407  -3.083
  506   2HG2  VAL  13          2HG2      VAL  13 -10.621  13.113  -2.596
  507   3HG2  VAL  13          3HG2      VAL  13 -11.543  12.681  -4.055
  508    HA   PRO  14           HA       PRO  14  -9.772  16.773  -6.907
  509   1HB   PRO  14          1HB       PRO  14 -11.046  18.296  -5.032
  510   2HB   PRO  14          2HB       PRO  14 -11.875  17.568  -6.407
  511   1HG   PRO  14          1HG       PRO  14 -11.834  16.755  -3.572
  512   2HG   PRO  14          2HG       PRO  14 -13.030  16.323  -4.847
  513   1HD   PRO  14          1HD       PRO  14 -10.947  14.701  -3.737
  514   2HD   PRO  14          2HD       PRO  14 -11.992  14.287  -5.101
  515    H    ALA  15           H        ALA  15  -7.882  15.331  -5.161
  516    HA   ALA  15           HA       ALA  15  -6.138  15.756  -3.837
  517   1HB   ALA  15          1HB       ALA  15  -5.880  17.043  -6.213
  518   2HB   ALA  15          2HB       ALA  15  -5.707  18.421  -5.100
  519   3HB   ALA  15          3HB       ALA  15  -4.609  17.027  -4.966
  520    H    LYS  16           H        LYS  16  -8.189  16.136  -2.241
  521    HA   LYS  16           HA       LYS  16  -7.321  18.114  -0.458
  522   1HB   LYS  16          1HB       LYS  16  -9.495  19.465  -0.535
  523   2HB   LYS  16          2HB       LYS  16  -8.256  19.815  -1.755
  524   1HG   LYS  16          1HG       LYS  16  -9.800  19.433  -3.348
  525   2HG   LYS  16          2HG       LYS  16  -9.873  17.736  -2.838
  526   1HD   LYS  16          1HD       LYS  16 -12.111  18.568  -2.729
  527   2HD   LYS  16          2HD       LYS  16 -11.554  18.491  -1.049
  528   1HE   LYS  16          1HE       LYS  16 -10.970  20.931  -1.191
  529   2HE   LYS  16          2HE       LYS  16 -11.651  20.976  -2.824
  530   1HZ   LYS  16          1HZ       LYS  16 -13.036  21.461  -0.639
  531   2HZ   LYS  16          2HZ       LYS  16 -13.713  20.879  -2.006
  532   3HZ   LYS  16          3HZ       LYS  16 -13.340  19.864  -0.784
  533    H    ASP  17           H        ASP  17  -7.905  15.252  -0.632
  534    HA   ASP  17           HA       ASP  17  -9.534  15.133   1.692
  535   1HB   ASP  17          1HB       ASP  17 -11.134  15.041  -0.321
  536   2HB   ASP  17          2HB       ASP  17 -10.394  13.483  -0.722
  537    H    ARG  18           H        ARG  18  -6.775  14.489   0.363
  538    HA   ARG  18           HA       ARG  18  -6.725  11.634   0.510
  539   1HB   ARG  18          1HB       ARG  18  -4.491  13.673   0.091
  540   2HB   ARG  18          2HB       ARG  18  -4.301  11.920  -0.087
  541   1HG   ARG  18          1HG       ARG  18  -5.404  11.877  -2.097
  542   2HG   ARG  18          2HG       ARG  18  -6.530  13.167  -1.643
  543   1HD   ARG  18          1HD       ARG  18  -4.900  14.869  -2.106
  544   2HD   ARG  18          2HD       ARG  18  -3.580  13.694  -2.207
  545    HE   ARG  18           HE       ARG  18  -5.752  13.273  -4.146
  546   1HH1  ARG  18          1HH1      ARG  18  -2.664  14.844  -3.530
  547   2HH1  ARG  18          2HH1      ARG  18  -2.275  15.022  -5.209
  548   1HH2  ARG  18          1HH2      ARG  18  -5.240  13.508  -6.360
  549   2HH2  ARG  18          2HH2      ARG  18  -3.750  14.257  -6.829
  550    H    VAL  19           H        VAL  19  -4.536  10.788   1.758
  551    HA   VAL  19           HA       VAL  19  -4.781  11.898   4.462
  552    HB   VAL  19           HB       VAL  19  -3.665   9.203   3.719
  553   1HG1  VAL  19          1HG1      VAL  19  -4.200  10.655   6.175
  554   2HG1  VAL  19          2HG1      VAL  19  -5.079   9.108   6.139
  555   3HG1  VAL  19          3HG1      VAL  19  -3.313   9.132   5.923
  556   1HG2  VAL  19          1HG2      VAL  19  -6.581   9.911   4.185
  557   2HG2  VAL  19          2HG2      VAL  19  -5.859   9.281   2.685
  558   3HG2  VAL  19          3HG2      VAL  19  -5.924   8.257   4.140
  559    H    ASP  20           H        ASP  20  -3.077  12.809   2.044
  560    HA   ASP  20           HA       ASP  20  -0.942  13.137   1.528
  561   1HB   ASP  20          1HB       ASP  20  -1.159  15.110   2.711
  562   2HB   ASP  20          2HB       ASP  20  -1.537  14.288   4.233
  563    H    CYS  21           H        CYS  21  -0.023  10.966   1.354
  564    HA   CYS  21           HA       CYS  21   0.651   9.294   3.364
  565   1HB   CYS  21          1HB       CYS  21   0.913   9.200   0.731
  566   2HB   CYS  21          2HB       CYS  21   2.594   9.577   1.118
  567    H    GLY  22           H        GLY  22   2.265  12.283   2.256
  568   1HA   GLY  22          1HA       GLY  22   3.940  13.505   3.121
  569   2HA   GLY  22          2HA       GLY  22   3.577  12.760   4.665
  570    H    TYR  23           H        TYR  23   4.838  11.400   1.535
  571    HA   TYR  23           HA       TYR  23   6.832   9.933   3.036
  572   1HB   TYR  23          1HB       TYR  23   5.255   9.574   0.754
  573   2HB   TYR  23          2HB       TYR  23   6.793  10.054   0.029
  574    HD1  TYR  23           HD1      TYR  23   7.525   8.049  -0.972
  575    HD2  TYR  23           HD2      TYR  23   6.247   8.016   3.111
  576    HE1  TYR  23           HE1      TYR  23   8.362   5.662  -0.722
  577    HE2  TYR  23           HE2      TYR  23   7.088   5.628   3.348
  578    HH   TYR  23           HH       TYR  23   8.960   4.249   2.106
  579    HA   PRO  24           HA       PRO  24   9.936  12.869   2.233
  580   1HB   PRO  24          1HB       PRO  24  12.075  11.450   3.164
  581   2HB   PRO  24          2HB       PRO  24  11.005  12.379   4.212
  582   1HG   PRO  24          1HG       PRO  24  11.155   9.467   3.757
  583   2HG   PRO  24          2HG       PRO  24  10.424  10.351   5.143
  584   1HD   PRO  24          1HD       PRO  24   9.100   9.061   2.957
  585   2HD   PRO  24          2HD       PRO  24   8.344  10.054   4.210
  586    H    HIS  25           H        HIS  25   9.451  10.049   0.603
  587    HA   HIS  25           HA       HIS  25  11.571  10.813  -1.271
  588   1HB   HIS  25          1HB       HIS  25  11.461   8.463   0.155
  589   2HB   HIS  25          2HB       HIS  25  10.710   8.008  -1.380
  590    HD1  HIS  25           HD1      HIS  25  12.225   8.458  -3.583
  591    HD2  HIS  25           HD2      HIS  25  14.202   8.661   0.110
  592    HE1  HIS  25           HE1      HIS  25  14.718   8.287  -4.097
  593    HE2  HIS  25           HE2      HIS  25  15.884   8.473  -1.794
  594    H    VAL  26           H        VAL  26   8.693  11.669  -0.989
  595    HA   VAL  26           HA       VAL  26   6.957  10.408  -2.644
  596    HB   VAL  26           HB       VAL  26   6.167  12.230  -1.458
  597   1HG1  VAL  26          1HG1      VAL  26   7.595  13.810  -0.791
  598   2HG1  VAL  26          2HG1      VAL  26   8.741  13.396  -2.090
  599   3HG1  VAL  26          3HG1      VAL  26   7.434  14.565  -2.396
  600   1HG2  VAL  26          1HG2      VAL  26   4.916  13.302  -3.020
  601   2HG2  VAL  26          2HG2      VAL  26   6.330  13.776  -3.991
  602   3HG2  VAL  26          3HG2      VAL  26   5.680  12.124  -4.115
  603    H    THR  27           H        THR  27   6.977   9.777  -4.736
  604    HA   THR  27           HA       THR  27   7.951  11.442  -6.800
  605    HB   THR  27           HB       THR  27   9.888   9.736  -5.437
  606    HG1  THR  27           HG1      THR  27   9.679  11.562  -7.713
  607   1HG2  THR  27          1HG2      THR  27  10.835   9.050  -7.836
  608   2HG2  THR  27          2HG2      THR  27   9.703   7.965  -6.993
  609   3HG2  THR  27          3HG2      THR  27   9.111   9.037  -8.284
  610    HA   PRO  28           HA       PRO  28   5.359   8.792  -8.957
  611   1HB   PRO  28          1HB       PRO  28   6.093   9.299 -11.539
  612   2HB   PRO  28          2HB       PRO  28   5.024  10.354 -10.616
  613   1HG   PRO  28          1HG       PRO  28   7.876  10.676 -11.303
  614   2HG   PRO  28          2HG       PRO  28   6.693  11.936 -10.800
  615   1HD   PRO  28          1HD       PRO  28   8.794  10.749  -9.258
  616   2HD   PRO  28          2HD       PRO  28   7.557  11.867  -8.671
  617    H    LYS  29           H        LYS  29   7.267   7.336  -7.734
  618    HA   LYS  29           HA       LYS  29   7.305   5.064  -9.339
  619   1HB   LYS  29          1HB       LYS  29   8.924   6.316 -10.686
  620   2HB   LYS  29          2HB       LYS  29   9.969   6.515  -9.268
  621   1HG   LYS  29          1HG       LYS  29  10.800   4.424  -9.487
  622   2HG   LYS  29          2HG       LYS  29   9.190   3.711  -9.679
  623   1HD   LYS  29          1HD       LYS  29   9.728   5.182 -12.057
  624   2HD   LYS  29          2HD       LYS  29  11.203   4.269 -11.696
  625   1HE   LYS  29          1HE       LYS  29  10.183   2.241 -12.057
  626   2HE   LYS  29          2HE       LYS  29   8.627   2.775 -11.406
  627   1HZ   LYS  29          1HZ       LYS  29   8.928   4.249 -13.626
  628   2HZ   LYS  29          2HZ       LYS  29   9.587   2.826 -14.081
  629   3HZ   LYS  29          3HZ       LYS  29   8.051   2.874 -13.527
  630    H    GLU  30           H        GLU  30   8.213   7.018  -6.597
  631    HA   GLU  30           HA       GLU  30   9.163   4.666  -5.197
  632   1HB   GLU  30          1HB       GLU  30   9.672   7.519  -5.045
  633   2HB   GLU  30          2HB       GLU  30   9.188   6.908  -3.454
  634   1HG   GLU  30          1HG       GLU  30  11.485   6.526  -3.408
  635   2HG   GLU  30          2HG       GLU  30  10.912   4.966  -4.016
  636    H    CYS  31           H        CYS  31   6.633   7.243  -5.055
  637    HA   CYS  31           HA       CYS  31   5.427   6.346  -2.715
  638   1HB   CYS  31          1HB       CYS  31   4.558   8.030  -5.027
  639   2HB   CYS  31          2HB       CYS  31   3.364   7.518  -3.831
  640    H    ASN  32           H        ASN  32   4.569   5.814  -6.217
  641    HA   ASN  32           HA       ASN  32   2.528   4.032  -5.686
  642   1HB   ASN  32          1HB       ASN  32   4.239   4.751  -8.046
  643   2HB   ASN  32          2HB       ASN  32   3.345   3.228  -8.163
  644   1HD2  ASN  32          1HD2      ASN  32   2.722   6.452  -6.771
  645   2HD2  ASN  32          2HD2      ASN  32   1.209   6.744  -7.563
  646    H    ASN  33           H        ASN  33   5.859   3.757  -5.109
  647    HA   ASN  33           HA       ASN  33   5.921   0.920  -5.689
  648   1HB   ASN  33          1HB       ASN  33   7.902   2.036  -6.449
  649   2HB   ASN  33          2HB       ASN  33   8.044   2.986  -4.963
  650   1HD2  ASN  33          1HD2      ASN  33   9.868   2.401  -4.050
  651   2HD2  ASN  33          2HD2      ASN  33  10.387   0.786  -3.700
  652    H    ARG  34           H        ARG  34   5.880   3.371  -3.101
  653    HA   ARG  34           HA       ARG  34   6.521   1.445  -1.091
  654   1HB   ARG  34          1HB       ARG  34   6.644   3.261   0.387
  655   2HB   ARG  34          2HB       ARG  34   7.055   4.040  -1.151
  656   1HG   ARG  34          1HG       ARG  34   5.449   5.503  -0.331
  657   2HG   ARG  34          2HG       ARG  34   4.424   4.422  -1.293
  658   1HD   ARG  34          1HD       ARG  34   3.221   4.072   0.590
  659   2HD   ARG  34          2HD       ARG  34   4.605   3.173   1.232
  660    HE   ARG  34           HE       ARG  34   4.999   6.000   1.610
  661   1HH1  ARG  34          1HH1      ARG  34   3.104   3.308   2.852
  662   2HH1  ARG  34          2HH1      ARG  34   2.907   4.005   4.425
  663   1HH2  ARG  34          1HH2      ARG  34   4.739   6.921   3.685
  664   2HH2  ARG  34          2HH2      ARG  34   3.843   6.075   4.901
  665    H    GLY  35           H        GLY  35   3.687   2.969  -2.586
  666   1HA   GLY  35          1HA       GLY  35   1.674   1.528  -2.347
  667   2HA   GLY  35          2HA       GLY  35   1.938   1.619  -0.617
  668    H    CYS  36           H        CYS  36   2.715   4.429  -2.630
  669    HA   CYS  36           HA       CYS  36   0.262   5.697  -1.646
  670   1HB   CYS  36          1HB       CYS  36   2.987   6.960  -1.967
  671   2HB   CYS  36          2HB       CYS  36   1.511   7.801  -1.482
  672    H    CYS  37           H        CYS  37  -0.281   7.712  -3.087
  673    HA   CYS  37           HA       CYS  37   0.327   6.988  -5.862
  674   1HB   CYS  37          1HB       CYS  37  -2.086   6.817  -4.855
  675   2HB   CYS  37          2HB       CYS  37  -2.105   8.564  -5.111
  676    H    PHE  38           H        PHE  38   1.308   8.583  -7.104
  677    HA   PHE  38           HA       PHE  38   1.776  11.126  -5.750
  678   1HB   PHE  38          1HB       PHE  38   3.575   9.504  -6.753
  679   2HB   PHE  38          2HB       PHE  38   2.976   9.998  -8.341
  680    HD1  PHE  38           HD1      PHE  38   2.987  12.558  -8.802
  681    HD2  PHE  38           HD2      PHE  38   5.266  10.704  -5.740
  682    HE1  PHE  38           HE1      PHE  38   4.527  14.539  -8.749
  683    HE2  PHE  38           HE2      PHE  38   6.806  12.686  -5.687
  684    HZ   PHE  38           HZ       PHE  38   6.419  14.580  -7.193
  685    H    ASP  39           H        ASP  39   0.555  12.861  -6.308
  686    HA   ASP  39           HA       ASP  39  -1.063  12.692  -8.638
  687   1HB   ASP  39          1HB       ASP  39  -1.925  13.730  -6.598
  688   2HB   ASP  39          2HB       ASP  39  -0.601  14.905  -6.587
  689    H    SER  40           H        SER  40   0.880  15.520  -7.442
  690    HA   SER  40           HA       SER  40   2.563  16.603  -8.388
  691   1HB   SER  40          1HB       SER  40   2.895  14.360  -9.774
  692   2HB   SER  40          2HB       SER  40   2.228  15.330 -11.101
  693    HG   SER  40           HG       SER  40   4.208  16.652  -9.633
  694    H    ARG  41           H        ARG  41  -0.649  16.175  -9.545
  695    HA   ARG  41           HA       ARG  41  -0.665  18.113 -11.547
  696   1HB   ARG  41          1HB       ARG  41  -2.942  17.181  -9.738
  697   2HB   ARG  41          2HB       ARG  41  -3.142  18.019 -11.286
  698   1HG   ARG  41          1HG       ARG  41  -1.627  16.000 -12.161
  699   2HG   ARG  41          2HG       ARG  41  -2.269  15.187 -10.724
  700   1HD   ARG  41          1HD       ARG  41  -4.258  14.855 -11.747
  701   2HD   ARG  41          2HD       ARG  41  -4.410  16.574 -12.138
  702    HE   ARG  41           HE       ARG  41  -3.561  16.134 -14.289
  703   1HH1  ARG  41          1HH1      ARG  41  -3.103  13.320 -12.226
  704   2HH1  ARG  41          2HH1      ARG  41  -2.630  12.282 -13.529
  705   1HH2  ARG  41          1HH2      ARG  41  -2.937  14.764 -16.009
  706   2HH2  ARG  41          2HH2      ARG  41  -2.535  13.109 -15.696
  707    H    ILE  42           H        ILE  42  -1.334  18.161  -7.997
  708    HA   ILE  42           HA       ILE  42  -1.333  21.095  -8.159
  709    HB   ILE  42           HB       ILE  42  -2.695  19.747  -5.898
  710   1HG1  ILE  42          1HG1      ILE  42  -3.756  19.733  -8.721
  711   2HG1  ILE  42          2HG1      ILE  42  -3.582  18.362  -7.611
  712   1HG2  ILE  42          1HG2      ILE  42  -4.004  21.933  -7.362
  713   2HG2  ILE  42          2HG2      ILE  42  -3.659  21.749  -5.626
  714   3HG2  ILE  42          3HG2      ILE  42  -2.391  22.339  -6.728
  715   1HD1  ILE  42          1HD1      ILE  42  -5.711  20.437  -7.780
  716   2HD1  ILE  42          2HD1      ILE  42  -5.804  18.754  -7.208
  717   3HD1  ILE  42          3HD1      ILE  42  -5.184  20.028  -6.130
  718    HA   PRO  43           HA       PRO  43   2.227  20.358  -5.709
  719   1HB   PRO  43          1HB       PRO  43   3.266  22.876  -5.912
  720   2HB   PRO  43          2HB       PRO  43   3.583  21.605  -7.091
  721   1HG   PRO  43          1HG       PRO  43   1.782  23.936  -7.253
  722   2HG   PRO  43          2HG       PRO  43   2.457  22.943  -8.595
  723   1HD   PRO  43          1HD       PRO  43  -0.198  22.917  -7.522
  724   2HD   PRO  43          2HD       PRO  43   0.461  21.810  -8.733
  725    H    GLY  44           H        GLY  44  -0.494  22.105  -5.095
  726   1HA   GLY  44          1HA       GLY  44   0.490  23.119  -2.527
  727   2HA   GLY  44          2HA       GLY  44  -1.042  23.484  -3.296
  728    H    VAL  45           H        VAL  45  -0.683  20.208  -3.780
  729    HA   VAL  45           HA       VAL  45  -1.993  19.585  -1.224
  730    HB   VAL  45           HB       VAL  45  -3.585  18.328  -2.287
  731   1HG1  VAL  45          1HG1      VAL  45  -4.128  20.559  -2.856
  732   2HG1  VAL  45          2HG1      VAL  45  -2.887  20.625  -4.130
  733   3HG1  VAL  45          3HG1      VAL  45  -4.342  19.625  -4.356
  734   1HG2  VAL  45          1HG2      VAL  45  -2.902  16.778  -3.744
  735   2HG2  VAL  45          2HG2      VAL  45  -2.955  18.034  -5.004
  736   3HG2  VAL  45          3HG2      VAL  45  -1.435  17.707  -4.138
  737    HA   PRO  46           HA       PRO  46   0.705  16.208  -0.879
  738   1HB   PRO  46          1HB       PRO  46  -0.814  13.993  -0.376
  739   2HB   PRO  46          2HB       PRO  46  -0.451  15.211   0.845
  740   1HG   PRO  46          1HG       PRO  46  -2.927  14.740  -0.687
  741   2HG   PRO  46          2HG       PRO  46  -2.717  15.637   0.860
  742   1HD   PRO  46          1HD       PRO  46  -3.129  16.695  -1.768
  743   2HD   PRO  46          2HD       PRO  46  -2.767  17.619  -0.304
  744    H    TRP  47           H        TRP  47   2.064  15.623  -2.440
  745    HA   TRP  47           HA       TRP  47   0.852  14.447  -4.799
  746   1HB   TRP  47          1HB       TRP  47   3.752  14.659  -4.763
  747   2HB   TRP  47          2HB       TRP  47   2.576  15.287  -5.918
  748    HD1  TRP  47           HD1      TRP  47   1.438  17.766  -5.165
  749    HE1  TRP  47           HE1      TRP  47   2.458  19.848  -3.904
  750    HE3  TRP  47           HE3      TRP  47   5.343  15.257  -3.088
  751    HZ2  TRP  47           HZ2      TRP  47   4.733  20.203  -2.218
  752    HZ3  TRP  47           HZ3      TRP  47   6.917  16.545  -1.648
  753    HH2  TRP  47           HH2      TRP  47   6.662  18.935  -1.200
  754    H    CYS  48           H        CYS  48   0.852  13.051  -2.138
  755    HA   CYS  48           HA       CYS  48   1.700  10.539  -3.080
  756   1HB   CYS  48          1HB       CYS  48   3.903  11.505  -2.459
  757   2HB   CYS  48          2HB       CYS  48   3.339  11.640  -0.791
  758    H    PHE  49           H        PHE  49  -0.295   9.696  -2.466
  759    HA   PHE  49           HA       PHE  49  -0.861   9.774   0.397
  760   1HB   PHE  49          1HB       PHE  49  -3.366   9.883  -0.683
  761   2HB   PHE  49          2HB       PHE  49  -2.475  11.352  -0.272
  762    HD1  PHE  49           HD1      PHE  49  -0.827  12.130  -2.257
  763    HD2  PHE  49           HD2      PHE  49  -4.347   9.812  -2.748
  764    HE1  PHE  49           HE1      PHE  49  -0.988  12.879  -4.648
  765    HE2  PHE  49           HE2      PHE  49  -4.508  10.561  -5.138
  766    HZ   PHE  49           HZ       PHE  49  -2.826  12.086  -6.059
  767    H    LYS  50           H        LYS  50  -3.209   8.311   0.447
  768    HA   LYS  50           HA       LYS  50  -2.445   5.843  -0.954
  769   1HB   LYS  50          1HB       LYS  50  -3.003   6.380   1.899
  770   2HB   LYS  50          2HB       LYS  50  -3.748   4.917   1.233
  771   1HG   LYS  50          1HG       LYS  50  -1.744   3.937   1.624
  772   2HG   LYS  50          2HG       LYS  50  -1.171   4.811   0.192
  773   1HD   LYS  50          1HD       LYS  50   0.376   5.268   1.977
  774   2HD   LYS  50          2HD       LYS  50  -0.575   6.745   1.747
  775   1HE   LYS  50          1HE       LYS  50  -2.038   6.074   3.645
  776   2HE   LYS  50          2HE       LYS  50  -1.072   4.609   3.877
  777   1HZ   LYS  50          1HZ       LYS  50   0.579   5.793   4.781
  778   2HZ   LYS  50          2HZ       LYS  50   0.367   7.101   3.826
  779   3HZ   LYS  50          3HZ       LYS  50  -0.601   6.870   5.121
  780    HA   PRO  51           HA       PRO  51  -6.640   7.084  -2.141
  781   1HB   PRO  51          1HB       PRO  51  -6.265   7.112  -4.846
  782   2HB   PRO  51          2HB       PRO  51  -6.156   8.557  -3.843
  783   1HG   PRO  51          1HG       PRO  51  -4.019   6.922  -5.053
  784   2HG   PRO  51          2HG       PRO  51  -3.935   8.620  -4.460
  785   1HD   PRO  51          1HD       PRO  51  -2.919   6.246  -3.220
  786   2HD   PRO  51          2HD       PRO  51  -2.952   7.871  -2.521
  787    H    LEU  52           H        LEU  52  -5.974   5.534  -5.066
  788    HA   LEU  52           HA       LEU  52  -7.426   3.216  -4.057
  789   1HB   LEU  52          1HB       LEU  52  -8.227   2.905  -6.139
  790   2HB   LEU  52          2HB       LEU  52  -8.014   4.665  -6.150
  791    HG   LEU  52           HG       LEU  52  -5.595   3.693  -7.113
  792   1HD1  LEU  52          1HD1      LEU  52  -7.279   2.308  -9.003
  793   2HD1  LEU  52          2HD1      LEU  52  -5.825   1.743  -8.145
  794   3HD1  LEU  52          3HD1      LEU  52  -7.427   1.580  -7.386
  795   1HD2  LEU  52          1HD2      LEU  52  -6.040   5.088  -8.815
  796   2HD2  LEU  52          2HD2      LEU  52  -7.613   4.331  -9.165
  797   3HD2  LEU  52          3HD2      LEU  52  -7.472   5.522  -7.850
  798    H    GLN  53           H        GLN  53  -4.823   3.422  -3.055
  799    HA   GLN  53           HA       GLN  53  -2.843   2.335  -4.562
  800   1HB   GLN  53          1HB       GLN  53  -3.444   2.005  -1.601
  801   2HB   GLN  53          2HB       GLN  53  -1.907   1.529  -2.343
  802   1HG   GLN  53          1HG       GLN  53  -3.120   4.326  -2.345
  803   2HG   GLN  53          2HG       GLN  53  -1.766   3.796  -1.336
  804   1HE2  GLN  53          1HE2      GLN  53  -0.564   2.119  -3.322
  805   2HE2  GLN  53          2HE2      GLN  53   0.171   3.131  -4.521
  806    H    GLU  54           H        GLU  54  -5.798   0.862  -3.496
  807    HA   GLU  54           HA       GLU  54  -5.250  -1.683  -2.994
  808   1HB   GLU  54          1HB       GLU  54  -7.430  -2.202  -3.697
  809   2HB   GLU  54          2HB       GLU  54  -7.525  -0.465  -3.354
  810   1HG   GLU  54          1HG       GLU  54  -8.405  -0.303  -5.439
  811   2HG   GLU  54          2HG       GLU  54  -6.740  -0.490  -6.013
  812    H    ALA  55           H        ALA  55  -4.594   0.017  -5.996
  813    HA   ALA  55           HA       ALA  55  -4.637  -1.728  -7.974
  814   1HB   ALA  55          1HB       ALA  55  -3.507   0.622  -7.722
  815   2HB   ALA  55          2HB       ALA  55  -2.029  -0.315  -7.398
  816   3HB   ALA  55          3HB       ALA  55  -2.886  -0.511  -8.946
  817    H    GLU  56           H        GLU  56  -1.755  -1.597  -5.753
  818    HA   GLU  56           HA       GLU  56  -1.707  -4.488  -5.873
  819   1HB   GLU  56          1HB       GLU  56   0.153  -2.746  -7.253
  820   2HB   GLU  56          2HB       GLU  56   1.017  -3.696  -6.031
  821   1HG   GLU  56          1HG       GLU  56   1.037  -5.335  -7.600
  822   2HG   GLU  56          2HG       GLU  56  -0.663  -5.588  -7.175
  823    H    CYS  57           H        CYS  57  -2.389  -2.299  -3.880
  824    HA   CYS  57           HA       CYS  57  -0.245  -2.737  -1.948
  825   1HB   CYS  57          1HB       CYS  57  -1.567  -0.447  -2.648
  826   2HB   CYS  57          2HB       CYS  57  -2.442  -0.939  -1.194
  827    H    THR  58           H        THR  58  -3.875  -2.701  -2.264
  828    HA   THR  58           HA       THR  58  -4.302  -4.068   0.174
  829    HB   THR  58           HB       THR  58  -5.885  -2.535  -1.206
  830    HG1  THR  58           HG1      THR  58  -7.667  -3.971  -0.444
  831   1HG2  THR  58          1HG2      THR  58  -6.207  -5.213  -2.656
  832   2HG2  THR  58          2HG2      THR  58  -7.437  -3.926  -2.683
  833   3HG2  THR  58          3HG2      THR  58  -5.832  -3.637  -3.395
  834    H    PHE  59           H        PHE  59  -3.964  -5.146  -3.239
  835    HA   PHE  59           HA       PHE  59  -4.803  -7.636  -3.241
  836   1HB   PHE  59          1HB       PHE  59  -2.741  -6.054  -4.470
  837   2HB   PHE  59          2HB       PHE  59  -1.980  -7.597  -4.071
  838    HD1  PHE  59           HD1      PHE  59  -1.881  -9.001  -5.884
  839    HD2  PHE  59           HD2      PHE  59  -5.323  -6.566  -5.401
  840    HE1  PHE  59           HE1      PHE  59  -2.889 -10.017  -7.946
  841    HE2  PHE  59           HE2      PHE  59  -6.331  -7.582  -7.464
  842    HZ   PHE  59           HZ       PHE  59  -5.101  -9.295  -8.712
  Start of MODEL    4
    1   1H    GLU   1           H1       GLU   1 -15.281  -8.103  -3.991
    2    HA   GLU   1           HA       GLU   1 -15.687  -5.935  -2.191
    3   1HB   GLU   1          1HB       GLU   1 -18.001  -7.703  -3.047
    4   2HB   GLU   1          2HB       GLU   1 -18.014  -6.801  -1.523
    5   1HG   GLU   1          1HG       GLU   1 -18.610  -4.919  -2.607
    6   2HG   GLU   1          2HG       GLU   1 -17.208  -5.037  -3.679
    7    H    GLU   2           H        GLU   2 -16.240  -9.472  -2.797
    8    HA   GLU   2           HA       GLU   2 -15.877 -10.167  -0.115
    9   1HB   GLU   2          1HB       GLU   2 -16.945 -11.459  -2.145
   10   2HB   GLU   2          2HB       GLU   2 -15.302 -12.083  -2.381
   11   1HG   GLU   2          1HG       GLU   2 -15.289 -13.165  -0.281
   12   2HG   GLU   2          2HG       GLU   2 -16.609 -12.170   0.356
   13    H    TYR   3           H        TYR   3 -13.873  -8.649   0.073
   14    HA   TYR   3           HA       TYR   3 -11.441  -9.511  -1.088
   15   1HB   TYR   3          1HB       TYR   3 -12.499  -7.667   1.074
   16   2HB   TYR   3          2HB       TYR   3 -10.770  -8.028   1.126
   17    HD1  TYR   3           HD1      TYR   3  -9.669  -7.852  -1.396
   18    HD2  TYR   3           HD2      TYR   3 -13.063  -5.687   0.051
   19    HE1  TYR   3           HE1      TYR   3  -9.261  -6.038  -3.130
   20    HE2  TYR   3           HE2      TYR   3 -12.643  -3.880  -1.688
   21    HH   TYR   3           HH       TYR   3 -10.854  -4.295  -4.319
   22    H    VAL   4           H        VAL   4 -11.141 -11.753  -0.673
   23    HA   VAL   4           HA       VAL   4 -10.908 -12.465   2.158
   24    HB   VAL   4           HB       VAL   4 -11.052 -14.753   1.406
   25   1HG1  VAL   4          1HG1      VAL   4 -13.333 -14.791   0.685
   26   2HG1  VAL   4          2HG1      VAL   4 -13.135 -13.367   1.736
   27   3HG1  VAL   4          3HG1      VAL   4 -13.201 -13.167  -0.032
   28   1HG2  VAL   4          1HG2      VAL   4 -11.540 -15.221  -1.038
   29   2HG2  VAL   4          2HG2      VAL   4 -10.989 -13.563  -1.382
   30   3HG2  VAL   4          3HG2      VAL   4  -9.867 -14.742  -0.663
   31    H    GLY   5           H        GLY   5  -9.207 -12.876  -1.029
   32   1HA   GLY   5          1HA       GLY   5  -6.772 -13.716   0.200
   33   2HA   GLY   5          2HA       GLY   5  -7.030 -13.284  -1.479
   34    H    LEU   6           H        LEU   6  -8.237 -10.830   0.605
   35    HA   LEU   6           HA       LEU   6  -5.672  -9.439   0.664
   36   1HB   LEU   6          1HB       LEU   6  -8.021  -7.862  -0.196
   37   2HB   LEU   6          2HB       LEU   6  -6.303  -7.670  -0.593
   38    HG   LEU   6           HG       LEU   6  -7.592  -8.220  -2.570
   39   1HD1  LEU   6          1HD1      LEU   6  -5.303  -9.587  -1.684
   40   2HD1  LEU   6          2HD1      LEU   6  -6.339 -10.817  -2.447
   41   3HD1  LEU   6          3HD1      LEU   6  -5.863  -9.365  -3.359
   42   1HD2  LEU   6          1HD2      LEU   6  -9.164  -9.747  -0.910
   43   2HD2  LEU   6          2HD2      LEU   6  -9.231  -9.734  -2.688
   44   3HD2  LEU   6          3HD2      LEU   6  -8.276 -10.976  -1.843
   45    H    SER   7           H        SER   7  -7.932 -10.808   2.438
   46    HA   SER   7           HA       SER   7  -8.824  -8.608   3.989
   47   1HB   SER   7          1HB       SER   7  -9.754 -11.117   3.612
   48   2HB   SER   7          2HB       SER   7  -8.863 -11.381   5.122
   49    HG   SER   7           HG       SER   7 -10.491  -9.075   5.046
   50    H    ALA   8           H        ALA   8  -8.499  -9.510   6.656
   51    HA   ALA   8           HA       ALA   8  -5.858  -8.628   7.167
   52   1HB   ALA   8          1HB       ALA   8  -7.987  -9.859   8.964
   53   2HB   ALA   8          2HB       ALA   8  -6.508  -9.047   9.530
   54   3HB   ALA   8          3HB       ALA   8  -7.748  -8.125   8.647
   55    H    ASN   9           H        ASN   9  -7.366 -11.744   6.574
   56    HA   ASN   9           HA       ASN   9  -5.208 -13.148   7.841
   57   1HB   ASN   9          1HB       ASN   9  -7.868 -13.753   7.310
   58   2HB   ASN   9          2HB       ASN   9  -7.032 -14.675   6.052
   59   1HD2  ASN   9          1HD2      ASN   9  -4.979 -15.796   6.905
   60   2HD2  ASN   9          2HD2      ASN   9  -5.151 -16.701   8.373
   61    H    GLN  10           H        GLN  10  -5.648 -11.455   4.982
   62    HA   GLN  10           HA       GLN  10  -4.743 -13.271   3.070
   63   1HB   GLN  10          1HB       GLN  10  -5.013 -11.538   1.630
   64   2HB   GLN  10          2HB       GLN  10  -5.788 -10.740   3.011
   65   1HG   GLN  10          1HG       GLN  10  -4.247  -9.113   2.495
   66   2HG   GLN  10          2HG       GLN  10  -3.216 -10.094   3.547
   67   1HE2  GLN  10          1HE2      GLN  10  -3.838  -8.915   0.392
   68   2HE2  GLN  10          2HE2      GLN  10  -2.498  -9.628  -0.441
   69    H    CYS  11           H        CYS  11  -3.103 -11.033   5.338
   70    HA   CYS  11           HA       CYS  11  -0.564 -11.265   4.152
   71   1HB   CYS  11          1HB       CYS  11  -0.965  -9.400   5.519
   72   2HB   CYS  11          2HB       CYS  11  -1.515 -10.389   6.874
   73    H    ALA  12           H        ALA  12  -2.563 -13.554   5.597
   74    HA   ALA  12           HA       ALA  12  -0.370 -14.995   6.880
   75   1HB   ALA  12          1HB       ALA  12  -3.034 -16.231   6.897
   76   2HB   ALA  12          2HB       ALA  12  -1.962 -15.813   8.256
   77   3HB   ALA  12          3HB       ALA  12  -3.039 -14.579   7.559
   78    H    VAL  13           H        VAL  13  -0.938 -14.503   3.843
   79    HA   VAL  13           HA       VAL  13  -1.813 -16.796   2.629
   80    HB   VAL  13           HB       VAL  13  -0.699 -14.390   1.890
   81   1HG1  VAL  13          1HG1      VAL  13   1.120 -16.596   0.864
   82   2HG1  VAL  13          2HG1      VAL  13   1.153 -14.885   0.375
   83   3HG1  VAL  13          3HG1      VAL  13   1.574 -15.343   2.043
   84   1HG2  VAL  13          1HG2      VAL  13  -2.085 -16.605   0.681
   85   2HG2  VAL  13          2HG2      VAL  13  -2.100 -14.884   0.229
   86   3HG2  VAL  13          3HG2      VAL  13  -0.869 -15.971  -0.456
   87    HA   PRO  14           HA       PRO  14   1.249 -19.783   3.237
   88   1HB   PRO  14          1HB       PRO  14   1.379 -21.098   0.846
   89   2HB   PRO  14          2HB       PRO  14   0.102 -21.374   2.029
   90   1HG   PRO  14          1HG       PRO  14   0.051 -19.852  -0.497
   91   2HG   PRO  14          2HG       PRO  14  -1.334 -20.524   0.437
   92   1HD   PRO  14          1HD       PRO  14  -0.462 -17.802   0.258
   93   2HD   PRO  14          2HD       PRO  14  -1.729 -18.436   1.317
   94    H    ALA  15           H        ALA  15   2.181 -17.124   2.426
   95    HA   ALA  15           HA       ALA  15   3.999 -16.140   1.578
   96   1HB   ALA  15          1HB       ALA  15   5.722 -16.630   2.966
   97   2HB   ALA  15          2HB       ALA  15   4.618 -17.842   3.659
   98   3HB   ALA  15          3HB       ALA  15   5.801 -18.323   2.419
   99    H    LYS  16           H        LYS  16   2.784 -17.119  -0.563
  100    HA   LYS  16           HA       LYS  16   4.930 -17.740  -2.296
  101   1HB   LYS  16          1HB       LYS  16   3.961 -19.923  -3.101
  102   2HB   LYS  16          2HB       LYS  16   4.802 -19.978  -1.542
  103   1HG   LYS  16          1HG       LYS  16   2.943 -20.855  -0.628
  104   2HG   LYS  16          2HG       LYS  16   2.081 -19.345  -0.968
  105   1HD   LYS  16          1HD       LYS  16   0.744 -20.703  -2.222
  106   2HD   LYS  16          2HD       LYS  16   2.021 -20.529  -3.441
  107   1HE   LYS  16          1HE       LYS  16   2.955 -22.639  -2.925
  108   2HE   LYS  16          2HE       LYS  16   2.169 -22.717  -1.340
  109   1HZ   LYS  16          1HZ       LYS  16   0.969 -24.108  -2.736
  110   2HZ   LYS  16          2HZ       LYS  16   0.048 -22.762  -2.651
  111   3HZ   LYS  16          3HZ       LYS  16   0.951 -23.051  -3.980
  112    H    ASP  17           H        ASP  17   2.804 -15.739  -1.824
  113    HA   ASP  17           HA       ASP  17   1.844 -15.721  -4.505
  114   1HB   ASP  17          1HB       ASP  17   0.119 -17.029  -3.146
  115   2HB   ASP  17          2HB       ASP  17  -0.177 -15.545  -2.226
  116    H    ARG  18           H        ARG  18   3.503 -14.257  -2.282
  117    HA   ARG  18           HA       ARG  18   2.008 -11.841  -1.960
  118   1HB   ARG  18          1HB       ARG  18   4.880 -12.537  -1.191
  119   2HB   ARG  18          2HB       ARG  18   4.012 -11.084  -0.666
  120   1HG   ARG  18          1HG       ARG  18   2.743 -12.239   0.858
  121   2HG   ARG  18          2HG       ARG  18   2.649 -13.696  -0.146
  122   1HD   ARG  18          1HD       ARG  18   4.840 -14.406   0.530
  123   2HD   ARG  18          2HD       ARG  18   5.225 -12.830   1.236
  124    HE   ARG  18           HE       ARG  18   2.890 -14.108   2.448
  125   1HH1  ARG  18          1HH1      ARG  18   6.401 -13.894   2.517
  126   2HH1  ARG  18          2HH1      ARG  18   6.529 -14.424   4.161
  127   1HH2  ARG  18          1HH2      ARG  18   3.057 -14.807   4.618
  128   2HH2  ARG  18          2HH2      ARG  18   4.614 -14.946   5.364
  129    H    VAL  19           H        VAL  19   3.476  -9.697  -2.344
  130    HA   VAL  19           HA       VAL  19   4.416  -9.924  -5.110
  131    HB   VAL  19           HB       VAL  19   3.651  -7.415  -3.624
  132   1HG1  VAL  19          1HG1      VAL  19   3.010  -7.291  -6.374
  133   2HG1  VAL  19          2HG1      VAL  19   4.315  -6.438  -5.517
  134   3HG1  VAL  19          3HG1      VAL  19   4.631  -8.019  -6.271
  135   1HG2  VAL  19          1HG2      VAL  19   1.750  -8.968  -3.509
  136   2HG2  VAL  19          2HG2      VAL  19   1.407  -7.604  -4.601
  137   3HG2  VAL  19          3HG2      VAL  19   1.825  -9.199  -5.272
  138    H    ASP  20           H        ASP  20   5.869 -10.559  -2.458
  139    HA   ASP  20           HA       ASP  20   7.694  -9.944  -1.357
  140   1HB   ASP  20          1HB       ASP  20   8.820 -11.284  -2.871
  141   2HB   ASP  20          2HB       ASP  20   8.343 -10.303  -4.266
  142    H    CYS  21           H        CYS  21   7.286  -7.803  -0.495
  143    HA   CYS  21           HA       CYS  21   7.260  -5.472  -1.922
  144   1HB   CYS  21          1HB       CYS  21   6.971  -6.175   0.693
  145   2HB   CYS  21          2HB       CYS  21   8.485  -5.266   0.748
  146    H    GLY  22           H        GLY  22   9.973  -7.456  -0.693
  147   1HA   GLY  22          1HA       GLY  22  12.194  -7.351  -1.019
  148   2HA   GLY  22          2HA       GLY  22  11.837  -6.521  -2.521
  149    H    TYR  23           H        TYR  23  11.517  -5.686   1.011
  150    HA   TYR  23           HA       TYR  23  12.478  -3.018   0.411
  151   1HB   TYR  23          1HB       TYR  23  10.638  -4.238   2.141
  152   2HB   TYR  23          2HB       TYR  23  12.016  -3.987   3.216
  153    HD1  TYR  23           HD1      TYR  23  11.485  -2.206   4.618
  154    HD2  TYR  23           HD2      TYR  23  10.625  -1.881   0.440
  155    HE1  TYR  23           HE1      TYR  23  10.763   0.210   4.947
  156    HE2  TYR  23           HE2      TYR  23   9.906   0.534   0.783
  157    HH   TYR  23           HH       TYR  23  10.593   2.231   3.623
  158    HA   PRO  24           HA       PRO  24  16.510  -3.859   1.762
  159   1HB   PRO  24          1HB       PRO  24  17.414  -1.304   2.107
  160   2HB   PRO  24          2HB       PRO  24  17.356  -2.103   0.537
  161   1HG   PRO  24          1HG       PRO  24  15.577  -0.051   1.688
  162   2HG   PRO  24          2HG       PRO  24  15.805  -0.496  -0.040
  163   1HD   PRO  24          1HD       PRO  24  13.620  -1.146   1.693
  164   2HD   PRO  24          2HD       PRO  24  13.875  -1.742   0.047
  165    H    HIS  25           H        HIS  25  14.136  -2.523   3.685
  166    HA   HIS  25           HA       HIS  25  15.855  -3.009   6.005
  167   1HB   HIS  25          1HB       HIS  25  14.500  -0.578   5.228
  168   2HB   HIS  25          2HB       HIS  25  13.896  -1.150   6.787
  169    HD1  HIS  25           HD1      HIS  25  15.763   1.429   6.239
  170    HD2  HIS  25           HD2      HIS  25  16.984  -2.288   7.750
  171    HE1  HIS  25           HE1      HIS  25  17.918   1.857   7.537
  172    HE2  HIS  25           HE2      HIS  25  18.590  -0.453   8.487
  173    H    VAL  26           H        VAL  26  14.246  -4.959   4.663
  174    HA   VAL  26           HA       VAL  26  11.666  -5.186   5.637
  175    HB   VAL  26           HB       VAL  26  12.246  -6.582   3.891
  176   1HG1  VAL  26          1HG1      VAL  26  14.535  -6.667   3.710
  177   2HG1  VAL  26          2HG1      VAL  26  14.772  -7.052   5.432
  178   3HG1  VAL  26          3HG1      VAL  26  14.217  -8.313   4.306
  179   1HG2  VAL  26          1HG2      VAL  26  11.041  -7.695   5.919
  180   2HG2  VAL  26          2HG2      VAL  26  11.631  -8.717   4.585
  181   3HG2  VAL  26          3HG2      VAL  26  12.560  -8.607   6.100
  182    H    THR  27           H        THR  27  10.909  -5.317   7.680
  183    HA   THR  27           HA       THR  27  12.037  -7.109   9.560
  184    HB   THR  27           HB       THR  27  13.209  -4.462   9.401
  185    HG1  THR  27           HG1      THR  27  14.320  -6.423   9.970
  186   1HG2  THR  27          1HG2      THR  27  12.821  -3.557  11.552
  187   2HG2  THR  27          2HG2      THR  27  11.184  -4.085  11.093
  188   3HG2  THR  27          3HG2      THR  27  12.171  -5.091  12.182
  189    HA   PRO  28           HA       PRO  28   8.052  -6.646  11.082
  190   1HB   PRO  28          1HB       PRO  28   8.302  -7.703  13.589
  191   2HB   PRO  28          2HB       PRO  28   8.142  -8.691  12.139
  192   1HG   PRO  28          1HG       PRO  28  10.526  -8.082  13.767
  193   2HG   PRO  28          2HG       PRO  28  10.272  -9.439  12.610
  194   1HD   PRO  28          1HD       PRO  28  11.821  -7.057  12.247
  195   2HD   PRO  28          2HD       PRO  28  11.471  -8.285  11.023
  196    H    LYS  29           H        LYS  29   8.886  -4.216  10.901
  197    HA   LYS  29           HA       LYS  29   7.558  -2.894  12.920
  198   1HB   LYS  29          1HB       LYS  29   9.286  -3.644  14.436
  199   2HB   LYS  29          2HB       LYS  29  10.553  -2.978  13.392
  200   1HG   LYS  29          1HG       LYS  29  10.218  -0.866  14.158
  201   2HG   LYS  29          2HG       LYS  29   8.453  -1.016  14.099
  202   1HD   LYS  29          1HD       LYS  29  10.169  -2.327  16.242
  203   2HD   LYS  29          2HD       LYS  29   9.488  -0.701  16.429
  204   1HE   LYS  29          1HE       LYS  29   7.307  -1.495  16.590
  205   2HE   LYS  29          2HE       LYS  29   7.638  -2.947  15.635
  206   1HZ   LYS  29          1HZ       LYS  29   8.806  -2.528  18.287
  207   2HZ   LYS  29          2HZ       LYS  29   7.341  -3.224  18.093
  208   3HZ   LYS  29          3HZ       LYS  29   8.669  -3.928  17.455
  209    H    GLU  30           H        GLU  30   9.947  -3.078  10.336
  210    HA   GLU  30           HA       GLU  30   9.612  -0.246   9.831
  211   1HB   GLU  30          1HB       GLU  30  11.698  -2.210   9.362
  212   2HB   GLU  30          2HB       GLU  30  11.288  -1.387   7.846
  213   1HG   GLU  30          1HG       GLU  30  12.108   0.620   8.575
  214   2HG   GLU  30          2HG       GLU  30  11.528   0.386  10.230
  215    H    CYS  31           H        CYS  31   9.161  -3.487   8.291
  216    HA   CYS  31           HA       CYS  31   8.135  -2.507   5.890
  217   1HB   CYS  31          1HB       CYS  31   8.169  -5.120   7.302
  218   2HB   CYS  31          2HB       CYS  31   6.993  -4.917   5.999
  219    H    ASN  32           H        ASN  32   6.492  -3.900   8.832
  220    HA   ASN  32           HA       ASN  32   3.936  -3.367   7.965
  221   1HB   ASN  32          1HB       ASN  32   5.289  -4.017  10.536
  222   2HB   ASN  32          2HB       ASN  32   3.737  -3.186  10.729
  223   1HD2  ASN  32          1HD2      ASN  32   5.177  -5.682   8.626
  224   2HD2  ASN  32          2HD2      ASN  32   3.886  -6.830   8.734
  225    H    ASN  33           H        ASN  33   6.449  -1.212   8.706
  226    HA   ASN  33           HA       ASN  33   4.619   0.806   9.719
  227   1HB   ASN  33          1HB       ASN  33   6.602   0.599  11.088
  228   2HB   ASN  33          2HB       ASN  33   7.668   0.592   9.676
  229   1HD2  ASN  33          1HD2      ASN  33   8.678   2.396   9.287
  230   2HD2  ASN  33          2HD2      ASN  33   8.170   4.001   9.699
  231    H    ARG  34           H        ARG  34   6.625  -0.254   7.008
  232    HA   ARG  34           HA       ARG  34   6.581   2.332   5.777
  233   1HB   ARG  34          1HB       ARG  34   8.164   1.486   4.310
  234   2HB   ARG  34          2HB       ARG  34   8.415   0.360   5.655
  235   1HG   ARG  34          1HG       ARG  34   8.160  -1.178   3.968
  236   2HG   ARG  34          2HG       ARG  34   6.444  -0.967   4.357
  237   1HD   ARG  34          1HD       ARG  34   7.040   1.114   2.552
  238   2HD   ARG  34          2HD       ARG  34   7.902  -0.290   1.903
  239    HE   ARG  34           HE       ARG  34   5.079  -0.702   2.714
  240   1HH1  ARG  34          1HH1      ARG  34   7.379  -0.167   0.105
  241   2HH1  ARG  34          2HH1      ARG  34   6.300  -0.721  -1.132
  242   1HH2  ARG  34          1HH2      ARG  34   3.655  -1.433   1.084
  243   2HH2  ARG  34          2HH2      ARG  34   4.167  -1.446  -0.571
  244    H    GLY  35           H        GLY  35   4.775  -0.695   5.795
  245   1HA   GLY  35          1HA       GLY  35   2.473  -0.390   4.939
  246   2HA   GLY  35          2HA       GLY  35   3.196   0.234   3.470
  247    H    CYS  36           H        CYS  36   4.893  -2.353   5.165
  248    HA   CYS  36           HA       CYS  36   3.898  -4.220   3.136
  249   1HB   CYS  36          1HB       CYS  36   6.680  -3.953   4.277
  250   2HB   CYS  36          2HB       CYS  36   6.140  -5.315   3.291
  251    H    CYS  37           H        CYS  37   4.487  -6.622   3.993
  252    HA   CYS  37           HA       CYS  37   3.763  -6.670   6.834
  253   1HB   CYS  37          1HB       CYS  37   1.992  -7.344   5.080
  254   2HB   CYS  37          2HB       CYS  37   2.945  -8.818   4.896
  255    H    PHE  38           H        PHE  38   5.311  -7.674   8.078
  256    HA   PHE  38           HA       PHE  38   7.424  -9.087   6.689
  257   1HB   PHE  38          1HB       PHE  38   7.799  -7.311   8.461
  258   2HB   PHE  38          2HB       PHE  38   6.932  -8.314   9.629
  259    HD1  PHE  38           HD1      PHE  38   8.032 -10.106  10.738
  260    HD2  PHE  38           HD2      PHE  38   9.993  -8.058   7.580
  261    HE1  PHE  38           HE1      PHE  38  10.193 -11.227  11.352
  262    HE2  PHE  38           HE2      PHE  38  12.153  -9.180   8.194
  263    HZ   PHE  38           HZ       PHE  38  12.227 -10.751  10.073
  264    H    ASP  39           H        ASP  39   7.476 -11.274   6.508
  265    HA   ASP  39           HA       ASP  39   5.558 -12.760   8.041
  266   1HB   ASP  39          1HB       ASP  39   5.700 -13.362   5.731
  267   2HB   ASP  39          2HB       ASP  39   7.468 -13.423   5.768
  268    H    SER  40           H        SER  40   8.864 -13.796   6.996
  269    HA   SER  40           HA       SER  40  10.691 -14.194   8.196
  270   1HB   SER  40          1HB       SER  40   9.460 -12.689  10.053
  271   2HB   SER  40          2HB       SER  40   9.337 -14.254  10.875
  272    HG   SER  40           HG       SER  40  11.283 -13.307  11.523
  273    H    ARG  41           H        ARG  41   7.575 -15.695   8.460
  274    HA   ARG  41           HA       ARG  41   8.206 -17.945   9.908
  275   1HB   ARG  41          1HB       ARG  41   6.248 -17.557   7.600
  276   2HB   ARG  41          2HB       ARG  41   6.251 -18.983   8.653
  277   1HG   ARG  41          1HG       ARG  41   6.200 -17.000  10.521
  278   2HG   ARG  41          2HG       ARG  41   5.344 -16.185   9.201
  279   1HD   ARG  41          1HD       ARG  41   3.587 -17.254  10.305
  280   2HD   ARG  41          2HD       ARG  41   3.987 -18.467   9.078
  281    HE   ARG  41           HE       ARG  41   4.773 -19.877  10.781
  282   1HH1  ARG  41          1HH1      ARG  41   4.401 -16.615  12.045
  283   2HH1  ARG  41          2HH1      ARG  41   4.683 -17.083  13.689
  284   1HH2  ARG  41          1HH2      ARG  41   5.145 -20.495  12.949
  285   2HH2  ARG  41          2HH2      ARG  41   5.108 -19.304  14.207
  286    H    ILE  42           H        ILE  42   8.451 -17.220   6.371
  287    HA   ILE  42           HA       ILE  42  10.081 -19.651   6.115
  288    HB   ILE  42           HB       ILE  42   8.684 -18.576   3.735
  289   1HG1  ILE  42          1HG1      ILE  42   7.242 -19.957   6.001
  290   2HG1  ILE  42          2HG1      ILE  42   6.861 -18.387   5.270
  291   1HG2  ILE  42          1HG2      ILE  42  10.172 -20.841   4.378
  292   2HG2  ILE  42          2HG2      ILE  42   8.492 -21.422   4.283
  293   3HG2  ILE  42          3HG2      ILE  42   9.217 -20.567   2.901
  294   1HD1  ILE  42          1HD1      ILE  42   6.253 -21.148   4.325
  295   2HD1  ILE  42          2HD1      ILE  42   5.357 -19.632   4.064
  296   3HD1  ILE  42          3HD1      ILE  42   6.780 -20.010   3.063
  297    HA   PRO  43           HA       PRO  43  13.004 -16.554   5.096
  298   1HB   PRO  43          1HB       PRO  43  15.210 -18.161   5.200
  299   2HB   PRO  43          2HB       PRO  43  14.542 -17.347   6.614
  300   1HG   PRO  43          1HG       PRO  43  14.352 -20.172   5.783
  301   2HG   PRO  43          2HG       PRO  43  14.099 -19.463   7.419
  302   1HD   PRO  43          1HD       PRO  43  12.131 -20.394   5.556
  303   2HD   PRO  43          2HD       PRO  43  11.826 -19.557   7.085
  304    H    GLY  44           H        GLY  44  11.936 -19.158   3.355
  305   1HA   GLY  44          1HA       GLY  44  13.756 -18.680   1.117
  306   2HA   GLY  44          2HA       GLY  44  12.561 -19.953   1.267
  307    H    VAL  45           H        VAL  45  10.927 -17.291   2.375
  308    HA   VAL  45           HA       VAL  45  10.047 -16.560  -0.333
  309    HB   VAL  45           HB       VAL  45   7.846 -16.669   0.297
  310   1HG1  VAL  45          1HG1      VAL  45   9.295 -18.819   1.864
  311   2HG1  VAL  45          2HG1      VAL  45   7.529 -18.795   1.645
  312   3HG1  VAL  45          3HG1      VAL  45   8.601 -18.926   0.230
  313   1HG2  VAL  45          1HG2      VAL  45   7.631 -17.065   3.064
  314   2HG2  VAL  45          2HG2      VAL  45   8.843 -15.775   2.874
  315   3HG2  VAL  45          3HG2      VAL  45   7.226 -15.591   2.153
  316    HA   PRO  46           HA       PRO  46  10.354 -12.412   0.896
  317   1HB   PRO  46          1HB       PRO  46   7.979 -11.196   0.308
  318   2HB   PRO  46          2HB       PRO  46   9.194 -11.581  -0.912
  319   1HG   PRO  46          1HG       PRO  46   6.647 -12.930  -0.279
  320   2HG   PRO  46          2HG       PRO  46   7.620 -13.020  -1.790
  321   1HD   PRO  46          1HD       PRO  46   7.384 -14.968   0.297
  322   2HD   PRO  46          2HD       PRO  46   8.477 -15.036  -1.093
  323    H    TRP  47           H        TRP  47  10.792 -11.727   2.886
  324    HA   TRP  47           HA       TRP  47   8.720 -12.215   4.863
  325   1HB   TRP  47          1HB       TRP  47  11.158 -10.921   5.779
  326   2HB   TRP  47          2HB       TRP  47  10.369 -12.396   6.340
  327    HD1  TRP  47           HD1      TRP  47  10.989 -14.678   4.741
  328    HE1  TRP  47           HE1      TRP  47  13.247 -15.417   3.592
  329    HE3  TRP  47           HE3      TRP  47  13.132 -10.066   4.786
  330    HZ2  TRP  47           HZ2      TRP  47  15.622 -14.021   2.847
  331    HZ3  TRP  47           HZ3      TRP  47  15.423  -9.841   3.828
  332    HH2  TRP  47           HH2      TRP  47  16.661 -11.723   2.882
  333    H    CYS  48           H        CYS  48   8.410 -10.203   2.651
  334    HA   CYS  48           HA       CYS  48   7.435  -8.103   4.236
  335   1HB   CYS  48          1HB       CYS  48   9.795  -7.489   4.375
  336   2HB   CYS  48          2HB       CYS  48   9.903  -7.444   2.613
  337    H    PHE  49           H        PHE  49   5.517  -8.008   3.102
  338    HA   PHE  49           HA       PHE  49   5.721  -7.468   0.247
  339   1HB   PHE  49          1HB       PHE  49   3.524  -9.100   0.347
  340   2HB   PHE  49          2HB       PHE  49   5.141  -9.736   0.024
  341    HD1  PHE  49           HD1      PHE  49   6.506 -10.324   2.234
  342    HD2  PHE  49           HD2      PHE  49   2.275 -10.112   1.980
  343    HE1  PHE  49           HE1      PHE  49   6.310 -11.803   4.253
  344    HE2  PHE  49           HE2      PHE  49   2.080 -11.592   3.998
  345    HZ   PHE  49           HZ       PHE  49   4.100 -12.420   5.110
  346    H    LYS  50           H        LYS  50   3.013  -7.400  -0.385
  347    HA   LYS  50           HA       LYS  50   1.963  -5.467   1.563
  348   1HB   LYS  50          1HB       LYS  50   0.949  -4.326  -0.448
  349   2HB   LYS  50          2HB       LYS  50   2.703  -4.159  -0.258
  350   1HG   LYS  50          1HG       LYS  50   2.070  -6.547  -1.792
  351   2HG   LYS  50          2HG       LYS  50   1.285  -5.136  -2.523
  352   1HD   LYS  50          1HD       LYS  50   4.240  -5.453  -1.850
  353   2HD   LYS  50          2HD       LYS  50   3.532  -5.424  -3.475
  354   1HE   LYS  50          1HE       LYS  50   2.698  -3.070  -2.003
  355   2HE   LYS  50          2HE       LYS  50   4.461  -3.212  -1.922
  356   1HZ   LYS  50          1HZ       LYS  50   4.042  -3.735  -4.457
  357   2HZ   LYS  50          2HZ       LYS  50   2.754  -2.764  -4.197
  358   3HZ   LYS  50          3HZ       LYS  50   4.265  -2.216  -3.902
  359    HA   PRO  51           HA       PRO  51  -0.976  -8.862   0.949
  360   1HB   PRO  51          1HB       PRO  51  -1.252  -9.590   3.567
  361   2HB   PRO  51          2HB       PRO  51  -0.144 -10.390   2.456
  362   1HG   PRO  51          1HG       PRO  51   0.400  -8.433   4.596
  363   2HG   PRO  51          2HG       PRO  51   1.540  -9.586   3.812
  364   1HD   PRO  51          1HD       PRO  51   1.311  -6.759   3.412
  365   2HD   PRO  51          2HD       PRO  51   2.338  -7.874   2.500
  366    H    LEU  52           H        LEU  52  -1.817  -8.066   4.164
  367    HA   LEU  52           HA       LEU  52  -4.162  -6.711   3.094
  368   1HB   LEU  52          1HB       LEU  52  -5.273  -7.361   4.943
  369   2HB   LEU  52          2HB       LEU  52  -4.092  -8.677   4.814
  370    HG   LEU  52           HG       LEU  52  -2.871  -6.738   6.432
  371   1HD1  LEU  52          1HD1      LEU  52  -5.800  -6.651   6.716
  372   2HD1  LEU  52          2HD1      LEU  52  -4.911  -6.905   8.236
  373   3HD1  LEU  52          3HD1      LEU  52  -4.554  -5.486   7.222
  374   1HD2  LEU  52          1HD2      LEU  52  -3.690  -9.494   6.543
  375   2HD2  LEU  52          2HD2      LEU  52  -2.359  -8.670   7.391
  376   3HD2  LEU  52          3HD2      LEU  52  -3.986  -8.708   8.112
  377    H    GLN  53           H        GLN  53  -1.607  -5.365   2.890
  378    HA   GLN  53           HA       GLN  53  -1.117  -3.674   4.998
  379   1HB   GLN  53          1HB       GLN  53  -0.746  -3.208   2.014
  380   2HB   GLN  53          2HB       GLN  53   0.012  -2.231   3.284
  381   1HG   GLN  53          1HG       GLN  53   0.411  -5.208   2.768
  382   2HG   GLN  53          2HG       GLN  53   1.599  -3.927   2.485
  383   1HE2  GLN  53          1HE2      GLN  53   0.116  -6.056   4.728
  384   2HE2  GLN  53          2HE2      GLN  53   1.017  -5.635   6.146
  385    H    GLU  54           H        GLU  54  -3.813  -3.798   2.818
  386    HA   GLU  54           HA       GLU  54  -4.527  -1.245   2.437
  387   1HB   GLU  54          1HB       GLU  54  -6.801  -2.016   2.262
  388   2HB   GLU  54          2HB       GLU  54  -5.757  -3.331   1.695
  389   1HG   GLU  54          1HG       GLU  54  -6.609  -4.706   3.263
  390   2HG   GLU  54          2HG       GLU  54  -6.131  -3.594   4.553
  391    H    ALA  55           H        ALA  55  -4.253  -2.928   5.493
  392    HA   ALA  55           HA       ALA  55  -6.059  -1.681   7.099
  393   1HB   ALA  55          1HB       ALA  55  -3.300  -1.922   8.183
  394   2HB   ALA  55          2HB       ALA  55  -4.829  -2.611   8.780
  395   3HB   ALA  55          3HB       ALA  55  -3.966  -3.394   7.435
  396    H    GLU  56           H        GLU  56  -2.608  -0.566   6.911
  397    HA   GLU  56           HA       GLU  56  -3.683   2.139   7.119
  398   1HB   GLU  56          1HB       GLU  56  -1.497   0.738   8.564
  399   2HB   GLU  56          2HB       GLU  56  -1.126   2.398   8.065
  400   1HG   GLU  56          1HG       GLU  56  -3.234   3.163   9.165
  401   2HG   GLU  56          2HG       GLU  56  -3.546   1.506   9.704
  402    H    CYS  57           H        CYS  57  -3.119   0.491   4.677
  403    HA   CYS  57           HA       CYS  57  -0.830   1.968   3.617
  404   1HB   CYS  57          1HB       CYS  57  -0.704  -0.467   3.465
  405   2HB   CYS  57          2HB       CYS  57  -2.209  -0.501   2.540
  406    H    THR  58           H        THR  58  -3.870   0.548   2.208
  407    HA   THR  58           HA       THR  58  -4.163   2.715   0.396
  408    HB   THR  58           HB       THR  58  -4.933   0.155   0.352
  409    HG1  THR  58           HG1      THR  58  -6.745   1.094  -1.078
  410   1HG2  THR  58          1HG2      THR  58  -7.431   0.062   0.721
  411   2HG2  THR  58          2HG2      THR  58  -6.529   0.253   2.244
  412   3HG2  THR  58          3HG2      THR  58  -7.341   1.656   1.509
  413    H    PHE  59           H        PHE  59  -5.307   2.051   3.681
  414    HA   PHE  59           HA       PHE  59  -7.508   3.449   4.012
  415   1HB   PHE  59          1HB       PHE  59  -5.786   2.456   5.699
  416   2HB   PHE  59          2HB       PHE  59  -4.951   4.012   5.619
  417    HD1  PHE  59           HD1      PHE  59  -8.466   2.812   6.079
  418    HD2  PHE  59           HD2      PHE  59  -5.379   5.413   7.383
  419    HE1  PHE  59           HE1      PHE  59  -9.974   3.697   7.879
  420    HE2  PHE  59           HE2      PHE  59  -6.886   6.299   9.185
  421    HZ   PHE  59           HZ       PHE  59  -9.165   5.430   9.412
  422   1H    GLU   1           H1       GLU   1 -22.390  -2.082   0.630
  423    HA   GLU   1           HA       GLU   1 -19.553  -2.000   0.922
  424   1HB   GLU   1          1HB       GLU   1 -19.533  -3.204  -1.226
  425   2HB   GLU   1          2HB       GLU   1 -20.674  -3.955  -0.098
  426   1HG   GLU   1          1HG       GLU   1 -22.304  -2.147  -1.353
  427   2HG   GLU   1          2HG       GLU   1 -21.173  -2.512  -2.664
  428    H    GLU   2           H        GLU   2 -20.078   0.575   1.102
  429    HA   GLU   2           HA       GLU   2 -20.297   1.782  -1.477
  430   1HB   GLU   2          1HB       GLU   2 -20.038   3.911  -0.184
  431   2HB   GLU   2          2HB       GLU   2 -21.357   2.888   0.412
  432   1HG   GLU   2          1HG       GLU   2 -18.884   2.177   1.745
  433   2HG   GLU   2          2HG       GLU   2 -19.133   3.924   1.876
  434    H    TYR   3           H        TYR   3 -18.303   0.491  -2.236
  435    HA   TYR   3           HA       TYR   3 -15.791   1.563  -1.249
  436   1HB   TYR   3          1HB       TYR   3 -16.820  -0.591  -3.157
  437   2HB   TYR   3          2HB       TYR   3 -15.111  -0.144  -3.211
  438    HD1  TYR   3           HD1      TYR   3 -13.632  -1.370  -1.907
  439    HD2  TYR   3           HD2      TYR   3 -17.736  -1.144  -0.715
  440    HE1  TYR   3           HE1      TYR   3 -13.173  -2.981   0.005
  441    HE2  TYR   3           HE2      TYR   3 -17.263  -2.756   1.193
  442    HH   TYR   3           HH       TYR   3 -14.625  -4.662   1.328
  443    H    VAL   4           H        VAL   4 -16.118   3.797  -1.990
  444    HA   VAL   4           HA       VAL   4 -15.611   4.001  -4.876
  445    HB   VAL   4           HB       VAL   4 -17.281   5.872  -3.184
  446   1HG1  VAL   4          1HG1      VAL   4 -15.876   6.532  -5.407
  447   2HG1  VAL   4          2HG1      VAL   4 -17.391   5.963  -6.148
  448   3HG1  VAL   4          3HG1      VAL   4 -17.425   7.282  -4.953
  449   1HG2  VAL   4          1HG2      VAL   4 -18.011   3.584  -4.993
  450   2HG2  VAL   4          2HG2      VAL   4 -18.690   4.047  -3.413
  451   3HG2  VAL   4          3HG2      VAL   4 -19.092   4.993  -4.866
  452    H    GLY   5           H        GLY   5 -15.386   5.633  -1.642
  453   1HA   GLY   5          1HA       GLY   5 -13.339   7.429  -2.476
  454   2HA   GLY   5          2HA       GLY   5 -13.868   7.098  -0.838
  455    H    LEU   6           H        LEU   6 -13.198   4.131  -2.369
  456    HA   LEU   6           HA       LEU   6 -10.363   4.216  -1.701
  457   1HB   LEU   6          1HB       LEU   6 -10.618   2.072  -0.461
  458   2HB   LEU   6          2HB       LEU   6 -11.238   3.515   0.359
  459    HG   LEU   6           HG       LEU   6 -12.624   1.430   0.588
  460   1HD1  LEU   6          1HD1      LEU   6 -14.636   3.068  -0.612
  461   2HD1  LEU   6          2HD1      LEU   6 -14.234   2.860   1.109
  462   3HD1  LEU   6          3HD1      LEU   6 -13.420   4.120   0.151
  463   1HD2  LEU   6          1HD2      LEU   6 -13.371   1.938  -2.303
  464   2HD2  LEU   6          2HD2      LEU   6 -12.280   0.643  -1.755
  465   3HD2  LEU   6          3HD2      LEU   6 -13.981   0.655  -1.231
  466    H    SER   7           H        SER   7 -12.410   3.972  -4.077
  467    HA   SER   7           HA       SER   7 -11.363   1.447  -5.081
  468   1HB   SER   7          1HB       SER   7 -13.908   1.982  -4.965
  469   2HB   SER   7          2HB       SER   7 -13.611   3.028  -6.365
  470    HG   SER   7           HG       SER   7 -13.963   0.336  -6.294
  471    H    ALA   8           H        ALA   8 -11.288   1.638  -7.734
  472    HA   ALA   8           HA       ALA   8  -9.157   3.388  -8.250
  473   1HB   ALA   8          1HB       ALA   8 -10.715   2.359 -10.553
  474   2HB   ALA   8          2HB       ALA   8  -8.990   2.168 -10.162
  475   3HB   ALA   8          3HB       ALA   8 -10.199   1.120  -9.383
  476    H    ASN   9           H        ASN   9  -9.745   5.542  -7.752
  477    HA   ASN   9           HA       ASN   9 -10.584   7.098  -9.734
  478   1HB   ASN   9          1HB       ASN   9 -12.799   6.264  -9.872
  479   2HB   ASN   9          2HB       ASN   9 -12.951   6.079  -8.119
  480   1HD2  ASN   9          1HD2      ASN   9 -11.928   8.725 -10.275
  481   2HD2  ASN   9          2HD2      ASN   9 -13.035   9.924  -9.692
  482    H    GLN  10           H        GLN  10 -10.593   6.282  -6.285
  483    HA   GLN  10           HA       GLN  10 -11.042   8.807  -5.243
  484   1HB   GLN  10          1HB       GLN  10 -11.016   6.536  -4.058
  485   2HB   GLN  10          2HB       GLN  10  -9.252   6.693  -3.984
  486   1HG   GLN  10          1HG       GLN  10 -10.249   9.175  -3.090
  487   2HG   GLN  10          2HG       GLN  10 -11.315   7.974  -2.345
  488   1HE2  GLN  10          1HE2      GLN  10  -9.451   5.852  -2.216
  489   2HE2  GLN  10          2HE2      GLN  10  -8.262   6.214  -1.010
  490    H    CYS  11           H        CYS  11  -8.159   7.262  -6.640
  491    HA   CYS  11           HA       CYS  11  -6.257   8.994  -5.565
  492   1HB   CYS  11          1HB       CYS  11  -5.616   6.906  -6.538
  493   2HB   CYS  11          2HB       CYS  11  -6.272   7.368  -8.112
  494    H    ALA  12           H        ALA  12  -8.891   9.541  -7.667
  495    HA   ALA  12           HA       ALA  12  -7.547  11.744  -9.045
  496   1HB   ALA  12          1HB       ALA  12  -8.937   9.973 -10.264
  497   2HB   ALA  12          2HB       ALA  12 -10.362  10.691  -9.476
  498   3HB   ALA  12          3HB       ALA  12  -9.371  11.669 -10.584
  499    H    VAL  13           H        VAL  13  -8.557  11.420  -6.066
  500    HA   VAL  13           HA       VAL  13 -10.713  12.863  -5.460
  501    HB   VAL  13           HB       VAL  13  -8.232  12.178  -4.233
  502   1HG1  VAL  13          1HG1      VAL  13  -7.511  14.436  -4.189
  503   2HG1  VAL  13          2HG1      VAL  13  -9.133  15.030  -3.758
  504   3HG1  VAL  13          3HG1      VAL  13  -8.178  14.111  -2.570
  505   1HG2  VAL  13          1HG2      VAL  13  -9.568  12.110  -2.216
  506   2HG2  VAL  13          2HG2      VAL  13 -10.827  13.118  -2.967
  507   3HG2  VAL  13          3HG2      VAL  13 -10.528  11.471  -3.571
  508    HA   PRO  14           HA       PRO  14 -10.240  16.903  -6.912
  509   1HB   PRO  14          1HB       PRO  14 -11.584  18.381  -5.050
  510   2HB   PRO  14          2HB       PRO  14 -12.393  17.469  -6.323
  511   1HG   PRO  14          1HG       PRO  14 -12.089  16.857  -3.453
  512   2HG   PRO  14          2HG       PRO  14 -13.291  16.200  -4.620
  513   1HD   PRO  14          1HD       PRO  14 -10.962  14.922  -3.554
  514   2HD   PRO  14          2HD       PRO  14 -12.023  14.293  -4.821
  515    H    ALA  15           H        ALA  15  -8.048  15.843  -5.306
  516    HA   ALA  15           HA       ALA  15  -6.246  16.554  -4.224
  517   1HB   ALA  15          1HB       ALA  15  -5.133  18.332  -5.274
  518   2HB   ALA  15          2HB       ALA  15  -6.296  17.811  -6.516
  519   3HB   ALA  15          3HB       ALA  15  -6.636  19.252  -5.529
  520    H    LYS  16           H        LYS  16  -7.876  16.426  -2.291
  521    HA   LYS  16           HA       LYS  16  -7.243  18.213  -0.410
  522   1HB   LYS  16          1HB       LYS  16  -9.460  19.609  -0.365
  523   2HB   LYS  16          2HB       LYS  16  -8.069  20.150  -1.321
  524   1HG   LYS  16          1HG       LYS  16  -9.247  19.983  -3.235
  525   2HG   LYS  16          2HG       LYS  16  -9.733  18.319  -2.870
  526   1HD   LYS  16          1HD       LYS  16 -11.824  19.074  -2.516
  527   2HD   LYS  16          2HD       LYS  16 -11.233  19.978  -1.113
  528   1HE   LYS  16          1HE       LYS  16 -11.174  21.976  -2.265
  529   2HE   LYS  16          2HE       LYS  16 -10.771  21.211  -3.809
  530   1HZ   LYS  16          1HZ       LYS  16 -12.913  21.005  -4.292
  531   2HZ   LYS  16          2HZ       LYS  16 -13.351  20.536  -2.791
  532   3HZ   LYS  16          3HZ       LYS  16 -13.181  22.124  -3.133
  533    H    ASP  17           H        ASP  17  -7.789  15.469  -0.723
  534    HA   ASP  17           HA       ASP  17  -9.636  15.176   1.415
  535   1HB   ASP  17          1HB       ASP  17 -11.043  15.159  -0.726
  536   2HB   ASP  17          2HB       ASP  17 -10.202  13.666  -1.174
  537    H    ARG  18           H        ARG  18  -6.752  14.651   0.203
  538    HA   ARG  18           HA       ARG  18  -6.666  11.786   0.370
  539   1HB   ARG  18          1HB       ARG  18  -4.397  13.789  -0.029
  540   2HB   ARG  18          2HB       ARG  18  -4.299  12.042  -0.306
  541   1HG   ARG  18          1HG       ARG  18  -5.380  12.179  -2.318
  542   2HG   ARG  18          2HG       ARG  18  -6.493  13.442  -1.762
  543   1HD   ARG  18          1HD       ARG  18  -4.804  15.153  -2.073
  544   2HD   ARG  18          2HD       ARG  18  -3.543  13.946  -2.363
  545    HE   ARG  18           HE       ARG  18  -5.795  13.766  -4.227
  546   1HH1  ARG  18          1HH1      ARG  18  -2.705  15.324  -3.589
  547   2HH1  ARG  18          2HH1      ARG  18  -2.408  15.704  -5.252
  548   1HH2  ARG  18          1HH2      ARG  18  -5.404  14.267  -6.422
  549   2HH2  ARG  18          2HH2      ARG  18  -3.953  15.099  -6.875
  550    H    VAL  19           H        VAL  19  -4.462  11.011   1.641
  551    HA   VAL  19           HA       VAL  19  -4.715  12.204   4.312
  552    HB   VAL  19           HB       VAL  19  -3.783   9.442   3.505
  553   1HG1  VAL  19          1HG1      VAL  19  -3.749  10.932   6.017
  554   2HG1  VAL  19          2HG1      VAL  19  -4.643   9.398   6.153
  555   3HG1  VAL  19          3HG1      VAL  19  -2.955   9.398   5.586
  556   1HG2  VAL  19          1HG2      VAL  19  -6.413  10.476   3.520
  557   2HG2  VAL  19          2HG2      VAL  19  -5.907   8.774   3.389
  558   3HG2  VAL  19          3HG2      VAL  19  -6.260   9.478   4.986
  559    H    ASP  20           H        ASP  20  -3.003  13.001   1.854
  560    HA   ASP  20           HA       ASP  20  -0.877  13.326   1.328
  561   1HB   ASP  20          1HB       ASP  20  -1.063  15.308   2.503
  562   2HB   ASP  20          2HB       ASP  20  -1.419  14.500   4.037
  563    H    CYS  21           H        CYS  21   0.044  11.165   1.149
  564    HA   CYS  21           HA       CYS  21   0.735   9.530   3.223
  565   1HB   CYS  21          1HB       CYS  21   0.887   9.389   0.535
  566   2HB   CYS  21          2HB       CYS  21   2.599   9.561   0.925
  567    H    GLY  22           H        GLY  22   2.352  12.413   1.867
  568   1HA   GLY  22          1HA       GLY  22   4.144  13.597   2.526
  569   2HA   GLY  22          2HA       GLY  22   3.812  13.007   4.143
  570    H    TYR  23           H        TYR  23   5.012  11.521   1.039
  571    HA   TYR  23           HA       TYR  23   6.915   9.969   2.587
  572   1HB   TYR  23          1HB       TYR  23   5.318   9.629   0.310
  573   2HB   TYR  23          2HB       TYR  23   6.887   9.997  -0.418
  574    HD1  TYR  23           HD1      TYR  23   7.540   7.934  -1.339
  575    HD2  TYR  23           HD2      TYR  23   6.173   8.081   2.712
  576    HE1  TYR  23           HE1      TYR  23   8.236   5.511  -1.009
  577    HE2  TYR  23           HE2      TYR  23   6.874   5.658   3.029
  578    HH   TYR  23           HH       TYR  23   8.914   4.085   0.938
  579    HA   PRO  24           HA       PRO  24  10.218  12.624   1.671
  580   1HB   PRO  24          1HB       PRO  24  12.305  10.980   2.301
  581   2HB   PRO  24          2HB       PRO  24  11.400  11.891   3.507
  582   1HG   PRO  24          1HG       PRO  24  11.281   9.026   2.813
  583   2HG   PRO  24          2HG       PRO  24  10.734   9.839   4.324
  584   1HD   PRO  24          1HD       PRO  24   9.143   8.840   2.164
  585   2HD   PRO  24          2HD       PRO  24   8.571   9.774   3.551
  586    H    HIS  25           H        HIS  25   9.547   9.816  -0.031
  587    HA   HIS  25           HA       HIS  25  11.421  10.722  -2.095
  588   1HB   HIS  25          1HB       HIS  25  10.857   7.987  -1.036
  589   2HB   HIS  25          2HB       HIS  25  11.210   8.159  -2.760
  590    HD1  HIS  25           HD1      HIS  25  13.471  10.182  -2.791
  591    HD2  HIS  25           HD2      HIS  25  13.183   7.137   0.081
  592    HE1  HIS  25           HE1      HIS  25  15.830   9.825  -1.887
  593    HE2  HIS  25           HE2      HIS  25  15.581   7.982  -0.089
  594    H    VAL  26           H        VAL  26   8.681  11.630  -1.619
  595    HA   VAL  26           HA       VAL  26   6.760  10.304  -3.053
  596    HB   VAL  26           HB       VAL  26   6.057  12.097  -1.782
  597   1HG1  VAL  26          1HG1      VAL  26   8.521  13.374  -2.748
  598   2HG1  VAL  26          2HG1      VAL  26   7.136  14.487  -2.640
  599   3HG1  VAL  26          3HG1      VAL  26   7.654  13.569  -1.205
  600   1HG2  VAL  26          1HG2      VAL  26   6.060  13.531  -4.430
  601   2HG2  VAL  26          2HG2      VAL  26   5.169  12.001  -4.238
  602   3HG2  VAL  26          3HG2      VAL  26   4.768  13.400  -3.212
  603    H    THR  27           H        THR  27   6.660   9.627  -5.125
  604    HA   THR  27           HA       THR  27   7.287  11.327  -7.284
  605    HB   THR  27           HB       THR  27   9.535  10.019  -6.098
  606    HG1  THR  27           HG1      THR  27  10.473  11.173  -7.902
  607   1HG2  THR  27          1HG2      THR  27  10.282   8.890  -8.349
  608   2HG2  THR  27          2HG2      THR  27   9.251   7.942  -7.252
  609   3HG2  THR  27          3HG2      THR  27   8.540   8.737  -8.677
  610    HA   PRO  28           HA       PRO  28   4.772   8.416  -9.179
  611   1HB   PRO  28          1HB       PRO  28   5.272   8.879 -11.825
  612   2HB   PRO  28          2HB       PRO  28   4.201   9.889 -10.856
  613   1HG   PRO  28          1HG       PRO  28   6.963  10.384 -11.770
  614   2HG   PRO  28          2HG       PRO  28   5.732  11.576 -11.218
  615   1HD   PRO  28          1HD       PRO  28   8.022  10.597  -9.806
  616   2HD   PRO  28          2HD       PRO  28   6.754  11.647  -9.160
  617    H    LYS  29           H        LYS  29   6.800   7.104  -8.049
  618    HA   LYS  29           HA       LYS  29   6.932   4.826  -9.664
  619   1HB   LYS  29          1HB       LYS  29   8.473   6.178 -11.004
  620   2HB   LYS  29          2HB       LYS  29   9.505   6.429  -9.587
  621   1HG   LYS  29          1HG       LYS  29  10.459   4.393  -9.820
  622   2HG   LYS  29          2HG       LYS  29   8.893   3.587 -10.012
  623   1HD   LYS  29          1HD       LYS  29   9.216   3.413 -12.233
  624   2HD   LYS  29          2HD       LYS  29   9.471   5.161 -12.380
  625   1HE   LYS  29          1HE       LYS  29  11.805   4.962 -12.099
  626   2HE   LYS  29          2HE       LYS  29  11.684   3.374 -11.327
  627   1HZ   LYS  29          1HZ       LYS  29  12.318   2.835 -13.421
  628   2HZ   LYS  29          2HZ       LYS  29  10.700   2.757 -13.622
  629   3HZ   LYS  29          3HZ       LYS  29  11.525   4.068 -14.139
  630    H    GLU  30           H        GLU  30   7.827   6.830  -6.928
  631    HA   GLU  30           HA       GLU  30   8.812   4.485  -5.535
  632   1HB   GLU  30          1HB       GLU  30   9.299   7.362  -5.388
  633   2HB   GLU  30          2HB       GLU  30   8.948   6.686  -3.788
  634   1HG   GLU  30          1HG       GLU  30  11.095   5.993  -3.730
  635   2HG   GLU  30          2HG       GLU  30  10.682   4.812  -4.982
  636    H    CYS  31           H        CYS  31   6.303   7.079  -5.371
  637    HA   CYS  31           HA       CYS  31   5.153   6.189  -2.985
  638   1HB   CYS  31          1HB       CYS  31   4.291   7.955  -5.234
  639   2HB   CYS  31          2HB       CYS  31   3.092   7.436  -4.046
  640    H    ASN  32           H        ASN  32   4.269   5.703  -6.484
  641    HA   ASN  32           HA       ASN  32   2.161   3.986  -5.938
  642   1HB   ASN  32          1HB       ASN  32   3.956   4.126  -8.410
  643   2HB   ASN  32          2HB       ASN  32   2.356   3.371  -8.361
  644   1HD2  ASN  32          1HD2      ASN  32   0.898   5.099  -6.883
  645   2HD2  ASN  32          2HD2      ASN  32   0.745   6.637  -7.665
  646    H    ASN  33           H        ASN  33   5.465   3.607  -5.366
  647    HA   ASN  33           HA       ASN  33   5.416   0.766  -5.971
  648   1HB   ASN  33          1HB       ASN  33   7.377   1.860  -6.864
  649   2HB   ASN  33          2HB       ASN  33   7.676   2.728  -5.351
  650   1HD2  ASN  33          1HD2      ASN  33   9.426   1.997  -4.431
  651   2HD2  ASN  33          2HD2      ASN  33   9.911   0.343  -4.252
  652    H    ARG  34           H        ARG  34   5.514   3.244  -3.434
  653    HA   ARG  34           HA       ARG  34   6.248   1.340  -1.424
  654   1HB   ARG  34          1HB       ARG  34   6.444   3.184   0.033
  655   2HB   ARG  34          2HB       ARG  34   6.865   3.899  -1.534
  656   1HG   ARG  34          1HG       ARG  34   5.335   5.449  -0.698
  657   2HG   ARG  34          2HG       ARG  34   4.272   4.415  -1.669
  658   1HD   ARG  34          1HD       ARG  34   3.035   4.141   0.206
  659   2HD   ARG  34          2HD       ARG  34   4.355   3.152   0.846
  660    HE   ARG  34           HE       ARG  34   4.783   6.018   1.216
  661   1HH1  ARG  34          1HH1      ARG  34   3.231   3.163   2.566
  662   2HH1  ARG  34          2HH1      ARG  34   3.189   3.792   4.179
  663   1HH2  ARG  34          1HH2      ARG  34   4.727   6.849   3.345
  664   2HH2  ARG  34          2HH2      ARG  34   4.044   5.903   4.625
  665    H    GLY  35           H        GLY  35   3.373   2.946  -2.768
  666   1HA   GLY  35          1HA       GLY  35   1.343   1.537  -2.410
  667   2HA   GLY  35          2HA       GLY  35   1.701   1.652  -0.699
  668    H    CYS  36           H        CYS  36   2.430   4.405  -2.807
  669    HA   CYS  36           HA       CYS  36   0.065   5.749  -1.715
  670   1HB   CYS  36          1HB       CYS  36   2.827   6.883  -2.163
  671   2HB   CYS  36          2HB       CYS  36   1.406   7.839  -1.733
  672    H    CYS  37           H        CYS  37  -0.455   7.790  -3.166
  673    HA   CYS  37           HA       CYS  37  -0.066   6.969  -5.952
  674   1HB   CYS  37          1HB       CYS  37  -2.403   6.860  -4.915
  675   2HB   CYS  37          2HB       CYS  37  -2.376   8.626  -4.955
  676    H    PHE  38           H        PHE  38   1.059   8.426  -7.212
  677    HA   PHE  38           HA       PHE  38   1.734  10.967  -5.983
  678   1HB   PHE  38          1HB       PHE  38   3.419   9.366  -7.024
  679   2HB   PHE  38          2HB       PHE  38   2.603   9.560  -8.579
  680    HD1  PHE  38           HD1      PHE  38   4.580  11.322  -5.997
  681    HD2  PHE  38           HD2      PHE  38   3.085  11.415  -9.967
  682    HE1  PHE  38           HE1      PHE  38   6.052  13.291  -6.505
  683    HE2  PHE  38           HE2      PHE  38   4.557  13.384 -10.475
  684    HZ   PHE  38           HZ       PHE  38   6.023  14.297  -8.738
  685    H    ASP  39           H        ASP  39   0.679  12.824  -6.488
  686    HA   ASP  39           HA       ASP  39  -1.138  12.745  -8.702
  687   1HB   ASP  39          1HB       ASP  39  -1.932  13.748  -6.653
  688   2HB   ASP  39          2HB       ASP  39  -0.516  14.805  -6.543
  689    H    SER  40           H        SER  40   0.843  15.544  -7.536
  690    HA   SER  40           HA       SER  40   2.513  16.632  -8.501
  691   1HB   SER  40          1HB       SER  40   2.762  14.356  -9.930
  692   2HB   SER  40          2HB       SER  40   2.215  15.429 -11.231
  693    HG   SER  40           HG       SER  40   3.994  16.844 -10.731
  694    H    ARG  41           H        ARG  41  -0.705  16.179  -9.627
  695    HA   ARG  41           HA       ARG  41  -0.785  18.052 -11.664
  696   1HB   ARG  41          1HB       ARG  41  -2.935  17.121  -9.709
  697   2HB   ARG  41          2HB       ARG  41  -3.279  18.088 -11.154
  698   1HG   ARG  41          1HG       ARG  41  -1.782  16.062 -12.228
  699   2HG   ARG  41          2HG       ARG  41  -2.576  15.201 -10.898
  700   1HD   ARG  41          1HD       ARG  41  -4.101  14.954 -12.673
  701   2HD   ARG  41          2HD       ARG  41  -4.769  16.342 -11.799
  702    HE   ARG  41           HE       ARG  41  -2.954  17.368 -13.710
  703   1HH1  ARG  41          1HH1      ARG  41  -5.974  15.563 -13.698
  704   2HH1  ARG  41          2HH1      ARG  41  -6.497  16.180 -15.230
  705   1HH2  ARG  41          1HH2      ARG  41  -3.643  18.182 -15.732
  706   2HH2  ARG  41          2HH2      ARG  41  -5.162  17.680 -16.394
  707    H    ILE  42           H        ILE  42  -1.366  18.276  -8.098
  708    HA   ILE  42           HA       ILE  42  -1.214  21.196  -8.386
  709    HB   ILE  42           HB       ILE  42  -2.700  19.930  -6.130
  710   1HG1  ILE  42          1HG1      ILE  42  -3.734  20.213  -8.953
  711   2HG1  ILE  42          2HG1      ILE  42  -3.678  18.748  -7.958
  712   1HG2  ILE  42          1HG2      ILE  42  -2.097  22.497  -6.708
  713   2HG2  ILE  42          2HG2      ILE  42  -3.665  22.350  -7.536
  714   3HG2  ILE  42          3HG2      ILE  42  -3.541  21.995  -5.796
  715   1HD1  ILE  42          1HD1      ILE  42  -5.157  20.262  -6.307
  716   2HD1  ILE  42          2HD1      ILE  42  -5.550  21.101  -7.827
  717   3HD1  ILE  42          3HD1      ILE  42  -5.899  19.363  -7.654
  718    HA   PRO  43           HA       PRO  43   2.279  20.397  -5.872
  719   1HB   PRO  43          1HB       PRO  43   3.402  22.875  -6.099
  720   2HB   PRO  43          2HB       PRO  43   3.686  21.580  -7.259
  721   1HG   PRO  43          1HG       PRO  43   1.965  23.966  -7.467
  722   2HG   PRO  43          2HG       PRO  43   2.617  22.933  -8.789
  723   1HD   PRO  43          1HD       PRO  43  -0.045  23.011  -7.738
  724   2HD   PRO  43          2HD       PRO  43   0.586  21.865  -8.929
  725    H    GLY  44           H        GLY  44  -0.390  22.235  -5.301
  726   1HA   GLY  44          1HA       GLY  44   0.602  23.285  -2.757
  727   2HA   GLY  44          2HA       GLY  44  -0.934  23.632  -3.527
  728    H    VAL  45           H        VAL  45  -0.644  20.361  -3.956
  729    HA   VAL  45           HA       VAL  45  -1.869  19.786  -1.346
  730    HB   VAL  45           HB       VAL  45  -3.555  18.602  -2.327
  731   1HG1  VAL  45          1HG1      VAL  45  -3.940  20.887  -2.939
  732   2HG1  VAL  45          2HG1      VAL  45  -2.847  20.761  -4.338
  733   3HG1  VAL  45          3HG1      VAL  45  -4.393  19.878  -4.333
  734   1HG2  VAL  45          1HG2      VAL  45  -2.010  17.130  -3.638
  735   2HG2  VAL  45          2HG2      VAL  45  -3.521  17.533  -4.487
  736   3HG2  VAL  45          3HG2      VAL  45  -2.006  18.358  -4.926
  737    HA   PRO  46           HA       PRO  46   0.736  16.325  -1.117
  738   1HB   PRO  46          1HB       PRO  46  -0.824  14.148  -0.577
  739   2HB   PRO  46          2HB       PRO  46  -0.386  15.346   0.639
  740   1HG   PRO  46          1HG       PRO  46  -2.926  14.954  -0.808
  741   2HG   PRO  46          2HG       PRO  46  -2.639  15.834   0.736
  742   1HD   PRO  46          1HD       PRO  46  -3.112  16.920  -1.870
  743   2HD   PRO  46          2HD       PRO  46  -2.674  17.825  -0.414
  744    H    TRP  47           H        TRP  47   2.031  15.683  -2.708
  745    HA   TRP  47           HA       TRP  47   0.703  14.561  -5.037
  746   1HB   TRP  47          1HB       TRP  47   3.600  14.699  -5.125
  747   2HB   TRP  47          2HB       TRP  47   2.392  15.387  -6.213
  748    HD1  TRP  47           HD1      TRP  47   1.304  17.856  -5.249
  749    HE1  TRP  47           HE1      TRP  47   2.475  19.891  -4.044
  750    HE3  TRP  47           HE3      TRP  47   5.380  15.256  -3.674
  751    HZ2  TRP  47           HZ2      TRP  47   4.919  20.178  -2.599
  752    HZ3  TRP  47           HZ3      TRP  47   7.111  16.489  -2.371
  753    HH2  TRP  47           HH2      TRP  47   6.929  18.865  -1.830
  754    H    CYS  48           H        CYS  48   0.777  13.158  -2.378
  755    HA   CYS  48           HA       CYS  48   1.520  10.630  -3.356
  756   1HB   CYS  48          1HB       CYS  48   3.776  11.472  -2.871
  757   2HB   CYS  48          2HB       CYS  48   3.313  11.742  -1.188
  758    H    PHE  49           H        PHE  49  -0.410   9.758  -2.625
  759    HA   PHE  49           HA       PHE  49  -0.863   9.895   0.253
  760   1HB   PHE  49          1HB       PHE  49  -3.413   9.991  -0.748
  761   2HB   PHE  49          2HB       PHE  49  -2.512  11.458  -0.347
  762    HD1  PHE  49           HD1      PHE  49  -0.897  12.227  -2.379
  763    HD2  PHE  49           HD2      PHE  49  -4.469   9.968  -2.776
  764    HE1  PHE  49           HE1      PHE  49  -1.123  13.000  -4.757
  765    HE2  PHE  49           HE2      PHE  49  -4.693  10.741  -5.153
  766    HZ   PHE  49           HZ       PHE  49  -3.017  12.247  -6.116
  767    H    LYS  50           H        LYS  50  -3.277   8.471   0.341
  768    HA   LYS  50           HA       LYS  50  -2.599   5.984  -1.063
  769   1HB   LYS  50          1HB       LYS  50  -3.404   4.797   1.004
  770   2HB   LYS  50          2HB       LYS  50  -1.846   5.628   1.155
  771   1HG   LYS  50          1HG       LYS  50  -4.127   7.358   1.822
  772   2HG   LYS  50          2HG       LYS  50  -4.058   5.918   2.852
  773   1HD   LYS  50          1HD       LYS  50  -1.806   7.914   2.364
  774   2HD   LYS  50          2HD       LYS  50  -2.765   7.777   3.850
  775   1HE   LYS  50          1HE       LYS  50  -1.616   5.201   3.085
  776   2HE   LYS  50          2HE       LYS  50  -0.350   6.429   3.240
  777   1HZ   LYS  50          1HZ       LYS  50  -1.960   6.840   5.366
  778   2HZ   LYS  50          2HZ       LYS  50  -1.934   5.211   5.246
  779   3HZ   LYS  50          3HZ       LYS  50  -0.535   6.042   5.392
  780    HA   PRO  51           HA       PRO  51  -6.876   7.263  -1.865
  781   1HB   PRO  51          1HB       PRO  51  -6.737   7.342  -4.592
  782   2HB   PRO  51          2HB       PRO  51  -6.539   8.768  -3.576
  783   1HG   PRO  51          1HG       PRO  51  -4.518   7.156  -4.997
  784   2HG   PRO  51          2HG       PRO  51  -4.379   8.843  -4.381
  785   1HD   PRO  51          1HD       PRO  51  -3.264   6.445  -3.279
  786   2HD   PRO  51          2HD       PRO  51  -3.234   8.056  -2.548
  787    H    LEU  52           H        LEU  52  -6.154   5.648  -4.814
  788    HA   LEU  52           HA       LEU  52  -7.700   3.386  -3.793
  789   1HB   LEU  52          1HB       LEU  52  -8.477   3.041  -5.885
  790   2HB   LEU  52          2HB       LEU  52  -8.284   4.804  -5.893
  791    HG   LEU  52           HG       LEU  52  -5.848   3.824  -6.841
  792   1HD1  LEU  52          1HD1      LEU  52  -7.322   2.512  -8.845
  793   2HD1  LEU  52          2HD1      LEU  52  -6.150   1.805  -7.707
  794   3HD1  LEU  52          3HD1      LEU  52  -7.882   1.833  -7.298
  795   1HD2  LEU  52          1HD2      LEU  52  -6.257   5.369  -8.388
  796   2HD2  LEU  52          2HD2      LEU  52  -7.694   4.501  -8.980
  797   3HD2  LEU  52          3HD2      LEU  52  -7.835   5.621  -7.604
  798    H    GLN  53           H        GLN  53  -5.072   3.603  -2.808
  799    HA   GLN  53           HA       GLN  53  -3.105   2.471  -4.275
  800   1HB   GLN  53          1HB       GLN  53  -3.733   2.096  -1.323
  801   2HB   GLN  53          2HB       GLN  53  -2.177   1.683  -2.066
  802   1HG   GLN  53          1HG       GLN  53  -3.475   4.443  -2.004
  803   2HG   GLN  53          2HG       GLN  53  -2.108   3.927  -1.005
  804   1HE2  GLN  53          1HE2      GLN  53  -0.847   2.342  -3.027
  805   2HE2  GLN  53          2HE2      GLN  53  -0.142   3.406  -4.198
  806    H    GLU  54           H        GLU  54  -6.087   1.026  -3.244
  807    HA   GLU  54           HA       GLU  54  -5.554  -1.530  -2.755
  808   1HB   GLU  54          1HB       GLU  54  -7.713  -0.328  -4.519
  809   2HB   GLU  54          2HB       GLU  54  -7.720  -2.037  -4.046
  810   1HG   GLU  54          1HG       GLU  54  -7.396  -0.993  -1.609
  811   2HG   GLU  54          2HG       GLU  54  -8.134   0.431  -2.360
  812    H    ALA  55           H        ALA  55  -4.897   0.193  -5.741
  813    HA   ALA  55           HA       ALA  55  -4.969  -1.530  -7.738
  814   1HB   ALA  55          1HB       ALA  55  -3.851   0.794  -7.540
  815   2HB   ALA  55          2HB       ALA  55  -2.374  -0.099  -7.107
  816   3HB   ALA  55          3HB       ALA  55  -3.143  -0.364  -8.690
  817    H    GLU  56           H        GLU  56  -1.987  -1.428  -5.658
  818    HA   GLU  56           HA       GLU  56  -2.007  -4.326  -5.737
  819   1HB   GLU  56          1HB       GLU  56  -0.329  -2.790  -7.375
  820   2HB   GLU  56          2HB       GLU  56   0.713  -3.270  -6.025
  821   1HG   GLU  56          1HG       GLU  56   0.030  -5.639  -6.370
  822   2HG   GLU  56          2HG       GLU  56  -0.982  -5.149  -7.737
  823    H    CYS  57           H        CYS  57  -2.567  -2.087  -3.740
  824    HA   CYS  57           HA       CYS  57  -0.366  -2.521  -1.885
  825   1HB   CYS  57          1HB       CYS  57  -1.565  -0.234  -2.506
  826   2HB   CYS  57          2HB       CYS  57  -2.665  -0.744  -1.222
  827    H    THR  58           H        THR  58  -4.014  -2.414  -1.876
  828    HA   THR  58           HA       THR  58  -4.273  -3.873   0.507
  829    HB   THR  58           HB       THR  58  -5.985  -2.345  -0.565
  830    HG1  THR  58           HG1      THR  58  -7.687  -3.870   0.043
  831   1HG2  THR  58          1HG2      THR  58  -6.738  -4.736  -2.285
  832   2HG2  THR  58          2HG2      THR  58  -7.278  -3.046  -2.432
  833   3HG2  THR  58          3HG2      THR  58  -5.628  -3.499  -2.924
  834    H    PHE  59           H        PHE  59  -4.040  -4.881  -2.922
  835    HA   PHE  59           HA       PHE  59  -4.911  -7.350  -3.000
  836   1HB   PHE  59          1HB       PHE  59  -2.782  -5.782  -4.148
  837   2HB   PHE  59          2HB       PHE  59  -2.091  -7.371  -3.808
  838    HD1  PHE  59           HD1      PHE  59  -4.186  -5.438  -5.990
  839    HD2  PHE  59           HD2      PHE  59  -3.220  -9.399  -4.810
  840    HE1  PHE  59           HE1      PHE  59  -5.217  -6.320  -8.102
  841    HE2  PHE  59           HE2      PHE  59  -4.250 -10.280  -6.922
  842    HZ   PHE  59           HZ       PHE  59  -5.237  -8.730  -8.543
  Start of MODEL    5
    1   1H    GLU   1           H1       GLU   1 -17.701  -7.620  -3.783
    2    HA   GLU   1           HA       GLU   1 -16.547  -7.438  -1.805
    3   1HB   GLU   1          1HB       GLU   1 -18.268  -7.648  -0.066
    4   2HB   GLU   1          2HB       GLU   1 -18.975  -6.999  -1.556
    5   1HG   GLU   1          1HG       GLU   1 -19.418  -9.601  -2.025
    6   2HG   GLU   1          2HG       GLU   1 -19.344  -9.695  -0.259
    7    H    GLU   2           H        GLU   2 -15.710  -9.968  -3.048
    8    HA   GLU   2           HA       GLU   2 -15.845 -11.862  -0.888
    9   1HB   GLU   2          1HB       GLU   2 -15.167 -11.900  -3.761
   10   2HB   GLU   2          2HB       GLU   2 -14.130 -12.946  -2.776
   11   1HG   GLU   2          1HG       GLU   2 -15.784 -14.469  -2.640
   12   2HG   GLU   2          2HG       GLU   2 -16.858 -13.275  -1.896
   13    H    TYR   3           H        TYR   3 -14.677 -10.151   0.519
   14    HA   TYR   3           HA       TYR   3 -11.836  -9.951  -0.045
   15   1HB   TYR   3          1HB       TYR   3 -13.914  -8.867   1.911
   16   2HB   TYR   3          2HB       TYR   3 -12.202  -8.679   2.305
   17    HD1  TYR   3           HD1      TYR   3 -14.363  -8.210  -0.740
   18    HD2  TYR   3           HD2      TYR   3 -11.355  -6.583   1.830
   19    HE1  TYR   3           HE1      TYR   3 -14.275  -6.105  -2.164
   20    HE2  TYR   3           HE2      TYR   3 -11.277  -4.484   0.398
   21    HH   TYR   3           HH       TYR   3 -11.802  -3.719  -1.701
   22    H    VAL   4           H        VAL   4 -11.513 -12.354   0.176
   23    HA   VAL   4           HA       VAL   4 -11.256 -13.027   3.025
   24    HB   VAL   4           HB       VAL   4 -13.048 -14.326   2.200
   25   1HG1  VAL   4          1HG1      VAL   4 -13.033 -15.603   0.156
   26   2HG1  VAL   4          2HG1      VAL   4 -12.573 -13.927  -0.227
   27   3HG1  VAL   4          3HG1      VAL   4 -11.327 -15.195  -0.144
   28   1HG2  VAL   4          1HG2      VAL   4 -11.949 -16.683   2.073
   29   2HG2  VAL   4          2HG2      VAL   4 -10.430 -15.808   2.383
   30   3HG2  VAL   4          3HG2      VAL   4 -11.764 -15.718   3.558
   31    H    GLY   5           H        GLY   5 -10.099 -13.713  -0.346
   32   1HA   GLY   5          1HA       GLY   5  -7.660 -14.893   0.495
   33   2HA   GLY   5          2HA       GLY   5  -8.069 -14.322  -1.111
   34    H    LEU   6           H        LEU   6  -8.747 -11.719   0.863
   35    HA   LEU   6           HA       LEU   6  -5.981 -10.766   0.882
   36   1HB   LEU   6          1HB       LEU   6  -7.974  -8.769   0.114
   37   2HB   LEU   6          2HB       LEU   6  -6.329  -9.042  -0.488
   38    HG   LEU   6           HG       LEU   6  -7.234 -10.936  -1.857
   39   1HD1  LEU   6          1HD1      LEU   6  -9.914 -10.358  -2.137
   40   2HD1  LEU   6          2HD1      LEU   6  -9.226 -11.742  -1.256
   41   3HD1  LEU   6          3HD1      LEU   6  -9.664 -10.258  -0.378
   42   1HD2  LEU   6          1HD2      LEU   6  -6.797  -8.889  -2.973
   43   2HD2  LEU   6          2HD2      LEU   6  -8.398  -9.439  -3.522
   44   3HD2  LEU   6          3HD2      LEU   6  -8.270  -8.134  -2.319
   45    H    SER   7           H        SER   7  -8.407 -11.723   2.730
   46    HA   SER   7           HA       SER   7  -9.125  -9.513   4.224
   47   1HB   SER   7          1HB       SER   7  -9.728 -11.178   5.978
   48   2HB   SER   7          2HB       SER   7 -10.332 -11.633   4.373
   49    HG   SER   7           HG       SER   7  -9.225 -13.448   4.547
   50    H    ALA   8           H        ALA   8  -8.512 -10.003   6.911
   51    HA   ALA   8           HA       ALA   8  -5.875  -8.961   7.052
   52   1HB   ALA   8          1HB       ALA   8  -8.191  -9.002   8.638
   53   2HB   ALA   8          2HB       ALA   8  -6.992  -9.931   9.571
   54   3HB   ALA   8          3HB       ALA   8  -6.625  -8.267   9.059
   55    H    ASN   9           H        ASN   9  -7.107 -12.110   6.644
   56    HA   ASN   9           HA       ASN   9  -4.991 -13.318   8.186
   57   1HB   ASN   9          1HB       ASN   9  -7.598 -14.090   7.529
   58   2HB   ASN   9          2HB       ASN   9  -6.615 -15.095   6.454
   59   1HD2  ASN   9          1HD2      ASN   9  -4.719 -16.167   7.498
   60   2HD2  ASN   9          2HD2      ASN   9  -4.933 -16.859   9.071
   61    H    GLN  10           H        GLN  10  -5.592 -12.038   5.062
   62    HA   GLN  10           HA       GLN  10  -4.406 -13.908   3.416
   63   1HB   GLN  10          1HB       GLN  10  -4.802 -12.369   1.804
   64   2HB   GLN  10          2HB       GLN  10  -5.619 -11.455   3.085
   65   1HG   GLN  10          1HG       GLN  10  -3.548 -10.215   3.547
   66   2HG   GLN  10          2HG       GLN  10  -2.667 -11.177   2.351
   67   1HE2  GLN  10          1HE2      GLN  10  -3.139 -10.943   0.152
   68   2HE2  GLN  10          2HE2      GLN  10  -3.904  -9.528  -0.491
   69    H    CYS  11           H        CYS  11  -3.019 -11.212   5.363
   70    HA   CYS  11           HA       CYS  11  -0.447 -11.351   4.323
   71   1HB   CYS  11          1HB       CYS  11  -1.038  -9.449   5.554
   72   2HB   CYS  11          2HB       CYS  11  -1.558 -10.392   6.953
   73    H    ALA  12           H        ALA  12  -2.285 -13.660   6.025
   74    HA   ALA  12           HA       ALA  12   0.076 -14.858   7.272
   75   1HB   ALA  12          1HB       ALA  12  -2.230 -14.409   8.445
   76   2HB   ALA  12          2HB       ALA  12  -2.758 -15.858   7.557
   77   3HB   ALA  12          3HB       ALA  12  -1.402 -15.964   8.707
   78    H    VAL  13           H        VAL  13  -0.776 -14.708   4.271
   79    HA   VAL  13           HA       VAL  13  -1.691 -17.088   3.336
   80    HB   VAL  13           HB       VAL  13  -0.535 -14.791   2.322
   81   1HG1  VAL  13          1HG1      VAL  13   1.698 -15.784   2.388
   82   2HG1  VAL  13          2HG1      VAL  13   1.122 -17.181   1.448
   83   3HG1  VAL  13          3HG1      VAL  13   1.160 -15.564   0.705
   84   1HG2  VAL  13          1HG2      VAL  13  -2.127 -17.003   1.428
   85   2HG2  VAL  13          2HG2      VAL  13  -2.046 -15.346   0.781
   86   3HG2  VAL  13          3HG2      VAL  13  -0.943 -16.598   0.161
   87    HA   PRO  14           HA       PRO  14   1.351 -20.073   4.057
   88   1HB   PRO  14          1HB       PRO  14   1.399 -21.566   1.769
   89   2HB   PRO  14          2HB       PRO  14   0.152 -21.732   3.001
   90   1HG   PRO  14          1HG       PRO  14   0.054 -20.403   0.371
   91   2HG   PRO  14          2HG       PRO  14  -1.315 -20.982   1.387
   92   1HD   PRO  14          1HD       PRO  14  -0.411 -18.295   0.982
   93   2HD   PRO  14          2HD       PRO  14  -1.657 -18.828   2.116
   94    H    ALA  15           H        ALA  15   2.277 -17.490   2.976
   95    HA   ALA  15           HA       ALA  15   4.110 -16.593   2.090
   96   1HB   ALA  15          1HB       ALA  15   4.931 -18.829   3.849
   97   2HB   ALA  15          2HB       ALA  15   6.195 -18.262   2.733
   98   3HB   ALA  15          3HB       ALA  15   5.428 -17.120   3.862
   99    H    LYS  16           H        LYS  16   2.928 -17.299  -0.043
  100    HA   LYS  16           HA       LYS  16   4.850 -18.003  -1.877
  101   1HB   LYS  16          1HB       LYS  16   3.899 -20.286  -2.545
  102   2HB   LYS  16          2HB       LYS  16   5.006 -20.220  -1.164
  103   1HG   LYS  16          1HG       LYS  16   3.423 -21.176   0.117
  104   2HG   LYS  16          2HG       LYS  16   2.360 -19.785  -0.154
  105   1HD   LYS  16          1HD       LYS  16   0.995 -21.349  -1.099
  106   2HD   LYS  16          2HD       LYS  16   2.037 -21.136  -2.519
  107   1HE   LYS  16          1HE       LYS  16   3.290 -23.095  -2.022
  108   2HE   LYS  16          2HE       LYS  16   2.710 -23.159  -0.351
  109   1HZ   LYS  16          1HZ       LYS  16   0.456 -23.457  -1.444
  110   2HZ   LYS  16          2HZ       LYS  16   1.278 -23.823  -2.807
  111   3HZ   LYS  16          3HZ       LYS  16   1.478 -24.731  -1.464
  112    H    ASP  17           H        ASP  17   2.762 -16.078  -1.398
  113    HA   ASP  17           HA       ASP  17   1.503 -16.298  -3.935
  114   1HB   ASP  17          1HB       ASP  17   0.008 -17.545  -2.231
  115   2HB   ASP  17          2HB       ASP  17  -0.311 -15.960  -1.513
  116    H    ARG  18           H        ARG  18   3.308 -14.628  -1.965
  117    HA   ARG  18           HA       ARG  18   1.751 -12.231  -1.738
  118   1HB   ARG  18          1HB       ARG  18   4.684 -12.727  -1.056
  119   2HB   ARG  18          2HB       ARG  18   3.717 -11.338  -0.530
  120   1HG   ARG  18          1HG       ARG  18   2.684 -12.531   1.117
  121   2HG   ARG  18          2HG       ARG  18   2.557 -13.999   0.131
  122   1HD   ARG  18          1HD       ARG  18   4.847 -14.601   0.603
  123   2HD   ARG  18          2HD       ARG  18   5.187 -13.024   1.335
  124    HE   ARG  18           HE       ARG  18   3.010 -14.470   2.648
  125   1HH1  ARG  18          1HH1      ARG  18   6.502 -14.064   2.503
  126   2HH1  ARG  18          2HH1      ARG  18   6.765 -14.635   4.117
  127   1HH2  ARG  18          1HH2      ARG  18   3.355 -15.224   4.778
  128   2HH2  ARG  18          2HH2      ARG  18   4.963 -15.300   5.420
  129    H    VAL  19           H        VAL  19   3.061 -10.086  -2.383
  130    HA   VAL  19           HA       VAL  19   3.938 -10.517  -5.142
  131    HB   VAL  19           HB       VAL  19   2.981  -8.021  -3.726
  132   1HG1  VAL  19          1HG1      VAL  19   4.040  -8.563  -6.463
  133   2HG1  VAL  19          2HG1      VAL  19   2.653  -7.456  -6.325
  134   3HG1  VAL  19          3HG1      VAL  19   4.163  -7.103  -5.451
  135   1HG2  VAL  19          1HG2      VAL  19   1.315  -9.960  -4.107
  136   2HG2  VAL  19          2HG2      VAL  19   0.862  -8.335  -4.675
  137   3HG2  VAL  19          3HG2      VAL  19   1.453  -9.550  -5.834
  138    H    ASP  20           H        ASP  20   5.507 -10.887  -2.504
  139    HA   ASP  20           HA       ASP  20   7.353 -10.136  -1.530
  140   1HB   ASP  20          1HB       ASP  20   8.468 -11.557  -2.975
  141   2HB   ASP  20          2HB       ASP  20   7.900 -10.713  -4.424
  142    H    CYS  21           H        CYS  21   6.925  -7.947  -0.819
  143    HA   CYS  21           HA       CYS  21   6.761  -5.738  -2.422
  144   1HB   CYS  21          1HB       CYS  21   6.604  -6.238   0.250
  145   2HB   CYS  21          2HB       CYS  21   8.091  -5.291   0.168
  146    H    GLY  22           H        GLY  22   9.591  -7.526  -1.142
  147   1HA   GLY  22          1HA       GLY  22  11.786  -7.398  -1.597
  148   2HA   GLY  22          2HA       GLY  22  11.342  -6.674  -3.129
  149    H    TYR  23           H        TYR  23  11.135  -5.622   0.353
  150    HA   TYR  23           HA       TYR  23  12.013  -2.978  -0.454
  151   1HB   TYR  23          1HB       TYR  23  10.254  -4.114   1.409
  152   2HB   TYR  23          2HB       TYR  23  11.659  -3.772   2.422
  153    HD1  TYR  23           HD1      TYR  23  10.454  -1.770  -0.485
  154    HD2  TYR  23           HD2      TYR  23  10.827  -2.014   3.770
  155    HE1  TYR  23           HE1      TYR  23   9.700   0.649  -0.273
  156    HE2  TYR  23           HE2      TYR  23  10.070   0.405   3.969
  157    HH   TYR  23           HH       TYR  23   8.726   2.096   1.305
  158    HA   PRO  24           HA       PRO  24  16.105  -3.660   0.809
  159   1HB   PRO  24          1HB       PRO  24  16.977  -1.074   0.911
  160   2HB   PRO  24          2HB       PRO  24  16.879  -2.000  -0.586
  161   1HG   PRO  24          1HG       PRO  24  15.105   0.116   0.453
  162   2HG   PRO  24          2HG       PRO  24  15.283  -0.469  -1.241
  163   1HD   PRO  24          1HD       PRO  24  13.168  -1.003   0.614
  164   2HD   PRO  24          2HD       PRO  24  13.378  -1.731  -0.983
  165    H    HIS  25           H        HIS  25  13.786  -2.146   2.688
  166    HA   HIS  25           HA       HIS  25  15.593  -2.405   4.980
  167   1HB   HIS  25          1HB       HIS  25  13.940  -0.144   4.099
  168   2HB   HIS  25          2HB       HIS  25  13.710  -0.577   5.797
  169    HD1  HIS  25           HD1      HIS  25  16.654   0.084   3.417
  170    HD2  HIS  25           HD2      HIS  25  15.540   0.622   7.424
  171    HE1  HIS  25           HE1      HIS  25  18.565   1.360   4.525
  172    HE2  HIS  25           HE2      HIS  25  17.799   1.709   6.972
  173    H    VAL  26           H        VAL  26  13.942  -4.482   3.797
  174    HA   VAL  26           HA       VAL  26  11.443  -4.740   4.910
  175    HB   VAL  26           HB       VAL  26  12.017  -6.260   3.271
  176   1HG1  VAL  26          1HG1      VAL  26  14.640  -6.220   4.561
  177   2HG1  VAL  26          2HG1      VAL  26  14.144  -7.859   4.074
  178   3HG1  VAL  26          3HG1      VAL  26  14.201  -6.552   2.867
  179   1HG2  VAL  26          1HG2      VAL  26  11.471  -8.324   4.162
  180   2HG2  VAL  26          2HG2      VAL  26  12.513  -8.107   5.589
  181   3HG2  VAL  26          3HG2      VAL  26  10.965  -7.235   5.476
  182    H    THR  27           H        THR  27  10.753  -4.731   6.981
  183    HA   THR  27           HA       THR  27  12.002  -6.313   8.964
  184    HB   THR  27           HB       THR  27  13.162  -3.730   8.527
  185    HG1  THR  27           HG1      THR  27  14.322  -4.563  10.465
  186   1HG2  THR  27          1HG2      THR  27  11.588  -2.552   9.902
  187   2HG2  THR  27          2HG2      THR  27  11.383  -3.942  10.995
  188   3HG2  THR  27          3HG2      THR  27  12.892  -2.998  11.027
  189    HA   PRO  28           HA       PRO  28   8.065  -5.830  10.598
  190   1HB   PRO  28          1HB       PRO  28   8.440  -6.619  13.187
  191   2HB   PRO  28          2HB       PRO  28   8.268  -7.753  11.849
  192   1HG   PRO  28          1HG       PRO  28  10.681  -6.903  13.316
  193   2HG   PRO  28          2HG       PRO  28  10.440  -8.377  12.312
  194   1HD   PRO  28          1HD       PRO  28  11.883  -5.993  11.656
  195   2HD   PRO  28          2HD       PRO  28  11.539  -7.349  10.574
  196    H    LYS  29           H        LYS  29   8.870  -3.399  10.155
  197    HA   LYS  29           HA       LYS  29   7.541  -1.924  12.079
  198   1HB   LYS  29          1HB       LYS  29   9.400  -2.514  13.558
  199   2HB   LYS  29          2HB       LYS  29  10.552  -1.790  12.422
  200   1HG   LYS  29          1HG       LYS  29  10.088   0.302  13.154
  201   2HG   LYS  29          2HG       LYS  29   8.338   0.034  13.088
  202   1HD   LYS  29          1HD       LYS  29   8.643   0.323  15.369
  203   2HD   LYS  29          2HD       LYS  29   8.819  -1.436  15.262
  204   1HE   LYS  29          1HE       LYS  29  11.363  -0.912  14.917
  205   2HE   LYS  29          2HE       LYS  29  10.971   0.683  15.575
  206   1HZ   LYS  29          1HZ       LYS  29   9.892  -1.476  17.081
  207   2HZ   LYS  29          2HZ       LYS  29  11.522  -1.509  17.014
  208   3HZ   LYS  29          3HZ       LYS  29  10.756  -0.185  17.587
  209    H    GLU  30           H        GLU  30   9.817  -2.305   9.423
  210    HA   GLU  30           HA       GLU  30   9.383   0.455   8.658
  211   1HB   GLU  30          1HB       GLU  30  11.485  -1.531   8.244
  212   2HB   GLU  30          2HB       GLU  30  11.010  -0.768   6.716
  213   1HG   GLU  30          1HG       GLU  30  12.019   1.171   7.290
  214   2HG   GLU  30          2HG       GLU  30  11.231   1.203   8.874
  215    H    CYS  31           H        CYS  31   8.949  -2.935   7.483
  216    HA   CYS  31           HA       CYS  31   7.804  -2.230   5.038
  217   1HB   CYS  31          1HB       CYS  31   7.915  -4.690   6.715
  218   2HB   CYS  31          2HB       CYS  31   6.746  -4.634   5.394
  219    H    ASN  32           H        ASN  32   6.338  -3.308   8.194
  220    HA   ASN  32           HA       ASN  32   3.727  -2.930   7.379
  221   1HB   ASN  32          1HB       ASN  32   5.194  -3.290   9.951
  222   2HB   ASN  32          2HB       ASN  32   3.616  -2.505  10.111
  223   1HD2  ASN  32          1HD2      ASN  32   5.070  -5.115   8.162
  224   2HD2  ASN  32          2HD2      ASN  32   3.842  -6.305   8.439
  225    H    ASN  33           H        ASN  33   6.209  -0.667   7.755
  226    HA   ASN  33           HA       ASN  33   4.399   1.402   8.696
  227   1HB   ASN  33          1HB       ASN  33   6.467   1.379   9.940
  228   2HB   ASN  33          2HB       ASN  33   7.442   1.235   8.469
  229   1HD2  ASN  33          1HD2      ASN  33   8.509   3.006   8.077
  230   2HD2  ASN  33          2HD2      ASN  33   7.955   4.636   8.262
  231    H    ARG  34           H        ARG  34   6.313   0.158   5.980
  232    HA   ARG  34           HA       ARG  34   6.098   2.599   4.512
  233   1HB   ARG  34          1HB       ARG  34   7.503   1.578   2.920
  234   2HB   ARG  34          2HB       ARG  34   8.018   0.796   4.424
  235   1HG   ARG  34          1HG       ARG  34   7.760  -1.028   2.986
  236   2HG   ARG  34          2HG       ARG  34   6.182  -0.997   3.793
  237   1HD   ARG  34          1HD       ARG  34   5.240  -0.873   1.743
  238   2HD   ARG  34          2HD       ARG  34   5.914   0.757   1.587
  239    HE   ARG  34           HE       ARG  34   7.990  -1.037   0.931
  240   1HH1  ARG  34          1HH1      ARG  34   4.801  -0.214  -0.308
  241   2HH1  ARG  34          2HH1      ARG  34   5.187  -0.634  -1.943
  242   1HH2  ARG  34          1HH2      ARG  34   8.500  -1.591  -1.228
  243   2HH2  ARG  34          2HH2      ARG  34   7.305  -1.422  -2.469
  244    H    GLY  35           H        GLY  35   4.442  -0.525   4.841
  245   1HA   GLY  35          1HA       GLY  35   2.052  -0.320   4.149
  246   2HA   GLY  35          2HA       GLY  35   2.663   0.191   2.588
  247    H    CYS  36           H        CYS  36   4.490  -2.214   4.435
  248    HA   CYS  36           HA       CYS  36   3.450  -4.267   2.620
  249   1HB   CYS  36          1HB       CYS  36   6.283  -3.916   3.606
  250   2HB   CYS  36          2HB       CYS  36   5.696  -5.293   2.669
  251    H    CYS  37           H        CYS  37   4.186  -6.570   3.657
  252    HA   CYS  37           HA       CYS  37   3.582  -6.383   6.520
  253   1HB   CYS  37          1HB       CYS  37   1.779  -7.291   4.903
  254   2HB   CYS  37          2HB       CYS  37   2.786  -8.739   4.835
  255    H    PHE  38           H        PHE  38   5.202  -7.228   7.792
  256    HA   PHE  38           HA       PHE  38   7.329  -8.665   6.446
  257   1HB   PHE  38          1HB       PHE  38   7.690  -6.727   8.045
  258   2HB   PHE  38          2HB       PHE  38   6.906  -7.656   9.325
  259    HD1  PHE  38           HD1      PHE  38   8.124  -9.264  10.568
  260    HD2  PHE  38           HD2      PHE  38   9.874  -7.501   7.127
  261    HE1  PHE  38           HE1      PHE  38  10.349 -10.243  11.197
  262    HE2  PHE  38           HE2      PHE  38  12.098  -8.481   7.755
  263    HZ   PHE  38           HZ       PHE  38  12.308  -9.840   9.783
  264    H    ASP  39           H        ASP  39   7.472 -10.855   6.453
  265    HA   ASP  39           HA       ASP  39   5.675 -12.279   8.178
  266   1HB   ASP  39          1HB       ASP  39   5.783 -13.055   5.909
  267   2HB   ASP  39          2HB       ASP  39   7.552 -13.079   5.919
  268    H    SER  40           H        SER  40   8.981 -13.282   7.108
  269    HA   SER  40           HA       SER  40  10.863 -13.492   8.270
  270   1HB   SER  40          1HB       SER  40   9.660 -11.868  10.021
  271   2HB   SER  40          2HB       SER  40   9.575 -13.353  10.984
  272    HG   SER  40           HG       SER  40  11.519 -12.122  11.406
  273    H    ARG  41           H        ARG  41   7.825 -15.087   8.778
  274    HA   ARG  41           HA       ARG  41   8.605 -17.174  10.389
  275   1HB   ARG  41          1HB       ARG  41   6.549 -17.078   8.136
  276   2HB   ARG  41          2HB       ARG  41   6.647 -18.392   9.322
  277   1HG   ARG  41          1HG       ARG  41   6.614 -16.137  10.928
  278   2HG   ARG  41          2HG       ARG  41   5.549 -15.651   9.598
  279   1HD   ARG  41          1HD       ARG  41   4.126 -16.697  11.202
  280   2HD   ARG  41          2HD       ARG  41   4.358 -17.921   9.945
  281    HE   ARG  41           HE       ARG  41   6.397 -18.456  11.724
  282   1HH1  ARG  41          1HH1      ARG  41   2.921 -18.057  12.095
  283   2HH1  ARG  41          2HH1      ARG  41   2.815 -19.123  13.457
  284   1HH2  ARG  41          1HH2      ARG  41   6.257 -19.862  13.520
  285   2HH2  ARG  41          2HH2      ARG  41   4.725 -20.156  14.273
  286    H    ILE  42           H        ILE  42   8.676 -16.756   6.795
  287    HA   ILE  42           HA       ILE  42  10.403 -19.132   6.679
  288    HB   ILE  42           HB       ILE  42   8.782 -18.282   4.328
  289   1HG1  ILE  42          1HG1      ILE  42   7.697 -19.704   6.756
  290   2HG1  ILE  42          2HG1      ILE  42   7.055 -18.258   5.957
  291   1HG2  ILE  42          1HG2      ILE  42   9.278 -21.098   5.228
  292   2HG2  ILE  42          2HG2      ILE  42   9.110 -20.433   3.585
  293   3HG2  ILE  42          3HG2      ILE  42  10.607 -20.157   4.508
  294   1HD1  ILE  42          1HD1      ILE  42   5.652 -20.050   5.235
  295   2HD1  ILE  42          2HD1      ILE  42   6.759 -19.767   3.871
  296   3HD1  ILE  42          3HD1      ILE  42   7.038 -21.136   4.973
  297    HA   PRO  43           HA       PRO  43  13.125 -15.997   5.275
  298   1HB   PRO  43          1HB       PRO  43  15.420 -17.463   5.493
  299   2HB   PRO  43          2HB       PRO  43  14.738 -16.535   6.828
  300   1HG   PRO  43          1HG       PRO  43  14.688 -19.439   6.317
  301   2HG   PRO  43          2HG       PRO  43  14.431 -18.569   7.871
  302   1HD   PRO  43          1HD       PRO  43  12.479 -19.802   6.177
  303   2HD   PRO  43          2HD       PRO  43  12.160 -18.820   7.612
  304    H    GLY  44           H        GLY  44  12.071 -18.739   3.824
  305   1HA   GLY  44          1HA       GLY  44  13.855 -18.472   1.516
  306   2HA   GLY  44          2HA       GLY  44  12.698 -19.751   1.824
  307    H    VAL  45           H        VAL  45  10.999 -17.051   2.694
  308    HA   VAL  45           HA       VAL  45  10.067 -16.595  -0.057
  309    HB   VAL  45           HB       VAL  45   7.873 -16.721   0.606
  310   1HG1  VAL  45          1HG1      VAL  45   9.617 -18.788   1.695
  311   2HG1  VAL  45          2HG1      VAL  45   8.082 -18.675   2.590
  312   3HG1  VAL  45          3HG1      VAL  45   8.068 -18.938   0.829
  313   1HG2  VAL  45          1HG2      VAL  45   8.128 -15.118   2.507
  314   2HG2  VAL  45          2HG2      VAL  45   7.017 -16.466   2.849
  315   3HG2  VAL  45          3HG2      VAL  45   8.663 -16.475   3.527
  316    HA   PRO  46           HA       PRO  46  10.194 -12.347   0.819
  317   1HB   PRO  46          1HB       PRO  46   7.748 -11.287   0.229
  318   2HB   PRO  46          2HB       PRO  46   8.933 -11.717  -1.001
  319   1HG   PRO  46          1HG       PRO  46   6.477 -13.117  -0.162
  320   2HG   PRO  46          2HG       PRO  46   7.397 -13.291  -1.700
  321   1HD   PRO  46          1HD       PRO  46   7.327 -15.070   0.543
  322   2HD   PRO  46          2HD       PRO  46   8.372 -15.205  -0.878
  323    H    TRP  47           H        TRP  47  10.679 -11.501   2.735
  324    HA   TRP  47           HA       TRP  47   8.690 -11.899   4.818
  325   1HB   TRP  47          1HB       TRP  47  11.115 -10.469   5.549
  326   2HB   TRP  47          2HB       TRP  47  10.391 -11.921   6.245
  327    HD1  TRP  47           HD1      TRP  47  11.035 -14.297   4.801
  328    HE1  TRP  47           HE1      TRP  47  13.276 -15.052   3.631
  329    HE3  TRP  47           HE3      TRP  47  13.024  -9.632   4.424
  330    HZ2  TRP  47           HZ2      TRP  47  15.578 -13.645   2.701
  331    HZ3  TRP  47           HZ3      TRP  47  15.273  -9.411   3.370
  332    HH2  TRP  47           HH2      TRP  47  16.542 -11.322   2.526
  333    H    CYS  48           H        CYS  48   8.255 -10.070   2.466
  334    HA   CYS  48           HA       CYS  48   7.263  -7.883   3.920
  335   1HB   CYS  48          1HB       CYS  48   9.604  -7.193   3.938
  336   2HB   CYS  48          2HB       CYS  48   9.660  -7.284   2.175
  337    H    PHE  49           H        PHE  49   5.306  -7.987   2.844
  338    HA   PHE  49           HA       PHE  49   5.405  -7.630  -0.047
  339   1HB   PHE  49          1HB       PHE  49   3.282  -9.337   0.238
  340   2HB   PHE  49          2HB       PHE  49   4.913  -9.930  -0.089
  341    HD1  PHE  49           HD1      PHE  49   6.363 -10.300   2.116
  342    HD2  PHE  49           HD2      PHE  49   2.122 -10.279   1.974
  343    HE1  PHE  49           HE1      PHE  49   6.285 -11.637   4.239
  344    HE2  PHE  49           HE2      PHE  49   2.044 -11.617   4.096
  345    HZ   PHE  49           HZ       PHE  49   4.126 -12.280   5.204
  346    H    LYS  50           H        LYS  50   2.677  -7.720  -0.591
  347    HA   LYS  50           HA       LYS  50   1.605  -5.696   1.248
  348   1HB   LYS  50          1HB       LYS  50   0.509  -4.701  -0.771
  349   2HB   LYS  50          2HB       LYS  50   2.272  -4.522  -0.710
  350   1HG   LYS  50          1HG       LYS  50   1.880  -6.960  -2.027
  351   2HG   LYS  50          2HG       LYS  50   0.587  -5.932  -2.668
  352   1HD   LYS  50          1HD       LYS  50   2.511  -5.639  -4.083
  353   2HD   LYS  50          2HD       LYS  50   2.363  -4.160  -3.119
  354   1HE   LYS  50          1HE       LYS  50   4.085  -5.017  -1.554
  355   2HE   LYS  50          2HE       LYS  50   4.227  -6.504  -2.505
  356   1HZ   LYS  50          1HZ       LYS  50   4.502  -4.180  -4.091
  357   2HZ   LYS  50          2HZ       LYS  50   5.606  -4.208  -2.888
  358   3HZ   LYS  50          3HZ       LYS  50   5.512  -5.455  -3.939
  359    HA   PRO  51           HA       PRO  51  -1.209  -9.236   0.961
  360   1HB   PRO  51          1HB       PRO  51  -1.388  -9.779   3.633
  361   2HB   PRO  51          2HB       PRO  51  -0.276 -10.616   2.551
  362   1HG   PRO  51          1HG       PRO  51   0.240  -8.488   4.528
  363   2HG   PRO  51          2HG       PRO  51   1.406  -9.648   3.798
  364   1HD   PRO  51          1HD       PRO  51   1.049  -6.871   3.202
  365   2HD   PRO  51          2HD       PRO  51   2.099  -8.007   2.345
  366    H    LEU  52           H        LEU  52  -2.040  -8.300   4.127
  367    HA   LEU  52           HA       LEU  52  -4.444  -7.088   3.024
  368   1HB   LEU  52          1HB       LEU  52  -5.496  -7.648   4.944
  369   2HB   LEU  52          2HB       LEU  52  -4.291  -8.945   4.841
  370    HG   LEU  52           HG       LEU  52  -3.094  -6.867   6.329
  371   1HD1  LEU  52          1HD1      LEU  52  -5.035  -7.092   8.223
  372   2HD1  LEU  52          2HD1      LEU  52  -4.835  -5.700   7.133
  373   3HD1  LEU  52          3HD1      LEU  52  -6.011  -6.976   6.739
  374   1HD2  LEU  52          1HD2      LEU  52  -2.434  -8.692   7.398
  375   2HD2  LEU  52          2HD2      LEU  52  -4.068  -8.891   8.077
  376   3HD2  LEU  52          3HD2      LEU  52  -3.649  -9.658   6.526
  377    H    GLN  53           H        GLN  53  -1.945  -5.660   2.698
  378    HA   GLN  53           HA       GLN  53  -1.442  -3.843   4.671
  379   1HB   GLN  53          1HB       GLN  53  -1.273  -3.524   1.651
  380   2HB   GLN  53          2HB       GLN  53  -0.521  -2.412   2.810
  381   1HG   GLN  53          1HG       GLN  53   0.064  -5.384   2.471
  382   2HG   GLN  53          2HG       GLN  53   1.138  -4.048   2.028
  383   1HE2  GLN  53          1HE2      GLN  53  -0.097  -6.078   4.514
  384   2HE2  GLN  53          2HE2      GLN  53   0.863  -5.502   5.837
  385    H    GLU  54           H        GLU  54  -4.265  -4.192   2.691
  386    HA   GLU  54           HA       GLU  54  -5.148  -1.728   2.209
  387   1HB   GLU  54          1HB       GLU  54  -7.208  -2.688   1.946
  388   2HB   GLU  54          2HB       GLU  54  -6.267  -4.181   2.100
  389   1HG   GLU  54          1HG       GLU  54  -6.726  -4.007   4.632
  390   2HG   GLU  54          2HG       GLU  54  -7.926  -2.769   4.229
  391    H    ALA  55           H        ALA  55  -4.569  -3.164   5.365
  392    HA   ALA  55           HA       ALA  55  -6.214  -1.947   7.075
  393   1HB   ALA  55          1HB       ALA  55  -3.352  -2.733   7.084
  394   2HB   ALA  55          2HB       ALA  55  -3.823  -1.577   8.352
  395   3HB   ALA  55          3HB       ALA  55  -4.657  -3.143   8.224
  396    H    GLU  56           H        GLU  56  -3.051  -0.374   6.213
  397    HA   GLU  56           HA       GLU  56  -4.520   2.143   6.190
  398   1HB   GLU  56          1HB       GLU  56  -2.120   1.355   7.791
  399   2HB   GLU  56          2HB       GLU  56  -2.131   2.998   7.125
  400   1HG   GLU  56          1HG       GLU  56  -4.652   2.075   8.434
  401   2HG   GLU  56          2HG       GLU  56  -3.270   2.322   9.513
  402    H    CYS  57           H        CYS  57  -3.603   0.245   4.039
  403    HA   CYS  57           HA       CYS  57  -1.555   1.907   2.782
  404   1HB   CYS  57          1HB       CYS  57  -1.337  -0.653   3.107
  405   2HB   CYS  57          2HB       CYS  57  -2.450  -0.764   1.741
  406    H    THR  58           H        THR  58  -4.576   0.019   2.002
  407    HA   THR  58           HA       THR  58  -5.065   1.392  -0.409
  408    HB   THR  58           HB       THR  58  -5.914  -0.922   0.548
  409    HG1  THR  58           HG1      THR  58  -7.983  -0.348  -0.759
  410   1HG2  THR  58          1HG2      THR  58  -8.140  -0.849   1.524
  411   2HG2  THR  58          2HG2      THR  58  -7.115   0.199   2.534
  412   3HG2  THR  58          3HG2      THR  58  -8.223   0.920   1.342
  413    H    PHE  59           H        PHE  59  -6.197   1.913   2.969
  414    HA   PHE  59           HA       PHE  59  -8.159   3.644   2.757
  415   1HB   PHE  59          1HB       PHE  59  -6.280   2.951   4.641
  416   2HB   PHE  59          2HB       PHE  59  -5.761   4.610   4.327
  417    HD1  PHE  59           HD1      PHE  59  -8.126   2.500   6.009
  418    HD2  PHE  59           HD2      PHE  59  -7.444   6.468   4.670
  419    HE1  PHE  59           HE1      PHE  59  -9.894   3.333   7.583
  420    HE2  PHE  59           HE2      PHE  59  -9.212   7.303   6.245
  421    HZ   PHE  59           HZ       PHE  59 -10.416   5.725   7.682
  422   1H    GLU   1           H1       GLU   1 -20.942  -3.568  -0.693
  423    HA   GLU   1           HA       GLU   1 -19.470  -1.924   1.217
  424   1HB   GLU   1          1HB       GLU   1 -18.689  -4.358  -0.205
  425   2HB   GLU   1          2HB       GLU   1 -17.563  -3.028  -0.530
  426   1HG   GLU   1          1HG       GLU   1 -16.608  -3.735   1.423
  427   2HG   GLU   1          2HG       GLU   1 -17.871  -2.745   2.171
  428    H    GLU   2           H        GLU   2 -19.745   0.153   0.475
  429    HA   GLU   2           HA       GLU   2 -19.887   0.583  -2.356
  430   1HB   GLU   2          1HB       GLU   2 -20.287   2.275   0.108
  431   2HB   GLU   2          2HB       GLU   2 -20.072   3.066  -1.464
  432   1HG   GLU   2          1HG       GLU   2 -21.998   0.798  -1.421
  433   2HG   GLU   2          2HG       GLU   2 -22.488   2.209  -0.472
  434    H    TYR   3           H        TYR   3 -17.577  -0.309  -2.575
  435    HA   TYR   3           HA       TYR   3 -15.524   1.544  -1.691
  436   1HB   TYR   3          1HB       TYR   3 -15.796  -1.186  -3.030
  437   2HB   TYR   3          2HB       TYR   3 -14.237  -0.360  -3.112
  438    HD1  TYR   3           HD1      TYR   3 -16.735  -0.632  -0.326
  439    HD2  TYR   3           HD2      TYR   3 -12.783  -1.518  -1.707
  440    HE1  TYR   3           HE1      TYR   3 -16.134  -1.560   1.963
  441    HE2  TYR   3           HE2      TYR   3 -12.196  -2.442   0.587
  442    HH   TYR   3           HH       TYR   3 -14.063  -1.865   3.294
  443    H    VAL   4           H        VAL   4 -16.405   3.354  -3.057
  444    HA   VAL   4           HA       VAL   4 -15.452   3.031  -5.818
  445    HB   VAL   4           HB       VAL   4 -17.793   4.667  -4.821
  446   1HG1  VAL   4          1HG1      VAL   4 -16.686   5.769  -6.684
  447   2HG1  VAL   4          2HG1      VAL   4 -16.698   4.257  -7.624
  448   3HG1  VAL   4          3HG1      VAL   4 -18.231   5.071  -7.230
  449   1HG2  VAL   4          1HG2      VAL   4 -18.953   2.763  -4.976
  450   2HG2  VAL   4          2HG2      VAL   4 -18.684   2.838  -6.734
  451   3HG2  VAL   4          3HG2      VAL   4 -17.576   1.900  -5.704
  452    H    GLY   5           H        GLY   5 -16.152   5.369  -3.133
  453   1HA   GLY   5          1HA       GLY   5 -14.503   7.418  -4.214
  454   2HA   GLY   5          2HA       GLY   5 -15.171   7.328  -2.597
  455    H    LEU   6           H        LEU   6 -13.645   4.380  -3.073
  456    HA   LEU   6           HA       LEU   6 -11.047   5.417  -2.191
  457   1HB   LEU   6          1HB       LEU   6 -11.016   3.389  -0.651
  458   2HB   LEU   6          2HB       LEU   6 -11.948   4.813  -0.158
  459    HG   LEU   6           HG       LEU   6 -13.096   2.715   0.365
  460   1HD1  LEU   6          1HD1      LEU   6 -14.188   4.964  -0.807
  461   2HD1  LEU   6          2HD1      LEU   6 -14.909   3.628  -1.738
  462   3HD1  LEU   6          3HD1      LEU   6 -15.082   3.674   0.033
  463   1HD2  LEU   6          1HD2      LEU   6 -13.426   1.000  -1.051
  464   2HD2  LEU   6          2HD2      LEU   6 -13.749   2.065  -2.441
  465   3HD2  LEU   6          3HD2      LEU   6 -12.072   1.730  -1.946
  466    H    SER   7           H        SER   7 -12.557   4.122  -4.688
  467    HA   SER   7           HA       SER   7 -10.636   1.964  -5.036
  468   1HB   SER   7          1HB       SER   7 -13.399   2.093  -5.510
  469   2HB   SER   7          2HB       SER   7 -12.678   2.185  -7.127
  470    HG   SER   7           HG       SER   7 -12.291   0.140  -5.115
  471    H    ALA   8           H        ALA   8 -10.767   1.864  -7.915
  472    HA   ALA   8           HA       ALA   8  -8.804   3.721  -8.576
  473   1HB   ALA   8          1HB       ALA   8 -10.697   2.097 -10.324
  474   2HB   ALA   8          2HB       ALA   8  -9.222   2.914 -10.895
  475   3HB   ALA   8          3HB       ALA   8  -9.103   1.579  -9.724
  476    H    ASN   9           H        ASN   9  -9.603   5.801  -7.851
  477    HA   ASN   9           HA       ASN   9 -10.545   7.381  -9.808
  478   1HB   ASN   9          1HB       ASN   9 -12.694   5.810  -8.897
  479   2HB   ASN   9          2HB       ASN   9 -12.925   7.352  -8.059
  480   1HD2  ASN   9          1HD2      ASN   9 -12.030   9.191  -9.780
  481   2HD2  ASN   9          2HD2      ASN   9 -12.947   9.215 -11.249
  482    H    GLN  10           H        GLN  10 -10.485   6.480  -6.361
  483    HA   GLN  10           HA       GLN  10 -10.932   9.013  -5.305
  484   1HB   GLN  10          1HB       GLN  10 -11.078   6.855  -4.055
  485   2HB   GLN  10          2HB       GLN  10  -9.313   6.723  -4.103
  486   1HG   GLN  10          1HG       GLN  10  -9.150   8.896  -2.886
  487   2HG   GLN  10          2HG       GLN  10 -10.916   8.981  -2.809
  488   1HE2  GLN  10          1HE2      GLN  10  -8.385   6.523  -2.281
  489   2HE2  GLN  10          2HE2      GLN  10  -8.933   5.975  -0.732
  490    H    CYS  11           H        CYS  11  -8.069   7.412  -6.670
  491    HA   CYS  11           HA       CYS  11  -6.138   9.073  -5.532
  492   1HB   CYS  11          1HB       CYS  11  -5.566   6.968  -6.539
  493   2HB   CYS  11          2HB       CYS  11  -6.137   7.509  -8.120
  494    H    ALA  12           H        ALA  12  -8.744   9.788  -7.569
  495    HA   ALA  12           HA       ALA  12  -7.304  11.975  -8.890
  496   1HB   ALA  12          1HB       ALA  12  -9.908  11.840  -9.906
  497   2HB   ALA  12          2HB       ALA  12  -8.440  11.185 -10.670
  498   3HB   ALA  12          3HB       ALA  12  -9.454  10.138  -9.648
  499    H    VAL  13           H        VAL  13  -8.269  11.698  -5.969
  500    HA   VAL  13           HA       VAL  13 -10.503  13.076  -5.386
  501    HB   VAL  13           HB       VAL  13  -8.847  14.099  -3.535
  502   1HG1  VAL  13          1HG1      VAL  13  -9.913  11.279  -3.806
  503   2HG1  VAL  13          2HG1      VAL  13  -9.139  11.876  -2.319
  504   3HG1  VAL  13          3HG1      VAL  13 -10.622  12.652  -2.924
  505   1HG2  VAL  13          1HG2      VAL  13  -6.881  12.872  -3.196
  506   2HG2  VAL  13          2HG2      VAL  13  -7.377  11.580  -4.316
  507   3HG2  VAL  13          3HG2      VAL  13  -6.892  13.171  -4.951
  508    HA   PRO  14           HA       PRO  14 -10.045  17.179  -6.666
  509   1HB   PRO  14          1HB       PRO  14 -11.097  18.661  -4.626
  510   2HB   PRO  14          2HB       PRO  14 -12.089  17.809  -5.810
  511   1HG   PRO  14          1HG       PRO  14 -11.465  17.120  -3.009
  512   2HG   PRO  14          2HG       PRO  14 -12.824  16.534  -4.035
  513   1HD   PRO  14          1HD       PRO  14 -10.433  15.147  -3.283
  514   2HD   PRO  14          2HD       PRO  14 -11.664  14.587  -4.422
  515    H    ALA  15           H        ALA  15  -8.054  15.976  -4.450
  516    HA   ALA  15           HA       ALA  15  -5.955  16.620  -3.993
  517   1HB   ALA  15          1HB       ALA  15  -4.991  18.571  -4.890
  518   2HB   ALA  15          2HB       ALA  15  -6.265  18.168  -6.066
  519   3HB   ALA  15          3HB       ALA  15  -6.535  19.457  -4.869
  520    H    LYS  16           H        LYS  16  -7.859  16.347  -2.068
  521    HA   LYS  16           HA       LYS  16  -6.858  17.722   0.063
  522   1HB   LYS  16          1HB       LYS  16  -9.089  19.186   0.369
  523   2HB   LYS  16          2HB       LYS  16  -7.587  19.825  -0.325
  524   1HG   LYS  16          1HG       LYS  16  -8.487  19.993  -2.411
  525   2HG   LYS  16          2HG       LYS  16  -9.366  18.460  -2.276
  526   1HD   LYS  16          1HD       LYS  16 -11.268  19.578  -1.841
  527   2HD   LYS  16          2HD       LYS  16 -10.526  20.353  -0.430
  528   1HE   LYS  16          1HE       LYS  16 -10.056  22.289  -1.583
  529   2HE   LYS  16          2HE       LYS  16  -9.758  21.446  -3.112
  530   1HZ   LYS  16          1HZ       LYS  16 -11.945  21.492  -3.612
  531   2HZ   LYS  16          2HZ       LYS  16 -12.456  21.451  -2.062
  532   3HZ   LYS  16          3HZ       LYS  16 -11.899  22.846  -2.700
  533    H    ASP  17           H        ASP  17  -7.607  15.103  -0.602
  534    HA   ASP  17           HA       ASP  17  -9.536  14.685   1.487
  535   1HB   ASP  17          1HB       ASP  17 -10.881  14.744  -0.602
  536   2HB   ASP  17          2HB       ASP  17  -9.849  13.492  -1.308
  537    H    ARG  18           H        ARG  18  -6.557  14.235   0.381
  538    HA   ARG  18           HA       ARG  18  -6.466  11.365   0.525
  539   1HB   ARG  18          1HB       ARG  18  -4.115  13.280   0.261
  540   2HB   ARG  18          2HB       ARG  18  -4.168  11.575  -0.220
  541   1HG   ARG  18          1HG       ARG  18  -5.168  12.049  -2.208
  542   2HG   ARG  18          2HG       ARG  18  -6.242  13.271  -1.501
  543   1HD   ARG  18          1HD       ARG  18  -4.404  14.908  -1.497
  544   2HD   ARG  18          2HD       ARG  18  -3.273  13.689  -2.105
  545    HE   ARG  18           HE       ARG  18  -5.677  14.173  -3.759
  546   1HH1  ARG  18          1HH1      ARG  18  -2.274  14.886  -3.211
  547   2HH1  ARG  18          2HH1      ARG  18  -2.004  15.460  -4.822
  548   1HH2  ARG  18          1HH2      ARG  18  -5.320  14.929  -5.885
  549   2HH2  ARG  18          2HH2      ARG  18  -3.748  15.485  -6.354
  550    H    VAL  19           H        VAL  19  -4.229  10.642   1.822
  551    HA   VAL  19           HA       VAL  19  -4.576  11.796   4.499
  552    HB   VAL  19           HB       VAL  19  -3.420   9.097   3.824
  553   1HG1  VAL  19          1HG1      VAL  19  -4.629   8.828   6.226
  554   2HG1  VAL  19          2HG1      VAL  19  -2.936   9.341   6.028
  555   3HG1  VAL  19          3HG1      VAL  19  -4.210  10.557   6.289
  556   1HG2  VAL  19          1HG2      VAL  19  -5.469   8.651   2.941
  557   2HG2  VAL  19          2HG2      VAL  19  -5.894   8.444   4.657
  558   3HG2  VAL  19          3HG2      VAL  19  -6.264   9.975   3.827
  559    H    ASP  20           H        ASP  20  -2.837  12.655   2.080
  560    HA   ASP  20           HA       ASP  20  -0.719  13.067   1.605
  561   1HB   ASP  20          1HB       ASP  20  -0.971  15.009   2.835
  562   2HB   ASP  20          2HB       ASP  20  -1.321  14.145   4.340
  563    H    CYS  21           H        CYS  21   0.135  10.843   1.417
  564    HA   CYS  21           HA       CYS  21   0.873   9.194   3.425
  565   1HB   CYS  21          1HB       CYS  21   1.060   9.110   0.760
  566   2HB   CYS  21          2HB       CYS  21   2.763   9.387   1.141
  567    H    GLY  22           H        GLY  22   2.514  12.119   2.161
  568   1HA   GLY  22          1HA       GLY  22   4.293  13.288   2.880
  569   2HA   GLY  22          2HA       GLY  22   3.861  12.737   4.487
  570    H    TYR  23           H        TYR  23   5.266  11.227   1.481
  571    HA   TYR  23           HA       TYR  23   7.038   9.662   3.169
  572   1HB   TYR  23          1HB       TYR  23   5.770   9.639   0.510
  573   2HB   TYR  23          2HB       TYR  23   7.506   9.360   0.342
  574    HD1  TYR  23           HD1      TYR  23   4.316   7.933   1.257
  575    HD2  TYR  23           HD2      TYR  23   8.549   7.417   1.605
  576    HE1  TYR  23           HE1      TYR  23   3.975   5.490   1.871
  577    HE2  TYR  23           HE2      TYR  23   8.194   4.976   2.218
  578    HH   TYR  23           HH       TYR  23   4.963   3.704   2.755
  579    HA   PRO  24           HA       PRO  24  10.399  12.313   2.469
  580   1HB   PRO  24          1HB       PRO  24  12.420  10.692   3.335
  581   2HB   PRO  24          2HB       PRO  24  11.415  11.645   4.425
  582   1HG   PRO  24          1HG       PRO  24  11.351   8.756   3.823
  583   2HG   PRO  24          2HG       PRO  24  10.677   9.622   5.251
  584   1HD   PRO  24          1HD       PRO  24   9.277   8.547   2.997
  585   2HD   PRO  24          2HD       PRO  24   8.589   9.529   4.295
  586    H    HIS  25           H        HIS  25   9.672   9.688   0.660
  587    HA   HIS  25           HA       HIS  25  11.862  10.372  -1.159
  588   1HB   HIS  25          1HB       HIS  25  11.758   8.019   0.146
  589   2HB   HIS  25          2HB       HIS  25  10.765   7.614  -1.260
  590    HD1  HIS  25           HD1      HIS  25  12.147   8.746  -3.611
  591    HD2  HIS  25           HD2      HIS  25  14.300   7.236  -0.343
  592    HE1  HIS  25           HE1      HIS  25  14.477   8.187  -4.487
  593    HE2  HIS  25           HE2      HIS  25  15.771   7.316  -2.423
  594    H    VAL  26           H        VAL  26   8.823  11.066  -0.662
  595    HA   VAL  26           HA       VAL  26   7.137  10.067  -2.464
  596    HB   VAL  26           HB       VAL  26   6.402  11.791  -1.081
  597   1HG1  VAL  26          1HG1      VAL  26   7.748  13.431  -0.401
  598   2HG1  VAL  26          2HG1      VAL  26   8.944  12.965  -1.633
  599   3HG1  VAL  26          3HG1      VAL  26   7.689  14.165  -2.021
  600   1HG2  VAL  26          1HG2      VAL  26   5.180  13.167  -2.508
  601   2HG2  VAL  26          2HG2      VAL  26   6.517  13.323  -3.673
  602   3HG2  VAL  26          3HG2      VAL  26   5.605  11.798  -3.562
  603    H    THR  27           H        THR  27   7.027   9.741  -4.632
  604    HA   THR  27           HA       THR  27   8.130  11.560  -6.498
  605    HB   THR  27           HB       THR  27   9.899   9.503  -5.396
  606    HG1  THR  27           HG1      THR  27  10.254  11.315  -7.655
  607   1HG2  THR  27          1HG2      THR  27  10.769   9.137  -7.915
  608   2HG2  THR  27          2HG2      THR  27   9.609   8.002  -7.183
  609   3HG2  THR  27          3HG2      THR  27   9.034   9.277  -8.285
  610    HA   PRO  28           HA       PRO  28   5.292   9.440  -8.917
  611   1HB   PRO  28          1HB       PRO  28   6.063  10.180 -11.432
  612   2HB   PRO  28          2HB       PRO  28   5.102  11.213 -10.374
  613   1HG   PRO  28          1HG       PRO  28   7.967  11.343 -11.063
  614   2HG   PRO  28          2HG       PRO  28   6.914  12.641 -10.395
  615   1HD   PRO  28          1HD       PRO  28   8.898  11.085  -9.037
  616   2HD   PRO  28          2HD       PRO  28   7.775  12.237  -8.302
  617    H    LYS  29           H        LYS  29   7.109   7.697  -7.906
  618    HA   LYS  29           HA       LYS  29   6.882   5.603  -9.703
  619   1HB   LYS  29          1HB       LYS  29   8.664   7.154 -10.825
  620   2HB   LYS  29          2HB       LYS  29   9.766   6.435  -9.637
  621   1HG   LYS  29          1HG       LYS  29   9.723   4.394 -10.660
  622   2HG   LYS  29          2HG       LYS  29   7.998   4.500 -11.054
  623   1HD   LYS  29          1HD       LYS  29   8.642   6.205 -12.842
  624   2HD   LYS  29          2HD       LYS  29  10.336   5.781 -12.537
  625   1HE   LYS  29          1HE       LYS  29  10.015   4.177 -14.112
  626   2HE   LYS  29          2HE       LYS  29   9.145   3.290 -12.852
  627   1HZ   LYS  29          1HZ       LYS  29   7.484   3.423 -14.297
  628   2HZ   LYS  29          2HZ       LYS  29   7.294   4.961 -13.785
  629   3HZ   LYS  29          3HZ       LYS  29   8.138   4.654 -15.148
  630    H    GLU  30           H        GLU  30   8.018   7.208  -6.855
  631    HA   GLU  30           HA       GLU  30   8.947   4.693  -5.750
  632   1HB   GLU  30          1HB       GLU  30   9.525   7.527  -5.293
  633   2HB   GLU  30          2HB       GLU  30   9.222   6.665  -3.776
  634   1HG   GLU  30          1HG       GLU  30  11.607   6.577  -4.342
  635   2HG   GLU  30          2HG       GLU  30  10.915   4.950  -4.444
  636    H    CYS  31           H        CYS  31   6.546   7.342  -5.225
  637    HA   CYS  31           HA       CYS  31   5.433   6.404  -2.898
  638   1HB   CYS  31          1HB       CYS  31   4.307   7.970  -5.202
  639   2HB   CYS  31          2HB       CYS  31   3.316   7.555  -3.801
  640    H    ASN  32           H        ASN  32   4.442   5.787  -6.349
  641    HA   ASN  32           HA       ASN  32   2.430   4.016  -5.732
  642   1HB   ASN  32          1HB       ASN  32   4.110   4.658  -8.131
  643   2HB   ASN  32          2HB       ASN  32   3.257   3.108  -8.182
  644   1HD2  ASN  32          1HD2      ASN  32   2.511   6.324  -6.843
  645   2HD2  ASN  32          2HD2      ASN  32   1.004   6.561  -7.663
  646    H    ASN  33           H        ASN  33   5.842   3.760  -5.361
  647    HA   ASN  33           HA       ASN  33   5.894   0.915  -5.789
  648   1HB   ASN  33          1HB       ASN  33   7.785   2.679  -6.326
  649   2HB   ASN  33          2HB       ASN  33   8.170   2.549  -4.604
  650   1HD2  ASN  33          1HD2      ASN  33  10.208   1.835  -5.759
  651   2HD2  ASN  33          2HD2      ASN  33  10.411   0.138  -6.040
  652    H    ARG  34           H        ARG  34   5.808   3.400  -3.231
  653    HA   ARG  34           HA       ARG  34   6.440   1.516  -1.186
  654   1HB   ARG  34          1HB       ARG  34   5.256   4.269  -0.721
  655   2HB   ARG  34          2HB       ARG  34   6.397   3.381   0.305
  656   1HG   ARG  34          1HG       ARG  34   7.695   3.648  -2.184
  657   2HG   ARG  34          2HG       ARG  34   6.921   5.221  -1.913
  658   1HD   ARG  34          1HD       ARG  34   8.295   5.722  -0.155
  659   2HD   ARG  34          2HD       ARG  34   8.287   4.067   0.471
  660    HE   ARG  34           HE       ARG  34   9.756   3.922  -1.894
  661   1HH1  ARG  34          1HH1      ARG  34   9.997   5.800   1.073
  662   2HH1  ARG  34          2HH1      ARG  34  11.720   5.951   0.988
  663   1HH2  ARG  34          1HH2      ARG  34  12.029   4.122  -2.006
  664   2HH2  ARG  34          2HH2      ARG  34  12.884   4.991  -0.775
  665    H    GLY  35           H        GLY  35   3.607   2.832  -2.818
  666   1HA   GLY  35          1HA       GLY  35   1.614   1.427  -2.600
  667   2HA   GLY  35          2HA       GLY  35   1.861   1.454  -0.866
  668    H    CYS  36           H        CYS  36   2.581   4.355  -2.773
  669    HA   CYS  36           HA       CYS  36   0.101   5.532  -1.745
  670   1HB   CYS  36          1HB       CYS  36   2.817   6.828  -2.001
  671   2HB   CYS  36          2HB       CYS  36   1.328   7.670  -1.561
  672    H    CYS  37           H        CYS  37  -0.410   7.645  -3.112
  673    HA   CYS  37           HA       CYS  37   0.107   6.960  -5.914
  674   1HB   CYS  37          1HB       CYS  37  -2.272   6.833  -4.929
  675   2HB   CYS  37          2HB       CYS  37  -2.235   8.598  -4.978
  676    H    PHE  38           H        PHE  38   1.059   8.557  -7.194
  677    HA   PHE  38           HA       PHE  38   1.808  10.994  -5.788
  678   1HB   PHE  38          1HB       PHE  38   3.407   9.369  -7.029
  679   2HB   PHE  38          2HB       PHE  38   2.635   9.885  -8.533
  680    HD1  PHE  38           HD1      PHE  38   4.866  10.865  -5.799
  681    HD2  PHE  38           HD2      PHE  38   3.064  12.089  -9.441
  682    HE1  PHE  38           HE1      PHE  38   6.468  12.791  -5.944
  683    HE2  PHE  38           HE2      PHE  38   4.666  14.015  -9.587
  684    HZ   PHE  38           HZ       PHE  38   6.349  14.344  -7.836
  685    H    ASP  39           H        ASP  39   0.630  12.817  -6.099
  686    HA   ASP  39           HA       ASP  39  -1.279  12.901  -8.173
  687   1HB   ASP  39          1HB       ASP  39  -2.052  14.156  -6.420
  688   2HB   ASP  39          2HB       ASP  39  -0.425  14.595  -5.877
  689    H    SER  40           H        SER  40   1.013  15.574  -7.322
  690    HA   SER  40           HA       SER  40   2.621  16.530  -8.502
  691   1HB   SER  40          1HB       SER  40   2.692  14.243  -9.823
  692   2HB   SER  40          2HB       SER  40   1.872  15.167 -11.093
  693    HG   SER  40           HG       SER  40   4.002  15.482 -11.559
  694    H    ARG  41           H        ARG  41  -0.702  16.105  -9.550
  695    HA   ARG  41           HA       ARG  41  -0.784  18.109 -11.462
  696   1HB   ARG  41          1HB       ARG  41  -3.094  17.388  -9.622
  697   2HB   ARG  41          2HB       ARG  41  -3.178  17.893 -11.318
  698   1HG   ARG  41          1HG       ARG  41  -1.552  15.628 -11.389
  699   2HG   ARG  41          2HG       ARG  41  -2.758  15.213 -10.159
  700   1HD   ARG  41          1HD       ARG  41  -3.880  14.524 -12.066
  701   2HD   ARG  41          2HD       ARG  41  -4.441  16.203 -12.004
  702    HE   ARG  41           HE       ARG  41  -1.955  15.922 -13.492
  703   1HH1  ARG  41          1HH1      ARG  41  -5.449  15.571 -13.730
  704   2HH1  ARG  41          2HH1      ARG  41  -5.482  15.795 -15.448
  705   1HH2  ARG  41          1HH2      ARG  41  -1.999  16.218 -15.757
  706   2HH2  ARG  41          2HH2      ARG  41  -3.507  16.164 -16.608
  707    H    ILE  42           H        ILE  42  -1.362  18.079  -7.892
  708    HA   ILE  42           HA       ILE  42  -1.299  21.015  -7.983
  709    HB   ILE  42           HB       ILE  42  -2.743  19.440  -5.874
  710   1HG1  ILE  42          1HG1      ILE  42  -3.654  20.098  -8.650
  711   2HG1  ILE  42          2HG1      ILE  42  -3.916  18.627  -7.695
  712   1HG2  ILE  42          1HG2      ILE  42  -2.079  21.962  -5.753
  713   2HG2  ILE  42          2HG2      ILE  42  -3.450  22.183  -6.867
  714   3HG2  ILE  42          3HG2      ILE  42  -3.711  21.444  -5.269
  715   1HD1  ILE  42          1HD1      ILE  42  -6.012  19.557  -7.454
  716   2HD1  ILE  42          2HD1      ILE  42  -5.212  20.423  -6.121
  717   3HD1  ILE  42          3HD1      ILE  42  -5.417  21.217  -7.701
  718    HA   PRO  43           HA       PRO  43   2.278  20.050  -5.613
  719   1HB   PRO  43          1HB       PRO  43   3.509  22.466  -5.935
  720   2HB   PRO  43          2HB       PRO  43   3.705  21.127  -7.064
  721   1HG   PRO  43          1HG       PRO  43   2.091  23.586  -7.299
  722   2HG   PRO  43          2HG       PRO  43   2.664  22.488  -8.607
  723   1HD   PRO  43          1HD       PRO  43   0.033  22.718  -7.498
  724   2HD   PRO  43          2HD       PRO  43   0.582  21.513  -8.671
  725    H    GLY  44           H        GLY  44  -0.318  21.931  -4.998
  726   1HA   GLY  44          1HA       GLY  44   0.774  23.113  -2.560
  727   2HA   GLY  44          2HA       GLY  44  -0.814  23.371  -3.254
  728    H    VAL  45           H        VAL  45  -0.483  20.103  -3.549
  729    HA   VAL  45           HA       VAL  45  -1.479  19.613  -0.828
  730    HB   VAL  45           HB       VAL  45  -3.232  18.378  -1.614
  731   1HG1  VAL  45          1HG1      VAL  45  -4.428  19.928  -2.713
  732   2HG1  VAL  45          2HG1      VAL  45  -2.934  20.895  -2.713
  733   3HG1  VAL  45          3HG1      VAL  45  -3.346  19.892  -4.126
  734   1HG2  VAL  45          1HG2      VAL  45  -1.899  18.070  -4.324
  735   2HG2  VAL  45          2HG2      VAL  45  -1.822  16.871  -3.010
  736   3HG2  VAL  45          3HG2      VAL  45  -3.387  17.271  -3.759
  737    HA   PRO  46           HA       PRO  46   1.137  16.150  -0.733
  738   1HB   PRO  46          1HB       PRO  46  -0.364  13.957  -0.100
  739   2HB   PRO  46          2HB       PRO  46   0.127  15.164   1.086
  740   1HG   PRO  46          1HG       PRO  46  -2.486  14.739  -0.216
  741   2HG   PRO  46          2HG       PRO  46  -2.121  15.626   1.308
  742   1HD   PRO  46          1HD       PRO  46  -2.753  16.702  -1.271
  743   2HD   PRO  46          2HD       PRO  46  -2.244  17.613   0.157
  744    H    TRP  47           H        TRP  47   2.365  15.445  -2.350
  745    HA   TRP  47           HA       TRP  47   0.926  14.356  -4.628
  746   1HB   TRP  47          1HB       TRP  47   3.830  14.457  -4.799
  747   2HB   TRP  47          2HB       TRP  47   2.598  15.119  -5.876
  748    HD1  TRP  47           HD1      TRP  47   1.596  17.638  -5.062
  749    HE1  TRP  47           HE1      TRP  47   2.770  19.691  -3.892
  750    HE3  TRP  47           HE3      TRP  47   5.553  15.013  -3.245
  751    HZ2  TRP  47           HZ2      TRP  47   5.167  19.981  -2.372
  752    HZ3  TRP  47           HZ3      TRP  47   7.265  16.256  -1.928
  753    HH2  TRP  47           HH2      TRP  47   7.119  18.656  -1.482
  754    H    CYS  48           H        CYS  48   1.018  12.924  -2.014
  755    HA   CYS  48           HA       CYS  48   1.788  10.405  -3.032
  756   1HB   CYS  48          1HB       CYS  48   3.998  11.414  -2.331
  757   2HB   CYS  48          2HB       CYS  48   3.416  11.333  -0.666
  758    H    PHE  49           H        PHE  49  -0.129   9.451  -2.395
  759    HA   PHE  49           HA       PHE  49  -0.710   9.484   0.451
  760   1HB   PHE  49          1HB       PHE  49  -3.226   9.732  -0.604
  761   2HB   PHE  49          2HB       PHE  49  -2.287  11.140  -0.095
  762    HD1  PHE  49           HD1      PHE  49  -0.687  12.093  -1.990
  763    HD2  PHE  49           HD2      PHE  49  -4.146   9.740  -2.703
  764    HE1  PHE  49           HE1      PHE  49  -0.829  13.009  -4.322
  765    HE2  PHE  49           HE2      PHE  49  -4.288  10.656  -5.036
  766    HZ   PHE  49           HZ       PHE  49  -2.628  12.280  -5.817
  767    H    LYS  50           H        LYS  50  -3.138   8.120   0.421
  768    HA   LYS  50           HA       LYS  50  -2.506   5.715  -1.141
  769   1HB   LYS  50          1HB       LYS  50  -3.810   4.853   1.162
  770   2HB   LYS  50          2HB       LYS  50  -2.093   4.650   0.767
  771   1HG   LYS  50          1HG       LYS  50  -3.002   7.263   1.946
  772   2HG   LYS  50          2HG       LYS  50  -2.886   5.862   3.025
  773   1HD   LYS  50          1HD       LYS  50  -0.688   7.100   1.323
  774   2HD   LYS  50          2HD       LYS  50  -0.763   7.042   3.092
  775   1HE   LYS  50          1HE       LYS  50  -0.193   4.821   1.119
  776   2HE   LYS  50          2HE       LYS  50   0.736   5.291   2.551
  777   1HZ   LYS  50          1HZ       LYS  50  -1.398   4.585   3.754
  778   2HZ   LYS  50          2HZ       LYS  50  -1.733   3.758   2.385
  779   3HZ   LYS  50          3HZ       LYS  50  -0.372   3.429   3.226
  780    HA   PRO  51           HA       PRO  51  -6.716   7.158  -1.990
  781   1HB   PRO  51          1HB       PRO  51  -6.503   7.326  -4.707
  782   2HB   PRO  51          2HB       PRO  51  -6.276   8.706  -3.636
  783   1HG   PRO  51          1HG       PRO  51  -4.281   7.068  -5.064
  784   2HG   PRO  51          2HG       PRO  51  -4.094   8.725  -4.384
  785   1HD   PRO  51          1HD       PRO  51  -3.100   6.251  -3.341
  786   2HD   PRO  51          2HD       PRO  51  -3.028   7.833  -2.554
  787    H    LEU  52           H        LEU  52  -5.945   5.603  -4.964
  788    HA   LEU  52           HA       LEU  52  -7.632   3.385  -4.080
  789   1HB   LEU  52          1HB       LEU  52  -8.299   3.110  -6.230
  790   2HB   LEU  52          2HB       LEU  52  -8.074   4.867  -6.155
  791    HG   LEU  52           HG       LEU  52  -5.610   3.855  -7.015
  792   1HD1  LEU  52          1HD1      LEU  52  -6.003   1.842  -7.890
  793   2HD1  LEU  52          2HD1      LEU  52  -7.768   2.042  -7.787
  794   3HD1  LEU  52          3HD1      LEU  52  -6.879   2.700  -9.180
  795   1HD2  LEU  52          1HD2      LEU  52  -5.900   5.573  -8.384
  796   2HD2  LEU  52          2HD2      LEU  52  -7.187   4.703  -9.253
  797   3HD2  LEU  52          3HD2      LEU  52  -7.589   5.705  -7.837
  798    H    GLN  53           H        GLN  53  -4.965   3.557  -3.040
  799    HA   GLN  53           HA       GLN  53  -3.062   2.273  -4.486
  800   1HB   GLN  53          1HB       GLN  53  -3.650   2.102  -1.506
  801   2HB   GLN  53          2HB       GLN  53  -2.130   1.572  -2.248
  802   1HG   GLN  53          1HG       GLN  53  -3.293   4.389  -2.344
  803   2HG   GLN  53          2HG       GLN  53  -1.944   3.872  -1.322
  804   1HE2  GLN  53          1HE2      GLN  53  -0.652   2.170  -3.120
  805   2HE2  GLN  53          2HE2      GLN  53   0.050   3.097  -4.404
  806    H    GLU  54           H        GLU  54  -6.084   1.030  -3.310
  807    HA   GLU  54           HA       GLU  54  -5.645  -1.520  -2.690
  808   1HB   GLU  54          1HB       GLU  54  -7.863  -2.020  -3.753
  809   2HB   GLU  54          2HB       GLU  54  -7.882  -0.576  -2.727
  810   1HG   GLU  54          1HG       GLU  54  -7.972   0.880  -4.577
  811   2HG   GLU  54          2HG       GLU  54  -7.335  -0.333  -5.699
  812    H    ALA  55           H        ALA  55  -4.995   0.012  -5.775
  813    HA   ALA  55           HA       ALA  55  -5.221  -1.796  -7.683
  814   1HB   ALA  55          1HB       ALA  55  -2.764  -0.148  -6.977
  815   2HB   ALA  55          2HB       ALA  55  -2.991  -0.972  -8.539
  816   3HB   ALA  55          3HB       ALA  55  -4.112   0.319  -8.041
  817    H    GLU  56           H        GLU  56  -2.199  -1.769  -5.657
  818    HA   GLU  56           HA       GLU  56  -2.370  -4.662  -5.620
  819   1HB   GLU  56          1HB       GLU  56  -0.433  -3.087  -7.125
  820   2HB   GLU  56          2HB       GLU  56   0.381  -4.122  -5.939
  821   1HG   GLU  56          1HG       GLU  56  -0.802  -6.090  -6.824
  822   2HG   GLU  56          2HG       GLU  56  -1.711  -5.074  -7.953
  823    H    CYS  57           H        CYS  57  -2.754  -2.285  -3.721
  824    HA   CYS  57           HA       CYS  57  -0.562  -2.794  -1.873
  825   1HB   CYS  57          1HB       CYS  57  -1.749  -0.464  -2.603
  826   2HB   CYS  57          2HB       CYS  57  -2.648  -0.847  -1.131
  827    H    THR  58           H        THR  58  -4.197  -2.586  -1.999
  828    HA   THR  58           HA       THR  58  -4.619  -3.743   0.516
  829    HB   THR  58           HB       THR  58  -6.201  -2.372  -1.026
  830    HG1  THR  58           HG1      THR  58  -7.125  -4.965  -0.020
  831   1HG2  THR  58          1HG2      THR  58  -5.937  -4.019  -3.005
  832   2HG2  THR  58          2HG2      THR  58  -6.883  -5.175  -2.035
  833   3HG2  THR  58          3HG2      THR  58  -7.612  -3.631  -2.541
  834    H    PHE  59           H        PHE  59  -4.120  -5.174  -2.724
  835    HA   PHE  59           HA       PHE  59  -4.945  -7.751  -2.051
  836   1HB   PHE  59          1HB       PHE  59  -3.134  -6.367  -4.051
  837   2HB   PHE  59          2HB       PHE  59  -3.055  -8.131  -3.980
  838    HD1  PHE  59           HD1      PHE  59  -5.380  -5.284  -4.499
  839    HD2  PHE  59           HD2      PHE  59  -4.669  -9.428  -5.079
  840    HE1  PHE  59           HE1      PHE  59  -7.389  -5.419  -5.998
  841    HE2  PHE  59           HE2      PHE  59  -6.678  -9.562  -6.579
  842    HZ   PHE  59           HZ       PHE  59  -8.014  -7.556  -7.020
  Start of MODEL    6
    1   1H    GLU   1           H1       GLU   1 -14.317  -6.990  -5.752
    2    HA   GLU   1           HA       GLU   1 -16.721  -7.192  -4.417
    3   1HB   GLU   1          1HB       GLU   1 -14.930  -8.895  -5.869
    4   2HB   GLU   1          2HB       GLU   1 -15.396  -9.743  -4.385
    5   1HG   GLU   1          1HG       GLU   1 -17.745  -9.501  -4.909
    6   2HG   GLU   1          2HG       GLU   1 -17.399  -8.407  -6.257
    7    H    GLU   2           H        GLU   2 -16.436  -9.520  -2.742
    8    HA   GLU   2           HA       GLU   2 -15.790  -8.226  -0.347
    9   1HB   GLU   2          1HB       GLU   2 -16.406 -11.117  -1.036
   10   2HB   GLU   2          2HB       GLU   2 -16.158 -10.566   0.630
   11   1HG   GLU   2          1HG       GLU   2 -18.388 -10.148   0.614
   12   2HG   GLU   2          2HG       GLU   2 -17.978  -8.709  -0.335
   13    H    TYR   3           H        TYR   3 -13.514  -7.588  -1.131
   14    HA   TYR   3           HA       TYR   3 -11.484  -9.387  -1.548
   15   1HB   TYR   3          1HB       TYR   3 -11.896  -6.613  -0.408
   16   2HB   TYR   3          2HB       TYR   3 -10.296  -7.317  -0.164
   17    HD1  TYR   3           HD1      TYR   3 -12.572  -7.633  -3.116
   18    HD2  TYR   3           HD2      TYR   3  -8.908  -6.053  -1.573
   19    HE1  TYR   3           HE1      TYR   3 -11.901  -6.891  -5.452
   20    HE2  TYR   3           HE2      TYR   3  -8.248  -5.316  -3.916
   21    HH   TYR   3           HH       TYR   3  -8.796  -5.243  -5.998
   22    H    VAL   4           H        VAL   4 -11.594 -11.251  -0.220
   23    HA   VAL   4           HA       VAL   4 -11.215 -10.749   2.643
   24    HB   VAL   4           HB       VAL   4 -11.724 -13.281   2.692
   25   1HG1  VAL   4          1HG1      VAL   4 -13.656 -12.553   3.534
   26   2HG1  VAL   4          2HG1      VAL   4 -13.332 -10.956   2.817
   27   3HG1  VAL   4          3HG1      VAL   4 -14.265 -12.169   1.907
   28   1HG2  VAL   4          1HG2      VAL   4 -11.486 -13.653   0.263
   29   2HG2  VAL   4          2HG2      VAL   4 -13.098 -14.120   0.857
   30   3HG2  VAL   4          3HG2      VAL   4 -12.885 -12.590  -0.029
   31    H    GLY   5           H        GLY   5  -9.980 -12.656  -0.176
   32   1HA   GLY   5          1HA       GLY   5  -7.731 -13.683   1.244
   33   2HA   GLY   5          2HA       GLY   5  -8.012 -13.721  -0.485
   34    H    LEU   6           H        LEU   6  -8.461 -10.519   0.485
   35    HA   LEU   6           HA       LEU   6  -5.614  -9.891   0.182
   36   1HB   LEU   6          1HB       LEU   6  -7.565  -8.092  -1.112
   37   2HB   LEU   6          2HB       LEU   6  -5.909  -8.513  -1.579
   38    HG   LEU   6           HG       LEU   6  -7.394  -9.302  -3.270
   39   1HD1  LEU   6          1HD1      LEU   6  -5.665 -10.997  -1.840
   40   2HD1  LEU   6          2HD1      LEU   6  -7.110 -11.968  -2.207
   41   3HD1  LEU   6          3HD1      LEU   6  -6.219 -11.166  -3.523
   42   1HD2  LEU   6          1HD2      LEU   6  -9.275  -9.533  -1.276
   43   2HD2  LEU   6          2HD2      LEU   6  -9.459 -10.093  -2.956
   44   3HD2  LEU   6          3HD2      LEU   6  -8.935 -11.230  -1.691
   45    H    SER   7           H        SER   7  -8.075  -9.972   2.263
   46    HA   SER   7           HA       SER   7  -7.651  -7.247   3.192
   47   1HB   SER   7          1HB       SER   7  -9.931  -9.118   3.231
   48   2HB   SER   7          2HB       SER   7  -9.656  -8.318   4.788
   49    HG   SER   7           HG       SER   7  -9.519  -6.282   3.343
   50    H    ALA   8           H        ALA   8  -8.278  -7.543   5.913
   51    HA   ALA   8           HA       ALA   8  -5.877  -8.395   6.984
   52   1HB   ALA   8          1HB       ALA   8  -8.034  -6.976   7.848
   53   2HB   ALA   8          2HB       ALA   8  -8.288  -8.504   8.725
   54   3HB   ALA   8          3HB       ALA   8  -6.767  -7.602   8.931
   55    H    ASN   9           H        ASN   9  -5.337 -10.483   6.157
   56    HA   ASN   9           HA       ASN   9  -5.816 -12.562   7.762
   57   1HB   ASN   9          1HB       ASN   9  -8.195 -12.072   6.310
   58   2HB   ASN   9          2HB       ASN   9  -7.459 -13.458   5.492
   59   1HD2  ASN   9          1HD2      ASN   9  -6.367 -14.990   7.233
   60   2HD2  ASN   9          2HD2      ASN   9  -7.426 -15.510   8.501
   61    H    GLN  10           H        GLN  10  -5.434 -11.282   4.465
   62    HA   GLN  10           HA       GLN  10  -4.341 -13.584   3.322
   63   1HB   GLN  10          1HB       GLN  10  -5.277 -11.726   2.008
   64   2HB   GLN  10          2HB       GLN  10  -3.981 -10.651   2.562
   65   1HG   GLN  10          1HG       GLN  10  -2.316 -12.199   1.507
   66   2HG   GLN  10          2HG       GLN  10  -3.647 -13.187   0.891
   67   1HE2  GLN  10          1HE2      GLN  10  -3.100  -9.680   1.186
   68   2HE2  GLN  10          2HE2      GLN  10  -3.340  -9.278  -0.482
   69    H    CYS  11           H        CYS  11  -3.029 -10.955   5.320
   70    HA   CYS  11           HA       CYS  11  -0.339 -11.302   4.683
   71   1HB   CYS  11          1HB       CYS  11  -1.142  -9.336   5.810
   72   2HB   CYS  11          2HB       CYS  11  -1.659 -10.284   7.206
   73    H    ALA  12           H        ALA  12  -2.564 -13.475   5.988
   74    HA   ALA  12           HA       ALA  12  -0.503 -14.833   7.582
   75   1HB   ALA  12          1HB       ALA  12  -3.415 -14.414   7.860
   76   2HB   ALA  12          2HB       ALA  12  -2.893 -16.095   8.124
   77   3HB   ALA  12          3HB       ALA  12  -2.189 -14.782   9.097
   78    H    VAL  13           H        VAL  13  -0.988 -14.700   4.528
   79    HA   VAL  13           HA       VAL  13  -2.127 -16.925   3.506
   80    HB   VAL  13           HB       VAL  13  -0.029 -16.764   1.893
   81   1HG1  VAL  13          1HG1      VAL  13  -2.366 -14.904   2.244
   82   2HG1  VAL  13          2HG1      VAL  13  -1.177 -14.603   0.954
   83   3HG1  VAL  13          3HG1      VAL  13  -2.075 -16.140   0.998
   84   1HG2  VAL  13          1HG2      VAL  13   0.066 -13.982   3.037
   85   2HG2  VAL  13          2HG2      VAL  13   1.089 -15.266   3.724
   86   3HG2  VAL  13          3HG2      VAL  13   1.247 -14.828   2.006
   87    HA   PRO  14           HA       PRO  14   0.207 -20.366   4.691
   88   1HB   PRO  14          1HB       PRO  14   0.366 -21.908   2.442
   89   2HB   PRO  14          2HB       PRO  14  -1.074 -21.825   3.454
   90   1HG   PRO  14          1HG       PRO  14  -0.518 -20.572   0.842
   91   2HG   PRO  14          2HG       PRO  14  -2.111 -20.882   1.622
   92   1HD   PRO  14          1HD       PRO  14  -0.705 -18.400   1.371
   93   2HD   PRO  14          2HD       PRO  14  -2.192 -18.683   2.286
   94    H    ALA  15           H        ALA  15   1.578 -18.051   2.948
   95    HA   ALA  15           HA       ALA  15   3.753 -17.495   2.883
   96   1HB   ALA  15          1HB       ALA  15   4.718 -20.298   3.369
   97   2HB   ALA  15          2HB       ALA  15   5.389 -18.748   3.933
   98   3HB   ALA  15          3HB       ALA  15   3.937 -19.425   4.710
   99    H    LYS  16           H        LYS  16   2.403 -17.710   0.626
  100    HA   LYS  16           HA       LYS  16   4.214 -18.159  -1.328
  101   1HB   LYS  16          1HB       LYS  16   3.111 -20.397  -2.236
  102   2HB   LYS  16          2HB       LYS  16   4.533 -20.405  -1.178
  103   1HG   LYS  16          1HG       LYS  16   3.389 -21.415   0.491
  104   2HG   LYS  16          2HG       LYS  16   2.016 -20.303   0.342
  105   1HD   LYS  16          1HD       LYS  16   2.570 -22.809  -1.296
  106   2HD   LYS  16          2HD       LYS  16   1.237 -22.557  -0.155
  107   1HE   LYS  16          1HE       LYS  16   0.734 -20.488  -1.783
  108   2HE   LYS  16          2HE       LYS  16   1.610 -21.490  -2.950
  109   1HZ   LYS  16          1HZ       LYS  16  -0.964 -21.733  -2.424
  110   2HZ   LYS  16          2HZ       LYS  16  -0.046 -22.965  -2.979
  111   3HZ   LYS  16          3HZ       LYS  16  -0.377 -22.846  -1.383
  112    H    ASP  17           H        ASP  17   2.220 -16.313  -0.670
  113    HA   ASP  17           HA       ASP  17   0.676 -16.488  -3.086
  114   1HB   ASP  17          1HB       ASP  17  -0.747 -17.505  -1.282
  115   2HB   ASP  17          2HB       ASP  17  -0.637 -15.991  -0.372
  116    H    ARG  18           H        ARG  18   2.850 -14.915  -1.321
  117    HA   ARG  18           HA       ARG  18   1.566 -12.343  -1.243
  118   1HB   ARG  18          1HB       ARG  18   4.467 -13.002  -0.585
  119   2HB   ARG  18          2HB       ARG  18   3.540 -11.594  -0.038
  120   1HG   ARG  18          1HG       ARG  18   2.559 -12.758   1.654
  121   2HG   ARG  18          2HG       ARG  18   2.322 -14.211   0.665
  122   1HD   ARG  18          1HD       ARG  18   4.730 -14.772   0.951
  123   2HD   ARG  18          2HD       ARG  18   4.954 -13.327   1.949
  124    HE   ARG  18           HE       ARG  18   2.853 -15.212   2.832
  125   1HH1  ARG  18          1HH1      ARG  18   6.181 -14.122   3.179
  126   2HH1  ARG  18          2HH1      ARG  18   6.383 -14.829   4.747
  127   1HH2  ARG  18          1HH2      ARG  18   3.119 -16.146   4.901
  128   2HH2  ARG  18          2HH2      ARG  18   4.630 -15.989   5.733
  129    H    VAL  19           H        VAL  19   3.109 -10.422  -2.063
  130    HA   VAL  19           HA       VAL  19   3.939 -11.186  -4.768
  131    HB   VAL  19           HB       VAL  19   3.289  -8.438  -3.701
  132   1HG1  VAL  19          1HG1      VAL  19   4.496  -9.258  -6.077
  133   2HG1  VAL  19          2HG1      VAL  19   2.798  -8.967  -6.527
  134   3HG1  VAL  19          3HG1      VAL  19   3.748  -7.675  -5.754
  135   1HG2  VAL  19          1HG2      VAL  19   1.120  -8.958  -5.151
  136   2HG2  VAL  19          2HG2      VAL  19   1.492 -10.629  -4.663
  137   3HG2  VAL  19          3HG2      VAL  19   1.216  -9.380  -3.425
  138    H    ASP  20           H        ASP  20   5.443 -11.402  -2.072
  139    HA   ASP  20           HA       ASP  20   7.346 -10.762  -1.159
  140   1HB   ASP  20          1HB       ASP  20   8.381 -12.306  -2.533
  141   2HB   ASP  20          2HB       ASP  20   7.865 -11.496  -4.022
  142    H    CYS  21           H        CYS  21   6.973  -8.510  -0.573
  143    HA   CYS  21           HA       CYS  21   6.957  -6.372  -2.250
  144   1HB   CYS  21          1HB       CYS  21   6.784  -6.741   0.434
  145   2HB   CYS  21          2HB       CYS  21   8.339  -5.910   0.317
  146    H    GLY  22           H        GLY  22   9.709  -8.223  -0.871
  147   1HA   GLY  22          1HA       GLY  22  11.930  -8.125  -1.227
  148   2HA   GLY  22          2HA       GLY  22  11.499  -7.752  -2.883
  149    H    TYR  23           H        TYR  23  11.480  -6.038   0.333
  150    HA   TYR  23           HA       TYR  23  12.263  -3.594  -1.031
  151   1HB   TYR  23          1HB       TYR  23  10.913  -4.540   1.419
  152   2HB   TYR  23          2HB       TYR  23  12.160  -3.359   1.832
  153    HD1  TYR  23           HD1      TYR  23   8.919  -3.904   0.211
  154    HD2  TYR  23           HD2      TYR  23  11.972  -1.028   1.054
  155    HE1  TYR  23           HE1      TYR  23   7.324  -2.023  -0.402
  156    HE2  TYR  23           HE2      TYR  23  10.367   0.845   0.438
  157    HH   TYR  23           HH       TYR  23   6.993   0.139  -0.358
  158    HA   PRO  24           HA       PRO  24  16.416  -3.965   0.141
  159   1HB   PRO  24          1HB       PRO  24  17.222  -1.368  -0.127
  160   2HB   PRO  24          2HB       PRO  24  17.077  -2.477  -1.487
  161   1HG   PRO  24          1HG       PRO  24  15.298  -0.286  -0.627
  162   2HG   PRO  24          2HG       PRO  24  15.410  -1.073  -2.243
  163   1HD   PRO  24          1HD       PRO  24  13.404  -1.416  -0.228
  164   2HD   PRO  24          2HD       PRO  24  13.554  -2.332  -1.734
  165    H    HIS  25           H        HIS  25  14.136  -2.364   1.958
  166    HA   HIS  25           HA       HIS  25  16.069  -2.250   4.155
  167   1HB   HIS  25          1HB       HIS  25  14.163  -0.206   3.168
  168   2HB   HIS  25          2HB       HIS  25  14.258  -0.400   4.921
  169    HD1  HIS  25           HD1      HIS  25  16.966  -0.406   5.788
  170    HD2  HIS  25           HD2      HIS  25  15.975   1.577   2.228
  171    HE1  HIS  25           HE1      HIS  25  18.864   1.239   5.334
  172    HE2  HIS  25           HE2      HIS  25  18.225   2.388   3.105
  173    H    VAL  26           H        VAL  26  14.171  -4.377   3.110
  174    HA   VAL  26           HA       VAL  26  11.859  -4.579   4.534
  175    HB   VAL  26           HB       VAL  26  12.296  -6.169   2.892
  176   1HG1  VAL  26          1HG1      VAL  26  14.499  -7.712   3.924
  177   2HG1  VAL  26          2HG1      VAL  26  14.350  -6.862   2.367
  178   3HG1  VAL  26          3HG1      VAL  26  14.978  -6.003   3.793
  179   1HG2  VAL  26          1HG2      VAL  26  11.475  -6.976   5.347
  180   2HG2  VAL  26          2HG2      VAL  26  11.545  -8.042   3.923
  181   3HG2  VAL  26          3HG2      VAL  26  12.872  -8.054   5.110
  182    H    THR  27           H        THR  27  11.308  -4.710   6.652
  183    HA   THR  27           HA       THR  27  12.911  -6.070   8.549
  184    HB   THR  27           HB       THR  27  13.626  -3.330   7.974
  185    HG1  THR  27           HG1      THR  27  15.336  -4.277   9.025
  186   1HG2  THR  27          1HG2      THR  27  12.092  -2.430   9.587
  187   2HG2  THR  27          2HG2      THR  27  12.266  -3.844  10.655
  188   3HG2  THR  27          3HG2      THR  27  13.598  -2.671  10.505
  189    HA   PRO  28           HA       PRO  28   9.107  -6.036  10.528
  190   1HB   PRO  28          1HB       PRO  28   9.803  -6.638  13.100
  191   2HB   PRO  28          2HB       PRO  28   9.677  -7.849  11.826
  192   1HG   PRO  28          1HG       PRO  28  12.065  -6.610  13.036
  193   2HG   PRO  28          2HG       PRO  28  11.946  -8.152  12.113
  194   1HD   PRO  28          1HD       PRO  28  12.985  -5.630  11.242
  195   2HD   PRO  28          2HD       PRO  28  12.741  -7.072  10.247
  196    H    LYS  29           H        LYS  29   9.607  -3.527   9.932
  197    HA   LYS  29           HA       LYS  29   8.182  -2.131  11.820
  198   1HB   LYS  29          1HB       LYS  29  10.493  -2.642  13.025
  199   2HB   LYS  29          2HB       LYS  29  11.000  -1.196  12.137
  200   1HG   LYS  29          1HG       LYS  29   9.959   0.089  13.663
  201   2HG   LYS  29          2HG       LYS  29   8.408  -0.665  13.259
  202   1HD   LYS  29          1HD       LYS  29   8.615  -2.274  14.975
  203   2HD   LYS  29          2HD       LYS  29  10.368  -2.057  15.112
  204   1HE   LYS  29          1HE       LYS  29   9.685  -0.872  16.975
  205   2HE   LYS  29          2HE       LYS  29   9.631   0.439  15.786
  206   1HZ   LYS  29          1HZ       LYS  29   7.589   0.533  16.767
  207   2HZ   LYS  29          2HZ       LYS  29   7.245  -0.400  15.470
  208   3HZ   LYS  29          3HZ       LYS  29   7.435  -1.083  16.941
  209    H    GLU  30           H        GLU  30  10.341  -2.441   9.106
  210    HA   GLU  30           HA       GLU  30   9.740   0.281   8.298
  211   1HB   GLU  30          1HB       GLU  30  11.949  -1.586   7.859
  212   2HB   GLU  30          2HB       GLU  30  11.382  -0.880   6.336
  213   1HG   GLU  30          1HG       GLU  30  12.687   0.891   6.876
  214   2HG   GLU  30          2HG       GLU  30  11.428   1.316   8.044
  215    H    CYS  31           H        CYS  31   9.466  -3.165   7.249
  216    HA   CYS  31           HA       CYS  31   8.311  -2.719   4.792
  217   1HB   CYS  31          1HB       CYS  31   8.130  -4.971   6.769
  218   2HB   CYS  31          2HB       CYS  31   7.212  -5.013   5.262
  219    H    ASN  32           H        ASN  32   6.791  -3.222   8.059
  220    HA   ASN  32           HA       ASN  32   4.194  -2.859   7.109
  221   1HB   ASN  32          1HB       ASN  32   5.574  -3.118   9.723
  222   2HB   ASN  32          2HB       ASN  32   4.094  -2.151   9.806
  223   1HD2  ASN  32          1HD2      ASN  32   5.279  -5.083   8.154
  224   2HD2  ASN  32          2HD2      ASN  32   3.914  -6.092   8.496
  225    H    ASN  33           H        ASN  33   6.762  -0.713   7.241
  226    HA   ASN  33           HA       ASN  33   5.101   1.533   8.034
  227   1HB   ASN  33          1HB       ASN  33   7.402   1.206   9.072
  228   2HB   ASN  33          2HB       ASN  33   8.112   1.480   7.473
  229   1HD2  ASN  33          1HD2      ASN  33   9.062   3.131   9.137
  230   2HD2  ASN  33          2HD2      ASN  33   8.343   4.707   9.113
  231    H    ARG  34           H        ARG  34   6.809  -0.074   5.374
  232    HA   ARG  34           HA       ARG  34   6.665   2.224   3.685
  233   1HB   ARG  34          1HB       ARG  34   7.296  -0.628   2.833
  234   2HB   ARG  34          2HB       ARG  34   7.830   0.872   2.058
  235   1HG   ARG  34          1HG       ARG  34   8.736   1.045   4.726
  236   2HG   ARG  34          2HG       ARG  34   9.051  -0.633   4.251
  237   1HD   ARG  34          1HD       ARG  34  10.639  -0.027   2.710
  238   2HD   ARG  34          2HD       ARG  34   9.772   1.439   2.222
  239    HE   ARG  34           HE       ARG  34  11.906   1.290   4.127
  240   1HH1  ARG  34          1HH1      ARG  34   8.781   2.848   3.689
  241   2HH1  ARG  34          2HH1      ARG  34   9.182   4.217   4.672
  242   1HH2  ARG  34          1HH2      ARG  34  12.435   3.095   5.425
  243   2HH2  ARG  34          2HH2      ARG  34  11.275   4.359   5.665
  244    H    GLY  35           H        GLY  35   4.738  -0.590   4.521
  245   1HA   GLY  35          1HA       GLY  35   2.381  -0.372   3.894
  246   2HA   GLY  35          2HA       GLY  35   2.913  -0.006   2.265
  247    H    CYS  36           H        CYS  36   4.653  -2.402   4.234
  248    HA   CYS  36           HA       CYS  36   3.456  -4.489   2.558
  249   1HB   CYS  36          1HB       CYS  36   6.286  -4.412   3.608
  250   2HB   CYS  36          2HB       CYS  36   5.576  -5.657   2.577
  251    H    CYS  37           H        CYS  37   4.269  -6.761   3.820
  252    HA   CYS  37           HA       CYS  37   3.577  -6.345   6.633
  253   1HB   CYS  37          1HB       CYS  37   1.705  -7.227   5.077
  254   2HB   CYS  37          2HB       CYS  37   2.604  -8.748   5.115
  255    H    PHE  38           H        PHE  38   5.113  -7.251   7.971
  256    HA   PHE  38           HA       PHE  38   7.170  -8.855   6.727
  257   1HB   PHE  38          1HB       PHE  38   7.596  -6.927   8.315
  258   2HB   PHE  38          2HB       PHE  38   6.707  -7.785   9.576
  259    HD1  PHE  38           HD1      PHE  38   7.781  -9.417  10.905
  260    HD2  PHE  38           HD2      PHE  38   9.751  -7.881   7.475
  261    HE1  PHE  38           HE1      PHE  38   9.912 -10.526  11.632
  262    HE2  PHE  38           HE2      PHE  38  11.882  -8.990   8.202
  263    HZ   PHE  38           HZ       PHE  38  11.937 -10.299  10.272
  264    H    ASP  39           H        ASP  39   7.174 -11.050   6.751
  265    HA   ASP  39           HA       ASP  39   5.243 -12.347   8.430
  266   1HB   ASP  39          1HB       ASP  39   5.424 -13.110   6.137
  267   2HB   ASP  39          2HB       ASP  39   7.174 -13.331   6.285
  268    H    SER  40           H        SER  40   8.519 -13.552   7.483
  269    HA   SER  40           HA       SER  40  10.341 -13.886   8.701
  270   1HB   SER  40          1HB       SER  40   9.176 -12.139  10.387
  271   2HB   SER  40          2HB       SER  40   9.039 -13.595  11.387
  272    HG   SER  40           HG       SER  40  11.052 -13.083  11.941
  273    H    ARG  41           H        ARG  41   7.206 -15.267   9.074
  274    HA   ARG  41           HA       ARG  41   7.740 -17.336  10.810
  275   1HB   ARG  41          1HB       ARG  41   5.845 -17.183   8.425
  276   2HB   ARG  41          2HB       ARG  41   5.785 -18.470   9.641
  277   1HG   ARG  41          1HG       ARG  41   5.798 -16.157  11.182
  278   2HG   ARG  41          2HG       ARG  41   4.821 -15.677   9.783
  279   1HD   ARG  41          1HD       ARG  41   3.298 -16.600  11.387
  280   2HD   ARG  41          2HD       ARG  41   3.487 -17.845  10.144
  281    HE   ARG  41           HE       ARG  41   4.519 -19.218  11.736
  282   1HH1  ARG  41          1HH1      ARG  41   4.477 -15.905  12.923
  283   2HH1  ARG  41          2HH1      ARG  41   5.059 -16.327  14.499
  284   1HH2  ARG  41          1HH2      ARG  41   5.287 -19.775  13.815
  285   2HH2  ARG  41          2HH2      ARG  41   5.522 -18.544  15.009
  286    H    ILE  42           H        ILE  42   8.038 -17.078   7.209
  287    HA   ILE  42           HA       ILE  42   9.638 -19.542   7.294
  288    HB   ILE  42           HB       ILE  42   8.107 -18.674   4.870
  289   1HG1  ILE  42          1HG1      ILE  42   7.022 -19.980   7.337
  290   2HG1  ILE  42          2HG1      ILE  42   6.289 -18.742   6.299
  291   1HG2  ILE  42          1HG2      ILE  42   8.446 -20.828   4.106
  292   2HG2  ILE  42          2HG2      ILE  42   9.958 -20.501   4.986
  293   3HG2  ILE  42          3HG2      ILE  42   8.684 -21.490   5.740
  294   1HD1  ILE  42          1HD1      ILE  42   5.081 -20.685   5.735
  295   2HD1  ILE  42          2HD1      ILE  42   6.329 -20.633   4.467
  296   3HD1  ILE  42          3HD1      ILE  42   6.517 -21.731   5.855
  297    HA   PRO  43           HA       PRO  43  12.626 -16.674   5.890
  298   1HB   PRO  43          1HB       PRO  43  14.791 -18.321   6.143
  299   2HB   PRO  43          2HB       PRO  43  14.163 -17.344   7.469
  300   1HG   PRO  43          1HG       PRO  43  13.887 -20.235   6.947
  301   2HG   PRO  43          2HG       PRO  43  13.674 -19.348   8.500
  302   1HD   PRO  43          1HD       PRO  43  11.660 -20.418   6.769
  303   2HD   PRO  43          2HD       PRO  43  11.395 -19.415   8.201
  304    H    GLY  44           H        GLY  44  11.456 -19.407   4.443
  305   1HA   GLY  44          1HA       GLY  44  13.259 -19.211   2.146
  306   2HA   GLY  44          2HA       GLY  44  12.053 -20.444   2.450
  307    H    VAL  45           H        VAL  45  10.454 -17.672   3.293
  308    HA   VAL  45           HA       VAL  45   9.532 -17.231   0.536
  309    HB   VAL  45           HB       VAL  45   7.355 -17.269   1.208
  310   1HG1  VAL  45          1HG1      VAL  45   8.819 -19.147   3.080
  311   2HG1  VAL  45          2HG1      VAL  45   7.048 -19.143   2.898
  312   3HG1  VAL  45          3HG1      VAL  45   8.087 -19.513   1.500
  313   1HG2  VAL  45          1HG2      VAL  45   8.178 -16.753   4.085
  314   2HG2  VAL  45          2HG2      VAL  45   7.614 -15.514   2.938
  315   3HG2  VAL  45          3HG2      VAL  45   6.517 -16.819   3.448
  316    HA   PRO  46           HA       PRO  46   9.936 -12.973   1.260
  317   1HB   PRO  46          1HB       PRO  46   7.566 -11.789   0.595
  318   2HB   PRO  46          2HB       PRO  46   8.737 -12.338  -0.601
  319   1HG   PRO  46          1HG       PRO  46   6.190 -13.554   0.254
  320   2HG   PRO  46          2HG       PRO  46   7.117 -13.840  -1.262
  321   1HD   PRO  46          1HD       PRO  46   6.911 -15.526   1.044
  322   2HD   PRO  46          2HD       PRO  46   7.962 -15.777  -0.356
  323    H    TRP  47           H        TRP  47  10.448 -12.085   3.149
  324    HA   TRP  47           HA       TRP  47   8.422 -12.292   5.222
  325   1HB   TRP  47          1HB       TRP  47  10.903 -10.952   5.925
  326   2HB   TRP  47          2HB       TRP  47  10.109 -12.345   6.663
  327    HD1  TRP  47           HD1      TRP  47  10.758 -14.810   5.510
  328    HE1  TRP  47           HE1      TRP  47  12.937 -15.700   4.318
  329    HE3  TRP  47           HE3      TRP  47  12.721 -10.226   4.515
  330    HZ2  TRP  47           HZ2      TRP  47  15.187 -14.417   3.119
  331    HZ3  TRP  47           HZ3      TRP  47  14.912 -10.133   3.330
  332    HH2  TRP  47           HH2      TRP  47  16.137 -12.131   2.637
  333    H    CYS  48           H        CYS  48   8.067 -10.548   2.808
  334    HA   CYS  48           HA       CYS  48   7.180  -8.258   4.160
  335   1HB   CYS  48          1HB       CYS  48   9.575  -7.709   4.155
  336   2HB   CYS  48          2HB       CYS  48   9.595  -7.813   2.391
  337    H    PHE  49           H        PHE  49   5.255  -8.130   3.054
  338    HA   PHE  49           HA       PHE  49   5.379  -7.905   0.170
  339   1HB   PHE  49          1HB       PHE  49   3.244  -9.576   0.392
  340   2HB   PHE  49          2HB       PHE  49   4.877 -10.212   0.163
  341    HD1  PHE  49           HD1      PHE  49   6.199 -10.690   2.376
  342    HD2  PHE  49           HD2      PHE  49   1.975 -10.342   2.153
  343    HE1  PHE  49           HE1      PHE  49   5.979 -11.983   4.516
  344    HE2  PHE  49           HE2      PHE  49   1.756 -11.635   4.294
  345    HZ   PHE  49           HZ       PHE  49   3.761 -12.440   5.449
  346    H    LYS  50           H        LYS  50   2.672  -7.929  -0.425
  347    HA   LYS  50           HA       LYS  50   1.617  -5.874   1.393
  348   1HB   LYS  50          1HB       LYS  50   0.466  -5.424  -1.093
  349   2HB   LYS  50          2HB       LYS  50   1.740  -4.461  -0.324
  350   1HG   LYS  50          1HG       LYS  50   2.521  -6.960  -1.805
  351   2HG   LYS  50          2HG       LYS  50   2.061  -5.541  -2.761
  352   1HD   LYS  50          1HD       LYS  50   4.276  -5.759  -0.686
  353   2HD   LYS  50          2HD       LYS  50   4.469  -5.480  -2.426
  354   1HE   LYS  50          1HE       LYS  50   3.506  -3.597  -0.269
  355   2HE   LYS  50          2HE       LYS  50   4.723  -3.314  -1.524
  356   1HZ   LYS  50          1HZ       LYS  50   2.602  -3.711  -3.001
  357   2HZ   LYS  50          2HZ       LYS  50   1.851  -3.129  -1.673
  358   3HZ   LYS  50          3HZ       LYS  50   2.993  -2.235  -2.424
  359    HA   PRO  51           HA       PRO  51  -1.258  -9.363   1.200
  360   1HB   PRO  51          1HB       PRO  51  -1.489  -9.786   3.889
  361   2HB   PRO  51          2HB       PRO  51  -0.371 -10.683   2.865
  362   1HG   PRO  51          1HG       PRO  51   0.142  -8.477   4.756
  363   2HG   PRO  51          2HG       PRO  51   1.304  -9.686   4.096
  364   1HD   PRO  51          1HD       PRO  51   0.998  -6.932   3.373
  365   2HD   PRO  51          2HD       PRO  51   2.044  -8.120   2.584
  366    H    LEU  52           H        LEU  52  -2.056  -8.171   4.313
  367    HA   LEU  52           HA       LEU  52  -4.479  -7.067   3.143
  368   1HB   LEU  52          1HB       LEU  52  -5.454  -7.296   5.222
  369   2HB   LEU  52          2HB       LEU  52  -4.437  -8.737   5.050
  370    HG   LEU  52           HG       LEU  52  -2.825  -6.852   6.353
  371   1HD1  LEU  52          1HD1      LEU  52  -4.627  -6.667   8.397
  372   2HD1  LEU  52          2HD1      LEU  52  -4.245  -5.365   7.244
  373   3HD1  LEU  52          3HD1      LEU  52  -5.665  -6.403   6.976
  374   1HD2  LEU  52          1HD2      LEU  52  -2.501  -8.553   7.779
  375   2HD2  LEU  52          2HD2      LEU  52  -4.241  -8.778   8.077
  376   3HD2  LEU  52          3HD2      LEU  52  -3.488  -9.478   6.623
  377    H    GLN  53           H        GLN  53  -1.901  -5.719   2.711
  378    HA   GLN  53           HA       GLN  53  -1.436  -3.694   4.477
  379   1HB   GLN  53          1HB       GLN  53  -1.178  -3.733   1.448
  380   2HB   GLN  53          2HB       GLN  53  -0.463  -2.483   2.481
  381   1HG   GLN  53          1HG       GLN  53   0.124  -5.473   2.568
  382   2HG   GLN  53          2HG       GLN  53   1.205  -4.223   1.935
  383   1HE2  GLN  53          1HE2      GLN  53   0.944  -2.234   3.768
  384   2HE2  GLN  53          2HE2      GLN  53   1.546  -2.722   5.317
  385    H    GLU  54           H        GLU  54  -4.178  -4.213   2.390
  386    HA   GLU  54           HA       GLU  54  -5.014  -1.800   1.659
  387   1HB   GLU  54          1HB       GLU  54  -7.212  -2.665   1.624
  388   2HB   GLU  54          2HB       GLU  54  -6.182  -4.099   1.470
  389   1HG   GLU  54          1HG       GLU  54  -7.410  -4.918   3.197
  390   2HG   GLU  54          2HG       GLU  54  -6.431  -3.856   4.220
  391    H    ALA  55           H        ALA  55  -4.636  -2.968   4.961
  392    HA   ALA  55           HA       ALA  55  -6.336  -1.568   6.463
  393   1HB   ALA  55          1HB       ALA  55  -4.926  -2.268   8.068
  394   2HB   ALA  55          2HB       ALA  55  -3.817  -2.802   6.781
  395   3HB   ALA  55          3HB       ALA  55  -3.645  -1.177   7.488
  396    H    GLU  56           H        GLU  56  -3.071  -0.122   5.837
  397    HA   GLU  56           HA       GLU  56  -4.472   2.406   5.441
  398   1HB   GLU  56          1HB       GLU  56  -2.536   1.672   7.466
  399   2HB   GLU  56          2HB       GLU  56  -1.879   2.977   6.464
  400   1HG   GLU  56          1HG       GLU  56  -3.669   4.434   6.994
  401   2HG   GLU  56          2HG       GLU  56  -4.715   3.116   7.540
  402    H    CYS  57           H        CYS  57  -3.439   0.300   3.530
  403    HA   CYS  57           HA       CYS  57  -1.293   1.835   2.273
  404   1HB   CYS  57          1HB       CYS  57  -1.128  -0.691   2.847
  405   2HB   CYS  57          2HB       CYS  57  -2.133  -0.917   1.413
  406    H    THR  58           H        THR  58  -4.346  -0.020   1.560
  407    HA   THR  58           HA       THR  58  -4.633   1.349  -0.970
  408    HB   THR  58           HB       THR  58  -5.195  -1.156  -0.266
  409    HG1  THR  58           HG1      THR  58  -7.140   0.535  -1.660
  410   1HG2  THR  58          1HG2      THR  58  -7.677  -1.357   0.157
  411   2HG2  THR  58          2HG2      THR  58  -6.809  -0.658   1.544
  412   3HG2  THR  58          3HG2      THR  58  -7.736   0.397   0.450
  413    H    PHE  59           H        PHE  59  -5.818   1.626   2.354
  414    HA   PHE  59           HA       PHE  59  -8.129   2.864   2.241
  415   1HB   PHE  59          1HB       PHE  59  -6.181   2.624   4.071
  416   2HB   PHE  59          2HB       PHE  59  -5.791   4.281   3.597
  417    HD1  PHE  59           HD1      PHE  59  -8.951   2.403   4.302
  418    HD2  PHE  59           HD2      PHE  59  -6.567   5.819   5.113
  419    HE1  PHE  59           HE1      PHE  59 -10.707   3.255   5.880
  420    HE2  PHE  59           HE2      PHE  59  -8.323   6.671   6.690
  421    HZ   PHE  59           HZ       PHE  59 -10.373   5.378   7.055
  422   1H    GLU   1           H1       GLU   1 -17.087  -2.835   0.755
  423    HA   GLU   1           HA       GLU   1 -17.942  -4.610  -1.369
  424   1HB   GLU   1          1HB       GLU   1 -19.795  -3.358   0.693
  425   2HB   GLU   1          2HB       GLU   1 -20.349  -4.154  -0.790
  426   1HG   GLU   1          1HG       GLU   1 -19.627  -6.277  -0.056
  427   2HG   GLU   1          2HG       GLU   1 -18.516  -5.601   1.145
  428    H    GLU   2           H        GLU   2 -18.722  -1.428   0.227
  429    HA   GLU   2           HA       GLU   2 -19.188  -0.277  -2.342
  430   1HB   GLU   2          1HB       GLU   2 -19.555   1.824  -0.966
  431   2HB   GLU   2          2HB       GLU   2 -20.617   0.465  -0.557
  432   1HG   GLU   2          1HG       GLU   2 -19.680   0.201   1.515
  433   2HG   GLU   2          2HG       GLU   2 -18.046   0.579   0.950
  434    H    TYR   3           H        TYR   3 -16.760  -1.071  -2.793
  435    HA   TYR   3           HA       TYR   3 -14.824   0.864  -1.822
  436   1HB   TYR   3          1HB       TYR   3 -14.952  -1.736  -3.401
  437   2HB   TYR   3          2HB       TYR   3 -13.491  -0.755  -3.546
  438    HD1  TYR   3           HD1      TYR   3 -15.703  -1.671  -0.648
  439    HD2  TYR   3           HD2      TYR   3 -11.768  -1.713  -2.328
  440    HE1  TYR   3           HE1      TYR   3 -14.797  -2.720   1.482
  441    HE2  TYR   3           HE2      TYR   3 -10.875  -2.762  -0.191
  442    HH   TYR   3           HH       TYR   3 -13.046  -3.855   2.324
  443    H    VAL   4           H        VAL   4 -15.680   2.792  -2.870
  444    HA   VAL   4           HA       VAL   4 -15.064   2.794  -5.742
  445    HB   VAL   4           HB       VAL   4 -17.320   2.991  -5.872
  446   1HG1  VAL   4          1HG1      VAL   4 -17.399   4.515  -3.246
  447   2HG1  VAL   4          2HG1      VAL   4 -18.797   3.945  -4.188
  448   3HG1  VAL   4          3HG1      VAL   4 -17.694   2.769  -3.433
  449   1HG2  VAL   4          1HG2      VAL   4 -16.865   5.884  -5.146
  450   2HG2  VAL   4          2HG2      VAL   4 -16.107   5.165  -6.587
  451   3HG2  VAL   4          3HG2      VAL   4 -17.880   5.193  -6.434
  452    H    GLY   5           H        GLY   5 -15.559   4.863  -2.796
  453   1HA   GLY   5          1HA       GLY   5 -13.990   7.008  -3.799
  454   2HA   GLY   5          2HA       GLY   5 -14.537   6.765  -2.151
  455    H    LEU   6           H        LEU   6 -13.059   3.881  -2.963
  456    HA   LEU   6           HA       LEU   6 -10.393   4.854  -2.233
  457   1HB   LEU   6          1HB       LEU   6 -10.508   2.462  -0.971
  458   2HB   LEU   6          2HB       LEU   6 -10.731   4.042  -0.198
  459    HG   LEU   6           HG       LEU   6 -13.077   2.524  -1.316
  460   1HD1  LEU   6          1HD1      LEU   6 -13.412   1.518   0.932
  461   2HD1  LEU   6          2HD1      LEU   6 -11.985   0.890   0.075
  462   3HD1  LEU   6          3HD1      LEU   6 -11.784   2.075   1.387
  463   1HD2  LEU   6          1HD2      LEU   6 -12.689   4.670   0.772
  464   2HD2  LEU   6          2HD2      LEU   6 -13.648   4.726  -0.727
  465   3HD2  LEU   6          3HD2      LEU   6 -14.191   3.724   0.639
  466    H    SER   7           H        SER   7 -12.092   3.749  -4.682
  467    HA   SER   7           HA       SER   7 -10.247   1.588  -5.311
  468   1HB   SER   7          1HB       SER   7 -13.011   1.724  -5.532
  469   2HB   SER   7          2HB       SER   7 -12.478   2.043  -7.191
  470    HG   SER   7           HG       SER   7 -11.155   0.064  -6.998
  471    H    ALA   8           H        ALA   8 -10.839   1.810  -8.228
  472    HA   ALA   8           HA       ALA   8  -8.796   3.629  -8.900
  473   1HB   ALA   8          1HB       ALA   8  -8.831   2.346 -10.742
  474   2HB   ALA   8          2HB       ALA   8 -10.262   1.506 -10.098
  475   3HB   ALA   8          3HB       ALA   8 -10.464   2.928 -11.150
  476    H    ASN   9           H        ASN   9  -9.402   5.691  -8.037
  477    HA   ASN   9           HA       ASN   9 -10.492   7.421  -9.745
  478   1HB   ASN   9          1HB       ASN   9 -12.600   5.838  -8.614
  479   2HB   ASN   9          2HB       ASN   9 -12.737   7.450  -7.896
  480   1HD2  ASN   9          1HD2      ASN   9 -12.179   9.221  -9.654
  481   2HD2  ASN   9          2HD2      ASN   9 -13.101   9.109 -11.116
  482    H    GLN  10           H        GLN  10 -10.134   6.255  -6.405
  483    HA   GLN  10           HA       GLN  10 -10.444   8.702  -5.115
  484   1HB   GLN  10          1HB       GLN  10 -10.515   6.454  -4.030
  485   2HB   GLN  10          2HB       GLN  10  -8.763   6.309  -4.249
  486   1HG   GLN  10          1HG       GLN  10  -8.427   8.334  -2.868
  487   2HG   GLN  10          2HG       GLN  10 -10.176   8.510  -2.669
  488   1HE2  GLN  10          1HE2      GLN  10  -7.915   5.758  -2.580
  489   2HE2  GLN  10          2HE2      GLN  10  -8.347   5.169  -1.008
  490    H    CYS  11           H        CYS  11  -7.742   7.179  -6.851
  491    HA   CYS  11           HA       CYS  11  -5.736   8.841  -5.772
  492   1HB   CYS  11          1HB       CYS  11  -5.170   6.725  -6.731
  493   2HB   CYS  11          2HB       CYS  11  -5.850   7.182  -8.295
  494    H    ALA  12           H        ALA  12  -8.463   9.596  -7.521
  495    HA   ALA  12           HA       ALA  12  -7.102  11.812  -8.894
  496   1HB   ALA  12          1HB       ALA  12  -8.467  11.542 -10.739
  497   2HB   ALA  12          2HB       ALA  12  -8.336   9.847 -10.210
  498   3HB   ALA  12          3HB       ALA  12  -9.781  10.800  -9.794
  499    H    VAL  13           H        VAL  13  -8.560  11.144  -6.113
  500    HA   VAL  13           HA       VAL  13 -10.876  12.498  -5.848
  501    HB   VAL  13           HB       VAL  13  -8.926  11.439  -4.197
  502   1HG1  VAL  13          1HG1      VAL  13  -8.582  13.151  -2.438
  503   2HG1  VAL  13          2HG1      VAL  13  -7.794  13.583  -3.974
  504   3HG1  VAL  13          3HG1      VAL  13  -9.320  14.370  -3.503
  505   1HG2  VAL  13          1HG2      VAL  13 -10.897  12.634  -2.542
  506   2HG2  VAL  13          2HG2      VAL  13 -11.689  12.224  -4.082
  507   3HG2  VAL  13          3HG2      VAL  13 -10.838  10.964  -3.155
  508    HA   PRO  14           HA       PRO  14 -10.139  16.712  -6.466
  509   1HB   PRO  14          1HB       PRO  14 -11.575  17.965  -4.510
  510   2HB   PRO  14          2HB       PRO  14 -12.307  17.300  -5.967
  511   1HG   PRO  14          1HG       PRO  14 -12.275  16.249  -3.210
  512   2HG   PRO  14          2HG       PRO  14 -13.400  15.840  -4.555
  513   1HD   PRO  14          1HD       PRO  14 -11.224  14.292  -3.520
  514   2HD   PRO  14          2HD       PRO  14 -12.200  13.919  -4.946
  515    H    ALA  15           H        ALA  15  -8.181  15.275  -4.795
  516    HA   ALA  15           HA       ALA  15  -6.461  15.722  -3.462
  517   1HB   ALA  15          1HB       ALA  15  -5.794  18.370  -3.932
  518   2HB   ALA  15          2HB       ALA  15  -5.307  16.986  -4.940
  519   3HB   ALA  15          3HB       ALA  15  -6.743  17.943  -5.376
  520    H    LYS  16           H        LYS  16  -8.241  15.497  -1.703
  521    HA   LYS  16           HA       LYS  16  -7.695  17.220   0.344
  522   1HB   LYS  16          1HB       LYS  16  -9.942  18.443   0.466
  523   2HB   LYS  16          2HB       LYS  16  -8.712  19.079  -0.640
  524   1HG   LYS  16          1HG       LYS  16 -10.130  18.836  -2.369
  525   2HG   LYS  16          2HG       LYS  16 -10.279  17.101  -2.044
  526   1HD   LYS  16          1HD       LYS  16 -12.344  17.373  -1.171
  527   2HD   LYS  16          2HD       LYS  16 -11.804  18.684  -0.107
  528   1HE   LYS  16          1HE       LYS  16 -12.263  20.338  -1.719
  529   2HE   LYS  16          2HE       LYS  16 -12.212  19.194  -3.067
  530   1HZ   LYS  16          1HZ       LYS  16 -14.199  18.368  -1.357
  531   2HZ   LYS  16          2HZ       LYS  16 -14.396  19.980  -1.519
  532   3HZ   LYS  16          3HZ       LYS  16 -14.380  19.023  -2.842
  533    H    ASP  17           H        ASP  17  -7.990  14.435  -0.213
  534    HA   ASP  17           HA       ASP  17  -9.765  13.820   1.917
  535   1HB   ASP  17          1HB       ASP  17 -11.185  13.856  -0.234
  536   2HB   ASP  17          2HB       ASP  17 -10.253  12.443  -0.757
  537    H    ARG  18           H        ARG  18  -6.870  13.639   0.645
  538    HA   ARG  18           HA       ARG  18  -6.546  10.786   0.579
  539   1HB   ARG  18          1HB       ARG  18  -4.424  12.964   0.333
  540   2HB   ARG  18          2HB       ARG  18  -4.250  11.270  -0.151
  541   1HG   ARG  18          1HG       ARG  18  -5.367  11.592  -2.112
  542   2HG   ARG  18          2HG       ARG  18  -6.560  12.682  -1.383
  543   1HD   ARG  18          1HD       ARG  18  -5.007  14.545  -1.492
  544   2HD   ARG  18          2HD       ARG  18  -3.674  13.487  -1.975
  545    HE   ARG  18           HE       ARG  18  -5.958  13.363  -3.794
  546   1HH1  ARG  18          1HH1      ARG  18  -3.022  15.136  -3.006
  547   2HH1  ARG  18          2HH1      ARG  18  -2.825  15.774  -4.604
  548   1HH2  ARG  18          1HH2      ARG  18  -5.699  14.204  -5.903
  549   2HH2  ARG  18          2HH2      ARG  18  -4.358  15.239  -6.263
  550    H    VAL  19           H        VAL  19  -4.381   9.996   1.795
  551    HA   VAL  19           HA       VAL  19  -4.685  10.921   4.549
  552    HB   VAL  19           HB       VAL  19  -3.219   8.477   3.573
  553   1HG1  VAL  19          1HG1      VAL  19  -3.709   9.658   6.136
  554   2HG1  VAL  19          2HG1      VAL  19  -4.577   8.107   6.051
  555   3HG1  VAL  19          3HG1      VAL  19  -2.825   8.164   5.744
  556   1HG2  VAL  19          1HG2      VAL  19  -5.215   7.841   2.698
  557   2HG2  VAL  19          2HG2      VAL  19  -5.579   7.449   4.396
  558   3HG2  VAL  19          3HG2      VAL  19  -6.144   8.986   3.697
  559    H    ASP  20           H        ASP  20  -3.087  12.136   2.124
  560    HA   ASP  20           HA       ASP  20  -1.046  12.847   1.681
  561   1HB   ASP  20          1HB       ASP  20  -1.542  14.672   3.016
  562   2HB   ASP  20          2HB       ASP  20  -1.757  13.692   4.473
  563    H    CYS  21           H        CYS  21   0.102  10.781   1.369
  564    HA   CYS  21           HA       CYS  21   1.062   9.159   3.334
  565   1HB   CYS  21          1HB       CYS  21   1.153   9.143   0.660
  566   2HB   CYS  21          2HB       CYS  21   2.827   9.597   0.986
  567    H    GLY  22           H        GLY  22   2.326  12.258   2.039
  568   1HA   GLY  22          1HA       GLY  22   4.006  13.601   2.696
  569   2HA   GLY  22          2HA       GLY  22   3.663  13.030   4.317
  570    H    TYR  23           H        TYR  23   5.172  11.668   1.292
  571    HA   TYR  23           HA       TYR  23   7.113  10.284   2.955
  572   1HB   TYR  23          1HB       TYR  23   5.823  10.139   0.308
  573   2HB   TYR  23          2HB       TYR  23   7.577  10.026   0.125
  574    HD1  TYR  23           HD1      TYR  23   8.807   8.200   1.413
  575    HD2  TYR  23           HD2      TYR  23   4.547   8.296   1.032
  576    HE1  TYR  23           HE1      TYR  23   8.689   5.736   2.028
  577    HE2  TYR  23           HE2      TYR  23   4.444   5.832   1.648
  578    HH   TYR  23           HH       TYR  23   7.407   4.053   2.468
  579    HA   PRO  24           HA       PRO  24  10.179  13.263   2.217
  580   1HB   PRO  24          1HB       PRO  24  12.364  11.856   3.061
  581   2HB   PRO  24          2HB       PRO  24  11.279  12.705   4.162
  582   1HG   PRO  24          1HG       PRO  24  11.502   9.825   3.564
  583   2HG   PRO  24          2HG       PRO  24  10.759  10.619   4.998
  584   1HD   PRO  24          1HD       PRO  24   9.451   9.404   2.758
  585   2HD   PRO  24          2HD       PRO  24   8.679  10.312   4.065
  586    H    HIS  25           H        HIS  25   9.701  10.576   0.417
  587    HA   HIS  25           HA       HIS  25  11.797  11.469  -1.421
  588   1HB   HIS  25          1HB       HIS  25  11.440   8.886  -0.203
  589   2HB   HIS  25          2HB       HIS  25  11.247   8.750  -1.954
  590    HD1  HIS  25           HD1      HIS  25  13.767   8.355   0.452
  591    HD2  HIS  25           HD2      HIS  25  13.603  10.429  -3.190
  592    HE1  HIS  25           HE1      HIS  25  16.186   8.678  -0.296
  593    HE2  HIS  25           HE2      HIS  25  16.019   9.910  -2.566
  594    H    VAL  26           H        VAL  26   8.710  11.874  -0.896
  595    HA   VAL  26           HA       VAL  26   7.120  10.723  -2.704
  596    HB   VAL  26           HB       VAL  26   6.211  12.329  -1.288
  597   1HG1  VAL  26          1HG1      VAL  26   7.293  14.831  -2.219
  598   2HG1  VAL  26          2HG1      VAL  26   7.326  14.127  -0.585
  599   3HG1  VAL  26          3HG1      VAL  26   8.620  13.744  -1.746
  600   1HG2  VAL  26          1HG2      VAL  26   4.865  13.635  -2.686
  601   2HG2  VAL  26          2HG2      VAL  26   6.173  13.899  -3.865
  602   3HG2  VAL  26          3HG2      VAL  26   5.389  12.306  -3.746
  603    H    THR  27           H        THR  27   7.037  10.425  -4.878
  604    HA   THR  27           HA       THR  27   7.908  12.383  -6.717
  605    HB   THR  27           HB       THR  27   9.947  10.633  -5.622
  606    HG1  THR  27           HG1      THR  27  10.766  12.564  -6.329
  607   1HG2  THR  27          1HG2      THR  27  10.838  10.130  -8.063
  608   2HG2  THR  27          2HG2      THR  27   9.708   8.979  -7.313
  609   3HG2  THR  27          3HG2      THR  27   9.115  10.158  -8.507
  610    HA   PRO  28           HA       PRO  28   5.372   9.960  -9.184
  611   1HB   PRO  28          1HB       PRO  28   6.098  10.757 -11.692
  612   2HB   PRO  28          2HB       PRO  28   5.019  11.693 -10.658
  613   1HG   PRO  28          1HG       PRO  28   7.866  12.118 -11.307
  614   2HG   PRO  28          2HG       PRO  28   6.671  13.302 -10.665
  615   1HD   PRO  28          1HD       PRO  28   8.786  11.972  -9.265
  616   2HD   PRO  28          2HD       PRO  28   7.539  13.006  -8.557
  617    H    LYS  29           H        LYS  29   7.333   8.416  -8.132
  618    HA   LYS  29           HA       LYS  29   7.356   6.298  -9.910
  619   1HB   LYS  29          1HB       LYS  29   8.988   8.035 -11.011
  620   2HB   LYS  29          2HB       LYS  29  10.141   7.403  -9.820
  621   1HG   LYS  29          1HG       LYS  29  10.259   5.355 -10.840
  622   2HG   LYS  29          2HG       LYS  29   8.550   5.356 -11.305
  623   1HD   LYS  29          1HD       LYS  29   9.556   7.412 -12.843
  624   2HD   LYS  29          2HD       LYS  29  10.937   6.301 -12.800
  625   1HE   LYS  29          1HE       LYS  29   9.910   4.861 -14.207
  626   2HE   LYS  29          2HE       LYS  29   8.423   4.862 -13.248
  627   1HZ   LYS  29          1HZ       LYS  29   7.585   6.566 -14.467
  628   2HZ   LYS  29          2HZ       LYS  29   9.040   7.176 -14.890
  629   3HZ   LYS  29          3HZ       LYS  29   8.473   5.832 -15.625
  630    H    GLU  30           H        GLU  30   8.210   8.020  -7.052
  631    HA   GLU  30           HA       GLU  30   9.407   5.631  -5.916
  632   1HB   GLU  30          1HB       GLU  30   9.661   8.521  -5.456
  633   2HB   GLU  30          2HB       GLU  30   9.478   7.607  -3.949
  634   1HG   GLU  30          1HG       GLU  30  11.456   6.420  -4.281
  635   2HG   GLU  30          2HG       GLU  30  11.400   6.590  -6.041
  636    H    CYS  31           H        CYS  31   6.753   8.038  -5.432
  637    HA   CYS  31           HA       CYS  31   5.707   6.990  -3.118
  638   1HB   CYS  31          1HB       CYS  31   4.457   8.453  -5.429
  639   2HB   CYS  31          2HB       CYS  31   3.507   7.954  -4.026
  640    H    ASN  32           H        ASN  32   4.808   6.310  -6.583
  641    HA   ASN  32           HA       ASN  32   2.968   4.351  -5.989
  642   1HB   ASN  32          1HB       ASN  32   4.575   5.186  -8.375
  643   2HB   ASN  32          2HB       ASN  32   3.890   3.555  -8.449
  644   1HD2  ASN  32          1HD2      ASN  32   2.783   6.631  -7.035
  645   2HD2  ASN  32          2HD2      ASN  32   1.268   6.726  -7.869
  646    H    ASN  33           H        ASN  33   6.384   4.418  -5.605
  647    HA   ASN  33           HA       ASN  33   6.706   1.593  -6.063
  648   1HB   ASN  33          1HB       ASN  33   8.424   3.504  -6.615
  649   2HB   ASN  33          2HB       ASN  33   8.813   3.454  -4.890
  650   1HD2  ASN  33          1HD2      ASN  33  10.925   2.911  -5.947
  651   2HD2  ASN  33          2HD2      ASN  33  11.295   1.240  -6.215
  652    H    ARG  34           H        ARG  34   6.349   4.033  -3.495
  653    HA   ARG  34           HA       ARG  34   7.182   2.208  -1.460
  654   1HB   ARG  34          1HB       ARG  34   5.764   4.862  -1.031
  655   2HB   ARG  34          2HB       ARG  34   6.904   4.054   0.058
  656   1HG   ARG  34          1HG       ARG  34   8.271   4.416  -2.406
  657   2HG   ARG  34          2HG       ARG  34   7.432   5.945  -2.090
  658   1HD   ARG  34          1HD       ARG  34   8.786   6.442  -0.324
  659   2HD   ARG  34          2HD       ARG  34   8.755   4.786   0.299
  660    HE   ARG  34           HE       ARG  34  10.336   5.190  -2.159
  661   1HH1  ARG  34          1HH1      ARG  34  10.361   5.031   1.356
  662   2HH1  ARG  34          2HH1      ARG  34  12.060   4.710   1.457
  663   1HH2  ARG  34          1HH2      ARG  34  12.578   4.766  -2.027
  664   2HH2  ARG  34          2HH2      ARG  34  13.329   4.558  -0.481
  665    H    GLY  35           H        GLY  35   4.240   3.237  -3.095
  666   1HA   GLY  35          1HA       GLY  35   2.387   1.664  -2.880
  667   2HA   GLY  35          2HA       GLY  35   2.635   1.692  -1.146
  668    H    CYS  36           H        CYS  36   3.082   4.678  -2.996
  669    HA   CYS  36           HA       CYS  36   0.493   5.595  -1.973
  670   1HB   CYS  36          1HB       CYS  36   3.041   7.198  -2.201
  671   2HB   CYS  36          2HB       CYS  36   1.476   7.809  -1.658
  672    H    CYS  37           H        CYS  37  -0.134   7.738  -3.294
  673    HA   CYS  37           HA       CYS  37   0.481   7.171  -6.103
  674   1HB   CYS  37          1HB       CYS  37  -1.900   6.763  -5.149
  675   2HB   CYS  37          2HB       CYS  37  -2.051   8.522  -5.224
  676    H    PHE  38           H        PHE  38   1.391   8.875  -7.244
  677    HA   PHE  38           HA       PHE  38   1.769  11.345  -5.763
  678   1HB   PHE  38          1HB       PHE  38   3.627  10.031  -6.921
  679   2HB   PHE  38          2HB       PHE  38   2.820  10.316  -8.468
  680    HD1  PHE  38           HD1      PHE  38   4.510  12.000  -5.633
  681    HD2  PHE  38           HD2      PHE  38   3.182  12.320  -9.651
  682    HE1  PHE  38           HE1      PHE  38   5.777  14.153  -5.880
  683    HE2  PHE  38           HE2      PHE  38   4.449  14.474  -9.898
  684    HZ   PHE  38           HZ       PHE  38   5.732  15.364  -8.010
  685    H    ASP  39           H        ASP  39   0.510  13.108  -6.117
  686    HA   ASP  39           HA       ASP  39  -1.258  13.035  -8.371
  687   1HB   ASP  39          1HB       ASP  39  -2.197  13.744  -6.267
  688   2HB   ASP  39          2HB       ASP  39  -0.903  14.926  -6.007
  689    H    SER  40           H        SER  40   0.371  15.918  -6.906
  690    HA   SER  40           HA       SER  40   1.942  17.251  -7.733
  691   1HB   SER  40          1HB       SER  40   2.513  15.227  -9.333
  692   2HB   SER  40          2HB       SER  40   1.688  16.210 -10.557
  693    HG   SER  40           HG       SER  40   3.704  17.002 -10.740
  694    H    ARG  41           H        ARG  41  -1.203  16.568  -9.021
  695    HA   ARG  41           HA       ARG  41  -1.482  18.662 -10.791
  696   1HB   ARG  41          1HB       ARG  41  -3.515  17.264  -8.997
  697   2HB   ARG  41          2HB       ARG  41  -3.973  18.382 -10.295
  698   1HG   ARG  41          1HG       ARG  41  -2.226  16.650 -11.573
  699   2HG   ARG  41          2HG       ARG  41  -3.051  15.569 -10.437
  700   1HD   ARG  41          1HD       ARG  41  -4.451  15.498 -12.320
  701   2HD   ARG  41          2HD       ARG  41  -5.242  16.735 -11.332
  702    HE   ARG  41           HE       ARG  41  -3.279  17.944 -13.060
  703   1HH1  ARG  41          1HH1      ARG  41  -6.481  16.486 -13.135
  704   2HH1  ARG  41          2HH1      ARG  41  -6.993  17.375 -14.531
  705   1HH2  ARG  41          1HH2      ARG  41  -3.954  19.117 -14.902
  706   2HH2  ARG  41          2HH2      ARG  41  -5.546  18.881 -15.543
  707    H    ILE  42           H        ILE  42  -2.005  18.412  -7.226
  708    HA   ILE  42           HA       ILE  42  -2.228  21.341  -7.177
  709    HB   ILE  42           HB       ILE  42  -3.508  19.584  -5.116
  710   1HG1  ILE  42          1HG1      ILE  42  -4.554  20.220  -7.865
  711   2HG1  ILE  42          2HG1      ILE  42  -4.504  18.658  -7.029
  712   1HG2  ILE  42          1HG2      ILE  42  -4.337  22.302  -6.147
  713   2HG2  ILE  42          2HG2      ILE  42  -4.846  21.481  -4.651
  714   3HG2  ILE  42          3HG2      ILE  42  -3.176  22.074  -4.817
  715   1HD1  ILE  42          1HD1      ILE  42  -6.367  21.006  -6.599
  716   2HD1  ILE  42          2HD1      ILE  42  -6.765  19.286  -6.826
  717   3HD1  ILE  42          3HD1      ILE  42  -6.079  19.844  -5.282
  718    HA   PRO  43           HA       PRO  43   1.417  20.630  -4.835
  719   1HB   PRO  43          1HB       PRO  43   2.354  23.191  -4.949
  720   2HB   PRO  43          2HB       PRO  43   2.705  21.982  -6.181
  721   1HG   PRO  43          1HG       PRO  43   0.813  24.245  -6.227
  722   2HG   PRO  43          2HG       PRO  43   1.506  23.332  -7.617
  723   1HD   PRO  43          1HD       PRO  43  -1.132  23.161  -6.513
  724   2HD   PRO  43          2HD       PRO  43  -0.447  22.129  -7.774
  725    H    GLY  44           H        GLY  44  -1.363  22.236  -4.115
  726   1HA   GLY  44          1HA       GLY  44  -0.401  23.257  -1.554
  727   2HA   GLY  44          2HA       GLY  44  -1.993  23.464  -2.258
  728    H    VAL  45           H        VAL  45  -1.441  20.276  -2.854
  729    HA   VAL  45           HA       VAL  45  -2.422  19.458  -0.206
  730    HB   VAL  45           HB       VAL  45  -4.082  18.188  -1.134
  731   1HG1  VAL  45          1HG1      VAL  45  -5.387  19.595  -2.461
  732   2HG1  VAL  45          2HG1      VAL  45  -4.254  20.724  -1.681
  733   3HG1  VAL  45          3HG1      VAL  45  -3.984  20.213  -3.364
  734   1HG2  VAL  45          1HG2      VAL  45  -2.747  18.267  -3.858
  735   2HG2  VAL  45          2HG2      VAL  45  -2.545  16.953  -2.675
  736   3HG2  VAL  45          3HG2      VAL  45  -4.149  17.286  -3.369
  737    HA   PRO  46           HA       PRO  46   0.418  16.182  -0.416
  738   1HB   PRO  46          1HB       PRO  46  -0.939  13.847  -0.003
  739   2HB   PRO  46          2HB       PRO  46  -0.528  14.967   1.295
  740   1HG   PRO  46          1HG       PRO  46  -3.107  14.499  -0.062
  741   2HG   PRO  46          2HG       PRO  46  -2.803  15.260   1.541
  742   1HD   PRO  46          1HD       PRO  46  -3.498  16.530  -0.930
  743   2HD   PRO  46          2HD       PRO  46  -3.053  17.334   0.581
  744    H    TRP  47           H        TRP  47   1.690  15.722  -2.086
  745    HA   TRP  47           HA       TRP  47   0.318  14.713  -4.449
  746   1HB   TRP  47          1HB       TRP  47   3.174  15.113  -4.697
  747   2HB   TRP  47          2HB       TRP  47   1.843  15.803  -5.628
  748    HD1  TRP  47           HD1      TRP  47   0.672  18.090  -4.392
  749    HE1  TRP  47           HE1      TRP  47   1.766  20.078  -3.046
  750    HE3  TRP  47           HE3      TRP  47   4.979  15.640  -3.253
  751    HZ2  TRP  47           HZ2      TRP  47   4.255  20.396  -1.687
  752    HZ3  TRP  47           HZ3      TRP  47   6.690  16.862  -1.913
  753    HH2  TRP  47           HH2      TRP  47   6.383  19.159  -1.135
  754    H    CYS  48           H        CYS  48   0.627  13.092  -1.958
  755    HA   CYS  48           HA       CYS  48   1.590  10.750  -3.188
  756   1HB   CYS  48          1HB       CYS  48   3.742  11.879  -2.565
  757   2HB   CYS  48          2HB       CYS  48   3.275  11.709  -0.871
  758    H    PHE  49           H        PHE  49  -0.208   9.595  -2.526
  759    HA   PHE  49           HA       PHE  49  -0.606   9.364   0.345
  760   1HB   PHE  49          1HB       PHE  49  -3.191   9.450  -0.513
  761   2HB   PHE  49          2HB       PHE  49  -2.343  10.917  -0.016
  762    HD1  PHE  49           HD1      PHE  49  -0.984  12.078  -1.985
  763    HD2  PHE  49           HD2      PHE  49  -4.279   9.461  -2.531
  764    HE1  PHE  49           HE1      PHE  49  -1.393  13.067  -4.256
  765    HE2  PHE  49           HE2      PHE  49  -4.688  10.449  -4.802
  766    HZ   PHE  49           HZ       PHE  49  -3.240  12.240  -5.637
  767    H    LYS  50           H        LYS  50  -2.933   7.794   0.300
  768    HA   LYS  50           HA       LYS  50  -2.098   5.541  -1.391
  769   1HB   LYS  50          1HB       LYS  50  -3.431   4.546   0.882
  770   2HB   LYS  50          2HB       LYS  50  -1.724   4.356   0.449
  771   1HG   LYS  50          1HG       LYS  50  -2.689   6.891   1.781
  772   2HG   LYS  50          2HG       LYS  50  -2.381   5.449   2.763
  773   1HD   LYS  50          1HD       LYS  50  -0.429   6.961   0.986
  774   2HD   LYS  50          2HD       LYS  50  -0.350   6.774   2.746
  775   1HE   LYS  50          1HE       LYS  50   0.172   4.718   0.581
  776   2HE   LYS  50          2HE       LYS  50   1.237   5.206   1.909
  777   1HZ   LYS  50          1HZ       LYS  50  -0.245   4.142   3.425
  778   2HZ   LYS  50          2HZ       LYS  50  -1.310   3.779   2.241
  779   3HZ   LYS  50          3HZ       LYS  50   0.160   3.069   2.262
  780    HA   PRO  51           HA       PRO  51  -6.382   6.689  -2.315
  781   1HB   PRO  51          1HB       PRO  51  -6.099   7.010  -5.013
  782   2HB   PRO  51          2HB       PRO  51  -6.020   8.349  -3.869
  783   1HG   PRO  51          1HG       PRO  51  -3.856   6.948  -5.305
  784   2HG   PRO  51          2HG       PRO  51  -3.825   8.578  -4.541
  785   1HD   PRO  51          1HD       PRO  51  -2.666   6.140  -3.583
  786   2HD   PRO  51          2HD       PRO  51  -2.746   7.682  -2.719
  787    H    LEU  52           H        LEU  52  -5.492   5.388  -5.359
  788    HA   LEU  52           HA       LEU  52  -7.003   3.001  -4.642
  789   1HB   LEU  52          1HB       LEU  52  -7.685   2.903  -6.756
  790   2HB   LEU  52          2HB       LEU  52  -7.281   4.630  -6.736
  791    HG   LEU  52           HG       LEU  52  -5.843   2.332  -8.031
  792   1HD1  LEU  52          1HD1      LEU  52  -7.224   4.803  -8.871
  793   2HD1  LEU  52          2HD1      LEU  52  -5.714   4.435  -9.740
  794   3HD1  LEU  52          3HD1      LEU  52  -7.035   3.243  -9.705
  795   1HD2  LEU  52          1HD2      LEU  52  -4.527   4.417  -6.583
  796   2HD2  LEU  52          2HD2      LEU  52  -3.821   3.109  -7.563
  797   3HD2  LEU  52          3HD2      LEU  52  -4.247   4.661  -8.325
  798    H    GLN  53           H        GLN  53  -4.363   3.363  -3.504
  799    HA   GLN  53           HA       GLN  53  -2.330   2.255  -4.901
  800   1HB   GLN  53          1HB       GLN  53  -3.039   1.965  -1.958
  801   2HB   GLN  53          2HB       GLN  53  -1.467   1.500  -2.634
  802   1HG   GLN  53          1HG       GLN  53  -2.724   4.277  -2.704
  803   2HG   GLN  53          2HG       GLN  53  -1.377   3.778  -1.669
  804   1HE2  GLN  53          1HE2      GLN  53   0.133   2.269  -3.354
  805   2HE2  GLN  53          2HE2      GLN  53   0.782   3.226  -4.644
  806    H    GLU  54           H        GLU  54  -5.292   0.747  -3.853
  807    HA   GLU  54           HA       GLU  54  -4.756  -1.766  -3.299
  808   1HB   GLU  54          1HB       GLU  54  -6.842  -2.396  -4.402
  809   2HB   GLU  54          2HB       GLU  54  -7.033  -0.807  -3.640
  810   1HG   GLU  54          1HG       GLU  54  -7.037   0.314  -5.695
  811   2HG   GLU  54          2HG       GLU  54  -6.157  -0.974  -6.530
  812    H    ALA  55           H        ALA  55  -4.026  -0.155  -6.354
  813    HA   ALA  55           HA       ALA  55  -3.900  -1.933  -8.265
  814   1HB   ALA  55          1HB       ALA  55  -2.892   0.155  -8.665
  815   2HB   ALA  55          2HB       ALA  55  -1.781  -0.010  -7.284
  816   3HB   ALA  55          3HB       ALA  55  -1.525  -0.981  -8.753
  817    H    GLU  56           H        GLU  56  -1.294  -1.802  -5.725
  818    HA   GLU  56           HA       GLU  56  -1.174  -4.685  -5.907
  819   1HB   GLU  56          1HB       GLU  56   0.821  -2.885  -7.001
  820   2HB   GLU  56          2HB       GLU  56   1.535  -3.863  -5.707
  821   1HG   GLU  56          1HG       GLU  56   1.339  -5.806  -6.901
  822   2HG   GLU  56          2HG       GLU  56  -0.222  -5.349  -7.603
  823    H    CYS  57           H        CYS  57  -1.962  -2.311  -4.017
  824    HA   CYS  57           HA       CYS  57  -0.112  -2.771  -1.843
  825   1HB   CYS  57          1HB       CYS  57  -1.861  -0.664  -2.639
  826   2HB   CYS  57          2HB       CYS  57  -2.333  -1.196  -1.024
  827    H    THR  58           H        THR  58  -3.745  -2.672  -2.131
  828    HA   THR  58           HA       THR  58  -4.242  -4.253   0.088
  829    HB   THR  58           HB       THR  58  -5.827  -2.752  -1.272
  830    HG1  THR  58           HG1      THR  58  -6.582  -5.556  -0.856
  831   1HG2  THR  58          1HG2      THR  58  -6.050  -5.319  -2.929
  832   2HG2  THR  58          2HG2      THR  58  -7.105  -3.892  -3.067
  833   3HG2  THR  58          3HG2      THR  58  -5.390  -3.780  -3.533
  834    H    PHE  59           H        PHE  59  -3.788  -5.220  -3.358
  835    HA   PHE  59           HA       PHE  59  -4.468  -7.813  -3.259
  836   1HB   PHE  59          1HB       PHE  59  -2.615  -6.035  -4.683
  837   2HB   PHE  59          2HB       PHE  59  -1.907  -7.649  -4.565
  838    HD1  PHE  59           HD1      PHE  59  -3.600  -5.652  -6.708
  839    HD2  PHE  59           HD2      PHE  59  -3.948  -9.515  -4.989
  840    HE1  PHE  59           HE1      PHE  59  -5.001  -6.392  -8.654
  841    HE2  PHE  59           HE2      PHE  59  -5.349 -10.256  -6.935
  842    HZ   PHE  59           HZ       PHE  59  -5.859  -8.685  -8.744
  Start of MODEL    7
    1   1H    GLU   1           H1       GLU   1 -19.959  -8.067  -0.984
    2    HA   GLU   1           HA       GLU   1 -18.109  -7.630  -2.037
    3   1HB   GLU   1          1HB       GLU   1 -17.998  -5.879   0.081
    4   2HB   GLU   1          2HB       GLU   1 -16.448  -6.721   0.249
    5   1HG   GLU   1          1HG       GLU   1 -16.301  -4.690  -1.193
    6   2HG   GLU   1          2HG       GLU   1 -15.861  -6.162  -2.070
    7    H    GLU   2           H        GLU   2 -15.967  -8.564  -2.491
    8    HA   GLU   2           HA       GLU   2 -15.667 -11.037  -1.046
    9   1HB   GLU   2          1HB       GLU   2 -15.116 -10.062  -3.744
   10   2HB   GLU   2          2HB       GLU   2 -13.729 -10.945  -3.085
   11   1HG   GLU   2          1HG       GLU   2 -15.790 -12.579  -2.325
   12   2HG   GLU   2          2HG       GLU   2 -16.451 -11.917  -3.827
   13    H    TYR   3           H        TYR   3 -14.937  -9.617   0.894
   14    HA   TYR   3           HA       TYR   3 -12.262  -8.558   0.647
   15   1HB   TYR   3          1HB       TYR   3 -14.284  -9.014   2.922
   16   2HB   TYR   3          2HB       TYR   3 -12.769  -8.134   3.145
   17    HD1  TYR   3           HD1      TYR   3 -13.220  -6.945   0.140
   18    HD2  TYR   3           HD2      TYR   3 -15.424  -6.963   3.807
   19    HE1  TYR   3           HE1      TYR   3 -14.388  -4.793  -0.543
   20    HE2  TYR   3           HE2      TYR   3 -16.585  -4.812   3.111
   21    HH   TYR   3           HH       TYR   3 -15.723  -2.793   1.343
   22    H    VAL   4           H        VAL   4 -11.333 -10.722  -0.026
   23    HA   VAL   4           HA       VAL   4 -10.730 -12.269   2.396
   24    HB   VAL   4           HB       VAL   4 -11.136 -13.333  -0.406
   25   1HG1  VAL   4          1HG1      VAL   4 -10.559 -15.433   0.346
   26   2HG1  VAL   4          2HG1      VAL   4  -9.464 -14.428   1.325
   27   3HG1  VAL   4          3HG1      VAL   4 -10.967 -15.061   2.039
   28   1HG2  VAL   4          1HG2      VAL   4 -13.288 -13.773   0.062
   29   2HG2  VAL   4          2HG2      VAL   4 -12.913 -14.315   1.715
   30   3HG2  VAL   4          3HG2      VAL   4 -13.110 -12.580   1.372
   31    H    GLY   5           H        GLY   5  -9.690 -11.605  -1.025
   32   1HA   GLY   5          1HA       GLY   5  -6.977 -12.267  -0.542
   33   2HA   GLY   5          2HA       GLY   5  -7.633 -11.410  -1.921
   34    H    LEU   6           H        LEU   6  -8.734  -9.829   0.868
   35    HA   LEU   6           HA       LEU   6  -6.337  -8.241   1.230
   36   1HB   LEU   6          1HB       LEU   6  -7.744  -6.152   0.880
   37   2HB   LEU   6          2HB       LEU   6  -7.131  -7.004  -0.548
   38    HG   LEU   6           HG       LEU   6  -9.419  -6.199  -0.858
   39   1HD1  LEU   6          1HD1      LEU   6  -8.451  -8.561  -1.656
   40   2HD1  LEU   6          2HD1      LEU   6  -9.835  -9.140  -0.698
   41   3HD1  LEU   6          3HD1      LEU   6 -10.097  -8.009  -2.047
   42   1HD2  LEU   6          1HD2      LEU   6 -10.409  -8.148   1.208
   43   2HD2  LEU   6          2HD2      LEU   6  -9.956  -6.486   1.656
   44   3HD2  LEU   6          3HD2      LEU   6 -11.245  -6.766   0.461
   45    H    SER   7           H        SER   7  -8.082 -10.202   2.735
   46    HA   SER   7           HA       SER   7  -9.104  -8.376   4.754
   47   1HB   SER   7          1HB       SER   7 -10.860  -9.805   4.364
   48   2HB   SER   7          2HB       SER   7  -9.813 -11.150   3.873
   49    HG   SER   7           HG       SER   7  -9.300 -11.495   6.114
   50    H    ALA   8           H        ALA   8  -8.645  -8.923   7.073
   51    HA   ALA   8           HA       ALA   8  -5.930  -9.349   7.504
   52   1HB   ALA   8          1HB       ALA   8  -6.590  -9.397   9.888
   53   2HB   ALA   8          2HB       ALA   8  -7.419  -8.090   9.011
   54   3HB   ALA   8          3HB       ALA   8  -8.293  -9.588   9.410
   55    H    ASN   9           H        ASN   9  -5.347 -11.292   6.355
   56    HA   ASN   9           HA       ASN   9  -5.210 -13.505   7.946
   57   1HB   ASN   9          1HB       ASN   9  -7.781 -13.373   6.958
   58   2HB   ASN   9          2HB       ASN   9  -7.001 -14.346   5.702
   59   1HD2  ASN   9          1HD2      ASN   9  -5.385 -16.000   6.724
   60   2HD2  ASN   9          2HD2      ASN   9  -6.036 -16.994   7.984
   61    H    GLN  10           H        GLN  10  -5.442 -12.027   4.702
   62    HA   GLN  10           HA       GLN  10  -4.167 -13.989   3.247
   63   1HB   GLN  10          1HB       GLN  10  -5.405 -11.981   2.362
   64   2HB   GLN  10          2HB       GLN  10  -4.003 -10.981   2.777
   65   1HG   GLN  10          1HG       GLN  10  -2.587 -12.297   1.266
   66   2HG   GLN  10          2HG       GLN  10  -3.924 -13.402   0.916
   67   1HE2  GLN  10          1HE2      GLN  10  -3.015  -9.967   0.866
   68   2HE2  GLN  10          2HE2      GLN  10  -3.865  -9.531  -0.578
   69    H    CYS  11           H        CYS  11  -2.920 -11.448   5.411
   70    HA   CYS  11           HA       CYS  11  -0.272 -11.505   4.534
   71   1HB   CYS  11          1HB       CYS  11  -1.073  -9.693   5.859
   72   2HB   CYS  11          2HB       CYS  11  -1.498 -10.766   7.195
   73    H    ALA  12           H        ALA  12  -2.224 -13.921   5.906
   74    HA   ALA  12           HA       ALA  12   0.055 -15.213   7.225
   75   1HB   ALA  12          1HB       ALA  12  -1.463 -15.711   8.801
   76   2HB   ALA  12          2HB       ALA  12  -2.744 -14.929   7.843
   77   3HB   ALA  12          3HB       ALA  12  -2.379 -16.655   7.600
   78    H    VAL  13           H        VAL  13  -0.829 -14.889   4.199
   79    HA   VAL  13           HA       VAL  13  -1.723 -17.150   3.085
   80    HB   VAL  13           HB       VAL  13  -0.355 -14.886   2.275
   81   1HG1  VAL  13          1HG1      VAL  13   1.791 -16.087   2.434
   82   2HG1  VAL  13          2HG1      VAL  13   1.176 -17.327   1.316
   83   3HG1  VAL  13          3HG1      VAL  13   1.400 -15.654   0.752
   84   1HG2  VAL  13          1HG2      VAL  13  -0.760 -16.616   0.020
   85   2HG2  VAL  13          2HG2      VAL  13  -2.079 -16.867   1.190
   86   3HG2  VAL  13          3HG2      VAL  13  -1.742 -15.235   0.566
   87    HA   PRO  14           HA       PRO  14   1.043 -20.369   3.888
   88   1HB   PRO  14          1HB       PRO  14   0.984 -21.851   1.595
   89   2HB   PRO  14          2HB       PRO  14  -0.282 -21.918   2.818
   90   1HG   PRO  14          1HG       PRO  14  -0.253 -20.576   0.192
   91   2HG   PRO  14          2HG       PRO  14  -1.670 -21.044   1.197
   92   1HD   PRO  14          1HD       PRO  14  -0.545 -18.439   0.812
   93   2HD   PRO  14          2HD       PRO  14  -1.840 -18.873   1.934
   94    H    ALA  15           H        ALA  15   2.199 -17.873   2.860
   95    HA   ALA  15           HA       ALA  15   4.115 -17.122   2.025
   96   1HB   ALA  15          1HB       ALA  15   5.285 -19.756   2.988
   97   2HB   ALA  15          2HB       ALA  15   6.076 -18.163   2.916
   98   3HB   ALA  15          3HB       ALA  15   4.778 -18.459   4.098
   99    H    LYS  16           H        LYS  16   3.061 -17.413  -0.169
  100    HA   LYS  16           HA       LYS  16   4.783 -18.179  -2.058
  101   1HB   LYS  16          1HB       LYS  16   3.707 -20.449  -2.770
  102   2HB   LYS  16          2HB       LYS  16   5.011 -20.415  -1.569
  103   1HG   LYS  16          1HG       LYS  16   3.656 -21.337  -0.025
  104   2HG   LYS  16          2HG       LYS  16   2.452 -20.054  -0.242
  105   1HD   LYS  16          1HD       LYS  16   1.249 -21.971  -0.830
  106   2HD   LYS  16          2HD       LYS  16   1.805 -21.405  -2.415
  107   1HE   LYS  16          1HE       LYS  16   3.721 -22.986  -2.284
  108   2HE   LYS  16          2HE       LYS  16   3.147 -23.558  -0.710
  109   1HZ   LYS  16          1HZ       LYS  16   2.144 -25.033  -2.050
  110   2HZ   LYS  16          2HZ       LYS  16   0.987 -23.883  -2.140
  111   3HZ   LYS  16          3HZ       LYS  16   2.078 -24.040  -3.345
  112    H    ASP  17           H        ASP  17   3.046 -16.140  -1.806
  113    HA   ASP  17           HA       ASP  17   1.510 -16.445  -4.148
  114   1HB   ASP  17          1HB       ASP  17   0.043 -17.442  -2.289
  115   2HB   ASP  17          2HB       ASP  17  -0.046 -15.813  -1.605
  116    H    ARG  18           H        ARG  18   2.699 -14.740  -1.294
  117    HA   ARG  18           HA       ARG  18   1.648 -12.278  -1.560
  118   1HB   ARG  18          1HB       ARG  18   4.560 -12.941  -0.924
  119   2HB   ARG  18          2HB       ARG  18   3.728 -11.444  -0.466
  120   1HG   ARG  18          1HG       ARG  18   2.609 -12.449   1.256
  121   2HG   ARG  18          2HG       ARG  18   2.376 -13.967   0.372
  122   1HD   ARG  18          1HD       ARG  18   4.683 -14.632   0.833
  123   2HD   ARG  18          2HD       ARG  18   5.039 -13.063   1.570
  124    HE   ARG  18           HE       ARG  18   2.812 -14.567   2.790
  125   1HH1  ARG  18          1HH1      ARG  18   6.250 -13.818   2.880
  126   2HH1  ARG  18          2HH1      ARG  18   6.439 -14.290   4.536
  127   1HH2  ARG  18          1HH2      ARG  18   3.062 -15.191   4.975
  128   2HH2  ARG  18          2HH2      ARG  18   4.615 -15.077   5.735
  129    H    VAL  19           H        VAL  19   3.373 -10.270  -2.167
  130    HA   VAL  19           HA       VAL  19   4.106 -10.805  -4.964
  131    HB   VAL  19           HB       VAL  19   3.213  -8.193  -3.732
  132   1HG1  VAL  19          1HG1      VAL  19   4.444  -8.876  -6.240
  133   2HG1  VAL  19          2HG1      VAL  19   2.792  -8.284  -6.535
  134   3HG1  VAL  19          3HG1      VAL  19   3.948  -7.280  -5.628
  135   1HG2  VAL  19          1HG2      VAL  19   1.522  -9.848  -5.599
  136   2HG2  VAL  19          2HG2      VAL  19   1.492 -10.140  -3.843
  137   3HG2  VAL  19          3HG2      VAL  19   1.036  -8.545  -4.488
  138    H    ASP  20           H        ASP  20   5.617 -11.059  -2.279
  139    HA   ASP  20           HA       ASP  20   7.460 -10.314  -1.316
  140   1HB   ASP  20          1HB       ASP  20   8.616 -11.730  -2.724
  141   2HB   ASP  20          2HB       ASP  20   8.037 -10.926  -4.192
  142    H    CYS  21           H        CYS  21   6.904  -8.110  -0.667
  143    HA   CYS  21           HA       CYS  21   6.763  -5.921  -2.259
  144   1HB   CYS  21          1HB       CYS  21   6.525  -6.353   0.366
  145   2HB   CYS  21          2HB       CYS  21   8.104  -5.560   0.370
  146    H    GLY  22           H        GLY  22   9.626  -7.662  -0.986
  147   1HA   GLY  22          1HA       GLY  22  11.831  -7.439  -1.369
  148   2HA   GLY  22          2HA       GLY  22  11.367  -6.926  -2.978
  149    H    TYR  23           H        TYR  23  11.290  -5.541   0.391
  150    HA   TYR  23           HA       TYR  23  11.957  -2.942  -0.730
  151   1HB   TYR  23          1HB       TYR  23  10.595  -4.158   1.568
  152   2HB   TYR  23          2HB       TYR  23  11.828  -3.040   2.160
  153    HD1  TYR  23           HD1      TYR  23  11.731  -0.621   1.421
  154    HD2  TYR  23           HD2      TYR  23   8.551  -3.380   0.661
  155    HE1  TYR  23           HE1      TYR  23  10.138   1.318   1.010
  156    HE2  TYR  23           HE2      TYR  23   6.969  -1.432   0.253
  157    HH   TYR  23           HH       TYR  23   6.723   0.807   0.692
  158    HA   PRO  24           HA       PRO  24  16.126  -3.314   0.407
  159   1HB   PRO  24          1HB       PRO  24  16.883  -0.702   0.164
  160   2HB   PRO  24          2HB       PRO  24  16.768  -1.802  -1.207
  161   1HG   PRO  24          1HG       PRO  24  14.944   0.349  -0.344
  162   2HG   PRO  24          2HG       PRO  24  15.078  -0.427  -1.964
  163   1HD   PRO  24          1HD       PRO  24  13.067  -0.821   0.037
  164   2HD   PRO  24          2HD       PRO  24  13.245  -1.724  -1.474
  165    H    HIS  25           H        HIS  25  13.794  -1.854   2.241
  166    HA   HIS  25           HA       HIS  25  15.737  -1.594   4.420
  167   1HB   HIS  25          1HB       HIS  25  14.129   0.413   3.316
  168   2HB   HIS  25          2HB       HIS  25  13.326  -0.033   4.825
  169    HD1  HIS  25           HD1      HIS  25  15.043   2.665   4.091
  170    HD2  HIS  25           HD2      HIS  25  16.189  -0.533   6.551
  171    HE1  HIS  25           HE1      HIS  25  16.824   3.582   5.670
  172    HE2  HIS  25           HE2      HIS  25  17.452   1.586   7.192
  173    H    VAL  26           H        VAL  26  13.764  -3.757   3.228
  174    HA   VAL  26           HA       VAL  26  11.625  -4.277   4.715
  175    HB   VAL  26           HB       VAL  26  12.273  -5.785   3.041
  176   1HG1  VAL  26          1HG1      VAL  26  14.814  -6.305   4.621
  177   2HG1  VAL  26          2HG1      VAL  26  14.324  -7.171   3.146
  178   3HG1  VAL  26          3HG1      VAL  26  14.683  -5.428   3.078
  179   1HG2  VAL  26          1HG2      VAL  26  11.620  -7.720   4.021
  180   2HG2  VAL  26          2HG2      VAL  26  12.886  -7.643   5.270
  181   3HG2  VAL  26          3HG2      VAL  26  11.401  -6.677   5.447
  182    H    THR  27           H        THR  27  11.076  -4.558   6.826
  183    HA   THR  27           HA       THR  27  12.846  -5.710   8.712
  184    HB   THR  27           HB       THR  27  13.116  -2.861   8.201
  185    HG1  THR  27           HG1      THR  27  14.997  -3.585   9.124
  186   1HG2  THR  27          1HG2      THR  27  12.969  -3.101  11.111
  187   2HG2  THR  27          2HG2      THR  27  12.244  -1.859  10.061
  188   3HG2  THR  27          3HG2      THR  27  11.361  -3.369  10.395
  189    HA   PRO  28           HA       PRO  28   9.051  -6.267  10.632
  190   1HB   PRO  28          1HB       PRO  28   9.815  -6.905  13.176
  191   2HB   PRO  28          2HB       PRO  28   9.844  -8.057  11.843
  192   1HG   PRO  28          1HG       PRO  28  12.055  -6.592  13.131
  193   2HG   PRO  28          2HG       PRO  28  12.132  -8.087  12.131
  194   1HD   PRO  28          1HD       PRO  28  12.847  -5.414  11.392
  195   2HD   PRO  28          2HD       PRO  28  12.787  -6.824  10.326
  196    H    LYS  29           H        LYS  29   9.333  -3.660  10.179
  197    HA   LYS  29           HA       LYS  29   7.689  -2.541  12.073
  198   1HB   LYS  29          1HB       LYS  29  10.003  -2.891  13.347
  199   2HB   LYS  29          2HB       LYS  29  10.363  -1.330  12.590
  200   1HG   LYS  29          1HG       LYS  29   9.144  -0.315  14.185
  201   2HG   LYS  29          2HG       LYS  29   7.697  -1.164  13.614
  202   1HD   LYS  29          1HD       LYS  29   8.429  -3.138  15.047
  203   2HD   LYS  29          2HD       LYS  29   9.682  -2.092  15.737
  204   1HE   LYS  29          1HE       LYS  29   7.401  -0.529  15.957
  205   2HE   LYS  29          2HE       LYS  29   6.762  -2.153  16.242
  206   1HZ   LYS  29          1HZ       LYS  29   7.542  -1.117  18.256
  207   2HZ   LYS  29          2HZ       LYS  29   8.445  -2.436  17.924
  208   3HZ   LYS  29          3HZ       LYS  29   9.046  -0.943  17.643
  209    H    GLU  30           H        GLU  30   9.989  -2.451   9.460
  210    HA   GLU  30           HA       GLU  30   9.205   0.257   8.803
  211   1HB   GLU  30          1HB       GLU  30  11.517  -1.451   8.277
  212   2HB   GLU  30          2HB       GLU  30  10.922  -0.697   6.787
  213   1HG   GLU  30          1HG       GLU  30  11.702   1.330   7.416
  214   2HG   GLU  30          2HG       GLU  30  10.959   1.207   9.018
  215    H    CYS  31           H        CYS  31   9.121  -3.120   7.525
  216    HA   CYS  31           HA       CYS  31   7.971  -2.581   5.088
  217   1HB   CYS  31          1HB       CYS  31   7.846  -4.954   6.925
  218   2HB   CYS  31          2HB       CYS  31   6.976  -4.942   5.390
  219    H    ASN  32           H        ASN  32   6.441  -3.319   8.302
  220    HA   ASN  32           HA       ASN  32   3.838  -3.031   7.338
  221   1HB   ASN  32          1HB       ASN  32   5.203  -3.331   9.964
  222   2HB   ASN  32          2HB       ASN  32   3.659  -2.471  10.057
  223   1HD2  ASN  32          1HD2      ASN  32   5.051  -5.225   8.266
  224   2HD2  ASN  32          2HD2      ASN  32   3.760  -6.344   8.549
  225    H    ASN  33           H        ASN  33   6.296  -0.778   7.583
  226    HA   ASN  33           HA       ASN  33   4.532   1.348   8.478
  227   1HB   ASN  33          1HB       ASN  33   6.925   0.987   9.428
  228   2HB   ASN  33          2HB       ASN  33   7.514   1.593   7.873
  229   1HD2  ASN  33          1HD2      ASN  33   8.422   3.102   9.615
  230   2HD2  ASN  33          2HD2      ASN  33   7.530   4.553   9.928
  231    H    ARG  34           H        ARG  34   6.367  -0.024   5.760
  232    HA   ARG  34           HA       ARG  34   6.096   2.334   4.180
  233   1HB   ARG  34          1HB       ARG  34   6.844  -0.411   3.125
  234   2HB   ARG  34          2HB       ARG  34   7.388   1.171   2.538
  235   1HG   ARG  34          1HG       ARG  34   8.192   1.090   5.233
  236   2HG   ARG  34          2HG       ARG  34   8.524  -0.544   4.631
  237   1HD   ARG  34          1HD       ARG  34  10.201   0.181   3.258
  238   2HD   ARG  34          2HD       ARG  34   9.330   1.648   2.784
  239    HE   ARG  34           HE       ARG  34  11.326   1.428   4.852
  240   1HH1  ARG  34          1HH1      ARG  34   8.296   3.057   4.113
  241   2HH1  ARG  34          2HH1      ARG  34   8.630   4.417   5.133
  242   1HH2  ARG  34          1HH2      ARG  34  11.769   3.222   6.197
  243   2HH2  ARG  34          2HH2      ARG  34  10.619   4.511   6.326
  244    H    GLY  35           H        GLY  35   4.325  -0.629   4.848
  245   1HA   GLY  35          1HA       GLY  35   1.956  -0.491   4.218
  246   2HA   GLY  35          2HA       GLY  35   2.481  -0.024   2.613
  247    H    CYS  36           H        CYS  36   4.361  -2.407   4.450
  248    HA   CYS  36           HA       CYS  36   3.255  -4.481   2.698
  249   1HB   CYS  36          1HB       CYS  36   6.091  -4.319   3.718
  250   2HB   CYS  36          2HB       CYS  36   5.428  -5.519   2.607
  251    H    CYS  37           H        CYS  37   4.119  -6.768   3.817
  252    HA   CYS  37           HA       CYS  37   3.469  -6.515   6.663
  253   1HB   CYS  37          1HB       CYS  37   1.643  -7.441   5.094
  254   2HB   CYS  37          2HB       CYS  37   2.642  -8.895   5.020
  255    H    PHE  38           H        PHE  38   5.083  -7.355   7.949
  256    HA   PHE  38           HA       PHE  38   7.212  -8.803   6.627
  257   1HB   PHE  38          1HB       PHE  38   7.510  -6.860   8.259
  258   2HB   PHE  38          2HB       PHE  38   6.778  -7.854   9.523
  259    HD1  PHE  38           HD1      PHE  38   9.729  -7.421   7.365
  260    HD2  PHE  38           HD2      PHE  38   8.047  -9.560  10.621
  261    HE1  PHE  38           HE1      PHE  38  11.994  -8.339   7.932
  262    HE2  PHE  38           HE2      PHE  38  10.313 -10.479  11.188
  263    HZ   PHE  38           HZ       PHE  38  12.260  -9.858   9.836
  264    H    ASP  39           H        ASP  39   7.364 -10.993   6.630
  265    HA   ASP  39           HA       ASP  39   5.543 -12.426   8.324
  266   1HB   ASP  39          1HB       ASP  39   5.697 -13.172   6.038
  267   2HB   ASP  39          2HB       ASP  39   7.465 -13.235   6.103
  268    H    SER  40           H        SER  40   8.883 -13.373   7.290
  269    HA   SER  40           HA       SER  40  10.745 -13.593   8.478
  270   1HB   SER  40          1HB       SER  40   9.479 -12.009  10.236
  271   2HB   SER  40          2HB       SER  40   9.434 -13.509  11.180
  272    HG   SER  40           HG       SER  40  11.924 -13.314  10.215
  273    H    ARG  41           H        ARG  41   7.724 -15.232   8.874
  274    HA   ARG  41           HA       ARG  41   8.431 -17.314  10.506
  275   1HB   ARG  41          1HB       ARG  41   6.530 -17.181   8.128
  276   2HB   ARG  41          2HB       ARG  41   6.606 -18.580   9.212
  277   1HG   ARG  41          1HG       ARG  41   6.411 -16.386  10.942
  278   2HG   ARG  41          2HG       ARG  41   5.332 -15.954   9.603
  279   1HD   ARG  41          1HD       ARG  41   3.962 -17.165  11.121
  280   2HD   ARG  41          2HD       ARG  41   4.357 -18.350   9.867
  281    HE   ARG  41           HE       ARG  41   5.707 -19.513  11.422
  282   1HH1  ARG  41          1HH1      ARG  41   4.654 -16.437  12.769
  283   2HH1  ARG  41          2HH1      ARG  41   5.170 -16.821  14.378
  284   1HH2  ARG  41          1HH2      ARG  41   6.388 -20.019  13.543
  285   2HH2  ARG  41          2HH2      ARG  41   6.163 -18.871  14.821
  286    H    ILE  42           H        ILE  42   8.656 -16.974   6.898
  287    HA   ILE  42           HA       ILE  42  10.513 -19.251   6.934
  288    HB   ILE  42           HB       ILE  42   9.070 -18.607   4.435
  289   1HG1  ILE  42          1HG1      ILE  42   7.679 -19.867   6.807
  290   2HG1  ILE  42          2HG1      ILE  42   7.242 -18.346   6.009
  291   1HG2  ILE  42          1HG2      ILE  42   9.053 -21.362   5.327
  292   2HG2  ILE  42          2HG2      ILE  42   9.792 -20.632   3.881
  293   3HG2  ILE  42          3HG2      ILE  42  10.689 -20.666   5.418
  294   1HD1  ILE  42          1HD1      ILE  42   5.752 -19.897   5.044
  295   2HD1  ILE  42          2HD1      ILE  42   7.067 -19.835   3.846
  296   3HD1  ILE  42          3HD1      ILE  42   6.975 -21.189   4.998
  297    HA   PRO  43           HA       PRO  43  13.244 -16.187   5.486
  298   1HB   PRO  43          1HB       PRO  43  15.478 -17.750   5.331
  299   2HB   PRO  43          2HB       PRO  43  14.952 -16.967   6.819
  300   1HG   PRO  43          1HG       PRO  43  14.725 -19.786   5.977
  301   2HG   PRO  43          2HG       PRO  43  14.636 -19.100   7.639
  302   1HD   PRO  43          1HD       PRO  43  12.498 -20.049   5.988
  303   2HD   PRO  43          2HD       PRO  43  12.342 -19.236   7.550
  304    H    GLY  44           H        GLY  44  12.224 -18.948   3.859
  305   1HA   GLY  44          1HA       GLY  44  13.708 -18.308   1.436
  306   2HA   GLY  44          2HA       GLY  44  12.631 -19.663   1.706
  307    H    VAL  45           H        VAL  45  10.817 -17.296   3.009
  308    HA   VAL  45           HA       VAL  45   9.564 -16.681   0.428
  309    HB   VAL  45           HB       VAL  45   8.556 -17.891   2.703
  310   1HG1  VAL  45          1HG1      VAL  45   8.451 -15.889   3.999
  311   2HG1  VAL  45          2HG1      VAL  45   7.734 -14.974   2.651
  312   3HG1  VAL  45          3HG1      VAL  45   6.791 -16.247   3.463
  313   1HG2  VAL  45          1HG2      VAL  45   7.114 -18.402   1.078
  314   2HG2  VAL  45          2HG2      VAL  45   6.352 -16.810   1.312
  315   3HG2  VAL  45          3HG2      VAL  45   7.645 -17.011   0.105
  316    HA   PRO  46           HA       PRO  46  10.076 -12.448   1.155
  317   1HB   PRO  46          1HB       PRO  46   7.704 -11.302   0.431
  318   2HB   PRO  46          2HB       PRO  46   8.912 -11.838  -0.735
  319   1HG   PRO  46          1HG       PRO  46   6.363 -13.088   0.066
  320   2HG   PRO  46          2HG       PRO  46   7.329 -13.366  -1.427
  321   1HD   PRO  46          1HD       PRO  46   7.095 -15.047   0.880
  322   2HD   PRO  46          2HD       PRO  46   8.182 -15.287  -0.495
  323    H    TRP  47           H        TRP  47  10.563 -11.684   3.110
  324    HA   TRP  47           HA       TRP  47   8.486 -11.870   5.115
  325   1HB   TRP  47          1HB       TRP  47  10.874 -10.482   5.938
  326   2HB   TRP  47          2HB       TRP  47  10.159 -11.973   6.556
  327    HD1  TRP  47           HD1      TRP  47  10.983 -14.301   5.211
  328    HE1  TRP  47           HE1      TRP  47  13.262 -14.960   4.055
  329    HE3  TRP  47           HE3      TRP  47  12.714  -9.545   4.715
  330    HZ2  TRP  47           HZ2      TRP  47  15.483 -13.453   3.085
  331    HZ3  TRP  47           HZ3      TRP  47  14.947  -9.226   3.653
  332    HH2  TRP  47           HH2      TRP  47  16.318 -11.085   2.852
  333    H    CYS  48           H        CYS  48   8.111 -10.136   2.713
  334    HA   CYS  48           HA       CYS  48   7.204  -7.848   4.070
  335   1HB   CYS  48          1HB       CYS  48   9.655  -7.348   3.939
  336   2HB   CYS  48          2HB       CYS  48   9.502  -7.317   2.181
  337    H    PHE  49           H        PHE  49   5.224  -8.055   3.031
  338    HA   PHE  49           HA       PHE  49   5.273  -7.728   0.139
  339   1HB   PHE  49          1HB       PHE  49   3.234  -9.508   0.410
  340   2HB   PHE  49          2HB       PHE  49   4.892 -10.058   0.142
  341    HD1  PHE  49           HD1      PHE  49   6.283 -10.353   2.393
  342    HD2  PHE  49           HD2      PHE  49   2.049 -10.449   2.131
  343    HE1  PHE  49           HE1      PHE  49   6.180 -11.655   4.536
  344    HE2  PHE  49           HE2      PHE  49   1.945 -11.751   4.274
  345    HZ   PHE  49           HZ       PHE  49   4.012 -12.338   5.452
  346    H    LYS  50           H        LYS  50   2.576  -7.859  -0.413
  347    HA   LYS  50           HA       LYS  50   1.431  -5.911   1.465
  348   1HB   LYS  50          1HB       LYS  50   0.268  -5.393  -0.991
  349   2HB   LYS  50          2HB       LYS  50   1.523  -4.428  -0.196
  350   1HG   LYS  50          1HG       LYS  50   2.377  -6.841  -1.767
  351   2HG   LYS  50          2HG       LYS  50   1.834  -5.424  -2.681
  352   1HD   LYS  50          1HD       LYS  50   4.101  -5.593  -0.658
  353   2HD   LYS  50          2HD       LYS  50   4.236  -5.243  -2.391
  354   1HE   LYS  50          1HE       LYS  50   3.234  -3.490  -0.144
  355   2HE   LYS  50          2HE       LYS  50   4.403  -3.101  -1.414
  356   1HZ   LYS  50          1HZ       LYS  50   2.604  -2.081  -2.238
  357   2HZ   LYS  50          2HZ       LYS  50   2.264  -3.555  -2.852
  358   3HZ   LYS  50          3HZ       LYS  50   1.524  -3.049  -1.487
  359    HA   PRO  51           HA       PRO  51  -1.280  -9.519   1.106
  360   1HB   PRO  51          1HB       PRO  51  -1.493 -10.076   3.771
  361   2HB   PRO  51          2HB       PRO  51  -0.334 -10.874   2.709
  362   1HG   PRO  51          1HG       PRO  51   0.079  -8.737   4.702
  363   2HG   PRO  51          2HG       PRO  51   1.294  -9.861   3.990
  364   1HD   PRO  51          1HD       PRO  51   0.865  -7.093   3.394
  365   2HD   PRO  51          2HD       PRO  51   1.963  -8.194   2.554
  366    H    LEU  52           H        LEU  52  -2.147  -8.535   4.266
  367    HA   LEU  52           HA       LEU  52  -4.595  -7.446   3.131
  368   1HB   LEU  52          1HB       LEU  52  -5.622  -7.936   5.109
  369   2HB   LEU  52          2HB       LEU  52  -4.457  -9.261   4.942
  370    HG   LEU  52           HG       LEU  52  -3.183  -7.196   6.418
  371   1HD1  LEU  52          1HD1      LEU  52  -6.077  -7.399   6.975
  372   2HD1  LEU  52          2HD1      LEU  52  -5.012  -7.510   8.398
  373   3HD1  LEU  52          3HD1      LEU  52  -4.920  -6.092   7.327
  374   1HD2  LEU  52          1HD2      LEU  52  -3.663 -10.003   6.545
  375   2HD2  LEU  52          2HD2      LEU  52  -2.437  -9.035   7.401
  376   3HD2  LEU  52          3HD2      LEU  52  -4.035  -9.300   8.138
  377    H    GLN  53           H        GLN  53  -2.124  -5.949   2.800
  378    HA   GLN  53           HA       GLN  53  -1.719  -4.068   4.739
  379   1HB   GLN  53          1HB       GLN  53  -1.489  -3.810   1.718
  380   2HB   GLN  53          2HB       GLN  53  -0.785  -2.664   2.870
  381   1HG   GLN  53          1HG       GLN  53  -0.140  -5.633   2.625
  382   2HG   GLN  53          2HG       GLN  53   0.911  -4.297   2.132
  383   1HE2  GLN  53          1HE2      GLN  53  -0.263  -6.269   4.683
  384   2HE2  GLN  53          2HE2      GLN  53   0.670  -5.614   5.988
  385    H    GLU  54           H        GLU  54  -4.418  -4.489   2.548
  386    HA   GLU  54           HA       GLU  54  -5.358  -2.062   2.063
  387   1HB   GLU  54          1HB       GLU  54  -7.354  -3.090   1.652
  388   2HB   GLU  54          2HB       GLU  54  -6.395  -4.559   1.898
  389   1HG   GLU  54          1HG       GLU  54  -8.276  -4.889   3.277
  390   2HG   GLU  54          2HG       GLU  54  -7.055  -4.300   4.415
  391    H    ALA  55           H        ALA  55  -4.966  -3.535   5.241
  392    HA   ALA  55           HA       ALA  55  -6.732  -2.362   6.852
  393   1HB   ALA  55          1HB       ALA  55  -4.726  -2.117   8.472
  394   2HB   ALA  55          2HB       ALA  55  -5.061  -3.734   7.808
  395   3HB   ALA  55          3HB       ALA  55  -3.740  -2.750   7.131
  396    H    GLU  56           H        GLU  56  -3.549  -0.720   6.226
  397    HA   GLU  56           HA       GLU  56  -5.060   1.765   6.098
  398   1HB   GLU  56          1HB       GLU  56  -3.286   2.888   7.408
  399   2HB   GLU  56          2HB       GLU  56  -4.068   1.605   8.347
  400   1HG   GLU  56          1HG       GLU  56  -1.828   0.525   6.847
  401   2HG   GLU  56          2HG       GLU  56  -1.290   1.921   7.793
  402    H    CYS  57           H        CYS  57  -3.948  -0.066   4.010
  403    HA   CYS  57           HA       CYS  57  -1.803   1.627   2.970
  404   1HB   CYS  57          1HB       CYS  57  -1.576  -0.932   3.280
  405   2HB   CYS  57          2HB       CYS  57  -2.576  -1.043   1.828
  406    H    THR  58           H        THR  58  -4.737  -0.266   1.915
  407    HA   THR  58           HA       THR  58  -5.013   1.260  -0.480
  408    HB   THR  58           HB       THR  58  -5.779  -1.223   0.313
  409    HG1  THR  58           HG1      THR  58  -7.318   0.608  -1.388
  410   1HG2  THR  58          1HG2      THR  58  -8.253   0.564   0.603
  411   2HG2  THR  58          2HG2      THR  58  -8.278  -1.213   0.491
  412   3HG2  THR  58          3HG2      THR  58  -7.532  -0.421   1.900
  413    H    PHE  59           H        PHE  59  -6.756   1.195   2.691
  414    HA   PHE  59           HA       PHE  59  -8.766   2.843   2.338
  415   1HB   PHE  59          1HB       PHE  59  -8.550   3.159   4.651
  416   2HB   PHE  59          2HB       PHE  59  -7.296   1.929   4.462
  417    HD1  PHE  59           HD1      PHE  59  -8.007   5.021   5.860
  418    HD2  PHE  59           HD2      PHE  59  -4.922   2.995   3.767
  419    HE1  PHE  59           HE1      PHE  59  -6.318   6.624   6.798
  420    HE2  PHE  59           HE2      PHE  59  -3.233   4.598   4.704
  421    HZ   PHE  59           HZ       PHE  59  -3.951   6.393   6.209
  422   1H    GLU   1           H1       GLU   1 -21.015  -3.395  -0.672
  423    HA   GLU   1           HA       GLU   1 -20.427  -1.267   1.231
  424   1HB   GLU   1          1HB       GLU   1 -18.645  -3.471   0.197
  425   2HB   GLU   1          2HB       GLU   1 -17.934  -1.924   0.687
  426   1HG   GLU   1          1HG       GLU   1 -17.867  -3.363   2.607
  427   2HG   GLU   1          2HG       GLU   1 -19.166  -2.200   2.912
  428    H    GLU   2           H        GLU   2 -20.272   0.696   0.238
  429    HA   GLU   2           HA       GLU   2 -20.055   0.688  -2.633
  430   1HB   GLU   2          1HB       GLU   2 -20.728   2.807  -0.572
  431   2HB   GLU   2          2HB       GLU   2 -20.491   3.212  -2.281
  432   1HG   GLU   2          1HG       GLU   2 -22.280   1.605  -2.896
  433   2HG   GLU   2          2HG       GLU   2 -22.514   1.198  -1.190
  434    H    TYR   3           H        TYR   3 -17.754  -0.078  -2.561
  435    HA   TYR   3           HA       TYR   3 -15.847   1.862  -1.548
  436   1HB   TYR   3          1HB       TYR   3 -16.034  -0.980  -2.501
  437   2HB   TYR   3          2HB       TYR   3 -14.516  -0.185  -2.929
  438    HD1  TYR   3           HD1      TYR   3 -12.947  -1.251  -1.541
  439    HD2  TYR   3           HD2      TYR   3 -16.572   0.251   0.162
  440    HE1  TYR   3           HE1      TYR   3 -12.060  -1.736   0.792
  441    HE2  TYR   3           HE2      TYR   3 -15.674  -0.239   2.490
  442    HH   TYR   3           HH       TYR   3 -13.387  -0.436   3.530
  443    H    VAL   4           H        VAL   4 -16.524   3.599  -3.080
  444    HA   VAL   4           HA       VAL   4 -15.366   3.112  -5.737
  445    HB   VAL   4           HB       VAL   4 -17.676   4.879  -4.911
  446   1HG1  VAL   4          1HG1      VAL   4 -15.883   5.016  -7.211
  447   2HG1  VAL   4          2HG1      VAL   4 -17.582   4.799  -7.694
  448   3HG1  VAL   4          3HG1      VAL   4 -17.120   6.168  -6.655
  449   1HG2  VAL   4          1HG2      VAL   4 -18.173   2.983  -7.057
  450   2HG2  VAL   4          2HG2      VAL   4 -17.617   2.159  -5.581
  451   3HG2  VAL   4          3HG2      VAL   4 -19.045   3.221  -5.524
  452    H    GLY   5           H        GLY   5 -15.983   5.529  -3.112
  453   1HA   GLY   5          1HA       GLY   5 -14.168   7.452  -4.170
  454   2HA   GLY   5          2HA       GLY   5 -14.894   7.432  -2.576
  455    H    LEU   6           H        LEU   6 -13.516   4.382  -3.073
  456    HA   LEU   6           HA       LEU   6 -10.909   5.248  -2.057
  457   1HB   LEU   6          1HB       LEU   6 -12.042   2.788  -0.899
  458   2HB   LEU   6          2HB       LEU   6 -11.010   4.031  -0.170
  459    HG   LEU   6           HG       LEU   6 -13.145   3.956   0.950
  460   1HD1  LEU   6          1HD1      LEU   6 -13.025   6.151   1.237
  461   2HD1  LEU   6          2HD1      LEU   6 -12.034   6.271  -0.236
  462   3HD1  LEU   6          3HD1      LEU   6 -13.804   6.434  -0.337
  463   1HD2  LEU   6          1HD2      LEU   6 -14.205   3.282  -1.506
  464   2HD2  LEU   6          2HD2      LEU   6 -15.126   3.655  -0.030
  465   3HD2  LEU   6          3HD2      LEU   6 -14.825   4.928  -1.236
  466    H    SER   7           H        SER   7 -12.429   4.040  -4.607
  467    HA   SER   7           HA       SER   7 -10.597   1.800  -4.918
  468   1HB   SER   7          1HB       SER   7 -13.273   1.806  -5.296
  469   2HB   SER   7          2HB       SER   7 -12.766   2.291  -6.925
  470    HG   SER   7           HG       SER   7 -12.789   0.070  -6.990
  471    H    ALA   8           H        ALA   8 -10.767   1.743  -7.832
  472    HA   ALA   8           HA       ALA   8  -8.694   3.527  -8.442
  473   1HB   ALA   8          1HB       ALA   8 -10.565   1.827 -10.131
  474   2HB   ALA   8          2HB       ALA   8  -9.196   2.742 -10.807
  475   3HB   ALA   8          3HB       ALA   8  -8.903   1.445  -9.623
  476    H    ASN   9           H        ASN   9  -9.460   5.633  -7.761
  477    HA   ASN   9           HA       ASN   9 -10.347   7.198  -9.768
  478   1HB   ASN   9          1HB       ASN   9 -12.532   5.704  -8.906
  479   2HB   ASN   9          2HB       ASN   9 -12.719   7.196  -7.973
  480   1HD2  ASN   9          1HD2      ASN   9 -12.294   9.233  -9.301
  481   2HD2  ASN   9          2HD2      ASN   9 -13.051   9.326 -10.856
  482    H    GLN  10           H        GLN  10 -10.338   6.378  -6.296
  483    HA   GLN  10           HA       GLN  10 -10.709   8.935  -5.293
  484   1HB   GLN  10          1HB       GLN  10 -10.915   6.863  -3.962
  485   2HB   GLN  10          2HB       GLN  10  -9.167   6.596  -4.084
  486   1HG   GLN  10          1HG       GLN  10  -8.770   8.745  -2.907
  487   2HG   GLN  10          2HG       GLN  10 -10.516   9.013  -2.789
  488   1HE2  GLN  10          1HE2      GLN  10  -8.435   6.154  -2.374
  489   2HE2  GLN  10          2HE2      GLN  10  -8.927   5.755  -0.761
  490    H    CYS  11           H        CYS  11  -7.885   7.259  -6.643
  491    HA   CYS  11           HA       CYS  11  -5.919   8.912  -5.551
  492   1HB   CYS  11          1HB       CYS  11  -5.339   6.800  -6.484
  493   2HB   CYS  11          2HB       CYS  11  -5.984   7.243  -8.067
  494    H    ALA  12           H        ALA  12  -8.519   9.608  -7.611
  495    HA   ALA  12           HA       ALA  12  -7.049  11.768  -8.950
  496   1HB   ALA  12          1HB       ALA  12  -8.957   9.841  -9.846
  497   2HB   ALA  12          2HB       ALA  12  -9.742  11.437  -9.905
  498   3HB   ALA  12          3HB       ALA  12  -8.212  11.166 -10.773
  499    H    VAL  13           H        VAL  13  -8.372  11.349  -6.071
  500    HA   VAL  13           HA       VAL  13 -10.548  12.860  -5.683
  501    HB   VAL  13           HB       VAL  13  -8.333  11.941  -4.173
  502   1HG1  VAL  13          1HG1      VAL  13  -7.415  14.126  -3.961
  503   2HG1  VAL  13          2HG1      VAL  13  -9.016  14.849  -3.670
  504   3HG1  VAL  13          3HG1      VAL  13  -8.279  13.796  -2.439
  505   1HG2  VAL  13          1HG2      VAL  13 -10.764  13.144  -2.889
  506   2HG2  VAL  13          2HG2      VAL  13 -10.955  11.738  -3.963
  507   3HG2  VAL  13          3HG2      VAL  13  -9.914  11.623  -2.524
  508    HA   PRO  14           HA       PRO  14  -9.687  16.943  -6.801
  509   1HB   PRO  14          1HB       PRO  14 -11.151  18.400  -5.014
  510   2HB   PRO  14          2HB       PRO  14 -11.858  17.611  -6.421
  511   1HG   PRO  14          1HG       PRO  14 -11.918  16.827  -3.576
  512   2HG   PRO  14          2HG       PRO  14 -13.015  16.311  -4.908
  513   1HD   PRO  14          1HD       PRO  14 -10.897  14.833  -3.671
  514   2HD   PRO  14          2HD       PRO  14 -11.842  14.341  -5.082
  515    H    ALA  15           H        ALA  15  -7.773  15.652  -5.001
  516    HA   ALA  15           HA       ALA  15  -6.056  16.193  -3.704
  517   1HB   ALA  15          1HB       ALA  15  -5.426  18.828  -4.294
  518   2HB   ALA  15          2HB       ALA  15  -4.909  17.406  -5.230
  519   3HB   ALA  15          3HB       ALA  15  -6.356  18.317  -5.722
  520    H    LYS  16           H        LYS  16  -7.826  16.021  -1.938
  521    HA   LYS  16           HA       LYS  16  -7.325  17.758   0.063
  522   1HB   LYS  16          1HB       LYS  16  -9.571  19.076   0.036
  523   2HB   LYS  16          2HB       LYS  16  -8.177  19.682  -0.877
  524   1HG   LYS  16          1HG       LYS  16  -9.338  19.541  -2.802
  525   2HG   LYS  16          2HG       LYS  16  -9.690  17.826  -2.522
  526   1HD   LYS  16          1HD       LYS  16 -11.823  18.812  -2.620
  527   2HD   LYS  16          2HD       LYS  16 -11.526  18.712  -0.876
  528   1HE   LYS  16          1HE       LYS  16 -10.785  21.075  -0.870
  529   2HE   LYS  16          2HE       LYS  16 -11.042  21.177  -2.618
  530   1HZ   LYS  16          1HZ       LYS  16 -13.213  20.354  -0.854
  531   2HZ   LYS  16          2HZ       LYS  16 -12.866  21.939  -1.031
  532   3HZ   LYS  16          3HZ       LYS  16 -13.298  21.048  -2.330
  533    H    ASP  17           H        ASP  17  -7.773  14.993  -0.446
  534    HA   ASP  17           HA       ASP  17  -9.698  14.543   1.600
  535   1HB   ASP  17          1HB       ASP  17 -10.999  14.582  -0.607
  536   2HB   ASP  17          2HB       ASP  17 -10.088  13.139  -1.079
  537    H    ARG  18           H        ARG  18  -6.747  14.157   0.454
  538    HA   ARG  18           HA       ARG  18  -6.577  11.294   0.528
  539   1HB   ARG  18          1HB       ARG  18  -4.353  13.371   0.287
  540   2HB   ARG  18          2HB       ARG  18  -4.203  11.641  -0.066
  541   1HG   ARG  18          1HG       ARG  18  -5.202  11.851  -2.106
  542   2HG   ARG  18          2HG       ARG  18  -6.389  13.034  -1.530
  543   1HD   ARG  18          1HD       ARG  18  -4.768  14.830  -1.687
  544   2HD   ARG  18          2HD       ARG  18  -3.446  13.697  -1.998
  545    HE   ARG  18           HE       ARG  18  -5.647  13.558  -3.939
  546   1HH1  ARG  18          1HH1      ARG  18  -2.579  15.082  -3.133
  547   2HH1  ARG  18          2HH1      ARG  18  -2.230  15.537  -4.768
  548   1HH2  ARG  18          1HH2      ARG  18  -5.186  14.159  -6.096
  549   2HH2  ARG  18          2HH2      ARG  18  -3.723  15.009  -6.464
  550    H    VAL  19           H        VAL  19  -4.277  10.642   1.814
  551    HA   VAL  19           HA       VAL  19  -4.686  11.699   4.524
  552    HB   VAL  19           HB       VAL  19  -3.650   8.986   3.683
  553   1HG1  VAL  19          1HG1      VAL  19  -2.851   9.080   5.799
  554   2HG1  VAL  19          2HG1      VAL  19  -3.959  10.388   6.276
  555   3HG1  VAL  19          3HG1      VAL  19  -4.535   8.704   6.235
  556   1HG2  VAL  19          1HG2      VAL  19  -5.761   8.063   3.964
  557   2HG2  VAL  19          2HG2      VAL  19  -6.349   9.433   4.938
  558   3HG2  VAL  19          3HG2      VAL  19  -6.142   9.614   3.179
  559    H    ASP  20           H        ASP  20  -2.942  12.645   2.164
  560    HA   ASP  20           HA       ASP  20  -0.814  13.039   1.699
  561   1HB   ASP  20          1HB       ASP  20  -1.057  14.961   2.957
  562   2HB   ASP  20          2HB       ASP  20  -1.450  14.076   4.439
  563    H    CYS  21           H        CYS  21   0.166  10.914   1.437
  564    HA   CYS  21           HA       CYS  21   0.854   9.201   3.452
  565   1HB   CYS  21          1HB       CYS  21   1.050   9.180   0.764
  566   2HB   CYS  21          2HB       CYS  21   2.754   9.374   1.187
  567    H    GLY  22           H        GLY  22   2.448  12.160   2.227
  568   1HA   GLY  22          1HA       GLY  22   4.199  13.355   2.971
  569   2HA   GLY  22          2HA       GLY  22   3.849  12.697   4.557
  570    H    TYR  23           H        TYR  23   5.135  11.356   1.422
  571    HA   TYR  23           HA       TYR  23   7.037   9.779   2.943
  572   1HB   TYR  23          1HB       TYR  23   5.493   9.506   0.621
  573   2HB   TYR  23          2HB       TYR  23   7.068   9.927  -0.058
  574    HD1  TYR  23           HD1      TYR  23   7.732   7.900  -1.064
  575    HD2  TYR  23           HD2      TYR  23   6.369   7.890   2.992
  576    HE1  TYR  23           HE1      TYR  23   8.464   5.478  -0.817
  577    HE2  TYR  23           HE2      TYR  23   7.106   5.467   3.225
  578    HH   TYR  23           HH       TYR  23   7.729   3.664   2.110
  579    HA   PRO  24           HA       PRO  24  10.308  12.525   2.202
  580   1HB   PRO  24          1HB       PRO  24  12.414  10.891   2.800
  581   2HB   PRO  24          2HB       PRO  24  11.470  11.733   4.026
  582   1HG   PRO  24          1HG       PRO  24  11.417   8.899   3.208
  583   2HG   PRO  24          2HG       PRO  24  10.828   9.636   4.740
  584   1HD   PRO  24          1HD       PRO  24   9.294   8.705   2.509
  585   2HD   PRO  24          2HD       PRO  24   8.679   9.568   3.925
  586    H    HIS  25           H        HIS  25   9.694   9.808   0.354
  587    HA   HIS  25           HA       HIS  25  11.603  10.820  -1.625
  588   1HB   HIS  25          1HB       HIS  25  10.883   7.967  -0.947
  589   2HB   HIS  25          2HB       HIS  25  11.682   8.421  -2.457
  590    HD1  HIS  25           HD1      HIS  25  14.133   8.025  -2.317
  591    HD2  HIS  25           HD2      HIS  25  12.533   9.231   1.368
  592    HE1  HIS  25           HE1      HIS  25  16.088   8.100  -0.678
  593    HE2  HIS  25           HE2      HIS  25  15.052   8.901   1.553
  594    H    VAL  26           H        VAL  26   8.807  11.628  -1.115
  595    HA   VAL  26           HA       VAL  26   6.944  10.374  -2.667
  596    HB   VAL  26           HB       VAL  26   6.193  12.086  -1.316
  597   1HG1  VAL  26          1HG1      VAL  26   7.676  13.610  -0.626
  598   2HG1  VAL  26          2HG1      VAL  26   8.679  13.392  -2.080
  599   3HG1  VAL  26          3HG1      VAL  26   7.305  14.525  -2.107
  600   1HG2  VAL  26          1HG2      VAL  26   6.207  13.702  -3.845
  601   2HG2  VAL  26          2HG2      VAL  26   5.391  12.120  -3.824
  602   3HG2  VAL  26          3HG2      VAL  26   4.884  13.399  -2.693
  603    H    THR  27           H        THR  27   6.955   9.767  -4.763
  604    HA   THR  27           HA       THR  27   7.588  11.610  -6.818
  605    HB   THR  27           HB       THR  27   9.804  10.202  -5.662
  606    HG1  THR  27           HG1      THR  27  10.096  12.187  -6.714
  607   1HG2  THR  27          1HG2      THR  27   8.856   9.137  -8.352
  608   2HG2  THR  27          2HG2      THR  27  10.595   9.279  -8.001
  609   3HG2  THR  27          3HG2      THR  27   9.566   8.234  -6.993
  610    HA   PRO  28           HA       PRO  28   5.105   8.814  -8.919
  611   1HB   PRO  28          1HB       PRO  28   5.650   9.429 -11.524
  612   2HB   PRO  28          2HB       PRO  28   4.561  10.380 -10.516
  613   1HG   PRO  28          1HG       PRO  28   7.335  10.930 -11.353
  614   2HG   PRO  28          2HG       PRO  28   6.094  12.087 -10.753
  615   1HD   PRO  28          1HD       PRO  28   8.363  11.028  -9.361
  616   2HD   PRO  28          2HD       PRO  28   7.082  12.039  -8.677
  617    H    LYS  29           H        LYS  29   7.148   7.459  -7.836
  618    HA   LYS  29           HA       LYS  29   7.296   5.265  -9.566
  619   1HB   LYS  29          1HB       LYS  29   8.838   6.689 -10.826
  620   2HB   LYS  29          2HB       LYS  29   9.860   6.877  -9.392
  621   1HG   LYS  29          1HG       LYS  29  10.857   4.890  -9.772
  622   2HG   LYS  29          2HG       LYS  29   9.300   4.056  -9.902
  623   1HD   LYS  29          1HD       LYS  29   9.425   5.486 -12.274
  624   2HD   LYS  29          2HD       LYS  29  11.120   5.034 -12.024
  625   1HE   LYS  29          1HE       LYS  29  10.680   2.908 -12.640
  626   2HE   LYS  29          2HE       LYS  29   9.395   2.769 -11.430
  627   1HZ   LYS  29          1HZ       LYS  29   8.238   2.556 -13.342
  628   2HZ   LYS  29          2HZ       LYS  29   8.139   4.180 -13.190
  629   3HZ   LYS  29          3HZ       LYS  29   9.220   3.521 -14.222
  630    H    GLU  30           H        GLU  30   8.133   7.123  -6.719
  631    HA   GLU  30           HA       GLU  30   9.143   4.720  -5.445
  632   1HB   GLU  30          1HB       GLU  30   9.593   7.588  -5.142
  633   2HB   GLU  30          2HB       GLU  30   9.220   6.833  -3.583
  634   1HG   GLU  30          1HG       GLU  30  11.040   5.159  -5.112
  635   2HG   GLU  30          2HG       GLU  30  11.696   6.798  -4.988
  636    H    CYS  31           H        CYS  31   6.599   7.270  -5.157
  637    HA   CYS  31           HA       CYS  31   5.438   6.265  -2.837
  638   1HB   CYS  31          1HB       CYS  31   4.537   8.058  -5.051
  639   2HB   CYS  31          2HB       CYS  31   3.351   7.478  -3.877
  640    H    ASN  32           H        ASN  32   4.532   5.889  -6.347
  641    HA   ASN  32           HA       ASN  32   2.503   4.076  -5.865
  642   1HB   ASN  32          1HB       ASN  32   4.155   4.938  -8.214
  643   2HB   ASN  32          2HB       ASN  32   3.305   3.398  -8.395
  644   1HD2  ASN  32          1HD2      ASN  32   2.590   6.506  -6.803
  645   2HD2  ASN  32          2HD2      ASN  32   1.064   6.799  -7.569
  646    H    ASN  33           H        ASN  33   5.841   3.789  -5.351
  647    HA   ASN  33           HA       ASN  33   5.897   0.980  -6.060
  648   1HB   ASN  33          1HB       ASN  33   7.847   2.159  -6.836
  649   2HB   ASN  33          2HB       ASN  33   8.048   3.007  -5.294
  650   1HD2  ASN  33          1HD2      ASN  33   9.895   2.355  -4.480
  651   2HD2  ASN  33          2HD2      ASN  33  10.417   0.718  -4.263
  652    H    ARG  34           H        ARG  34   5.878   3.322  -3.384
  653    HA   ARG  34           HA       ARG  34   6.596   1.320  -1.468
  654   1HB   ARG  34          1HB       ARG  34   6.722   3.081   0.096
  655   2HB   ARG  34          2HB       ARG  34   7.173   3.887  -1.417
  656   1HG   ARG  34          1HG       ARG  34   5.597   5.374  -0.580
  657   2HG   ARG  34          2HG       ARG  34   4.554   4.344  -1.578
  658   1HD   ARG  34          1HD       ARG  34   3.321   4.006   0.288
  659   2HD   ARG  34          2HD       ARG  34   4.656   3.021   0.903
  660    HE   ARG  34           HE       ARG  34   5.106   5.853   1.363
  661   1HH1  ARG  34          1HH1      ARG  34   3.360   3.052   2.584
  662   2HH1  ARG  34          2HH1      ARG  34   3.253   3.663   4.201
  663   1HH2  ARG  34          1HH2      ARG  34   4.964   6.661   3.496
  664   2HH2  ARG  34          2HH2      ARG  34   4.171   5.730   4.723
  665    H    GLY  35           H        GLY  35   3.725   2.968  -2.777
  666   1HA   GLY  35          1HA       GLY  35   1.712   1.497  -2.546
  667   2HA   GLY  35          2HA       GLY  35   2.027   1.536  -0.822
  668    H    CYS  36           H        CYS  36   2.766   4.403  -2.764
  669    HA   CYS  36           HA       CYS  36   0.354   5.655  -1.666
  670   1HB   CYS  36          1HB       CYS  36   3.101   6.857  -2.022
  671   2HB   CYS  36          2HB       CYS  36   1.656   7.763  -1.566
  672    H    CYS  37           H        CYS  37  -0.231   7.708  -3.035
  673    HA   CYS  37           HA       CYS  37   0.241   7.038  -5.848
  674   1HB   CYS  37          1HB       CYS  37  -2.114   6.852  -4.806
  675   2HB   CYS  37          2HB       CYS  37  -2.122   8.617  -4.869
  676    H    PHE  38           H        PHE  38   1.259   8.612  -7.074
  677    HA   PHE  38           HA       PHE  38   1.902  11.090  -5.701
  678   1HB   PHE  38          1HB       PHE  38   3.561   9.513  -6.907
  679   2HB   PHE  38          2HB       PHE  38   2.773   9.959  -8.425
  680    HD1  PHE  38           HD1      PHE  38   3.305  12.001  -9.507
  681    HD2  PHE  38           HD2      PHE  38   4.780  11.242  -5.601
  682    HE1  PHE  38           HE1      PHE  38   4.838  13.978  -9.701
  683    HE2  PHE  38           HE2      PHE  38   6.312  13.221  -5.795
  684    HZ   PHE  38           HZ       PHE  38   6.323  14.565  -7.843
  685    H    ASP  39           H        ASP  39   0.775  12.934  -6.078
  686    HA   ASP  39           HA       ASP  39  -1.119  12.938  -8.202
  687   1HB   ASP  39          1HB       ASP  39  -2.042  14.112  -6.468
  688   2HB   ASP  39          2HB       ASP  39  -0.468  14.592  -5.817
  689    H    SER  40           H        SER  40   1.005  15.684  -7.168
  690    HA   SER  40           HA       SER  40   2.605  16.762  -8.242
  691   1HB   SER  40          1HB       SER  40   2.871  14.505  -9.599
  692   2HB   SER  40          2HB       SER  40   2.088  15.423 -10.898
  693    HG   SER  40           HG       SER  40   3.919  16.481 -11.227
  694    H    ARG  41           H        ARG  41  -0.632  16.188  -9.452
  695    HA   ARG  41           HA       ARG  41  -0.724  18.208 -11.350
  696   1HB   ARG  41          1HB       ARG  41  -3.078  17.350  -9.626
  697   2HB   ARG  41          2HB       ARG  41  -3.109  17.872 -11.321
  698   1HG   ARG  41          1HG       ARG  41  -1.430  15.733 -11.502
  699   2HG   ARG  41          2HG       ARG  41  -2.433  15.208 -10.139
  700   1HD   ARG  41          1HD       ARG  41  -3.600  14.384 -12.010
  701   2HD   ARG  41          2HD       ARG  41  -4.450  15.901 -11.676
  702    HE   ARG  41           HE       ARG  41  -3.567  16.807 -13.664
  703   1HH1  ARG  41          1HH1      ARG  41  -1.965  13.764 -12.916
  704   2HH1  ARG  41          2HH1      ARG  41  -1.168  13.659 -14.450
  705   1HH2  ARG  41          1HH2      ARG  41  -2.515  16.669 -15.688
  706   2HH2  ARG  41          2HH2      ARG  41  -1.483  15.323 -16.037
  707    H    ILE  42           H        ILE  42  -1.401  18.109  -7.805
  708    HA   ILE  42           HA       ILE  42  -1.529  21.044  -7.871
  709    HB   ILE  42           HB       ILE  42  -2.914  19.377  -5.797
  710   1HG1  ILE  42          1HG1      ILE  42  -3.835  19.978  -8.590
  711   2HG1  ILE  42          2HG1      ILE  42  -3.939  18.462  -7.677
  712   1HG2  ILE  42          1HG2      ILE  42  -4.172  21.327  -5.367
  713   2HG2  ILE  42          2HG2      ILE  42  -2.484  21.864  -5.532
  714   3HG2  ILE  42          3HG2      ILE  42  -3.629  22.108  -6.873
  715   1HD1  ILE  42          1HD1      ILE  42  -5.696  20.895  -7.587
  716   2HD1  ILE  42          2HD1      ILE  42  -6.134  19.174  -7.472
  717   3HD1  ILE  42          3HD1      ILE  42  -5.445  20.013  -6.061
  718    HA   PRO  43           HA       PRO  43   2.044  20.288  -5.419
  719   1HB   PRO  43          1HB       PRO  43   3.122  22.783  -5.690
  720   2HB   PRO  43          2HB       PRO  43   3.432  21.471  -6.824
  721   1HG   PRO  43          1HG       PRO  43   1.667  23.821  -7.078
  722   2HG   PRO  43          2HG       PRO  43   2.341  22.777  -8.381
  723   1HD   PRO  43          1HD       PRO  43  -0.324  22.826  -7.336
  724   2HD   PRO  43          2HD       PRO  43   0.331  21.670  -8.506
  725    H    GLY  44           H        GLY  44  -0.672  22.041  -4.870
  726   1HA   GLY  44          1HA       GLY  44   0.286  23.225  -2.378
  727   2HA   GLY  44          2HA       GLY  44  -1.286  23.431  -3.124
  728    H    VAL  45           H        VAL  45  -0.825  20.186  -3.463
  729    HA   VAL  45           HA       VAL  45  -1.891  19.609  -0.785
  730    HB   VAL  45           HB       VAL  45  -3.556  18.302  -1.656
  731   1HG1  VAL  45          1HG1      VAL  45  -4.787  19.859  -2.696
  732   2HG1  VAL  45          2HG1      VAL  45  -3.320  20.869  -2.696
  733   3HG1  VAL  45          3HG1      VAL  45  -3.715  19.872  -4.116
  734   1HG2  VAL  45          1HG2      VAL  45  -2.202  18.169  -4.366
  735   2HG2  VAL  45          2HG2      VAL  45  -1.979  16.953  -3.085
  736   3HG2  VAL  45          3HG2      VAL  45  -3.592  17.218  -3.791
  737    HA   PRO  46           HA       PRO  46   0.846  16.241  -0.659
  738   1HB   PRO  46          1HB       PRO  46  -0.591  13.976  -0.148
  739   2HB   PRO  46          2HB       PRO  46  -0.201  15.168   1.087
  740   1HG   PRO  46          1HG       PRO  46  -2.735  14.678  -0.340
  741   2HG   PRO  46          2HG       PRO  46  -2.474  15.537   1.221
  742   1HD   PRO  46          1HD       PRO  46  -3.035  16.655  -1.355
  743   2HD   PRO  46          2HD       PRO  46  -2.627  17.546   0.116
  744    H    TRP  47           H        TRP  47   2.173  15.621  -2.233
  745    HA   TRP  47           HA       TRP  47   0.881  14.550  -4.605
  746   1HB   TRP  47          1HB       TRP  47   3.790  14.749  -4.616
  747   2HB   TRP  47          2HB       TRP  47   2.596  15.383  -5.750
  748    HD1  TRP  47           HD1      TRP  47   1.418  17.833  -4.899
  749    HE1  TRP  47           HE1      TRP  47   2.459  19.912  -3.652
  750    HE3  TRP  47           HE3      TRP  47   5.451  15.360  -3.034
  751    HZ2  TRP  47           HZ2      TRP  47   4.799  20.281  -2.060
  752    HZ3  TRP  47           HZ3      TRP  47   7.065  16.653  -1.643
  753    HH2  TRP  47           HH2      TRP  47   6.790  19.031  -1.147
  754    H    CYS  48           H        CYS  48   0.958  13.077  -1.977
  755    HA   CYS  48           HA       CYS  48   1.761  10.588  -3.026
  756   1HB   CYS  48          1HB       CYS  48   3.979  11.508  -2.417
  757   2HB   CYS  48          2HB       CYS  48   3.447  11.618  -0.737
  758    H    PHE  49           H        PHE  49  -0.177   9.661  -2.387
  759    HA   PHE  49           HA       PHE  49  -0.717   9.684   0.478
  760   1HB   PHE  49          1HB       PHE  49  -3.241   9.788  -0.606
  761   2HB   PHE  49          2HB       PHE  49  -2.376  11.242  -0.098
  762    HD1  PHE  49           HD1      PHE  49  -0.712  12.152  -2.021
  763    HD2  PHE  49           HD2      PHE  49  -4.208   9.839  -2.678
  764    HE1  PHE  49           HE1      PHE  49  -0.861  13.043  -4.363
  765    HE2  PHE  49           HE2      PHE  49  -4.358  10.730  -5.019
  766    HZ   PHE  49           HZ       PHE  49  -2.682  12.321  -5.834
  767    H    LYS  50           H        LYS  50  -3.111   8.228   0.446
  768    HA   LYS  50           HA       LYS  50  -2.365   5.809  -1.040
  769   1HB   LYS  50          1HB       LYS  50  -3.301   4.580   1.004
  770   2HB   LYS  50          2HB       LYS  50  -1.674   5.271   1.123
  771   1HG   LYS  50          1HG       LYS  50  -3.796   7.160   1.897
  772   2HG   LYS  50          2HG       LYS  50  -3.786   5.702   2.904
  773   1HD   LYS  50          1HD       LYS  50  -1.448   7.582   2.368
  774   2HD   LYS  50          2HD       LYS  50  -2.327   7.413   3.897
  775   1HE   LYS  50          1HE       LYS  50  -1.567   4.811   3.401
  776   2HE   LYS  50          2HE       LYS  50  -0.200   5.701   2.712
  777   1HZ   LYS  50          1HZ       LYS  50  -1.231   6.380   5.355
  778   2HZ   LYS  50          2HZ       LYS  50  -0.201   5.125   5.177
  779   3HZ   LYS  50          3HZ       LYS  50   0.263   6.630   4.743
  780    HA   PRO  51           HA       PRO  51  -6.637   7.064  -1.902
  781   1HB   PRO  51          1HB       PRO  51  -6.431   7.242  -4.620
  782   2HB   PRO  51          2HB       PRO  51  -6.274   8.633  -3.549
  783   1HG   PRO  51          1HG       PRO  51  -4.201   7.096  -4.975
  784   2HG   PRO  51          2HG       PRO  51  -4.096   8.760  -4.295
  785   1HD   PRO  51          1HD       PRO  51  -2.980   6.337  -3.252
  786   2HD   PRO  51          2HD       PRO  51  -2.987   7.921  -2.464
  787    H    LEU  52           H        LEU  52  -5.839   5.570  -4.891
  788    HA   LEU  52           HA       LEU  52  -7.389   3.261  -3.996
  789   1HB   LEU  52          1HB       LEU  52  -8.102   2.994  -6.117
  790   2HB   LEU  52          2HB       LEU  52  -7.879   4.753  -6.083
  791    HG   LEU  52           HG       LEU  52  -5.425   3.705  -6.955
  792   1HD1  LEU  52          1HD1      LEU  52  -7.639   1.934  -7.708
  793   2HD1  LEU  52          2HD1      LEU  52  -6.700   2.541  -9.094
  794   3HD1  LEU  52          3HD1      LEU  52  -5.879   1.675  -7.774
  795   1HD2  LEU  52          1HD2      LEU  52  -5.689   5.317  -8.469
  796   2HD2  LEU  52          2HD2      LEU  52  -7.171   4.575  -9.119
  797   3HD2  LEU  52          3HD2      LEU  52  -7.261   5.648  -7.702
  798    H    GLN  53           H        GLN  53  -4.748   3.532  -2.956
  799    HA   GLN  53           HA       GLN  53  -2.744   2.432  -4.369
  800   1HB   GLN  53          1HB       GLN  53  -3.465   1.988  -1.448
  801   2HB   GLN  53          2HB       GLN  53  -1.888   1.583  -2.147
  802   1HG   GLN  53          1HG       GLN  53  -3.176   4.345  -2.063
  803   2HG   GLN  53          2HG       GLN  53  -1.832   3.802  -1.047
  804   1HE2  GLN  53          1HE2      GLN  53  -0.538   2.255  -3.082
  805   2HE2  GLN  53          2HE2      GLN  53   0.197   3.344  -4.211
  806    H    GLU  54           H        GLU  54  -5.735   0.922  -3.423
  807    HA   GLU  54           HA       GLU  54  -5.247  -1.621  -2.975
  808   1HB   GLU  54          1HB       GLU  54  -7.326  -2.168  -4.124
  809   2HB   GLU  54          2HB       GLU  54  -7.502  -0.600  -3.315
  810   1HG   GLU  54          1HG       GLU  54  -8.070   0.321  -5.288
  811   2HG   GLU  54          2HG       GLU  54  -6.473  -0.084  -5.937
  812    H    ALA  55           H        ALA  55  -4.440   0.112  -5.942
  813    HA   ALA  55           HA       ALA  55  -4.312  -1.615  -7.917
  814   1HB   ALA  55          1HB       ALA  55  -1.655  -0.506  -7.651
  815   2HB   ALA  55          2HB       ALA  55  -2.975  -0.008  -8.737
  816   3HB   ALA  55          3HB       ALA  55  -2.857   0.685  -7.101
  817    H    GLU  56           H        GLU  56  -1.468  -1.450  -5.658
  818    HA   GLU  56           HA       GLU  56  -1.397  -4.354  -5.814
  819   1HB   GLU  56          1HB       GLU  56   0.581  -2.449  -6.809
  820   2HB   GLU  56          2HB       GLU  56   1.295  -3.556  -5.623
  821   1HG   GLU  56          1HG       GLU  56   1.528  -4.596  -7.774
  822   2HG   GLU  56          2HG       GLU  56   0.229  -5.470  -6.945
  823    H    CYS  57           H        CYS  57  -2.264  -2.135  -3.823
  824    HA   CYS  57           HA       CYS  57  -0.382  -2.702  -1.676
  825   1HB   CYS  57          1HB       CYS  57  -1.719  -0.401  -2.426
  826   2HB   CYS  57          2HB       CYS  57  -2.629  -0.963  -1.020
  827    H    THR  58           H        THR  58  -3.978  -2.201  -1.746
  828    HA   THR  58           HA       THR  58  -4.668  -3.755   0.342
  829    HB   THR  58           HB       THR  58  -6.077  -2.287  -1.297
  830    HG1  THR  58           HG1      THR  58  -7.113  -4.928  -0.580
  831   1HG2  THR  58          1HG2      THR  58  -5.758  -3.537  -3.394
  832   2HG2  THR  58          2HG2      THR  58  -6.261  -5.052  -2.604
  833   3HG2  THR  58          3HG2      THR  58  -7.445  -3.748  -2.866
  834    H    PHE  59           H        PHE  59  -3.886  -4.915  -2.969
  835    HA   PHE  59           HA       PHE  59  -4.702  -7.483  -2.809
  836   1HB   PHE  59          1HB       PHE  59  -2.443  -5.916  -4.016
  837   2HB   PHE  59          2HB       PHE  59  -2.186  -7.663  -3.996
  838    HD1  PHE  59           HD1      PHE  59  -5.220  -5.569  -4.608
  839    HD2  PHE  59           HD2      PHE  59  -2.526  -8.475  -6.127
  840    HE1  PHE  59           HE1      PHE  59  -6.618  -5.782  -6.681
  841    HE2  PHE  59           HE2      PHE  59  -3.925  -8.687  -8.200
  842    HZ   PHE  59           HZ       PHE  59  -5.954  -7.338  -8.452
  Start of MODEL    8
    1   1H    GLU   1           H1       GLU   1 -11.078 -11.834  -4.123
    2    HA   GLU   1           HA       GLU   1 -12.977 -11.104  -4.881
    3   1HB   GLU   1          1HB       GLU   1 -13.448 -13.683  -4.170
    4   2HB   GLU   1          2HB       GLU   1 -14.702 -12.879  -3.208
    5   1HG   GLU   1          1HG       GLU   1 -15.825 -13.229  -5.217
    6   2HG   GLU   1          2HG       GLU   1 -15.193 -11.597  -5.481
    7    H    GLU   2           H        GLU   2 -14.038 -12.034  -1.526
    8    HA   GLU   2           HA       GLU   2 -15.184  -9.404  -1.281
    9   1HB   GLU   2          1HB       GLU   2 -15.263 -11.745   0.661
   10   2HB   GLU   2          2HB       GLU   2 -16.282 -10.297   0.724
   11   1HG   GLU   2          1HG       GLU   2 -17.705 -11.804  -0.333
   12   2HG   GLU   2          2HG       GLU   2 -16.951 -11.037  -1.739
   13    H    TYR   3           H        TYR   3 -14.626 -10.317   1.845
   14    HA   TYR   3           HA       TYR   3 -12.346  -8.521   2.036
   15   1HB   TYR   3          1HB       TYR   3 -13.011  -9.040   4.567
   16   2HB   TYR   3          2HB       TYR   3 -14.115  -8.056   3.599
   17    HD1  TYR   3           HD1      TYR   3 -16.286  -8.914   2.931
   18    HD2  TYR   3           HD2      TYR   3 -13.549 -11.371   5.118
   19    HE1  TYR   3           HE1      TYR   3 -18.150 -10.575   3.413
   20    HE2  TYR   3           HE2      TYR   3 -15.422 -13.023   5.592
   21    HH   TYR   3           HH       TYR   3 -17.663 -13.615   4.321
   22    H    VAL   4           H        VAL   4 -11.155 -10.489   0.863
   23    HA   VAL   4           HA       VAL   4 -10.015 -12.105   3.034
   24    HB   VAL   4           HB       VAL   4 -10.622 -12.927   0.188
   25   1HG1  VAL   4          1HG1      VAL   4  -9.697 -14.972   2.108
   26   2HG1  VAL   4          2HG1      VAL   4  -9.287 -14.735   0.392
   27   3HG1  VAL   4          3HG1      VAL   4  -8.466 -13.774   1.643
   28   1HG2  VAL   4          1HG2      VAL   4 -11.680 -14.153   2.746
   29   2HG2  VAL   4          2HG2      VAL   4 -12.528 -12.852   1.877
   30   3HG2  VAL   4          3HG2      VAL   4 -12.240 -14.416   1.076
   31    H    GLY   5           H        GLY   5  -9.504 -10.856  -0.340
   32   1HA   GLY   5          1HA       GLY   5  -6.681 -11.056  -0.219
   33   2HA   GLY   5          2HA       GLY   5  -7.633 -10.156  -1.382
   34    H    LEU   6           H        LEU   6  -8.711  -9.142   1.635
   35    HA   LEU   6           HA       LEU   6  -6.582  -7.187   1.994
   36   1HB   LEU   6          1HB       LEU   6  -9.095  -5.861   2.229
   37   2HB   LEU   6          2HB       LEU   6  -7.696  -5.458   1.217
   38    HG   LEU   6           HG       LEU   6  -9.811  -5.679  -0.045
   39   1HD1  LEU   6          1HD1      LEU   6  -8.456  -7.935  -1.246
   40   2HD1  LEU   6          2HD1      LEU   6  -8.590  -6.252  -1.809
   41   3HD1  LEU   6          3HD1      LEU   6  -7.287  -6.714  -0.687
   42   1HD2  LEU   6          1HD2      LEU   6  -9.936  -8.586  -0.037
   43   2HD2  LEU   6          2HD2      LEU   6 -10.258  -7.896   1.572
   44   3HD2  LEU   6          3HD2      LEU   6 -11.228  -7.380   0.172
   45    H    SER   7           H        SER   7  -7.590  -9.657   3.383
   46    HA   SER   7           HA       SER   7  -8.676  -8.420   5.774
   47   1HB   SER   7          1HB       SER   7  -9.098 -10.805   6.481
   48   2HB   SER   7          2HB       SER   7  -9.972 -10.316   5.019
   49    HG   SER   7           HG       SER   7  -8.187 -12.358   5.369
   50    H    ALA   8           H        ALA   8  -7.788  -9.426   7.921
   51    HA   ALA   8           HA       ALA   8  -4.991  -9.003   7.950
   52   1HB   ALA   8          1HB       ALA   8  -6.702  -8.486   9.773
   53   2HB   ALA   8          2HB       ALA   8  -6.713 -10.228  10.132
   54   3HB   ALA   8          3HB       ALA   8  -5.211  -9.292  10.315
   55    H    ASN   9           H        ASN   9  -6.819 -11.615   6.877
   56    HA   ASN   9           HA       ASN   9  -5.025 -13.602   7.931
   57   1HB   ASN   9          1HB       ASN   9  -7.706 -13.630   7.206
   58   2HB   ASN   9          2HB       ASN   9  -6.951 -14.405   5.806
   59   1HD2  ASN   9          1HD2      ASN   9  -5.127 -15.982   6.495
   60   2HD2  ASN   9          2HD2      ASN   9  -5.543 -17.133   7.721
   61    H    GLN  10           H        GLN  10  -5.256 -11.404   5.309
   62    HA   GLN  10           HA       GLN  10  -4.352 -12.995   3.210
   63   1HB   GLN  10          1HB       GLN  10  -5.169 -10.350   3.573
   64   2HB   GLN  10          2HB       GLN  10  -3.476 -10.193   3.072
   65   1HG   GLN  10          1HG       GLN  10  -4.979 -12.200   1.518
   66   2HG   GLN  10          2HG       GLN  10  -5.661 -10.573   1.377
   67   1HE2  GLN  10          1HE2      GLN  10  -3.738  -8.864   1.330
   68   2HE2  GLN  10          2HE2      GLN  10  -2.561  -9.146   0.091
   69    H    CYS  11           H        CYS  11  -2.687 -11.097   5.766
   70    HA   CYS  11           HA       CYS  11  -0.116 -11.467   4.626
   71   1HB   CYS  11          1HB       CYS  11  -0.584  -9.566   6.027
   72   2HB   CYS  11          2HB       CYS  11  -0.984 -10.611   7.393
   73    H    ALA  12           H        ALA  12  -2.309 -13.645   5.822
   74    HA   ALA  12           HA       ALA  12  -0.274 -15.251   7.198
   75   1HB   ALA  12          1HB       ALA  12  -2.560 -16.562   7.707
   76   2HB   ALA  12          2HB       ALA  12  -2.031 -15.169   8.683
   77   3HB   ALA  12          3HB       ALA  12  -3.247 -14.949   7.402
   78    H    VAL  13           H        VAL  13  -1.126 -14.686   4.145
   79    HA   VAL  13           HA       VAL  13  -2.169 -16.836   2.944
   80    HB   VAL  13           HB       VAL  13  -0.632 -14.636   2.229
   81   1HG1  VAL  13          1HG1      VAL  13   0.992 -15.507   0.590
   82   2HG1  VAL  13          2HG1      VAL  13   1.410 -15.983   2.254
   83   3HG1  VAL  13          3HG1      VAL  13   0.662 -17.164   1.151
   84   1HG2  VAL  13          1HG2      VAL  13  -1.288 -16.328  -0.048
   85   2HG2  VAL  13          2HG2      VAL  13  -2.614 -16.274   1.138
   86   3HG2  VAL  13          3HG2      VAL  13  -1.975 -14.763   0.447
   87    HA   PRO  14           HA       PRO  14   0.381 -20.254   3.633
   88   1HB   PRO  14          1HB       PRO  14   0.113 -21.694   1.329
   89   2HB   PRO  14          2HB       PRO  14  -1.099 -21.688   2.607
   90   1HG   PRO  14          1HG       PRO  14  -1.089 -20.312  -0.002
   91   2HG   PRO  14          2HG       PRO  14  -2.491 -20.692   1.062
   92   1HD   PRO  14          1HD       PRO  14  -1.198 -18.171   0.653
   93   2HD   PRO  14          2HD       PRO  14  -2.470 -18.525   1.830
   94    H    ALA  15           H        ALA  15   1.686 -17.842   2.624
   95    HA   ALA  15           HA       ALA  15   3.608 -17.216   1.701
   96   1HB   ALA  15          1HB       ALA  15   5.551 -18.696   2.295
   97   2HB   ALA  15          2HB       ALA  15   4.461 -18.362   3.662
   98   3HB   ALA  15          3HB       ALA  15   4.388 -19.933   2.829
   99    H    LYS  16           H        LYS  16   2.454 -17.381  -0.450
  100    HA   LYS  16           HA       LYS  16   4.025 -18.236  -2.425
  101   1HB   LYS  16          1HB       LYS  16   2.768 -20.412  -3.122
  102   2HB   LYS  16          2HB       LYS  16   4.118 -20.491  -1.975
  103   1HG   LYS  16          1HG       LYS  16   2.762 -21.361  -0.403
  104   2HG   LYS  16          2HG       LYS  16   1.661 -19.978  -0.527
  105   1HD   LYS  16          1HD       LYS  16   0.291 -21.799  -1.092
  106   2HD   LYS  16          2HD       LYS  16   0.778 -21.191  -2.683
  107   1HE   LYS  16          1HE       LYS  16   2.647 -22.895  -2.668
  108   2HE   LYS  16          2HE       LYS  16   1.978 -23.557  -1.170
  109   1HZ   LYS  16          1HZ       LYS  16  -0.049 -23.303  -3.059
  110   2HZ   LYS  16          2HZ       LYS  16   1.199 -24.089  -3.760
  111   3HZ   LYS  16          3HZ       LYS  16   0.540 -24.668  -2.382
  112    H    ASP  17           H        ASP  17   2.445 -16.088  -2.064
  113    HA   ASP  17           HA       ASP  17   0.797 -16.238  -4.342
  114   1HB   ASP  17          1HB       ASP  17  -0.660 -17.186  -2.450
  115   2HB   ASP  17          2HB       ASP  17  -0.612 -15.573  -1.721
  116    H    ARG  18           H        ARG  18   2.200 -14.681  -1.497
  117    HA   ARG  18           HA       ARG  18   1.310 -12.161  -1.629
  118   1HB   ARG  18          1HB       ARG  18   4.210 -13.031  -1.232
  119   2HB   ARG  18          2HB       ARG  18   3.531 -11.485  -0.694
  120   1HG   ARG  18          1HG       ARG  18   2.521 -12.429   1.115
  121   2HG   ARG  18          2HG       ARG  18   2.019 -13.874   0.218
  122   1HD   ARG  18          1HD       ARG  18   4.238 -14.847   0.443
  123   2HD   ARG  18          2HD       ARG  18   4.885 -13.353   1.138
  124    HE   ARG  18           HE       ARG  18   2.624 -14.532   2.609
  125   1HH1  ARG  18          1HH1      ARG  18   6.123 -14.372   2.272
  126   2HH1  ARG  18          2HH1      ARG  18   6.431 -14.923   3.886
  127   1HH2  ARG  18          1HH2      ARG  18   3.030 -15.258   4.737
  128   2HH2  ARG  18          2HH2      ARG  18   4.660 -15.430   5.297
  129    H    VAL  19           H        VAL  19   2.962 -10.195  -2.345
  130    HA   VAL  19           HA       VAL  19   3.486 -10.686  -5.194
  131    HB   VAL  19           HB       VAL  19   2.946  -8.028  -3.879
  132   1HG1  VAL  19          1HG1      VAL  19   2.209  -7.475  -6.243
  133   2HG1  VAL  19          2HG1      VAL  19   3.950  -7.772  -6.021
  134   3HG1  VAL  19          3HG1      VAL  19   2.916  -9.032  -6.737
  135   1HG2  VAL  19          1HG2      VAL  19   0.614  -8.550  -5.147
  136   2HG2  VAL  19          2HG2      VAL  19   1.046 -10.191  -4.610
  137   3HG2  VAL  19          3HG2      VAL  19   0.891  -8.878  -3.419
  138    H    ASP  20           H        ASP  20   5.213 -11.150  -2.690
  139    HA   ASP  20           HA       ASP  20   7.171 -10.540  -1.857
  140   1HB   ASP  20          1HB       ASP  20   8.117 -11.957  -3.412
  141   2HB   ASP  20          2HB       ASP  20   7.456 -11.066  -4.793
  142    H    CYS  21           H        CYS  21   6.933  -8.362  -1.045
  143    HA   CYS  21           HA       CYS  21   6.747  -6.090  -2.554
  144   1HB   CYS  21          1HB       CYS  21   6.750  -6.653   0.085
  145   2HB   CYS  21          2HB       CYS  21   8.323  -5.863  -0.059
  146    H    GLY  22           H        GLY  22   9.573  -8.077  -1.618
  147   1HA   GLY  22          1HA       GLY  22  11.726  -8.038  -2.259
  148   2HA   GLY  22          2HA       GLY  22  11.184  -7.240  -3.722
  149    H    TYR  23           H        TYR  23  11.365  -6.307  -0.204
  150    HA   TYR  23           HA       TYR  23  12.311  -3.684  -1.015
  151   1HB   TYR  23          1HB       TYR  23  10.647  -4.777   0.958
  152   2HB   TYR  23          2HB       TYR  23  12.148  -4.543   1.859
  153    HD1  TYR  23           HD1      TYR  23  11.727  -2.732   3.279
  154    HD2  TYR  23           HD2      TYR  23  10.630  -2.445  -0.846
  155    HE1  TYR  23           HE1      TYR  23  11.129  -0.281   3.600
  156    HE2  TYR  23           HE2      TYR  23  10.036   0.004  -0.511
  157    HH   TYR  23           HH       TYR  23  10.533   1.793   0.937
  158    HA   PRO  24           HA       PRO  24  16.445  -4.641  -0.121
  159   1HB   PRO  24          1HB       PRO  24  17.478  -2.113  -0.053
  160   2HB   PRO  24          2HB       PRO  24  17.201  -3.001  -1.549
  161   1HG   PRO  24          1HG       PRO  24  15.651  -0.806  -0.331
  162   2HG   PRO  24          2HG       PRO  24  15.651  -1.364  -2.042
  163   1HD   PRO  24          1HD       PRO  24  13.670  -1.812  -0.023
  164   2HD   PRO  24          2HD       PRO  24  13.701  -2.516  -1.645
  165    H    HIS  25           H        HIS  25  14.343  -3.219   1.994
  166    HA   HIS  25           HA       HIS  25  16.315  -3.609   4.115
  167   1HB   HIS  25          1HB       HIS  25  14.823  -1.173   3.425
  168   2HB   HIS  25          2HB       HIS  25  14.698  -1.634   5.127
  169    HD1  HIS  25           HD1      HIS  25  17.520  -2.620   5.736
  170    HD2  HIS  25           HD2      HIS  25  16.728   0.769   3.394
  171    HE1  HIS  25           HE1      HIS  25  19.622  -1.178   5.833
  172    HE2  HIS  25           HE2      HIS  25  19.096   0.863   4.331
  173    H    VAL  26           H        VAL  26  14.604  -5.618   3.213
  174    HA   VAL  26           HA       VAL  26  12.098  -5.634   4.444
  175    HB   VAL  26           HB       VAL  26  12.443  -7.155   2.727
  176   1HG1  VAL  26          1HG1      VAL  26  14.623  -7.534   2.265
  177   2HG1  VAL  26          2HG1      VAL  26  15.099  -7.532   3.979
  178   3HG1  VAL  26          3HG1      VAL  26  14.384  -8.992   3.257
  179   1HG2  VAL  26          1HG2      VAL  26  11.431  -8.053   5.002
  180   2HG2  VAL  26          2HG2      VAL  26  11.693  -9.141   3.618
  181   3HG2  VAL  26          3HG2      VAL  26  12.861  -9.110   4.961
  182    H    THR  27           H        THR  27  11.549  -5.669   6.557
  183    HA   THR  27           HA       THR  27  12.876  -7.351   8.409
  184    HB   THR  27           HB       THR  27  14.006  -4.713   7.968
  185    HG1  THR  27           HG1      THR  27  15.280  -6.535   8.507
  186   1HG2  THR  27          1HG2      THR  27  13.828  -3.674  10.069
  187   2HG2  THR  27          2HG2      THR  27  12.178  -4.320   9.904
  188   3HG2  THR  27          3HG2      THR  27  13.379  -5.189  10.888
  189    HA   PRO  28           HA       PRO  28   9.078  -6.778  10.320
  190   1HB   PRO  28          1HB       PRO  28   9.596  -7.689  12.843
  191   2HB   PRO  28          2HB       PRO  28   9.280  -8.758  11.478
  192   1HG   PRO  28          1HG       PRO  28  11.827  -8.072  12.800
  193   2HG   PRO  28          2HG       PRO  28  11.449  -9.492  11.759
  194   1HD   PRO  28          1HD       PRO  28  12.949  -7.146  11.093
  195   2HD   PRO  28          2HD       PRO  28  12.469  -8.440   9.988
  196    H    LYS  29           H        LYS  29   9.940  -4.366   9.914
  197    HA   LYS  29           HA       LYS  29   8.817  -2.914  11.972
  198   1HB   LYS  29          1HB       LYS  29  10.688  -3.619  13.345
  199   2HB   LYS  29          2HB       LYS  29  11.844  -2.995  12.153
  200   1HG   LYS  29          1HG       LYS  29  11.540  -0.838  12.820
  201   2HG   LYS  29          2HG       LYS  29   9.791  -1.030  13.024
  202   1HD   LYS  29          1HD       LYS  29  11.634  -2.405  14.966
  203   2HD   LYS  29          2HD       LYS  29  11.419  -0.653  15.121
  204   1HE   LYS  29          1HE       LYS  29   8.834  -1.848  14.728
  205   2HE   LYS  29          2HE       LYS  29   9.664  -2.767  15.992
  206   1HZ   LYS  29          1HZ       LYS  29   8.636  -0.132  16.062
  207   2HZ   LYS  29          2HZ       LYS  29   9.058  -1.111  17.298
  208   3HZ   LYS  29          3HZ       LYS  29  10.188  -0.184  16.569
  209    H    GLU  30           H        GLU  30  10.941  -3.278   9.186
  210    HA   GLU  30           HA       GLU  30  10.597  -0.474   8.556
  211   1HB   GLU  30          1HB       GLU  30  12.580  -2.520   7.968
  212   2HB   GLU  30          2HB       GLU  30  12.038  -1.736   6.474
  213   1HG   GLU  30          1HG       GLU  30  12.456   0.207   8.621
  214   2HG   GLU  30          2HG       GLU  30  13.922  -0.744   8.330
  215    H    CYS  31           H        CYS  31   9.928  -3.781   7.257
  216    HA   CYS  31           HA       CYS  31   8.680  -2.913   4.920
  217   1HB   CYS  31          1HB       CYS  31   8.808  -5.438   6.474
  218   2HB   CYS  31          2HB       CYS  31   7.499  -5.281   5.300
  219    H    ASN  32           H        ASN  32   7.330  -4.061   8.105
  220    HA   ASN  32           HA       ASN  32   4.705  -3.514   7.466
  221   1HB   ASN  32          1HB       ASN  32   6.298  -4.087   9.905
  222   2HB   ASN  32          2HB       ASN  32   4.828  -3.155  10.230
  223   1HD2  ASN  32          1HD2      ASN  32   5.892  -5.851   8.151
  224   2HD2  ASN  32          2HD2      ASN  32   4.557  -6.909   8.464
  225    H    ASN  33           H        ASN  33   7.333  -1.396   7.818
  226    HA   ASN  33           HA       ASN  33   5.674   0.730   8.897
  227   1HB   ASN  33          1HB       ASN  33   7.792   0.552  10.046
  228   2HB   ASN  33          2HB       ASN  33   8.691   0.419   8.526
  229   1HD2  ASN  33          1HD2      ASN  33   9.736   2.156   7.972
  230   2HD2  ASN  33          2HD2      ASN  33   9.307   3.800   8.305
  231    H    ARG  34           H        ARG  34   7.346  -0.534   6.048
  232    HA   ARG  34           HA       ARG  34   7.226   1.971   4.677
  233   1HB   ARG  34          1HB       ARG  34   8.562   0.967   3.056
  234   2HB   ARG  34          2HB       ARG  34   8.976  -0.046   4.450
  235   1HG   ARG  34          1HG       ARG  34   8.453  -1.735   3.002
  236   2HG   ARG  34          2HG       ARG  34   6.793  -1.393   3.522
  237   1HD   ARG  34          1HD       ARG  34   7.439   0.447   1.425
  238   2HD   ARG  34          2HD       ARG  34   7.956  -1.155   0.881
  239    HE   ARG  34           HE       ARG  34   5.249  -0.959   2.072
  240   1HH1  ARG  34          1HH1      ARG  34   7.208  -1.121  -0.848
  241   2HH1  ARG  34          2HH1      ARG  34   5.886  -1.600  -1.861
  242   1HH2  ARG  34          1HH2      ARG  34   3.506  -1.591   0.735
  243   2HH2  ARG  34          2HH2      ARG  34   3.767  -1.869  -0.954
  244    H    GLY  35           H        GLY  35   5.321  -0.962   5.095
  245   1HA   GLY  35          1HA       GLY  35   2.948  -0.612   4.502
  246   2HA   GLY  35          2HA       GLY  35   3.506  -0.090   2.925
  247    H    CYS  36           H        CYS  36   5.294  -2.663   4.555
  248    HA   CYS  36           HA       CYS  36   4.014  -4.579   2.742
  249   1HB   CYS  36          1HB       CYS  36   6.904  -4.446   3.607
  250   2HB   CYS  36          2HB       CYS  36   6.188  -5.760   2.671
  251    H    CYS  37           H        CYS  37   4.726  -6.967   3.686
  252    HA   CYS  37           HA       CYS  37   4.240  -6.844   6.573
  253   1HB   CYS  37          1HB       CYS  37   2.266  -7.526   5.098
  254   2HB   CYS  37          2HB       CYS  37   3.154  -9.023   4.799
  255    H    PHE  38           H        PHE  38   5.833  -7.886   7.731
  256    HA   PHE  38           HA       PHE  38   7.791  -9.393   6.219
  257   1HB   PHE  38          1HB       PHE  38   8.278  -7.563   7.955
  258   2HB   PHE  38          2HB       PHE  38   7.586  -8.619   9.190
  259    HD1  PHE  38           HD1      PHE  38   8.881 -10.341  10.165
  260    HD2  PHE  38           HD2      PHE  38  10.361  -8.269   6.770
  261    HE1  PHE  38           HE1      PHE  38  11.132 -11.398  10.501
  262    HE2  PHE  38           HE2      PHE  38  12.613  -9.326   7.107
  263    HZ   PHE  38           HZ       PHE  38  12.971 -10.879   8.968
  264    H    ASP  39           H        ASP  39   7.715 -11.579   6.057
  265    HA   ASP  39           HA       ASP  39   5.852 -12.989   7.678
  266   1HB   ASP  39          1HB       ASP  39   5.894 -13.987   5.613
  267   2HB   ASP  39          2HB       ASP  39   7.577 -13.531   5.306
  268    H    SER  40           H        SER  40   9.180 -14.088   6.773
  269    HA   SER  40           HA       SER  40  10.962 -14.494   8.014
  270   1HB   SER  40          1HB       SER  40   9.831 -12.768   9.705
  271   2HB   SER  40          2HB       SER  40   9.561 -14.232  10.666
  272    HG   SER  40           HG       SER  40  12.156 -13.768   9.563
  273    H    ARG  41           H        ARG  41   7.757 -15.804   8.555
  274    HA   ARG  41           HA       ARG  41   8.472 -18.003  10.089
  275   1HB   ARG  41          1HB       ARG  41   6.220 -17.980   8.046
  276   2HB   ARG  41          2HB       ARG  41   6.262 -18.827   9.602
  277   1HG   ARG  41          1HG       ARG  41   6.628 -16.225  10.398
  278   2HG   ARG  41          2HG       ARG  41   5.592 -15.992   8.979
  279   1HD   ARG  41          1HD       ARG  41   3.988 -16.295  10.635
  280   2HD   ARG  41          2HD       ARG  41   4.188 -17.971  10.103
  281    HE   ARG  41           HE       ARG  41   5.981 -17.118  12.282
  282   1HH1  ARG  41          1HH1      ARG  41   2.918 -18.628  11.430
  283   2HH1  ARG  41          2HH1      ARG  41   2.750 -19.440  12.949
  284   1HH2  ARG  41          1HH2      ARG  41   5.758 -18.191  14.288
  285   2HH2  ARG  41          2HH2      ARG  41   4.376 -19.191  14.586
  286    H    ILE  42           H        ILE  42   8.229 -17.433   6.530
  287    HA   ILE  42           HA       ILE  42   9.606 -20.001   6.149
  288    HB   ILE  42           HB       ILE  42   7.827 -18.813   4.058
  289   1HG1  ILE  42          1HG1      ILE  42   6.938 -20.365   6.486
  290   2HG1  ILE  42          2HG1      ILE  42   6.328 -18.811   5.893
  291   1HG2  ILE  42          1HG2      ILE  42   8.178 -21.730   4.641
  292   2HG2  ILE  42          2HG2      ILE  42   7.874 -20.899   3.096
  293   3HG2  ILE  42          3HG2      ILE  42   9.490 -20.833   3.841
  294   1HD1  ILE  42          1HD1      ILE  42   5.541 -21.531   5.158
  295   2HD1  ILE  42          2HD1      ILE  42   4.729 -19.988   4.799
  296   3HD1  ILE  42          3HD1      ILE  42   6.013 -20.588   3.723
  297    HA   PRO  43           HA       PRO  43  12.526 -17.108   4.594
  298   1HB   PRO  43          1HB       PRO  43  14.682 -18.782   4.682
  299   2HB   PRO  43          2HB       PRO  43  14.179 -17.787   6.046
  300   1HG   PRO  43          1HG       PRO  43  13.822 -20.678   5.574
  301   2HG   PRO  43          2HG       PRO  43  13.750 -19.777   7.131
  302   1HD   PRO  43          1HD       PRO  43  11.585 -20.830   5.582
  303   2HD   PRO  43          2HD       PRO  43  11.455 -19.814   7.023
  304    H    GLY  44           H        GLY  44  11.155 -19.782   3.258
  305   1HA   GLY  44          1HA       GLY  44  12.804 -19.751   0.853
  306   2HA   GLY  44          2HA       GLY  44  11.476 -20.830   1.228
  307    H    VAL  45           H        VAL  45  10.216 -17.934   2.144
  308    HA   VAL  45           HA       VAL  45   9.285 -17.316  -0.575
  309    HB   VAL  45           HB       VAL  45   7.113 -17.152   0.144
  310   1HG1  VAL  45          1HG1      VAL  45   6.706 -19.297   0.647
  311   2HG1  VAL  45          2HG1      VAL  45   8.471 -19.494   0.762
  312   3HG1  VAL  45          3HG1      VAL  45   7.514 -19.166   2.227
  313   1HG2  VAL  45          1HG2      VAL  45   8.038 -17.003   3.032
  314   2HG2  VAL  45          2HG2      VAL  45   7.577 -15.609   2.025
  315   3HG2  VAL  45          3HG2      VAL  45   6.367 -16.847   2.440
  316    HA   PRO  46           HA       PRO  46   9.985 -13.131   0.357
  317   1HB   PRO  46          1HB       PRO  46   7.666 -11.746  -0.049
  318   2HB   PRO  46          2HB       PRO  46   8.701 -12.297  -1.363
  319   1HG   PRO  46          1HG       PRO  46   6.142 -13.387  -0.380
  320   2HG   PRO  46          2HG       PRO  46   6.929 -13.639  -1.980
  321   1HD   PRO  46          1HD       PRO  46   6.773 -15.450   0.232
  322   2HD   PRO  46          2HD       PRO  46   7.695 -15.683  -1.259
  323    H    TRP  47           H        TRP  47  10.649 -12.213   2.184
  324    HA   TRP  47           HA       TRP  47   8.824 -12.508   4.434
  325   1HB   TRP  47          1HB       TRP  47  11.432 -11.270   4.906
  326   2HB   TRP  47          2HB       TRP  47  10.628 -12.601   5.742
  327    HD1  TRP  47           HD1      TRP  47  10.917 -15.104   4.446
  328    HE1  TRP  47           HE1      TRP  47  12.930 -16.151   3.100
  329    HE3  TRP  47           HE3      TRP  47  13.250 -10.691   3.479
  330    HZ2  TRP  47           HZ2      TRP  47  15.222 -15.040   1.811
  331    HZ3  TRP  47           HZ3      TRP  47  15.370 -10.760   2.170
  332    HH2  TRP  47           HH2      TRP  47  16.358 -12.838   1.346
  333    H    CYS  48           H        CYS  48   8.402 -10.622   2.090
  334    HA   CYS  48           HA       CYS  48   7.686  -8.374   3.638
  335   1HB   CYS  48          1HB       CYS  48  10.085  -7.900   3.399
  336   2HB   CYS  48          2HB       CYS  48   9.918  -7.938   1.642
  337    H    PHE  49           H        PHE  49   5.625  -8.386   2.758
  338    HA   PHE  49           HA       PHE  49   5.468  -7.995  -0.126
  339   1HB   PHE  49          1HB       PHE  49   3.283  -9.579   0.357
  340   2HB   PHE  49          2HB       PHE  49   4.836 -10.259  -0.142
  341    HD1  PHE  49           HD1      PHE  49   6.483 -10.719   1.916
  342    HD2  PHE  49           HD2      PHE  49   2.252 -10.509   2.177
  343    HE1  PHE  49           HE1      PHE  49   6.546 -12.081   4.022
  344    HE2  PHE  49           HE2      PHE  49   2.315 -11.871   4.285
  345    HZ   PHE  49           HZ       PHE  49   4.461 -12.642   5.182
  346    H    LYS  50           H        LYS  50   2.704  -7.912  -0.412
  347    HA   LYS  50           HA       LYS  50   1.913  -5.884   1.559
  348   1HB   LYS  50          1HB       LYS  50   0.738  -4.747  -0.343
  349   2HB   LYS  50          2HB       LYS  50   2.508  -4.664  -0.389
  350   1HG   LYS  50          1HG       LYS  50   1.740  -7.048  -1.757
  351   2HG   LYS  50          2HG       LYS  50   0.678  -5.761  -2.353
  352   1HD   LYS  50          1HD       LYS  50   2.513  -5.562  -3.778
  353   2HD   LYS  50          2HD       LYS  50   2.929  -4.379  -2.526
  354   1HE   LYS  50          1HE       LYS  50   4.699  -5.617  -1.783
  355   2HE   LYS  50          2HE       LYS  50   3.842  -7.155  -1.965
  356   1HZ   LYS  50          1HZ       LYS  50   5.412  -5.680  -3.900
  357   2HZ   LYS  50          2HZ       LYS  50   5.353  -7.288  -3.620
  358   3HZ   LYS  50          3HZ       LYS  50   4.156  -6.561  -4.462
  359    HA   PRO  51           HA       PRO  51  -1.138  -9.228   1.347
  360   1HB   PRO  51          1HB       PRO  51  -1.163  -9.869   4.003
  361   2HB   PRO  51          2HB       PRO  51  -0.186 -10.727   2.813
  362   1HG   PRO  51          1HG       PRO  51   0.604  -8.719   4.824
  363   2HG   PRO  51          2HG       PRO  51   1.640  -9.919   3.968
  364   1HD   PRO  51          1HD       PRO  51   1.422  -7.102   3.503
  365   2HD   PRO  51          2HD       PRO  51   2.332  -8.264   2.529
  366    H    LEU  52           H        LEU  52  -1.617  -8.290   4.605
  367    HA   LEU  52           HA       LEU  52  -4.058  -6.965   3.746
  368   1HB   LEU  52          1HB       LEU  52  -4.931  -7.475   5.763
  369   2HB   LEU  52          2HB       LEU  52  -3.791  -8.816   5.563
  370    HG   LEU  52           HG       LEU  52  -2.447  -6.680   6.902
  371   1HD1  LEU  52          1HD1      LEU  52  -5.276  -7.045   7.715
  372   2HD1  LEU  52          2HD1      LEU  52  -4.069  -6.997   9.023
  373   3HD1  LEU  52          3HD1      LEU  52  -4.198  -5.638   7.880
  374   1HD2  LEU  52          1HD2      LEU  52  -1.551  -8.492   7.808
  375   2HD2  LEU  52          2HD2      LEU  52  -3.060  -8.780   8.708
  376   3HD2  LEU  52          3HD2      LEU  52  -2.830  -9.508   7.099
  377    H    GLN  53           H        GLN  53  -1.484  -5.692   3.191
  378    HA   GLN  53           HA       GLN  53  -0.717  -3.881   5.069
  379   1HB   GLN  53          1HB       GLN  53  -0.821  -3.629   2.041
  380   2HB   GLN  53          2HB       GLN  53   0.052  -2.496   3.086
  381   1HG   GLN  53          1HG       GLN  53   0.542  -5.492   2.821
  382   2HG   GLN  53          2HG       GLN  53   1.595  -4.206   2.212
  383   1HE2  GLN  53          1HE2      GLN  53   1.531  -2.418   4.290
  384   2HE2  GLN  53          2HE2      GLN  53   2.294  -3.082   5.696
  385    H    GLU  54           H        GLU  54  -3.724  -4.076   3.333
  386    HA   GLU  54           HA       GLU  54  -4.531  -1.586   2.924
  387   1HB   GLU  54          1HB       GLU  54  -6.816  -2.335   3.442
  388   2HB   GLU  54          2HB       GLU  54  -5.929  -3.595   2.566
  389   1HG   GLU  54          1HG       GLU  54  -6.515  -5.001   4.232
  390   2HG   GLU  54          2HG       GLU  54  -5.389  -4.121   5.277
  391    H    ALA  55           H        ALA  55  -3.734  -3.020   6.038
  392    HA   ALA  55           HA       ALA  55  -5.129  -1.667   7.870
  393   1HB   ALA  55          1HB       ALA  55  -3.040  -1.710   9.250
  394   2HB   ALA  55          2HB       ALA  55  -3.360  -3.250   8.414
  395   3HB   ALA  55          3HB       ALA  55  -2.122  -2.136   7.786
  396    H    GLU  56           H        GLU  56  -1.870  -0.321   7.109
  397    HA   GLU  56           HA       GLU  56  -3.165   2.293   7.058
  398   1HB   GLU  56          1HB       GLU  56  -0.591   1.339   8.298
  399   2HB   GLU  56          2HB       GLU  56  -0.724   3.030   7.787
  400   1HG   GLU  56          1HG       GLU  56  -2.239   3.537   9.437
  401   2HG   GLU  56          2HG       GLU  56  -3.025   1.953   9.363
  402    H    CYS  57           H        CYS  57  -2.587   0.323   4.825
  403    HA   CYS  57           HA       CYS  57  -0.613   1.900   3.353
  404   1HB   CYS  57          1HB       CYS  57  -0.479  -0.691   3.714
  405   2HB   CYS  57          2HB       CYS  57  -1.647  -0.740   2.391
  406    H    THR  58           H        THR  58  -3.784   0.141   3.007
  407    HA   THR  58           HA       THR  58  -4.452   1.842   0.739
  408    HB   THR  58           HB       THR  58  -4.780  -0.814   1.135
  409    HG1  THR  58           HG1      THR  58  -6.875  -0.254  -0.246
  410   1HG2  THR  58          1HG2      THR  58  -6.357  -0.432   3.103
  411   2HG2  THR  58          2HG2      THR  58  -7.448   0.425   1.987
  412   3HG2  THR  58          3HG2      THR  58  -7.105  -1.305   1.744
  413    H    PHE  59           H        PHE  59  -4.758   1.865   4.146
  414    HA   PHE  59           HA       PHE  59  -7.161   2.651   4.841
  415   1HB   PHE  59          1HB       PHE  59  -4.705   2.852   5.910
  416   2HB   PHE  59          2HB       PHE  59  -4.817   4.533   5.379
  417    HD1  PHE  59           HD1      PHE  59  -6.878   2.019   7.231
  418    HD2  PHE  59           HD2      PHE  59  -5.588   6.050   6.924
  419    HE1  PHE  59           HE1      PHE  59  -8.137   2.582   9.328
  420    HE2  PHE  59           HE2      PHE  59  -6.848   6.613   9.022
  421    HZ   PHE  59           HZ       PHE  59  -8.107   4.872  10.198
  422   1H    GLU   1           H1       GLU   1 -21.427  -2.064  -0.995
  423    HA   GLU   1           HA       GLU   1 -18.766  -3.121  -0.941
  424   1HB   GLU   1          1HB       GLU   1 -20.533  -3.276  -3.399
  425   2HB   GLU   1          2HB       GLU   1 -18.766  -3.253  -3.526
  426   1HG   GLU   1          1HG       GLU   1 -18.657  -5.439  -2.987
  427   2HG   GLU   1          2HG       GLU   1 -19.591  -5.176  -1.506
  428    H    GLU   2           H        GLU   2 -18.669  -0.909   0.075
  429    HA   GLU   2           HA       GLU   2 -19.073   1.249  -1.786
  430   1HB   GLU   2          1HB       GLU   2 -18.405   1.071   1.160
  431   2HB   GLU   2          2HB       GLU   2 -18.271   2.610   0.292
  432   1HG   GLU   2          1HG       GLU   2 -20.792   0.949   0.099
  433   2HG   GLU   2          2HG       GLU   2 -20.529   1.988   1.507
  434    H    TYR   3           H        TYR   3 -17.309   0.235  -3.217
  435    HA   TYR   3           HA       TYR   3 -14.618   0.639  -2.200
  436   1HB   TYR   3          1HB       TYR   3 -15.988  -0.432  -4.726
  437   2HB   TYR   3          2HB       TYR   3 -14.232  -0.251  -4.662
  438    HD1  TYR   3           HD1      TYR   3 -16.959  -1.713  -2.520
  439    HD2  TYR   3           HD2      TYR   3 -13.051  -2.184  -4.197
  440    HE1  TYR   3           HE1      TYR   3 -16.771  -4.014  -1.454
  441    HE2  TYR   3           HE2      TYR   3 -12.876  -4.483  -3.125
  442    HH   TYR   3           HH       TYR   3 -13.850  -5.645  -1.193
  443    H    VAL   4           H        VAL   4 -14.466   2.933  -2.010
  444    HA   VAL   4           HA       VAL   4 -14.269   4.244  -4.619
  445    HB   VAL   4           HB       VAL   4 -16.335   5.035  -3.919
  446   1HG1  VAL   4          1HG1      VAL   4 -17.047   5.473  -1.728
  447   2HG1  VAL   4          2HG1      VAL   4 -16.025   4.025  -1.563
  448   3HG1  VAL   4          3HG1      VAL   4 -15.383   5.624  -1.115
  449   1HG2  VAL   4          1HG2      VAL   4 -15.158   7.291  -2.542
  450   2HG2  VAL   4          2HG2      VAL   4 -14.125   6.784  -3.900
  451   3HG2  VAL   4          3HG2      VAL   4 -15.833   7.193  -4.186
  452    H    GLY   5           H        GLY   5 -13.686   4.640  -1.050
  453   1HA   GLY   5          1HA       GLY   5 -11.463   6.356  -1.383
  454   2HA   GLY   5          2HA       GLY   5 -11.924   5.486   0.067
  455    H    LEU   6           H        LEU   6 -11.758   3.197  -2.408
  456    HA   LEU   6           HA       LEU   6  -8.893   2.847  -2.319
  457   1HB   LEU   6          1HB       LEU   6  -9.160   0.494  -1.498
  458   2HB   LEU   6          2HB       LEU   6  -9.325   1.780  -0.290
  459    HG   LEU   6           HG       LEU   6 -10.926  -0.191  -0.142
  460   1HD1  LEU   6          1HD1      LEU   6 -12.024   1.207   1.179
  461   2HD1  LEU   6          2HD1      LEU   6 -11.316   2.593   0.315
  462   3HD1  LEU   6          3HD1      LEU   6 -12.861   1.899  -0.232
  463   1HD2  LEU   6          1HD2      LEU   6 -11.351  -0.278  -2.618
  464   2HD2  LEU   6          2HD2      LEU   6 -12.808  -0.315  -1.596
  465   3HD2  LEU   6          3HD2      LEU   6 -12.345   1.187  -2.432
  466    H    SER   7           H        SER   7 -11.187   3.415  -4.236
  467    HA   SER   7           HA       SER   7 -10.939   0.996  -5.836
  468   1HB   SER   7          1HB       SER   7 -13.143   2.723  -5.229
  469   2HB   SER   7          2HB       SER   7 -12.828   2.851  -6.968
  470    HG   SER   7           HG       SER   7 -12.983   0.528  -7.102
  471    H    ALA   8           H        ALA   8 -10.384   1.211  -8.126
  472    HA   ALA   8           HA       ALA   8  -8.364   3.073  -8.611
  473   1HB   ALA   8          1HB       ALA   8  -8.805   0.768  -9.668
  474   2HB   ALA   8          2HB       ALA   8  -9.967   1.604 -10.728
  475   3HB   ALA   8          3HB       ALA   8  -8.246   2.060 -10.758
  476    H    ASN   9           H        ASN   9  -9.282   5.157  -8.045
  477    HA   ASN   9           HA       ASN   9 -10.060   6.620 -10.191
  478   1HB   ASN   9          1HB       ASN   9 -12.258   5.105  -9.310
  479   2HB   ASN   9          2HB       ASN   9 -12.532   6.690  -8.570
  480   1HD2  ASN   9          1HD2      ASN   9 -12.353   8.578  -9.990
  481   2HD2  ASN   9          2HD2      ASN   9 -12.910   8.468 -11.626
  482    H    GLN  10           H        GLN  10 -10.194   5.944  -6.695
  483    HA   GLN  10           HA       GLN  10 -10.736   8.489  -5.782
  484   1HB   GLN  10          1HB       GLN  10 -10.324   6.037  -4.647
  485   2HB   GLN  10          2HB       GLN  10  -8.839   6.872  -4.157
  486   1HG   GLN  10          1HG       GLN  10 -10.948   8.727  -3.765
  487   2HG   GLN  10          2HG       GLN  10 -11.560   7.183  -3.151
  488   1HE2  GLN  10          1HE2      GLN  10  -9.146   6.026  -2.363
  489   2HE2  GLN  10          2HE2      GLN  10  -8.511   6.871  -0.990
  490    H    CYS  11           H        CYS  11  -7.755   6.993  -7.018
  491    HA   CYS  11           HA       CYS  11  -6.002   8.936  -5.976
  492   1HB   CYS  11          1HB       CYS  11  -5.215   6.755  -6.612
  493   2HB   CYS  11          2HB       CYS  11  -5.711   7.009  -8.288
  494    H    ALA  12           H        ALA  12  -8.518   9.099  -8.238
  495    HA   ALA  12           HA       ALA  12  -7.169  11.138  -9.850
  496   1HB   ALA  12          1HB       ALA  12  -8.647   9.023 -10.655
  497   2HB   ALA  12          2HB       ALA  12  -9.945  10.224 -10.457
  498   3HB   ALA  12          3HB       ALA  12  -8.585  10.558 -11.555
  499    H    VAL  13           H        VAL  13  -8.533  11.053  -6.927
  500    HA   VAL  13           HA       VAL  13 -10.737  12.541  -6.754
  501    HB   VAL  13           HB       VAL  13  -8.459  11.965  -5.140
  502   1HG1  VAL  13          1HG1      VAL  13  -7.715  14.207  -5.169
  503   2HG1  VAL  13          2HG1      VAL  13  -9.371  14.848  -5.058
  504   3HG1  VAL  13          3HG1      VAL  13  -8.634  14.040  -3.654
  505   1HG2  VAL  13          1HG2      VAL  13 -11.167  13.033  -4.285
  506   2HG2  VAL  13          2HG2      VAL  13 -10.871  11.348  -4.779
  507   3HG2  VAL  13          3HG2      VAL  13 -10.052  12.012  -3.345
  508    HA   PRO  14           HA       PRO  14 -10.010  16.428  -8.492
  509   1HB   PRO  14          1HB       PRO  14 -11.644  18.051  -7.022
  510   2HB   PRO  14          2HB       PRO  14 -12.229  17.020  -8.325
  511   1HG   PRO  14          1HG       PRO  14 -12.411  16.670  -5.401
  512   2HG   PRO  14          2HG       PRO  14 -13.404  15.896  -6.689
  513   1HD   PRO  14          1HD       PRO  14 -11.290  14.744  -5.139
  514   2HD   PRO  14          2HD       PRO  14 -12.126  13.994  -6.503
  515    H    ALA  15           H        ALA  15  -8.135  15.538  -6.430
  516    HA   ALA  15           HA       ALA  15  -6.533  16.366  -5.138
  517   1HB   ALA  15          1HB       ALA  15  -5.706  17.253  -7.202
  518   2HB   ALA  15          2HB       ALA  15  -6.880  18.592  -7.176
  519   3HB   ALA  15          3HB       ALA  15  -5.545  18.556  -5.999
  520    H    LYS  16           H        LYS  16  -8.462  16.390  -3.501
  521    HA   LYS  16           HA       LYS  16  -8.144  18.400  -1.740
  522   1HB   LYS  16          1HB       LYS  16 -10.415  19.642  -2.168
  523   2HB   LYS  16          2HB       LYS  16  -8.921  20.178  -2.958
  524   1HG   LYS  16          1HG       LYS  16  -9.803  19.774  -4.990
  525   2HG   LYS  16          2HG       LYS  16 -10.199  18.104  -4.549
  526   1HD   LYS  16          1HD       LYS  16 -12.381  18.643  -4.459
  527   2HD   LYS  16          2HD       LYS  16 -12.053  19.860  -3.211
  528   1HE   LYS  16          1HE       LYS  16 -11.730  21.577  -4.842
  529   2HE   LYS  16          2HE       LYS  16 -11.599  20.415  -6.171
  530   1HZ   LYS  16          1HZ       LYS  16 -13.828  21.694  -5.453
  531   2HZ   LYS  16          2HZ       LYS  16 -13.796  20.313  -6.323
  532   3HZ   LYS  16          3HZ       LYS  16 -14.042  20.255  -4.710
  533    H    ASP  17           H        ASP  17  -8.550  15.586  -1.886
  534    HA   ASP  17           HA       ASP  17 -10.653  15.413   0.025
  535   1HB   ASP  17          1HB       ASP  17 -11.756  15.103  -2.256
  536   2HB   ASP  17          2HB       ASP  17 -10.781  13.639  -2.453
  537    H    ARG  18           H        ARG  18  -7.605  14.916  -0.765
  538    HA   ARG  18           HA       ARG  18  -7.441  12.098  -0.228
  539   1HB   ARG  18          1HB       ARG  18  -5.191  14.120  -0.616
  540   2HB   ARG  18          2HB       ARG  18  -5.041  12.358  -0.708
  541   1HG   ARG  18          1HG       ARG  18  -5.914  12.271  -2.820
  542   2HG   ARG  18          2HG       ARG  18  -7.085  13.564  -2.515
  543   1HD   ARG  18          1HD       ARG  18  -5.443  15.265  -2.891
  544   2HD   ARG  18          2HD       ARG  18  -4.101  14.114  -2.788
  545    HE   ARG  18           HE       ARG  18  -5.977  13.473  -4.928
  546   1HH1  ARG  18          1HH1      ARG  18  -3.203  15.465  -4.077
  547   2HH1  ARG  18          2HH1      ARG  18  -2.674  15.653  -5.716
  548   1HH2  ARG  18          1HH2      ARG  18  -5.280  13.721  -7.090
  549   2HH2  ARG  18          2HH2      ARG  18  -3.864  14.655  -7.441
  550    H    VAL  19           H        VAL  19  -5.231  11.712   1.314
  551    HA   VAL  19           HA       VAL  19  -5.878  13.167   3.784
  552    HB   VAL  19           HB       VAL  19  -4.565  10.466   3.621
  553   1HG1  VAL  19          1HG1      VAL  19  -4.545  10.660   5.840
  554   2HG1  VAL  19          2HG1      VAL  19  -5.328  12.254   5.723
  555   3HG1  VAL  19          3HG1      VAL  19  -6.321  10.781   5.842
  556   1HG2  VAL  19          1HG2      VAL  19  -7.402  11.160   3.098
  557   2HG2  VAL  19          2HG2      VAL  19  -6.451   9.743   2.591
  558   3HG2  VAL  19          3HG2      VAL  19  -7.124   9.822   4.238
  559    H    ASP  20           H        ASP  20  -3.969  13.787   1.430
  560    HA   ASP  20           HA       ASP  20  -1.827  14.204   1.074
  561   1HB   ASP  20          1HB       ASP  20  -2.252  16.283   1.999
  562   2HB   ASP  20          2HB       ASP  20  -2.692  15.615   3.578
  563    H    CYS  21           H        CYS  21  -0.803  12.077   1.236
  564    HA   CYS  21           HA       CYS  21  -0.220  10.734   3.532
  565   1HB   CYS  21          1HB       CYS  21   0.239  10.362   0.876
  566   2HB   CYS  21          2HB       CYS  21   1.884  10.603   1.474
  567    H    GLY  22           H        GLY  22   1.357  13.558   2.018
  568   1HA   GLY  22          1HA       GLY  22   3.189  14.762   2.593
  569   2HA   GLY  22          2HA       GLY  22   2.467  14.681   4.189
  570    H    TYR  23           H        TYR  23   4.355  12.487   1.976
  571    HA   TYR  23           HA       TYR  23   5.680  11.364   4.304
  572   1HB   TYR  23          1HB       TYR  23   5.001  10.732   1.500
  573   2HB   TYR  23          2HB       TYR  23   6.711  10.407   1.797
  574    HD1  TYR  23           HD1      TYR  23   7.397   8.613   3.298
  575    HD2  TYR  23           HD2      TYR  23   3.254   9.454   2.636
  576    HE1  TYR  23           HE1      TYR  23   6.769   6.386   4.351
  577    HE2  TYR  23           HE2      TYR  23   2.641   7.224   3.691
  578    HH   TYR  23           HH       TYR  23   5.151   5.129   5.066
  579    HA   PRO  24           HA       PRO  24   9.286  13.694   3.746
  580   1HB   PRO  24          1HB       PRO  24  11.099  12.127   5.058
  581   2HB   PRO  24          2HB       PRO  24  10.000  13.228   5.885
  582   1HG   PRO  24          1HG       PRO  24   9.888  10.293   5.604
  583   2HG   PRO  24          2HG       PRO  24   9.068  11.337   6.821
  584   1HD   PRO  24          1HD       PRO  24   7.937  10.049   4.527
  585   2HD   PRO  24          2HD       PRO  24   7.124  11.195   5.602
  586    H    HIS  25           H        HIS  25   8.739  10.822   2.220
  587    HA   HIS  25           HA       HIS  25  11.146  11.273   0.613
  588   1HB   HIS  25          1HB       HIS  25  10.536   9.001   2.150
  589   2HB   HIS  25          2HB       HIS  25  10.220   8.536   0.476
  590    HD1  HIS  25           HD1      HIS  25  12.375   9.382  -1.204
  591    HD2  HIS  25           HD2      HIS  25  13.119   8.573   2.844
  592    HE1  HIS  25           HE1      HIS  25  14.884   8.959  -1.010
  593    HE2  HIS  25           HE2      HIS  25  15.289   8.521   1.509
  594    H    VAL  26           H        VAL  26   8.117  12.076   0.594
  595    HA   VAL  26           HA       VAL  26   6.676  10.801  -1.290
  596    HB   VAL  26           HB       VAL  26   5.723  12.619  -0.188
  597   1HG1  VAL  26          1HG1      VAL  26   7.220  14.877  -1.257
  598   2HG1  VAL  26          2HG1      VAL  26   6.815  14.471   0.428
  599   3HG1  VAL  26          3HG1      VAL  26   8.265  13.771  -0.331
  600   1HG2  VAL  26          1HG2      VAL  26   4.624  13.706  -1.887
  601   2HG2  VAL  26          2HG2      VAL  26   6.114  14.006  -2.812
  602   3HG2  VAL  26          3HG2      VAL  26   5.379  12.385  -2.811
  603    H    THR  27           H        THR  27   7.008  10.156  -3.350
  604    HA   THR  27           HA       THR  27   8.259  11.867  -5.248
  605    HB   THR  27           HB       THR  27   9.964  10.165  -3.656
  606    HG1  THR  27           HG1      THR  27  11.442  11.411  -4.920
  607   1HG2  THR  27          1HG2      THR  27  10.505   8.409  -5.012
  608   2HG2  THR  27          2HG2      THR  27   9.157   8.853  -6.085
  609   3HG2  THR  27          3HG2      THR  27  10.780   9.528  -6.368
  610    HA   PRO  28           HA       PRO  28   5.970   9.340  -7.849
  611   1HB   PRO  28          1HB       PRO  28   7.227   9.667 -10.252
  612   2HB   PRO  28          2HB       PRO  28   6.107  10.851  -9.581
  613   1HG   PRO  28          1HG       PRO  28   9.055  10.890  -9.711
  614   2HG   PRO  28          2HG       PRO  28   7.923  12.270  -9.479
  615   1HD   PRO  28          1HD       PRO  28   9.569  10.970  -7.530
  616   2HD   PRO  28          2HD       PRO  28   8.355  12.218  -7.222
  617    H    LYS  29           H        LYS  29   7.495   7.789  -6.240
  618    HA   LYS  29           HA       LYS  29   7.566   5.431  -7.674
  619   1HB   LYS  29          1HB       LYS  29   9.624   6.889  -8.583
  620   2HB   LYS  29          2HB       LYS  29  10.419   6.119  -7.199
  621   1HG   LYS  29          1HG       LYS  29  10.471   4.112  -8.241
  622   2HG   LYS  29          2HG       LYS  29   8.768   4.219  -8.719
  623   1HD   LYS  29          1HD       LYS  29   9.300   5.433 -10.701
  624   2HD   LYS  29          2HD       LYS  29  10.942   5.800 -10.145
  625   1HE   LYS  29          1HE       LYS  29  11.276   4.061 -11.696
  626   2HE   LYS  29          2HE       LYS  29  11.268   3.195 -10.151
  627   1HZ   LYS  29          1HZ       LYS  29   9.777   1.995 -11.313
  628   2HZ   LYS  29          2HZ       LYS  29   8.735   3.101 -10.717
  629   3HZ   LYS  29          3HZ       LYS  29   9.279   3.236 -12.250
  630    H    GLU  30           H        GLU  30   8.374   7.507  -4.983
  631    HA   GLU  30           HA       GLU  30   8.981   5.220  -3.326
  632   1HB   GLU  30          1HB       GLU  30   9.543   8.081  -3.269
  633   2HB   GLU  30          2HB       GLU  30   8.909   7.530  -1.710
  634   1HG   GLU  30          1HG       GLU  30  11.029   6.861  -1.278
  635   2HG   GLU  30          2HG       GLU  30  10.713   5.518  -2.388
  636    H    CYS  31           H        CYS  31   6.539   7.846  -3.724
  637    HA   CYS  31           HA       CYS  31   5.026   7.326  -1.493
  638   1HB   CYS  31          1HB       CYS  31   4.342   8.399  -4.214
  639   2HB   CYS  31          2HB       CYS  31   3.105   8.210  -2.969
  640    H    ASN  32           H        ASN  32   4.588   6.083  -4.893
  641    HA   ASN  32           HA       ASN  32   2.530   4.372  -4.287
  642   1HB   ASN  32          1HB       ASN  32   4.560   4.647  -6.471
  643   2HB   ASN  32          2HB       ASN  32   3.756   3.074  -6.372
  644   1HD2  ASN  32          1HD2      ASN  32   2.578   6.324  -5.575
  645   2HD2  ASN  32          2HD2      ASN  32   1.275   6.379  -6.715
  646    H    ASN  33           H        ASN  33   5.877   4.286  -3.419
  647    HA   ASN  33           HA       ASN  33   6.074   1.440  -3.351
  648   1HB   ASN  33          1HB       ASN  33   7.922   3.441  -3.545
  649   2HB   ASN  33          2HB       ASN  33   8.006   3.142  -1.803
  650   1HD2  ASN  33          1HD2      ASN  33  10.189   2.482  -2.284
  651   2HD2  ASN  33          2HD2      ASN  33  10.522   0.868  -2.816
  652    H    ARG  34           H        ARG  34   5.476   4.225  -1.163
  653    HA   ARG  34           HA       ARG  34   5.632   2.613   1.169
  654   1HB   ARG  34          1HB       ARG  34   4.357   5.366   0.973
  655   2HB   ARG  34          2HB       ARG  34   5.162   4.643   2.376
  656   1HG   ARG  34          1HG       ARG  34   6.984   4.699   0.125
  657   2HG   ARG  34          2HG       ARG  34   6.300   6.318   0.357
  658   1HD   ARG  34          1HD       ARG  34   7.532   6.642   2.229
  659   2HD   ARG  34          2HD       ARG  34   7.025   5.093   2.920
  660    HE   ARG  34           HE       ARG  34   8.954   4.715   0.792
  661   1HH1  ARG  34          1HH1      ARG  34   8.676   5.660   4.171
  662   2HH1  ARG  34          2HH1      ARG  34  10.290   5.175   4.571
  663   1HH2  ARG  34          1HH2      ARG  34  11.084   4.077   1.320
  664   2HH2  ARG  34          2HH2      ARG  34  11.669   4.269   2.939
  665    H    GLY  35           H        GLY  35   3.208   3.552  -1.199
  666   1HA   GLY  35          1HA       GLY  35   1.241   2.110  -1.233
  667   2HA   GLY  35          2HA       GLY  35   1.104   2.346   0.497
  668    H    CYS  36           H        CYS  36   2.207   5.112  -1.360
  669    HA   CYS  36           HA       CYS  36  -0.432   6.310  -0.966
  670   1HB   CYS  36          1HB       CYS  36   2.240   7.679  -1.292
  671   2HB   CYS  36          2HB       CYS  36   0.693   8.463  -0.963
  672    H    CYS  37           H        CYS  37  -0.579   8.313  -2.726
  673    HA   CYS  37           HA       CYS  37   0.145   7.132  -5.308
  674   1HB   CYS  37          1HB       CYS  37  -2.323   7.003  -4.583
  675   2HB   CYS  37          2HB       CYS  37  -2.364   8.740  -4.900
  676    H    PHE  38           H        PHE  38   1.381   8.514  -6.548
  677    HA   PHE  38           HA       PHE  38   1.776  11.194  -5.536
  678   1HB   PHE  38          1HB       PHE  38   3.596   9.538  -6.287
  679   2HB   PHE  38          2HB       PHE  38   2.965   9.673  -7.933
  680    HD1  PHE  38           HD1      PHE  38   4.511  11.612  -5.175
  681    HD2  PHE  38           HD2      PHE  38   3.664  11.427  -9.329
  682    HE1  PHE  38           HE1      PHE  38   6.002  13.593  -5.567
  683    HE2  PHE  38           HE2      PHE  38   5.155  13.408  -9.721
  684    HZ   PHE  38           HZ       PHE  38   6.306  14.467  -7.837
  685    H    ASP  39           H        ASP  39   0.744  12.962  -6.332
  686    HA   ASP  39           HA       ASP  39  -0.885  12.595  -8.655
  687   1HB   ASP  39          1HB       ASP  39  -2.092  13.929  -7.250
  688   2HB   ASP  39          2HB       ASP  39  -0.650  14.528  -6.414
  689    H    SER  40           H        SER  40   0.994  15.536  -7.676
  690    HA   SER  40           HA       SER  40   2.684  16.570  -8.645
  691   1HB   SER  40          1HB       SER  40   3.062  14.107  -9.762
  692   2HB   SER  40          2HB       SER  40   2.734  15.066 -11.216
  693    HG   SER  40           HG       SER  40   4.823  15.544 -11.051
  694    H    ARG  41           H        ARG  41  -0.303  15.662 -10.241
  695    HA   ARG  41           HA       ARG  41  -0.198  17.391 -12.390
  696   1HB   ARG  41          1HB       ARG  41  -2.743  16.718 -10.870
  697   2HB   ARG  41          2HB       ARG  41  -2.557  16.969 -12.614
  698   1HG   ARG  41          1HG       ARG  41  -0.820  14.891 -12.196
  699   2HG   ARG  41          2HG       ARG  41  -2.040  14.544 -10.957
  700   1HD   ARG  41          1HD       ARG  41  -2.835  13.407 -12.872
  701   2HD   ARG  41          2HD       ARG  41  -3.778  14.906 -12.876
  702    HE   ARG  41           HE       ARG  41  -1.287  15.118 -14.387
  703   1HH1  ARG  41          1HH1      ARG  41  -4.645  14.078 -14.549
  704   2HH1  ARG  41          2HH1      ARG  41  -4.745  14.241 -16.270
  705   1HH2  ARG  41          1HH2      ARG  41  -1.420  15.334 -16.658
  706   2HH2  ARG  41          2HH2      ARG  41  -2.899  14.960 -17.478
  707    H    ILE  42           H        ILE  42  -1.289  17.802  -8.978
  708    HA   ILE  42           HA       ILE  42  -1.468  20.686  -9.506
  709    HB   ILE  42           HB       ILE  42  -3.079  19.393  -7.352
  710   1HG1  ILE  42          1HG1      ILE  42  -3.740  19.358 -10.297
  711   2HG1  ILE  42          2HG1      ILE  42  -3.674  17.986  -9.178
  712   1HG2  ILE  42          1HG2      ILE  42  -2.793  21.998  -8.513
  713   2HG2  ILE  42          2HG2      ILE  42  -4.461  21.426  -8.755
  714   3HG2  ILE  42          3HG2      ILE  42  -3.769  21.485  -7.116
  715   1HD1  ILE  42          1HD1      ILE  42  -5.500  19.749  -7.982
  716   2HD1  ILE  42          2HD1      ILE  42  -5.862  19.868  -9.720
  717   3HD1  ILE  42          3HD1      ILE  42  -5.909  18.285  -8.908
  718    HA   PRO  43           HA       PRO  43   1.752  20.430  -6.525
  719   1HB   PRO  43          1HB       PRO  43   2.803  22.905  -7.006
  720   2HB   PRO  43          2HB       PRO  43   3.290  21.462  -7.893
  721   1HG   PRO  43          1HG       PRO  43   1.526  23.681  -8.705
  722   2HG   PRO  43          2HG       PRO  43   2.390  22.495  -9.748
  723   1HD   PRO  43          1HD       PRO  43  -0.393  22.577  -9.075
  724   2HD   PRO  43          2HD       PRO  43   0.438  21.301  -9.972
  725    H    GLY  44           H        GLY  44  -1.046  22.141  -6.592
  726   1HA   GLY  44          1HA       GLY  44  -0.458  23.696  -4.193
  727   2HA   GLY  44          2HA       GLY  44  -1.923  23.726  -5.155
  728    H    VAL  45           H        VAL  45  -1.383  20.495  -4.981
  729    HA   VAL  45           HA       VAL  45  -2.750  20.252  -2.390
  730    HB   VAL  45           HB       VAL  45  -4.269  18.772  -3.263
  731   1HG1  VAL  45          1HG1      VAL  45  -5.400  20.160  -4.605
  732   2HG1  VAL  45          2HG1      VAL  45  -3.951  21.194  -4.612
  733   3HG1  VAL  45          3HG1      VAL  45  -4.198  19.998  -5.907
  734   1HG2  VAL  45          1HG2      VAL  45  -4.029  17.465  -5.282
  735   2HG2  VAL  45          2HG2      VAL  45  -2.551  18.349  -5.730
  736   3HG2  VAL  45          3HG2      VAL  45  -2.554  17.284  -4.303
  737    HA   PRO  46           HA       PRO  46   0.003  17.019  -1.477
  738   1HB   PRO  46          1HB       PRO  46  -1.449  14.793  -0.847
  739   2HB   PRO  46          2HB       PRO  46  -1.239  16.150   0.257
  740   1HG   PRO  46          1HG       PRO  46  -3.564  15.390  -1.391
  741   2HG   PRO  46          2HG       PRO  46  -3.516  16.456   0.058
  742   1HD   PRO  46          1HD       PRO  46  -3.765  17.204  -2.694
  743   2HD   PRO  46          2HD       PRO  46  -3.563  18.296  -1.317
  744    H    TRP  47           H        TRP  47   1.521  16.280  -2.807
  745    HA   TRP  47           HA       TRP  47   0.565  14.863  -5.149
  746   1HB   TRP  47          1HB       TRP  47   3.446  15.124  -4.819
  747   2HB   TRP  47          2HB       TRP  47   2.402  15.598  -6.161
  748    HD1  TRP  47           HD1      TRP  47   1.210  18.128  -5.869
  749    HE1  TRP  47           HE1      TRP  47   2.045  20.352  -4.720
  750    HE3  TRP  47           HE3      TRP  47   4.767  15.922  -2.981
  751    HZ2  TRP  47           HZ2      TRP  47   4.053  20.927  -2.776
  752    HZ3  TRP  47           HZ3      TRP  47   6.120  17.386  -1.485
  753    HH2  TRP  47           HH2      TRP  47   5.809  19.807  -1.353
  754    H    CYS  48           H        CYS  48   0.283  13.721  -2.389
  755    HA   CYS  48           HA       CYS  48   1.208  11.141  -2.986
  756   1HB   CYS  48          1HB       CYS  48   3.358  12.183  -2.280
  757   2HB   CYS  48          2HB       CYS  48   2.658  12.459  -0.683
  758    H    PHE  49           H        PHE  49  -0.710  10.189  -2.362
  759    HA   PHE  49           HA       PHE  49  -1.558  10.641   0.384
  760   1HB   PHE  49          1HB       PHE  49  -3.959  10.515  -0.947
  761   2HB   PHE  49          2HB       PHE  49  -3.173  12.051  -0.571
  762    HD1  PHE  49           HD1      PHE  49  -1.377  12.776  -2.422
  763    HD2  PHE  49           HD2      PHE  49  -4.674  10.192  -3.097
  764    HE1  PHE  49           HE1      PHE  49  -1.300  13.319  -4.872
  765    HE2  PHE  49           HE2      PHE  49  -4.597  10.735  -5.547
  766    HZ   PHE  49           HZ       PHE  49  -2.911  12.292  -6.405
  767    H    LYS  50           H        LYS  50  -3.901   9.125   0.363
  768    HA   LYS  50           HA       LYS  50  -2.958   6.534  -0.648
  769   1HB   LYS  50          1HB       LYS  50  -4.451   5.883   1.537
  770   2HB   LYS  50          2HB       LYS  50  -2.683   5.989   1.510
  771   1HG   LYS  50          1HG       LYS  50  -4.210   8.527   1.960
  772   2HG   LYS  50          2HG       LYS  50  -4.209   7.351   3.286
  773   1HD   LYS  50          1HD       LYS  50  -1.798   8.622   1.930
  774   2HD   LYS  50          2HD       LYS  50  -2.336   8.884   3.598
  775   1HE   LYS  50          1HE       LYS  50  -0.966   6.498   2.362
  776   2HE   LYS  50          2HE       LYS  50  -0.600   7.325   3.884
  777   1HZ   LYS  50          1HZ       LYS  50  -2.953   6.443   4.467
  778   2HZ   LYS  50          2HZ       LYS  50  -2.629   5.337   3.309
  779   3HZ   LYS  50          3HZ       LYS  50  -1.647   5.471   4.607
  780    HA   PRO  51           HA       PRO  51  -7.083   7.510  -2.264
  781   1HB   PRO  51          1HB       PRO  51  -6.505   7.290  -4.924
  782   2HB   PRO  51          2HB       PRO  51  -6.517   8.827  -4.066
  783   1HG   PRO  51          1HG       PRO  51  -4.245   7.165  -4.948
  784   2HG   PRO  51          2HG       PRO  51  -4.258   8.915  -4.522
  785   1HD   PRO  51          1HD       PRO  51  -3.268   6.713  -2.982
  786   2HD   PRO  51          2HD       PRO  51  -3.403   8.396  -2.452
  787    H    LEU  52           H        LEU  52  -5.894   5.627  -4.871
  788    HA   LEU  52           HA       LEU  52  -7.449   3.395  -3.791
  789   1HB   LEU  52          1HB       LEU  52  -8.034   2.835  -5.889
  790   2HB   LEU  52          2HB       LEU  52  -7.864   4.589  -6.083
  791    HG   LEU  52           HG       LEU  52  -5.335   3.517  -6.670
  792   1HD1  LEU  52          1HD1      LEU  52  -6.382   2.036  -8.698
  793   2HD1  LEU  52          2HD1      LEU  52  -5.733   1.367  -7.181
  794   3HD1  LEU  52          3HD1      LEU  52  -7.485   1.622  -7.364
  795   1HD2  LEU  52          1HD2      LEU  52  -7.358   5.143  -7.879
  796   2HD2  LEU  52          2HD2      LEU  52  -5.610   5.087  -8.210
  797   3HD2  LEU  52          3HD2      LEU  52  -6.718   4.011  -9.095
  798    H    GLN  53           H        GLN  53  -4.948   3.853  -2.593
  799    HA   GLN  53           HA       GLN  53  -2.747   2.819  -3.660
  800   1HB   GLN  53          1HB       GLN  53  -3.408   1.813  -0.923
  801   2HB   GLN  53          2HB       GLN  53  -1.952   2.646  -1.495
  802   1HG   GLN  53          1HG       GLN  53  -2.923   4.317  -0.211
  803   2HG   GLN  53          2HG       GLN  53  -3.643   4.690  -1.784
  804   1HE2  GLN  53          1HE2      GLN  53  -5.267   2.207  -1.667
  805   2HE2  GLN  53          2HE2      GLN  53  -6.595   2.538  -0.604
  806    H    GLU  54           H        GLU  54  -5.735   1.105  -3.020
  807    HA   GLU  54           HA       GLU  54  -5.010  -1.418  -2.573
  808   1HB   GLU  54          1HB       GLU  54  -7.039  -2.108  -3.744
  809   2HB   GLU  54          2HB       GLU  54  -7.348  -0.603  -2.861
  810   1HG   GLU  54          1HG       GLU  54  -7.740   0.559  -4.774
  811   2HG   GLU  54          2HG       GLU  54  -6.368  -0.174  -5.620
  812    H    ALA  55           H        ALA  55  -4.256   0.492  -5.410
  813    HA   ALA  55           HA       ALA  55  -4.030  -1.038  -7.509
  814   1HB   ALA  55          1HB       ALA  55  -1.395  -0.035  -7.218
  815   2HB   ALA  55          2HB       ALA  55  -2.766   0.739  -8.048
  816   3HB   ALA  55          3HB       ALA  55  -2.454   1.087  -6.331
  817    H    GLU  56           H        GLU  56  -1.474  -1.199  -4.920
  818    HA   GLU  56           HA       GLU  56  -1.425  -4.049  -5.280
  819   1HB   GLU  56          1HB       GLU  56   0.310  -2.626  -6.818
  820   2HB   GLU  56          2HB       GLU  56   1.295  -2.823  -5.359
  821   1HG   GLU  56          1HG       GLU  56   0.662  -5.321  -5.477
  822   2HG   GLU  56          2HG       GLU  56   0.057  -4.988  -7.107
  823    H    CYS  57           H        CYS  57  -2.045  -1.826  -3.230
  824    HA   CYS  57           HA       CYS  57  -0.048  -2.514  -1.219
  825   1HB   CYS  57          1HB       CYS  57  -1.356  -0.121  -1.877
  826   2HB   CYS  57          2HB       CYS  57  -2.042  -0.624  -0.330
  827    H    THR  58           H        THR  58  -3.638  -1.875  -1.296
  828    HA   THR  58           HA       THR  58  -4.267  -3.383   0.925
  829    HB   THR  58           HB       THR  58  -5.606  -1.719  -0.722
  830    HG1  THR  58           HG1      THR  58  -7.537  -2.840   0.344
  831   1HG2  THR  58          1HG2      THR  58  -7.347  -2.957  -1.952
  832   2HG2  THR  58          2HG2      THR  58  -5.753  -3.440  -2.582
  833   3HG2  THR  58          3HG2      THR  58  -6.629  -4.511  -1.461
  834    H    PHE  59           H        PHE  59  -3.959  -4.426  -2.507
  835    HA   PHE  59           HA       PHE  59  -4.993  -6.843  -2.556
  836   1HB   PHE  59          1HB       PHE  59  -2.823  -5.405  -3.762
  837   2HB   PHE  59          2HB       PHE  59  -2.162  -6.996  -3.364
  838    HD1  PHE  59           HD1      PHE  59  -5.221  -5.513  -4.920
  839    HD2  PHE  59           HD2      PHE  59  -2.342  -8.630  -4.974
  840    HE1  PHE  59           HE1      PHE  59  -6.278  -6.452  -6.994
  841    HE2  PHE  59           HE2      PHE  59  -3.398  -9.569  -7.048
  842    HZ   PHE  59           HZ       PHE  59  -5.354  -8.469  -8.033
  Start of MODEL    9
    1   1H    GLU   1           H1       GLU   1 -14.373 -11.610  -4.754
    2    HA   GLU   1           HA       GLU   1 -15.697  -9.210  -4.578
    3   1HB   GLU   1          1HB       GLU   1 -17.519 -11.617  -4.869
    4   2HB   GLU   1          2HB       GLU   1 -18.048 -10.134  -4.055
    5   1HG   GLU   1          1HG       GLU   1 -18.602  -9.329  -6.086
    6   2HG   GLU   1          2HG       GLU   1 -16.875  -9.258  -6.471
    7    H    GLU   2           H        GLU   2 -15.257 -12.561  -3.407
    8    HA   GLU   2           HA       GLU   2 -15.905 -11.907  -0.735
    9   1HB   GLU   2          1HB       GLU   2 -14.711 -14.280  -2.156
   10   2HB   GLU   2          2HB       GLU   2 -14.638 -14.210  -0.388
   11   1HG   GLU   2          1HG       GLU   2 -17.209 -13.631  -0.604
   12   2HG   GLU   2          2HG       GLU   2 -17.054 -14.365  -2.206
   13    H    TYR   3           H        TYR   3 -14.491  -9.915  -0.642
   14    HA   TYR   3           HA       TYR   3 -11.737  -9.991  -0.862
   15   1HB   TYR   3          1HB       TYR   3 -13.720  -8.497   0.953
   16   2HB   TYR   3          2HB       TYR   3 -12.024  -8.017   0.820
   17    HD1  TYR   3           HD1      TYR   3 -11.774  -8.546  -2.205
   18    HD2  TYR   3           HD2      TYR   3 -14.709  -6.492   0.133
   19    HE1  TYR   3           HE1      TYR   3 -12.362  -7.094  -4.207
   20    HE2  TYR   3           HE2      TYR   3 -15.288  -5.046  -1.877
   21    HH   TYR   3           HH       TYR   3 -13.324  -4.864  -4.590
   22    H    VAL   4           H        VAL   4 -11.065 -12.077   0.039
   23    HA   VAL   4           HA       VAL   4 -10.832 -11.909   2.960
   24    HB   VAL   4           HB       VAL   4 -11.105 -14.308   3.098
   25   1HG1  VAL   4          1HG1      VAL   4 -13.537 -14.451   2.304
   26   2HG1  VAL   4          2HG1      VAL   4 -13.130 -13.142   3.439
   27   3HG1  VAL   4          3HG1      VAL   4 -13.320 -12.790   1.704
   28   1HG2  VAL   4          1HG2      VAL   4 -11.938 -15.578   1.085
   29   2HG2  VAL   4          2HG2      VAL   4 -11.476 -14.175   0.090
   30   3HG2  VAL   4          3HG2      VAL   4 -10.235 -15.069   1.001
   31    H    GLY   5           H        GLY   5  -9.581 -13.448  -0.082
   32   1HA   GLY   5          1HA       GLY   5  -7.046 -14.079   1.029
   33   2HA   GLY   5          2HA       GLY   5  -7.494 -14.069  -0.665
   34    H    LEU   6           H        LEU   6  -8.439 -11.066   0.455
   35    HA   LEU   6           HA       LEU   6  -5.784  -9.903  -0.004
   36   1HB   LEU   6          1HB       LEU   6  -6.998  -8.071  -1.225
   37   2HB   LEU   6          2HB       LEU   6  -6.817  -9.619  -2.071
   38    HG   LEU   6           HG       LEU   6  -9.116 -10.148  -1.765
   39   1HD1  LEU   6          1HD1      LEU   6 -10.596  -8.374  -0.548
   40   2HD1  LEU   6          2HD1      LEU   6  -9.711  -9.598   0.393
   41   3HD1  LEU   6          3HD1      LEU   6  -9.073  -7.940   0.267
   42   1HD2  LEU   6          1HD2      LEU   6  -9.428  -8.878  -3.565
   43   2HD2  LEU   6          2HD2      LEU   6 -10.031  -7.618  -2.462
   44   3HD2  LEU   6          3HD2      LEU   6  -8.323  -7.618  -2.964
   45    H    SER   7           H        SER   7  -8.242 -10.453   2.147
   46    HA   SER   7           HA       SER   7  -7.945  -7.801   3.318
   47   1HB   SER   7          1HB       SER   7 -10.258  -9.154   2.755
   48   2HB   SER   7          2HB       SER   7  -9.998  -9.639   4.441
   49    HG   SER   7           HG       SER   7 -10.492  -7.651   5.094
   50    H    ALA   8           H        ALA   8  -8.380  -8.123   5.948
   51    HA   ALA   8           HA       ALA   8  -6.120  -8.989   7.063
   52   1HB   ALA   8          1HB       ALA   8  -7.275  -8.964   9.134
   53   2HB   ALA   8          2HB       ALA   8  -8.197  -7.854   8.093
   54   3HB   ALA   8          3HB       ALA   8  -8.798  -9.503   8.389
   55    H    ASN   9           H        ASN   9  -5.100 -10.893   7.615
   56    HA   ASN   9           HA       ASN   9  -5.186 -13.095   8.273
   57   1HB   ASN   9          1HB       ASN   9  -7.715 -13.194   7.901
   58   2HB   ASN   9          2HB       ASN   9  -7.389 -13.530   6.193
   59   1HD2  ASN   9          1HD2      ASN   9  -5.812 -15.338   5.801
   60   2HD2  ASN   9          2HD2      ASN   9  -5.975 -16.775   6.754
   61    H    GLN  10           H        GLN  10  -5.606 -11.719   5.005
   62    HA   GLN  10           HA       GLN  10  -4.493 -13.733   3.512
   63   1HB   GLN  10          1HB       GLN  10  -4.768 -12.272   1.814
   64   2HB   GLN  10          2HB       GLN  10  -5.504 -11.207   3.025
   65   1HG   GLN  10          1HG       GLN  10  -3.338 -10.122   3.420
   66   2HG   GLN  10          2HG       GLN  10  -2.534 -11.241   2.309
   67   1HE2  GLN  10          1HE2      GLN  10  -2.433 -10.765   0.229
   68   2HE2  GLN  10          2HE2      GLN  10  -3.251  -9.465  -0.571
   69    H    CYS  11           H        CYS  11  -2.961 -11.065   5.377
   70    HA   CYS  11           HA       CYS  11  -0.389 -11.374   4.402
   71   1HB   CYS  11          1HB       CYS  11  -1.044  -9.451   5.673
   72   2HB   CYS  11          2HB       CYS  11  -1.371 -10.435   7.102
   73    H    ALA  12           H        ALA  12  -2.389 -13.558   6.100
   74    HA   ALA  12           HA       ALA  12  -0.133 -14.887   7.399
   75   1HB   ALA  12          1HB       ALA  12  -2.668 -14.348   8.279
   76   2HB   ALA  12          2HB       ALA  12  -2.876 -15.995   7.636
   77   3HB   ALA  12          3HB       ALA  12  -1.656 -15.678   8.893
   78    H    VAL  13           H        VAL  13  -0.862 -14.683   4.367
   79    HA   VAL  13           HA       VAL  13  -1.835 -17.036   3.399
   80    HB   VAL  13           HB       VAL  13  -0.609 -14.764   2.419
   81   1HG1  VAL  13          1HG1      VAL  13   1.601 -15.830   2.553
   82   2HG1  VAL  13          2HG1      VAL  13   1.017 -17.178   1.549
   83   3HG1  VAL  13          3HG1      VAL  13   1.123 -15.538   0.863
   84   1HG2  VAL  13          1HG2      VAL  13  -2.205 -16.959   1.471
   85   2HG2  VAL  13          2HG2      VAL  13  -2.105 -15.292   0.853
   86   3HG2  VAL  13          3HG2      VAL  13  -0.994 -16.538   0.236
   87    HA   PRO  14           HA       PRO  14   1.115 -20.097   4.176
   88   1HB   PRO  14          1HB       PRO  14   1.175 -21.586   1.886
   89   2HB   PRO  14          2HB       PRO  14  -0.102 -21.723   3.091
   90   1HG   PRO  14          1HG       PRO  14  -0.111 -20.385   0.462
   91   2HG   PRO  14          2HG       PRO  14  -1.515 -20.932   1.448
   92   1HD   PRO  14          1HD       PRO  14  -0.535 -18.267   1.071
   93   2HD   PRO  14          2HD       PRO  14  -1.820 -18.773   2.176
   94    H    ALA  15           H        ALA  15   2.134 -17.537   3.141
   95    HA   ALA  15           HA       ALA  15   4.003 -16.683   2.286
   96   1HB   ALA  15          1HB       ALA  15   6.020 -18.439   2.980
   97   2HB   ALA  15          2HB       ALA  15   5.297 -17.227   4.065
   98   3HB   ALA  15          3HB       ALA  15   4.713 -18.908   4.092
   99    H    LYS  16           H        LYS  16   2.897 -17.314   0.114
  100    HA   LYS  16           HA       LYS  16   4.832 -18.083  -1.665
  101   1HB   LYS  16          1HB       LYS  16   3.884 -20.340  -2.366
  102   2HB   LYS  16          2HB       LYS  16   4.902 -20.305  -0.916
  103   1HG   LYS  16          1HG       LYS  16   3.218 -21.217   0.263
  104   2HG   LYS  16          2HG       LYS  16   2.200 -19.809  -0.086
  105   1HD   LYS  16          1HD       LYS  16   0.919 -21.532  -0.986
  106   2HD   LYS  16          2HD       LYS  16   1.840 -21.035  -2.416
  107   1HE   LYS  16          1HE       LYS  16   3.313 -22.891  -2.242
  108   2HE   LYS  16          2HE       LYS  16   2.858 -23.220  -0.563
  109   1HZ   LYS  16          1HZ       LYS  16   1.523 -24.698  -1.516
  110   2HZ   LYS  16          2HZ       LYS  16   0.539 -23.438  -1.851
  111   3HZ   LYS  16          3HZ       LYS  16   1.567 -23.998  -2.990
  112    H    ASP  17           H        ASP  17   2.798 -16.099  -1.254
  113    HA   ASP  17           HA       ASP  17   1.595 -16.289  -3.818
  114   1HB   ASP  17          1HB       ASP  17   0.019 -17.507  -2.179
  115   2HB   ASP  17          2HB       ASP  17  -0.267 -15.928  -1.433
  116    H    ARG  18           H        ARG  18   3.386 -14.667  -1.795
  117    HA   ARG  18           HA       ARG  18   1.879 -12.231  -1.616
  118   1HB   ARG  18          1HB       ARG  18   4.772 -12.795  -0.824
  119   2HB   ARG  18          2HB       ARG  18   3.813 -11.389  -0.328
  120   1HG   ARG  18          1HG       ARG  18   2.705 -12.567   1.278
  121   2HG   ARG  18          2HG       ARG  18   2.568 -14.022   0.276
  122   1HD   ARG  18          1HD       ARG  18   4.849 -14.668   0.801
  123   2HD   ARG  18          2HD       ARG  18   5.167 -13.124   1.605
  124    HE   ARG  18           HE       ARG  18   2.916 -14.571   2.771
  125   1HH1  ARG  18          1HH1      ARG  18   6.423 -14.276   2.770
  126   2HH1  ARG  18          2HH1      ARG  18   6.605 -14.925   4.365
  127   1HH2  ARG  18          1HH2      ARG  18   3.157 -15.427   4.876
  128   2HH2  ARG  18          2HH2      ARG  18   4.735 -15.585   5.571
  129    H    VAL  19           H        VAL  19   3.198 -10.117  -2.244
  130    HA   VAL  19           HA       VAL  19   4.149 -10.556  -4.967
  131    HB   VAL  19           HB       VAL  19   3.552  -7.914  -3.658
  132   1HG1  VAL  19          1HG1      VAL  19   4.192  -8.865  -6.343
  133   2HG1  VAL  19          2HG1      VAL  19   2.687  -7.916  -6.307
  134   3HG1  VAL  19          3HG1      VAL  19   4.198  -7.211  -5.683
  135   1HG2  VAL  19          1HG2      VAL  19   1.578  -9.907  -4.803
  136   2HG2  VAL  19          2HG2      VAL  19   1.566  -9.138  -3.197
  137   3HG2  VAL  19          3HG2      VAL  19   1.226  -8.168  -4.650
  138    H    ASP  20           H        ASP  20   5.631 -11.001  -2.253
  139    HA   ASP  20           HA       ASP  20   7.512 -10.388  -1.266
  140   1HB   ASP  20          1HB       ASP  20   8.580 -11.864  -2.682
  141   2HB   ASP  20          2HB       ASP  20   8.061 -11.013  -4.145
  142    H    CYS  21           H        CYS  21   7.145  -8.165  -0.580
  143    HA   CYS  21           HA       CYS  21   7.169  -5.955  -2.176
  144   1HB   CYS  21          1HB       CYS  21   6.917  -6.441   0.487
  145   2HB   CYS  21          2HB       CYS  21   8.466  -5.594   0.447
  146    H    GLY  22           H        GLY  22   9.865  -7.889  -0.810
  147   1HA   GLY  22          1HA       GLY  22  12.102  -7.758  -1.061
  148   2HA   GLY  22          2HA       GLY  22  11.725  -7.357  -2.724
  149    H    TYR  23           H        TYR  23  11.597  -5.702   0.519
  150    HA   TYR  23           HA       TYR  23  12.416  -3.232  -0.774
  151   1HB   TYR  23          1HB       TYR  23  10.965  -4.216   1.587
  152   2HB   TYR  23          2HB       TYR  23  12.223  -3.088   2.104
  153    HD1  TYR  23           HD1      TYR  23   9.054  -3.473   0.294
  154    HD2  TYR  23           HD2      TYR  23  12.122  -0.722   1.443
  155    HE1  TYR  23           HE1      TYR  23   7.540  -1.522  -0.308
  156    HE2  TYR  23           HE2      TYR  23  10.597   1.221   0.837
  157    HH   TYR  23           HH       TYR  23   8.682   1.827   0.062
  158    HA   PRO  24           HA       PRO  24  16.532  -3.616   0.517
  159   1HB   PRO  24          1HB       PRO  24  17.339  -1.014   0.318
  160   2HB   PRO  24          2HB       PRO  24  17.240  -2.101  -1.066
  161   1HG   PRO  24          1HG       PRO  24  15.431   0.073  -0.230
  162   2HG   PRO  24          2HG       PRO  24  15.593  -0.690  -1.852
  163   1HD   PRO  24          1HD       PRO  24  13.526  -1.066   0.093
  164   2HD   PRO  24          2HD       PRO  24  13.727  -1.959  -1.419
  165    H    HIS  25           H        HIS  25  14.205  -1.987   2.273
  166    HA   HIS  25           HA       HIS  25  16.087  -1.835   4.514
  167   1HB   HIS  25          1HB       HIS  25  14.161   0.096   3.453
  168   2HB   HIS  25          2HB       HIS  25  13.972  -0.186   5.187
  169    HD1  HIS  25           HD1      HIS  25  14.808   2.507   4.950
  170    HD2  HIS  25           HD2      HIS  25  17.653  -0.539   4.473
  171    HE1  HIS  25           HE1      HIS  25  17.088   3.593   5.320
  172    HE2  HIS  25           HE2      HIS  25  18.792   1.662   5.068
  173    H    VAL  26           H        VAL  26  14.024  -3.904   3.240
  174    HA   VAL  26           HA       VAL  26  11.863  -4.369   4.704
  175    HB   VAL  26           HB       VAL  26  12.482  -5.866   3.001
  176   1HG1  VAL  26          1HG1      VAL  26  14.801  -7.035   4.503
  177   2HG1  VAL  26          2HG1      VAL  26  14.485  -6.978   2.753
  178   3HG1  VAL  26          3HG1      VAL  26  15.029  -5.514   3.607
  179   1HG2  VAL  26          1HG2      VAL  26  11.621  -7.717   3.944
  180   2HG2  VAL  26          2HG2      VAL  26  12.953  -7.856   5.116
  181   3HG2  VAL  26          3HG2      VAL  26  11.588  -6.762   5.446
  182    H    THR  27           H        THR  27  11.297  -4.588   6.811
  183    HA   THR  27           HA       THR  27  12.977  -5.880   8.695
  184    HB   THR  27           HB       THR  27  13.443  -3.057   8.210
  185    HG1  THR  27           HG1      THR  27  15.214  -4.195   8.925
  186   1HG2  THR  27          1HG2      THR  27  13.208  -3.304  11.119
  187   2HG2  THR  27          2HG2      THR  27  12.625  -1.996  10.063
  188   3HG2  THR  27          3HG2      THR  27  11.606  -3.427  10.353
  189    HA   PRO  28           HA       PRO  28   9.153  -6.207  10.609
  190   1HB   PRO  28          1HB       PRO  28   9.862  -6.848  13.168
  191   2HB   PRO  28          2HB       PRO  28   9.845  -8.018  11.852
  192   1HG   PRO  28          1HG       PRO  28  12.116  -6.646  13.141
  193   2HG   PRO  28          2HG       PRO  28  12.126  -8.157  12.163
  194   1HD   PRO  28          1HD       PRO  28  12.981  -5.535  11.394
  195   2HD   PRO  28          2HD       PRO  28  12.859  -6.954  10.346
  196    H    LYS  29           H        LYS  29   9.515  -3.637  10.114
  197    HA   LYS  29           HA       LYS  29   7.933  -2.411  11.986
  198   1HB   LYS  29          1HB       LYS  29  10.213  -2.844  13.284
  199   2HB   LYS  29          2HB       LYS  29  10.664  -1.324  12.493
  200   1HG   LYS  29          1HG       LYS  29   9.454  -0.179  14.003
  201   2HG   LYS  29          2HG       LYS  29   7.986  -1.044  13.518
  202   1HD   LYS  29          1HD       LYS  29   9.894  -2.535  15.265
  203   2HD   LYS  29          2HD       LYS  29   9.058  -1.169  16.025
  204   1HE   LYS  29          1HE       LYS  29   6.971  -2.169  15.825
  205   2HE   LYS  29          2HE       LYS  29   7.423  -3.100  14.387
  206   1HZ   LYS  29          1HZ       LYS  29   8.451  -4.663  15.678
  207   2HZ   LYS  29          2HZ       LYS  29   8.685  -3.667  16.951
  208   3HZ   LYS  29          3HZ       LYS  29   7.194  -4.258  16.641
  209    H    GLU  30           H        GLU  30  10.295  -2.437   9.410
  210    HA   GLU  30           HA       GLU  30   9.602   0.279   8.694
  211   1HB   GLU  30          1HB       GLU  30  11.876  -1.478   8.277
  212   2HB   GLU  30          2HB       GLU  30  11.319  -0.825   6.726
  213   1HG   GLU  30          1HG       GLU  30  12.672   0.922   7.338
  214   2HG   GLU  30          2HG       GLU  30  11.226   1.442   8.219
  215    H    CYS  31           H        CYS  31   9.392  -3.116   7.491
  216    HA   CYS  31           HA       CYS  31   8.318  -2.590   5.017
  217   1HB   CYS  31          1HB       CYS  31   8.060  -4.901   6.916
  218   2HB   CYS  31          2HB       CYS  31   7.196  -4.893   5.375
  219    H    ASN  32           H        ASN  32   6.662  -3.241   8.193
  220    HA   ASN  32           HA       ASN  32   4.107  -2.846   7.184
  221   1HB   ASN  32          1HB       ASN  32   5.412  -3.044   9.860
  222   2HB   ASN  32          2HB       ASN  32   3.864  -2.186   9.857
  223   1HD2  ASN  32          1HD2      ASN  32   5.273  -4.988   8.157
  224   2HD2  ASN  32          2HD2      ASN  32   3.993  -6.109   8.486
  225    H    ASN  33           H        ASN  33   6.681  -0.682   7.516
  226    HA   ASN  33           HA       ASN  33   4.991   1.545   8.268
  227   1HB   ASN  33          1HB       ASN  33   7.438   1.054   9.141
  228   2HB   ASN  33          2HB       ASN  33   7.950   1.751   7.596
  229   1HD2  ASN  33          1HD2      ASN  33   8.958   3.235   9.222
  230   2HD2  ASN  33          2HD2      ASN  33   8.065   4.635   9.711
  231    H    ARG  34           H        ARG  34   6.799   0.035   5.592
  232    HA   ARG  34           HA       ARG  34   6.580   2.337   3.932
  233   1HB   ARG  34          1HB       ARG  34   7.260  -0.489   3.038
  234   2HB   ARG  34          2HB       ARG  34   7.772   1.032   2.287
  235   1HG   ARG  34          1HG       ARG  34   8.633   1.087   5.014
  236   2HG   ARG  34          2HG       ARG  34   9.076  -0.502   4.368
  237   1HD   ARG  34          1HD       ARG  34  10.689   0.387   3.038
  238   2HD   ARG  34          2HD       ARG  34   9.642   1.702   2.483
  239    HE   ARG  34           HE       ARG  34  10.255   2.383   5.105
  240   1HH1  ARG  34          1HH1      ARG  34  12.167   1.609   2.254
  241   2HH1  ARG  34          2HH1      ARG  34  13.506   2.602   2.726
  242   1HH2  ARG  34          1HH2      ARG  34  12.021   3.693   5.728
  243   2HH2  ARG  34          2HH2      ARG  34  13.422   3.795   4.715
  244    H    GLY  35           H        GLY  35   4.685  -0.499   4.741
  245   1HA   GLY  35          1HA       GLY  35   2.336  -0.338   4.115
  246   2HA   GLY  35          2HA       GLY  35   2.850   0.093   2.497
  247    H    CYS  36           H        CYS  36   4.674  -2.319   4.358
  248    HA   CYS  36           HA       CYS  36   3.517  -4.377   2.620
  249   1HB   CYS  36          1HB       CYS  36   6.333  -4.335   3.703
  250   2HB   CYS  36          2HB       CYS  36   5.645  -5.481   2.549
  251    H    CYS  37           H        CYS  37   4.306  -6.678   3.785
  252    HA   CYS  37           HA       CYS  37   3.614  -6.375   6.615
  253   1HB   CYS  37          1HB       CYS  37   1.787  -7.258   4.982
  254   2HB   CYS  37          2HB       CYS  37   2.714  -8.759   5.034
  255    H    PHE  38           H        PHE  38   5.222  -7.216   7.899
  256    HA   PHE  38           HA       PHE  38   7.276  -8.795   6.620
  257   1HB   PHE  38          1HB       PHE  38   7.686  -6.848   8.200
  258   2HB   PHE  38          2HB       PHE  38   6.863  -7.741   9.483
  259    HD1  PHE  38           HD1      PHE  38   7.995  -9.459  10.692
  260    HD2  PHE  38           HD2      PHE  38   9.872  -7.619   7.361
  261    HE1  PHE  38           HE1      PHE  38  10.181 -10.509  11.343
  262    HE2  PHE  38           HE2      PHE  38  12.058  -8.667   8.012
  263    HZ   PHE  38           HZ       PHE  38  12.186 -10.099   9.995
  264    H    ASP  39           H        ASP  39   7.309 -10.989   6.648
  265    HA   ASP  39           HA       ASP  39   5.436 -12.308   8.376
  266   1HB   ASP  39          1HB       ASP  39   5.562 -13.079   6.087
  267   2HB   ASP  39          2HB       ASP  39   7.321 -13.262   6.177
  268    H    SER  40           H        SER  40   8.709 -13.460   7.346
  269    HA   SER  40           HA       SER  40  10.569 -13.736   8.531
  270   1HB   SER  40          1HB       SER  40   9.436 -12.048  10.253
  271   2HB   SER  40          2HB       SER  40   9.233 -13.518  11.223
  272    HG   SER  40           HG       SER  40  11.558 -13.858  11.014
  273    H    ARG  41           H        ARG  41   7.476 -15.222   8.959
  274    HA   ARG  41           HA       ARG  41   8.153 -17.329  10.605
  275   1HB   ARG  41          1HB       ARG  41   6.123 -17.141   8.335
  276   2HB   ARG  41          2HB       ARG  41   6.164 -18.474   9.503
  277   1HG   ARG  41          1HG       ARG  41   6.194 -16.260  11.154
  278   2HG   ARG  41          2HG       ARG  41   5.183 -15.688   9.815
  279   1HD   ARG  41          1HD       ARG  41   3.770 -16.731  11.512
  280   2HD   ARG  41          2HD       ARG  41   3.768 -17.759  10.071
  281    HE   ARG  41           HE       ARG  41   5.876 -18.591  11.828
  282   1HH1  ARG  41          1HH1      ARG  41   2.364 -18.610  11.611
  283   2HH1  ARG  41          2HH1      ARG  41   2.184 -20.030  12.587
  284   1HH2  ARG  41          1HH2      ARG  41   5.640 -20.463  13.116
  285   2HH2  ARG  41          2HH2      ARG  41   4.060 -21.091  13.449
  286    H    ILE  42           H        ILE  42   8.359 -16.869   7.030
  287    HA   ILE  42           HA       ILE  42   9.940 -19.344   6.925
  288    HB   ILE  42           HB       ILE  42   8.370 -18.331   4.586
  289   1HG1  ILE  42          1HG1      ILE  42   7.309 -19.828   6.965
  290   2HG1  ILE  42          2HG1      ILE  42   6.607 -18.440   6.116
  291   1HG2  ILE  42          1HG2      ILE  42   8.529 -20.570   3.807
  292   2HG2  ILE  42          2HG2      ILE  42  10.148 -20.105   4.386
  293   3HG2  ILE  42          3HG2      ILE  42   9.111 -21.152   5.385
  294   1HD1  ILE  42          1HD1      ILE  42   5.296 -20.274   5.387
  295   2HD1  ILE  42          2HD1      ILE  42   6.467 -20.057   4.065
  296   3HD1  ILE  42          3HD1      ILE  42   6.709 -21.350   5.264
  297    HA   PRO  43           HA       PRO  43  12.858 -16.316   5.667
  298   1HB   PRO  43          1HB       PRO  43  15.077 -17.870   6.026
  299   2HB   PRO  43          2HB       PRO  43  14.363 -16.896   7.311
  300   1HG   PRO  43          1HG       PRO  43  14.224 -19.803   6.833
  301   2HG   PRO  43          2HG       PRO  43  13.918 -18.901   8.360
  302   1HD   PRO  43          1HD       PRO  43  12.013 -20.080   6.578
  303   2HD   PRO  43          2HD       PRO  43  11.657 -19.067   7.982
  304    H    GLY  44           H        GLY  44  11.794 -19.057   4.203
  305   1HA   GLY  44          1HA       GLY  44  13.704 -18.894   1.992
  306   2HA   GLY  44          2HA       GLY  44  12.472 -20.113   2.248
  307    H    VAL  45           H        VAL  45  10.831 -17.350   2.989
  308    HA   VAL  45           HA       VAL  45  10.113 -16.855   0.182
  309    HB   VAL  45           HB       VAL  45   7.884 -16.977   0.656
  310   1HG1  VAL  45          1HG1      VAL  45   7.436 -19.020   1.821
  311   2HG1  VAL  45          2HG1      VAL  45   9.030 -19.191   1.047
  312   3HG1  VAL  45          3HG1      VAL  45   8.919 -18.864   2.793
  313   1HG2  VAL  45          1HG2      VAL  45   8.411 -16.630   3.626
  314   2HG2  VAL  45          2HG2      VAL  45   7.979 -15.310   2.511
  315   3HG2  VAL  45          3HG2      VAL  45   6.830 -16.638   2.806
  316    HA   PRO  46           HA       PRO  46  10.265 -12.620   1.123
  317   1HB   PRO  46          1HB       PRO  46   7.880 -11.495   0.407
  318   2HB   PRO  46          2HB       PRO  46   9.126 -11.938  -0.758
  319   1HG   PRO  46          1HG       PRO  46   6.593 -13.293  -0.084
  320   2HG   PRO  46          2HG       PRO  46   7.599 -13.464  -1.568
  321   1HD   PRO  46          1HD       PRO  46   7.359 -15.273   0.641
  322   2HD   PRO  46          2HD       PRO  46   8.480 -15.411  -0.719
  323    H    TRP  47           H        TRP  47  10.661 -11.837   3.086
  324    HA   TRP  47           HA       TRP  47   8.540 -12.204   5.038
  325   1HB   TRP  47          1HB       TRP  47  10.924 -10.854   5.971
  326   2HB   TRP  47          2HB       TRP  47  10.160 -12.337   6.542
  327    HD1  TRP  47           HD1      TRP  47  11.014 -14.667   5.285
  328    HE1  TRP  47           HE1      TRP  47  13.285 -15.358   4.132
  329    HE3  TRP  47           HE3      TRP  47  12.744  -9.927   4.658
  330    HZ2  TRP  47           HZ2      TRP  47  15.501 -13.877   3.111
  331    HZ3  TRP  47           HZ3      TRP  47  14.970  -9.637   3.574
  332    HH2  TRP  47           HH2      TRP  47  16.335 -11.517   2.812
  333    H    CYS  48           H        CYS  48   8.236 -10.345   2.718
  334    HA   CYS  48           HA       CYS  48   7.259  -8.143   4.155
  335   1HB   CYS  48          1HB       CYS  48   9.634  -7.539   4.250
  336   2HB   CYS  48          2HB       CYS  48   9.717  -7.574   2.486
  337    H    PHE  49           H        PHE  49   5.357  -8.026   3.004
  338    HA   PHE  49           HA       PHE  49   5.559  -7.652   0.139
  339   1HB   PHE  49          1HB       PHE  49   3.451  -9.373   0.227
  340   2HB   PHE  49          2HB       PHE  49   5.101  -9.961   0.003
  341    HD1  PHE  49           HD1      PHE  49   6.388 -10.553   2.193
  342    HD2  PHE  49           HD2      PHE  49   2.165 -10.220   1.946
  343    HE1  PHE  49           HE1      PHE  49   6.156 -11.956   4.263
  344    HE2  PHE  49           HE2      PHE  49   1.933 -11.623   4.015
  345    HZ   PHE  49           HZ       PHE  49   3.931 -12.474   5.148
  346    H    LYS  50           H        LYS  50   2.854  -7.724  -0.518
  347    HA   LYS  50           HA       LYS  50   1.716  -5.764   1.352
  348   1HB   LYS  50          1HB       LYS  50   0.594  -5.181  -1.088
  349   2HB   LYS  50          2HB       LYS  50   1.920  -4.293  -0.316
  350   1HG   LYS  50          1HG       LYS  50   2.589  -6.754  -1.905
  351   2HG   LYS  50          2HG       LYS  50   2.135  -5.294  -2.802
  352   1HD   LYS  50          1HD       LYS  50   4.399  -5.615  -0.792
  353   2HD   LYS  50          2HD       LYS  50   4.557  -5.313  -2.532
  354   1HE   LYS  50          1HE       LYS  50   3.704  -3.441  -0.322
  355   2HE   LYS  50          2HE       LYS  50   4.883  -3.167  -1.615
  356   1HZ   LYS  50          1HZ       LYS  50   2.723  -3.477  -3.035
  357   2HZ   LYS  50          2HZ       LYS  50   2.003  -2.942  -1.669
  358   3HZ   LYS  50          3HZ       LYS  50   3.134  -2.025  -2.409
  359    HA   PRO  51           HA       PRO  51  -1.077  -9.300   0.960
  360   1HB   PRO  51          1HB       PRO  51  -1.379  -9.813   3.624
  361   2HB   PRO  51          2HB       PRO  51  -0.210 -10.653   2.608
  362   1HG   PRO  51          1HG       PRO  51   0.196  -8.498   4.581
  363   2HG   PRO  51          2HG       PRO  51   1.404  -9.657   3.921
  364   1HD   PRO  51          1HD       PRO  51   1.055  -6.890   3.274
  365   2HD   PRO  51          2HD       PRO  51   2.152  -8.027   2.482
  366    H    LEU  52           H        LEU  52  -2.089  -8.371   4.065
  367    HA   LEU  52           HA       LEU  52  -4.435  -7.174   2.835
  368   1HB   LEU  52          1HB       LEU  52  -5.575  -7.703   4.726
  369   2HB   LEU  52          2HB       LEU  52  -4.393  -9.021   4.646
  370    HG   LEU  52           HG       LEU  52  -3.184  -7.015   6.198
  371   1HD1  LEU  52          1HD1      LEU  52  -4.878  -5.761   6.959
  372   2HD1  LEU  52          2HD1      LEU  52  -6.113  -6.946   6.470
  373   3HD1  LEU  52          3HD1      LEU  52  -5.232  -7.157   8.002
  374   1HD2  LEU  52          1HD2      LEU  52  -4.033  -9.776   6.427
  375   2HD2  LEU  52          2HD2      LEU  52  -2.640  -8.943   7.158
  376   3HD2  LEU  52          3HD2      LEU  52  -4.223  -8.910   7.970
  377    H    GLN  53           H        GLN  53  -1.927  -5.732   2.635
  378    HA   GLN  53           HA       GLN  53  -1.506  -3.908   4.605
  379   1HB   GLN  53          1HB       GLN  53  -1.298  -3.557   1.590
  380   2HB   GLN  53          2HB       GLN  53  -0.571  -2.453   2.773
  381   1HG   GLN  53          1HG       GLN  53   0.037  -5.421   2.435
  382   2HG   GLN  53          2HG       GLN  53   1.099  -4.085   1.968
  383   1HE2  GLN  53          1HE2      GLN  53  -0.162  -6.050   4.511
  384   2HE2  GLN  53          2HE2      GLN  53   0.822  -5.467   5.812
  385    H    GLU  54           H        GLU  54  -4.282  -4.269   2.549
  386    HA   GLU  54           HA       GLU  54  -5.203  -1.832   2.068
  387   1HB   GLU  54          1HB       GLU  54  -7.331  -2.768   1.941
  388   2HB   GLU  54          2HB       GLU  54  -6.309  -4.211   1.836
  389   1HG   GLU  54          1HG       GLU  54  -7.749  -4.923   3.484
  390   2HG   GLU  54          2HG       GLU  54  -6.578  -4.096   4.524
  391    H    ALA  55           H        ALA  55  -4.662  -3.253   5.247
  392    HA   ALA  55           HA       ALA  55  -6.322  -2.025   6.928
  393   1HB   ALA  55          1HB       ALA  55  -3.641  -3.077   6.992
  394   2HB   ALA  55          2HB       ALA  55  -3.707  -1.608   7.995
  395   3HB   ALA  55          3HB       ALA  55  -4.824  -2.956   8.317
  396    H    GLU  56           H        GLU  56  -3.138  -0.439   6.194
  397    HA   GLU  56           HA       GLU  56  -4.620   2.072   6.133
  398   1HB   GLU  56          1HB       GLU  56  -1.895   1.539   7.375
  399   2HB   GLU  56          2HB       GLU  56  -2.625   3.147   7.213
  400   1HG   GLU  56          1HG       GLU  56  -4.123   2.773   8.910
  401   2HG   GLU  56          2HG       GLU  56  -4.326   1.060   8.513
  402    H    CYS  57           H        CYS  57  -3.737   0.179   3.960
  403    HA   CYS  57           HA       CYS  57  -1.700   1.833   2.677
  404   1HB   CYS  57          1HB       CYS  57  -1.393  -0.665   2.942
  405   2HB   CYS  57          2HB       CYS  57  -2.687  -0.867   1.757
  406    H    THR  58           H        THR  58  -4.676  -0.081   1.784
  407    HA   THR  58           HA       THR  58  -5.204   1.415  -0.531
  408    HB   THR  58           HB       THR  58  -6.049  -0.953   0.515
  409    HG1  THR  58           HG1      THR  58  -6.298   0.172  -1.674
  410   1HG2  THR  58          1HG2      THR  58  -7.555   0.099   2.213
  411   2HG2  THR  58          2HG2      THR  58  -8.344   1.038   0.923
  412   3HG2  THR  58          3HG2      THR  58  -8.501  -0.735   0.958
  413    H    PHE  59           H        PHE  59  -5.903   1.998   2.884
  414    HA   PHE  59           HA       PHE  59  -8.022   3.527   3.010
  415   1HB   PHE  59          1HB       PHE  59  -5.531   3.263   4.332
  416   2HB   PHE  59          2HB       PHE  59  -5.627   4.994   3.994
  417    HD1  PHE  59           HD1      PHE  59  -7.121   6.389   5.212
  418    HD2  PHE  59           HD2      PHE  59  -7.271   2.179   5.722
  419    HE1  PHE  59           HE1      PHE  59  -8.598   6.685   7.220
  420    HE2  PHE  59           HE2      PHE  59  -8.749   2.475   7.729
  421    HZ   PHE  59           HZ       PHE  59  -9.394   4.724   8.455
  422   1H    GLU   1           H1       GLU   1 -23.413   5.038  -3.544
  423    HA   GLU   1           HA       GLU   1 -21.017   5.014  -4.005
  424   1HB   GLU   1          1HB       GLU   1 -22.035   6.391  -1.500
  425   2HB   GLU   1          2HB       GLU   1 -20.429   6.719  -2.173
  426   1HG   GLU   1          1HG       GLU   1 -22.126   6.898  -4.386
  427   2HG   GLU   1          2HG       GLU   1 -23.082   7.624  -3.085
  428    H    GLU   2           H        GLU   2 -20.650   2.561  -3.535
  429    HA   GLU   2           HA       GLU   2 -19.639   2.094  -0.885
  430   1HB   GLU   2          1HB       GLU   2 -21.041   0.446  -2.272
  431   2HB   GLU   2          2HB       GLU   2 -19.575   0.156  -3.226
  432   1HG   GLU   2          1HG       GLU   2 -19.384  -1.509  -1.618
  433   2HG   GLU   2          2HG       GLU   2 -18.479  -0.211  -0.825
  434    H    TYR   3           H        TYR   3 -17.791   0.051  -2.631
  435    HA   TYR   3           HA       TYR   3 -15.419   1.499  -2.186
  436   1HB   TYR   3          1HB       TYR   3 -14.626  -0.510  -3.737
  437   2HB   TYR   3          2HB       TYR   3 -15.336  -0.910  -2.170
  438    HD1  TYR   3           HD1      TYR   3 -17.459  -2.048  -2.025
  439    HD2  TYR   3           HD2      TYR   3 -15.922  -0.809  -5.822
  440    HE1  TYR   3           HE1      TYR   3 -19.196  -3.481  -3.205
  441    HE2  TYR   3           HE2      TYR   3 -17.665  -2.247  -6.988
  442    HH   TYR   3           HH       TYR   3 -19.788  -4.365  -5.131
  443    H    VAL   4           H        VAL   4 -16.465   3.470  -3.489
  444    HA   VAL   4           HA       VAL   4 -15.444   3.222  -6.233
  445    HB   VAL   4           HB       VAL   4 -17.856   4.720  -5.199
  446   1HG1  VAL   4          1HG1      VAL   4 -16.386   4.903  -7.830
  447   2HG1  VAL   4          2HG1      VAL   4 -18.123   5.271  -7.710
  448   3HG1  VAL   4          3HG1      VAL   4 -16.947   6.213  -6.762
  449   1HG2  VAL   4          1HG2      VAL   4 -18.554   2.527  -5.553
  450   2HG2  VAL   4          2HG2      VAL   4 -18.914   3.304  -7.113
  451   3HG2  VAL   4          3HG2      VAL   4 -17.461   2.292  -6.938
  452    H    GLY   5           H        GLY   5 -16.192   5.475  -3.489
  453   1HA   GLY   5          1HA       GLY   5 -14.506   7.547  -4.471
  454   2HA   GLY   5          2HA       GLY   5 -15.222   7.418  -2.878
  455    H    LEU   6           H        LEU   6 -13.681   4.477  -3.432
  456    HA   LEU   6           HA       LEU   6 -11.116   5.471  -2.420
  457   1HB   LEU   6          1HB       LEU   6 -11.069   3.544  -0.875
  458   2HB   LEU   6          2HB       LEU   6 -12.269   4.784  -0.475
  459    HG   LEU   6           HG       LEU   6 -13.005   2.414  -0.137
  460   1HD1  LEU   6          1HD1      LEU   6 -15.158   2.978  -0.512
  461   2HD1  LEU   6          2HD1      LEU   6 -14.446   4.567  -0.883
  462   3HD1  LEU   6          3HD1      LEU   6 -14.861   3.448  -2.203
  463   1HD2  LEU   6          1HD2      LEU   6 -11.806   1.600  -2.239
  464   2HD2  LEU   6          2HD2      LEU   6 -13.431   0.946  -1.922
  465   3HD2  LEU   6          3HD2      LEU   6 -13.208   2.222  -3.142
  466    H    SER   7           H        SER   7 -12.604   4.211  -4.983
  467    HA   SER   7           HA       SER   7 -10.621   2.116  -5.369
  468   1HB   SER   7          1HB       SER   7 -12.116   1.002  -6.708
  469   2HB   SER   7          2HB       SER   7 -13.278   1.879  -5.697
  470    HG   SER   7           HG       SER   7 -13.126   3.592  -7.454
  471    H    ALA   8           H        ALA   8 -10.876   2.124  -8.295
  472    HA   ALA   8           HA       ALA   8  -8.895   3.973  -8.926
  473   1HB   ALA   8          1HB       ALA   8 -10.729   2.117 -10.399
  474   2HB   ALA   8          2HB       ALA   8  -9.888   3.369 -11.343
  475   3HB   ALA   8          3HB       ALA   8  -8.951   2.194 -10.389
  476    H    ASN   9           H        ASN   9  -9.636   6.022  -8.052
  477    HA   ASN   9           HA       ASN   9 -10.611   7.722  -9.896
  478   1HB   ASN   9          1HB       ASN   9 -12.757   6.150  -8.991
  479   2HB   ASN   9          2HB       ASN   9 -12.918   7.641  -8.050
  480   1HD2  ASN   9          1HD2      ASN   9 -12.208   9.621  -9.586
  481   2HD2  ASN   9          2HD2      ASN   9 -13.130   9.735 -11.047
  482    H    GLN  10           H        GLN  10 -10.461   6.648  -6.498
  483    HA   GLN  10           HA       GLN  10 -10.780   9.152  -5.321
  484   1HB   GLN  10          1HB       GLN  10 -11.025   6.992  -4.132
  485   2HB   GLN  10          2HB       GLN  10  -9.281   6.708  -4.279
  486   1HG   GLN  10          1HG       GLN  10  -8.801   8.668  -2.913
  487   2HG   GLN  10          2HG       GLN  10 -10.508   9.134  -2.890
  488   1HE2  GLN  10          1HE2      GLN  10  -8.419   6.328  -2.217
  489   2HE2  GLN  10          2HE2      GLN  10  -9.195   5.821  -0.754
  490    H    CYS  11           H        CYS  11  -8.035   7.494  -6.838
  491    HA   CYS  11           HA       CYS  11  -6.020   9.063  -5.670
  492   1HB   CYS  11          1HB       CYS  11  -5.494   6.948  -6.644
  493   2HB   CYS  11          2HB       CYS  11  -6.105   7.450  -8.223
  494    H    ALA  12           H        ALA  12  -8.624   9.932  -7.588
  495    HA   ALA  12           HA       ALA  12  -7.103  12.097  -8.873
  496   1HB   ALA  12          1HB       ALA  12  -8.916  10.169  -9.947
  497   2HB   ALA  12          2HB       ALA  12  -9.731  11.751  -9.994
  498   3HB   ALA  12          3HB       ALA  12  -8.147  11.541 -10.781
  499    H    VAL  13           H        VAL  13  -8.551  11.563  -6.086
  500    HA   VAL  13           HA       VAL  13 -10.787  13.028  -5.786
  501    HB   VAL  13           HB       VAL  13  -8.831  11.926  -4.167
  502   1HG1  VAL  13          1HG1      VAL  13  -8.361  13.650  -2.460
  503   2HG1  VAL  13          2HG1      VAL  13  -7.625  14.044  -4.033
  504   3HG1  VAL  13          3HG1      VAL  13  -9.108  14.879  -3.510
  505   1HG2  VAL  13          1HG2      VAL  13 -10.706  11.558  -3.020
  506   2HG2  VAL  13          2HG2      VAL  13 -10.738  13.264  -2.515
  507   3HG2  VAL  13          3HG2      VAL  13 -11.559  12.763  -4.013
  508    HA   PRO  14           HA       PRO  14  -9.885  17.187  -6.543
  509   1HB   PRO  14          1HB       PRO  14 -11.254  18.548  -4.611
  510   2HB   PRO  14          2HB       PRO  14 -12.026  17.873  -6.043
  511   1HG   PRO  14          1HG       PRO  14 -12.010  16.897  -3.260
  512   2HG   PRO  14          2HG       PRO  14 -13.162  16.496  -4.584
  513   1HD   PRO  14          1HD       PRO  14 -11.041  14.891  -3.525
  514   2HD   PRO  14          2HD       PRO  14 -12.042  14.518  -4.933
  515    H    ALA  15           H        ALA  15  -7.981  15.713  -4.831
  516    HA   ALA  15           HA       ALA  15  -6.231  16.128  -3.530
  517   1HB   ALA  15          1HB       ALA  15  -6.473  18.477  -5.367
  518   2HB   ALA  15          2HB       ALA  15  -5.296  18.598  -4.037
  519   3HB   ALA  15          3HB       ALA  15  -5.171  17.273  -5.218
  520    H    LYS  16           H        LYS  16  -7.920  16.001  -1.715
  521    HA   LYS  16           HA       LYS  16  -7.318  17.728   0.278
  522   1HB   LYS  16          1HB       LYS  16  -9.578  19.040   0.329
  523   2HB   LYS  16          2HB       LYS  16  -8.203  19.659  -0.603
  524   1HG   LYS  16          1HG       LYS  16  -9.407  19.549  -2.501
  525   2HG   LYS  16          2HG       LYS  16  -9.732  17.825  -2.250
  526   1HD   LYS  16          1HD       LYS  16 -11.864  18.273  -1.680
  527   2HD   LYS  16          2HD       LYS  16 -11.345  19.411  -0.424
  528   1HE   LYS  16          1HE       LYS  16 -11.780  21.216  -1.736
  529   2HE   LYS  16          2HE       LYS  16 -11.057  20.474  -3.171
  530   1HZ   LYS  16          1HZ       LYS  16 -13.666  20.848  -2.788
  531   2HZ   LYS  16          2HZ       LYS  16 -13.038  19.753  -3.823
  532   3HZ   LYS  16          3HZ       LYS  16 -13.514  19.287  -2.332
  533    H    ASP  17           H        ASP  17  -7.779  14.967  -0.201
  534    HA   ASP  17           HA       ASP  17  -9.618  14.514   1.916
  535   1HB   ASP  17          1HB       ASP  17 -10.991  14.576  -0.272
  536   2HB   ASP  17          2HB       ASP  17 -10.151  13.083  -0.719
  537    H    ARG  18           H        ARG  18  -6.726  14.118   0.640
  538    HA   ARG  18           HA       ARG  18  -6.578  11.249   0.699
  539   1HB   ARG  18          1HB       ARG  18  -4.332  13.280   0.333
  540   2HB   ARG  18          2HB       ARG  18  -4.266  11.557  -0.072
  541   1HG   ARG  18          1HG       ARG  18  -5.387  11.856  -2.036
  542   2HG   ARG  18          2HG       ARG  18  -6.499  13.052  -1.348
  543   1HD   ARG  18          1HD       ARG  18  -4.868  14.814  -1.588
  544   2HD   ARG  18          2HD       ARG  18  -3.574  13.666  -1.966
  545    HE   ARG  18           HE       ARG  18  -5.848  13.557  -3.817
  546   1HH1  ARG  18          1HH1      ARG  18  -2.762  15.098  -3.116
  547   2HH1  ARG  18          2HH1      ARG  18  -2.485  15.578  -4.756
  548   1HH2  ARG  18          1HH2      ARG  18  -5.481  14.191  -5.982
  549   2HH2  ARG  18          2HH2      ARG  18  -4.041  15.059  -6.397
  550    H    VAL  19           H        VAL  19  -4.425  10.405   1.923
  551    HA   VAL  19           HA       VAL  19  -4.636  11.485   4.634
  552    HB   VAL  19           HB       VAL  19  -3.356   8.889   3.811
  553   1HG1  VAL  19          1HG1      VAL  19  -4.787   8.749   6.268
  554   2HG1  VAL  19          2HG1      VAL  19  -3.029   8.681   6.005
  555   3HG1  VAL  19          3HG1      VAL  19  -3.827  10.246   6.290
  556   1HG2  VAL  19          1HG2      VAL  19  -5.549   8.809   2.807
  557   2HG2  VAL  19          2HG2      VAL  19  -5.557   7.796   4.270
  558   3HG2  VAL  19          3HG2      VAL  19  -6.305   9.411   4.301
  559    H    ASP  20           H        ASP  20  -3.003  12.475   2.152
  560    HA   ASP  20           HA       ASP  20  -0.922  13.001   1.638
  561   1HB   ASP  20          1HB       ASP  20  -1.251  14.908   2.910
  562   2HB   ASP  20          2HB       ASP  20  -1.498  14.003   4.410
  563    H    CYS  21           H        CYS  21   0.024  10.815   1.401
  564    HA   CYS  21           HA       CYS  21   0.906   9.204   3.399
  565   1HB   CYS  21          1HB       CYS  21   0.978   9.134   0.703
  566   2HB   CYS  21          2HB       CYS  21   2.691   9.389   1.046
  567    H    GLY  22           H        GLY  22   2.333  12.189   2.039
  568   1HA   GLY  22          1HA       GLY  22   4.176  13.374   2.575
  569   2HA   GLY  22          2HA       GLY  22   3.756  12.962   4.226
  570    H    TYR  23           H        TYR  23   5.217  11.299   1.331
  571    HA   TYR  23           HA       TYR  23   6.964   9.828   3.129
  572   1HB   TYR  23          1HB       TYR  23   5.745   9.659   0.450
  573   2HB   TYR  23          2HB       TYR  23   7.487   9.386   0.329
  574    HD1  TYR  23           HD1      TYR  23   4.286   8.047   1.467
  575    HD2  TYR  23           HD2      TYR  23   8.523   7.454   1.498
  576    HE1  TYR  23           HE1      TYR  23   3.950   5.635   2.197
  577    HE2  TYR  23           HE2      TYR  23   8.173   5.044   2.229
  578    HH   TYR  23           HH       TYR  23   6.602   3.390   2.272
  579    HA   PRO  24           HA       PRO  24  10.353  12.410   2.346
  580   1HB   PRO  24          1HB       PRO  24  12.385  10.771   3.152
  581   2HB   PRO  24          2HB       PRO  24  11.407  11.719   4.272
  582   1HG   PRO  24          1HG       PRO  24  11.316   8.836   3.646
  583   2HG   PRO  24          2HG       PRO  24  10.677   9.691   5.095
  584   1HD   PRO  24          1HD       PRO  24   9.224   8.645   2.860
  585   2HD   PRO  24          2HD       PRO  24   8.568   9.617   4.184
  586    H    HIS  25           H        HIS  25   9.679   9.668   0.606
  587    HA   HIS  25           HA       HIS  25  11.798  10.405  -1.280
  588   1HB   HIS  25          1HB       HIS  25  10.892   7.757  -0.279
  589   2HB   HIS  25          2HB       HIS  25  11.313   7.866  -1.992
  590    HD1  HIS  25           HD1      HIS  25  12.796   8.059   1.471
  591    HD2  HIS  25           HD2      HIS  25  14.061   8.238  -2.525
  592    HE1  HIS  25           HE1      HIS  25  15.341   7.883   1.518
  593    HE2  HIS  25           HE2      HIS  25  16.057   7.943  -0.968
  594    H    VAL  26           H        VAL  26   8.725  11.030  -0.703
  595    HA   VAL  26           HA       VAL  26   7.033  10.065  -2.499
  596    HB   VAL  26           HB       VAL  26   6.340  11.779  -1.062
  597   1HG1  VAL  26          1HG1      VAL  26   8.583  12.884  -0.886
  598   2HG1  VAL  26          2HG1      VAL  26   8.237  13.721  -2.419
  599   3HG1  VAL  26          3HG1      VAL  26   7.218  14.021  -0.991
  600   1HG2  VAL  26          1HG2      VAL  26   4.993  13.057  -2.439
  601   2HG2  VAL  26          2HG2      VAL  26   6.284  13.330  -3.634
  602   3HG2  VAL  26          3HG2      VAL  26   5.474  11.748  -3.546
  603    H    THR  27           H        THR  27   6.981   9.675  -4.651
  604    HA   THR  27           HA       THR  27   7.967  11.542  -6.537
  605    HB   THR  27           HB       THR  27   9.870   9.653  -5.415
  606    HG1  THR  27           HG1      THR  27  11.008  11.352  -6.274
  607   1HG2  THR  27          1HG2      THR  27   9.494   8.014  -7.103
  608   2HG2  THR  27          2HG2      THR  27   9.016   9.236  -8.305
  609   3HG2  THR  27          3HG2      THR  27  10.727   9.063  -7.844
  610    HA   PRO  28           HA       PRO  28   5.237   9.263  -8.936
  611   1HB   PRO  28          1HB       PRO  28   5.984   9.982 -11.462
  612   2HB   PRO  28          2HB       PRO  28   4.983  10.998 -10.428
  613   1HG   PRO  28          1HG       PRO  28   7.844  11.227 -11.111
  614   2HG   PRO  28          2HG       PRO  28   6.736  12.495 -10.473
  615   1HD   PRO  28          1HD       PRO  28   8.776  11.046  -9.079
  616   2HD   PRO  28          2HD       PRO  28   7.607  12.168  -8.370
  617    H    LYS  29           H        LYS  29   7.069   7.590  -7.883
  618    HA   LYS  29           HA       LYS  29   6.956   5.475  -9.670
  619   1HB   LYS  29          1HB       LYS  29   8.729   7.074 -10.741
  620   2HB   LYS  29          2HB       LYS  29   9.810   6.389  -9.516
  621   1HG   LYS  29          1HG       LYS  29   9.823   4.320 -10.505
  622   2HG   LYS  29          2HG       LYS  29   8.130   4.425 -11.018
  623   1HD   LYS  29          1HD       LYS  29   8.724   5.843 -12.891
  624   2HD   LYS  29          2HD       LYS  29  10.388   6.021 -12.310
  625   1HE   LYS  29          1HE       LYS  29  10.480   3.414 -12.512
  626   2HE   LYS  29          2HE       LYS  29   9.041   3.586 -13.527
  627   1HZ   LYS  29          1HZ       LYS  29  10.611   3.850 -15.079
  628   2HZ   LYS  29          2HZ       LYS  29  10.612   5.405 -14.580
  629   3HZ   LYS  29          3HZ       LYS  29  11.760   4.375 -14.044
  630    H    GLU  30           H        GLU  30   7.973   7.135  -6.802
  631    HA   GLU  30           HA       GLU  30   8.899   4.638  -5.648
  632   1HB   GLU  30          1HB       GLU  30   9.461   7.484  -5.211
  633   2HB   GLU  30          2HB       GLU  30   9.148   6.626  -3.694
  634   1HG   GLU  30          1HG       GLU  30  11.388   6.157  -3.876
  635   2HG   GLU  30          2HG       GLU  30  10.795   4.824  -4.879
  636    H    CYS  31           H        CYS  31   6.487   7.293  -5.215
  637    HA   CYS  31           HA       CYS  31   5.331   6.389  -2.892
  638   1HB   CYS  31          1HB       CYS  31   4.258   7.932  -5.237
  639   2HB   CYS  31          2HB       CYS  31   3.232   7.529  -3.858
  640    H    ASN  32           H        ASN  32   4.397   5.733  -6.353
  641    HA   ASN  32           HA       ASN  32   2.379   3.963  -5.739
  642   1HB   ASN  32          1HB       ASN  32   4.058   4.621  -8.126
  643   2HB   ASN  32          2HB       ASN  32   3.250   3.047  -8.182
  644   1HD2  ASN  32          1HD2      ASN  32   2.382   6.226  -6.829
  645   2HD2  ASN  32          2HD2      ASN  32   0.882   6.422  -7.673
  646    H    ASN  33           H        ASN  33   5.787   3.722  -5.339
  647    HA   ASN  33           HA       ASN  33   5.840   0.869  -5.739
  648   1HB   ASN  33          1HB       ASN  33   7.730   2.564  -6.363
  649   2HB   ASN  33          2HB       ASN  33   8.109   2.582  -4.634
  650   1HD2  ASN  33          1HD2      ASN  33  10.161   1.802  -5.730
  651   2HD2  ASN  33          2HD2      ASN  33  10.387   0.090  -5.865
  652    H    ARG  34           H        ARG  34   5.659   3.379  -3.236
  653    HA   ARG  34           HA       ARG  34   6.351   1.536  -1.157
  654   1HB   ARG  34          1HB       ARG  34   5.188   4.322  -0.790
  655   2HB   ARG  34          2HB       ARG  34   6.248   3.436   0.319
  656   1HG   ARG  34          1HG       ARG  34   7.667   3.592  -2.119
  657   2HG   ARG  34          2HG       ARG  34   6.941   5.196  -1.909
  658   1HD   ARG  34          1HD       ARG  34   8.265   5.682  -0.109
  659   2HD   ARG  34          2HD       ARG  34   8.154   4.046   0.555
  660    HE   ARG  34           HE       ARG  34   9.718   3.853  -1.783
  661   1HH1  ARG  34          1HH1      ARG  34   9.915   5.499   1.321
  662   2HH1  ARG  34          2HH1      ARG  34  11.648   5.503   1.353
  663   1HH2  ARG  34          1HH2      ARG  34  12.002   3.858  -1.741
  664   2HH2  ARG  34          2HH2      ARG  34  12.842   4.563  -0.401
  665    H    GLY  35           H        GLY  35   3.514   2.799  -2.816
  666   1HA   GLY  35          1HA       GLY  35   1.524   1.406  -2.564
  667   2HA   GLY  35          2HA       GLY  35   1.775   1.459  -0.831
  668    H    CYS  36           H        CYS  36   2.495   4.338  -2.765
  669    HA   CYS  36           HA       CYS  36   0.002   5.518  -1.770
  670   1HB   CYS  36          1HB       CYS  36   2.666   6.910  -2.061
  671   2HB   CYS  36          2HB       CYS  36   1.164   7.626  -1.472
  672    H    CYS  37           H        CYS  37  -0.474   7.638  -3.153
  673    HA   CYS  37           HA       CYS  37   0.114   6.960  -5.944
  674   1HB   CYS  37          1HB       CYS  37  -2.298   6.780  -4.973
  675   2HB   CYS  37          2HB       CYS  37  -2.301   8.539  -5.132
  676    H    PHE  38           H        PHE  38   1.180   8.548  -7.109
  677    HA   PHE  38           HA       PHE  38   1.686  11.046  -5.704
  678   1HB   PHE  38          1HB       PHE  38   3.487   9.511  -6.712
  679   2HB   PHE  38          2HB       PHE  38   2.812   9.856  -8.309
  680    HD1  PHE  38           HD1      PHE  38   3.240  11.957  -9.390
  681    HD2  PHE  38           HD2      PHE  38   4.658  11.252  -5.453
  682    HE1  PHE  38           HE1      PHE  38   4.716  13.981  -9.560
  683    HE2  PHE  38           HE2      PHE  38   6.134  13.276  -5.623
  684    HZ   PHE  38           HZ       PHE  38   6.146  14.615  -7.674
  685    H    ASP  39           H        ASP  39   0.498  12.827  -6.181
  686    HA   ASP  39           HA       ASP  39  -1.124  12.775  -8.526
  687   1HB   ASP  39          1HB       ASP  39  -2.026  13.673  -6.439
  688   2HB   ASP  39          2HB       ASP  39  -0.711  14.853  -6.327
  689    H    SER  40           H        SER  40   0.749  15.553  -7.128
  690    HA   SER  40           HA       SER  40   2.432  16.718  -7.969
  691   1HB   SER  40          1HB       SER  40   2.786  14.540  -9.502
  692   2HB   SER  40          2HB       SER  40   2.235  15.650 -10.768
  693    HG   SER  40           HG       SER  40   3.947  17.149  -9.868
  694    H    ARG  41           H        ARG  41  -0.732  16.279  -9.264
  695    HA   ARG  41           HA       ARG  41  -0.739  18.312 -11.158
  696   1HB   ARG  41          1HB       ARG  41  -3.036  17.257  -9.444
  697   2HB   ARG  41          2HB       ARG  41  -3.223  18.173 -10.950
  698   1HG   ARG  41          1HG       ARG  41  -1.545  16.142 -11.744
  699   2HG   ARG  41          2HG       ARG  41  -2.525  15.313 -10.522
  700   1HD   ARG  41          1HD       ARG  41  -3.629  15.049 -12.656
  701   2HD   ARG  41          2HD       ARG  41  -4.591  16.202 -11.720
  702    HE   ARG  41           HE       ARG  41  -3.933  17.925 -13.201
  703   1HH1  ARG  41          1HH1      ARG  41  -2.126  14.979 -13.862
  704   2HH1  ARG  41          2HH1      ARG  41  -1.488  15.555 -15.365
  705   1HH2  ARG  41          1HH2      ARG  41  -3.090  18.687 -15.184
  706   2HH2  ARG  41          2HH2      ARG  41  -2.039  17.678 -16.122
  707    H    ILE  42           H        ILE  42  -1.398  18.196  -7.619
  708    HA   ILE  42           HA       ILE  42  -1.481  21.132  -7.655
  709    HB   ILE  42           HB       ILE  42  -2.891  19.491  -5.583
  710   1HG1  ILE  42          1HG1      ILE  42  -3.861  20.143  -8.358
  711   2HG1  ILE  42          2HG1      ILE  42  -3.871  18.580  -7.523
  712   1HG2  ILE  42          1HG2      ILE  42  -3.555  22.225  -6.687
  713   2HG2  ILE  42          2HG2      ILE  42  -4.142  21.463  -5.190
  714   3HG2  ILE  42          3HG2      ILE  42  -2.440  21.966  -5.324
  715   1HD1  ILE  42          1HD1      ILE  42  -6.074  19.149  -7.164
  716   2HD1  ILE  42          2HD1      ILE  42  -5.379  20.037  -5.788
  717   3HD1  ILE  42          3HD1      ILE  42  -5.752  20.894  -7.301
  718    HA   PRO  43           HA       PRO  43   2.075  20.300  -5.212
  719   1HB   PRO  43          1HB       PRO  43   3.167  22.796  -5.412
  720   2HB   PRO  43          2HB       PRO  43   3.470  21.515  -6.585
  721   1HG   PRO  43          1HG       PRO  43   1.718  23.881  -6.770
  722   2HG   PRO  43          2HG       PRO  43   2.385  22.870  -8.103
  723   1HD   PRO  43          1HD       PRO  43  -0.280  22.902  -7.055
  724   2HD   PRO  43          2HD       PRO  43   0.367  21.778  -8.257
  725    H    GLY  44           H        GLY  44  -0.626  22.064  -4.616
  726   1HA   GLY  44          1HA       GLY  44   0.342  23.148  -2.081
  727   2HA   GLY  44          2HA       GLY  44  -1.217  23.420  -2.831
  728    H    VAL  45           H        VAL  45  -0.866  20.187  -3.293
  729    HA   VAL  45           HA       VAL  45  -1.951  19.540  -0.639
  730    HB   VAL  45           HB       VAL  45  -3.652  18.318  -1.564
  731   1HG1  VAL  45          1HG1      VAL  45  -3.280  20.911  -2.583
  732   2HG1  VAL  45          2HG1      VAL  45  -3.824  19.932  -3.967
  733   3HG1  VAL  45          3HG1      VAL  45  -4.804  19.997  -2.481
  734   1HG2  VAL  45          1HG2      VAL  45  -2.182  16.929  -3.010
  735   2HG2  VAL  45          2HG2      VAL  45  -3.714  17.375  -3.799
  736   3HG2  VAL  45          3HG2      VAL  45  -2.209  18.220  -4.234
  737    HA   PRO  46           HA       PRO  46   0.701  16.104  -0.622
  738   1HB   PRO  46          1HB       PRO  46  -0.800  13.873  -0.138
  739   2HB   PRO  46          2HB       PRO  46  -0.356  15.027   1.117
  740   1HG   PRO  46          1HG       PRO  46  -2.923  14.643  -0.285
  741   2HG   PRO  46          2HG       PRO  46  -2.614  15.462   1.289
  742   1HD   PRO  46          1HD       PRO  46  -3.174  16.650  -1.255
  743   2HD   PRO  46          2HD       PRO  46  -2.719  17.498   0.228
  744    H    TRP  47           H        TRP  47   1.974  15.535  -2.258
  745    HA   TRP  47           HA       TRP  47   0.611  14.501  -4.607
  746   1HB   TRP  47          1HB       TRP  47   3.501  14.682  -4.755
  747   2HB   TRP  47          2HB       TRP  47   2.260  15.407  -5.779
  748    HD1  TRP  47           HD1      TRP  47   1.180  17.820  -4.688
  749    HE1  TRP  47           HE1      TRP  47   2.356  19.806  -3.408
  750    HE3  TRP  47           HE3      TRP  47   5.298  15.181  -3.299
  751    HZ2  TRP  47           HZ2      TRP  47   4.820  20.044  -1.990
  752    HZ3  TRP  47           HZ3      TRP  47   7.042  16.364  -1.968
  753    HH2  TRP  47           HH2      TRP  47   6.852  18.712  -1.314
  754    H    CYS  48           H        CYS  48   0.729  12.971  -2.037
  755    HA   CYS  48           HA       CYS  48   1.522  10.508  -3.140
  756   1HB   CYS  48          1HB       CYS  48   3.753  11.480  -2.545
  757   2HB   CYS  48          2HB       CYS  48   3.258  11.445  -0.851
  758    H    PHE  49           H        PHE  49  -0.339   9.493  -2.437
  759    HA   PHE  49           HA       PHE  49  -0.787   9.430   0.428
  760   1HB   PHE  49          1HB       PHE  49  -3.352   9.708  -0.445
  761   2HB   PHE  49          2HB       PHE  49  -2.380  11.115  -0.006
  762    HD1  PHE  49           HD1      PHE  49  -0.954  12.111  -1.997
  763    HD2  PHE  49           HD2      PHE  49  -4.402   9.687  -2.487
  764    HE1  PHE  49           HE1      PHE  49  -1.274  13.034  -4.309
  765    HE2  PHE  49           HE2      PHE  49  -4.722  10.609  -4.800
  766    HZ   PHE  49           HZ       PHE  49  -3.154  12.271  -5.683
  767    H    LYS  50           H        LYS  50  -3.231   8.061   0.438
  768    HA   LYS  50           HA       LYS  50  -2.599   5.689  -1.179
  769   1HB   LYS  50          1HB       LYS  50  -3.981   4.862   1.123
  770   2HB   LYS  50          2HB       LYS  50  -2.286   4.552   0.703
  771   1HG   LYS  50          1HG       LYS  50  -3.065   7.195   1.936
  772   2HG   LYS  50          2HG       LYS  50  -2.913   5.771   2.980
  773   1HD   LYS  50          1HD       LYS  50  -0.786   7.002   1.184
  774   2HD   LYS  50          2HD       LYS  50  -0.772   6.928   2.954
  775   1HE   LYS  50          1HE       LYS  50  -0.363   4.703   0.941
  776   2HE   LYS  50          2HE       LYS  50   0.679   5.166   2.294
  777   1HZ   LYS  50          1HZ       LYS  50  -1.286   4.476   3.699
  778   2HZ   LYS  50          2HZ       LYS  50  -1.868   3.735   2.365
  779   3HZ   LYS  50          3HZ       LYS  50  -0.428   3.281   2.988
  780    HA   PRO  51           HA       PRO  51  -6.780   7.153  -2.115
  781   1HB   PRO  51          1HB       PRO  51  -6.503   7.328  -4.827
  782   2HB   PRO  51          2HB       PRO  51  -6.294   8.705  -3.745
  783   1HG   PRO  51          1HG       PRO  51  -4.276   7.059  -5.133
  784   2HG   PRO  51          2HG       PRO  51  -4.096   8.711  -4.443
  785   1HD   PRO  51          1HD       PRO  51  -3.142   6.227  -3.387
  786   2HD   PRO  51          2HD       PRO  51  -3.077   7.806  -2.591
  787    H    LEU  52           H        LEU  52  -6.000   5.627  -5.093
  788    HA   LEU  52           HA       LEU  52  -7.683   3.397  -4.235
  789   1HB   LEU  52          1HB       LEU  52  -8.370   3.164  -6.378
  790   2HB   LEU  52          2HB       LEU  52  -8.113   4.916  -6.297
  791    HG   LEU  52           HG       LEU  52  -5.679   3.736  -7.169
  792   1HD1  LEU  52          1HD1      LEU  52  -6.304   1.848  -8.181
  793   2HD1  LEU  52          2HD1      LEU  52  -8.034   2.258  -8.083
  794   3HD1  LEU  52          3HD1      LEU  52  -7.041   2.901  -9.414
  795   1HD2  LEU  52          1HD2      LEU  52  -7.214   4.945  -9.301
  796   2HD2  LEU  52          2HD2      LEU  52  -7.356   5.890  -7.800
  797   3HD2  LEU  52          3HD2      LEU  52  -5.750   5.530  -8.475
  798    H    GLN  53           H        GLN  53  -5.088   3.469  -3.132
  799    HA   GLN  53           HA       GLN  53  -3.166   2.216  -4.632
  800   1HB   GLN  53          1HB       GLN  53  -3.711   2.009  -1.645
  801   2HB   GLN  53          2HB       GLN  53  -2.188   1.549  -2.425
  802   1HG   GLN  53          1HG       GLN  53  -3.453   4.322  -2.390
  803   2HG   GLN  53          2HG       GLN  53  -2.024   3.823  -1.473
  804   1HE2  GLN  53          1HE2      GLN  53  -3.358   4.661  -4.568
  805   2HE2  GLN  53          2HE2      GLN  53  -1.878   4.816  -5.453
  806    H    GLU  54           H        GLU  54  -6.219   1.022  -3.642
  807    HA   GLU  54           HA       GLU  54  -5.742  -1.563  -2.974
  808   1HB   GLU  54          1HB       GLU  54  -8.014  -2.019  -3.975
  809   2HB   GLU  54          2HB       GLU  54  -7.973  -0.642  -2.860
  810   1HG   GLU  54          1HG       GLU  54  -8.940   0.552  -4.519
  811   2HG   GLU  54          2HG       GLU  54  -7.378   0.501  -5.351
  812    H    ALA  55           H        ALA  55  -5.041   0.035  -5.962
  813    HA   ALA  55           HA       ALA  55  -5.421  -1.620  -7.979
  814   1HB   ALA  55          1HB       ALA  55  -3.926  -0.226  -8.909
  815   2HB   ALA  55          2HB       ALA  55  -3.535   0.387  -7.284
  816   3HB   ALA  55          3HB       ALA  55  -2.606  -0.966  -7.972
  817    H    GLU  56           H        GLU  56  -2.432  -2.003  -5.938
  818    HA   GLU  56           HA       GLU  56  -2.862  -4.865  -6.107
  819   1HB   GLU  56          1HB       GLU  56  -0.443  -3.344  -7.084
  820   2HB   GLU  56          2HB       GLU  56  -0.261  -5.004  -6.489
  821   1HG   GLU  56          1HG       GLU  56  -2.122  -5.654  -8.112
  822   2HG   GLU  56          2HG       GLU  56  -1.990  -4.031  -8.806
  823    H    CYS  57           H        CYS  57  -2.812  -2.367  -4.137
  824    HA   CYS  57           HA       CYS  57  -0.789  -3.274  -2.285
  825   1HB   CYS  57          1HB       CYS  57  -1.584  -0.820  -2.859
  826   2HB   CYS  57          2HB       CYS  57  -2.768  -1.151  -1.592
  827    H    THR  58           H        THR  58  -4.373  -2.590  -2.222
  828    HA   THR  58           HA       THR  58  -4.830  -4.008   0.156
  829    HB   THR  58           HB       THR  58  -6.243  -2.203  -1.128
  830    HG1  THR  58           HG1      THR  58  -8.196  -3.493  -0.250
  831   1HG2  THR  58          1HG2      THR  58  -6.596  -3.374  -3.263
  832   2HG2  THR  58          2HG2      THR  58  -7.184  -4.822  -2.409
  833   3HG2  THR  58          3HG2      THR  58  -8.146  -3.324  -2.390
  834    H    PHE  59           H        PHE  59  -4.360  -5.068  -3.160
  835    HA   PHE  59           HA       PHE  59  -5.701  -7.295  -3.495
  836   1HB   PHE  59          1HB       PHE  59  -2.946  -6.327  -3.963
  837   2HB   PHE  59          2HB       PHE  59  -2.985  -8.091  -3.873
  838    HD1  PHE  59           HD1      PHE  59  -5.166  -5.451  -5.383
  839    HD2  PHE  59           HD2      PHE  59  -3.032  -9.075  -5.945
  840    HE1  PHE  59           HE1      PHE  59  -5.945  -5.540  -7.767
  841    HE2  PHE  59           HE2      PHE  59  -3.810  -9.163  -8.330
  842    HZ   PHE  59           HZ       PHE  59  -5.257  -7.395  -9.212
  Start of MODEL   10
    1   1H    GLU   1           H1       GLU   1 -12.458 -13.694  -6.437
    2    HA   GLU   1           HA       GLU   1 -11.157 -13.819  -4.484
    3   1HB   GLU   1          1HB       GLU   1  -9.272 -12.373  -6.220
    4   2HB   GLU   1          2HB       GLU   1  -9.346 -11.704  -4.581
    5   1HG   GLU   1          1HG       GLU   1  -8.517 -13.640  -3.614
    6   2HG   GLU   1          2HG       GLU   1  -9.192 -14.696  -4.865
    7    H    GLU   2           H        GLU   2 -12.742 -12.992  -3.182
    8    HA   GLU   2           HA       GLU   2 -13.764 -10.381  -3.765
    9   1HB   GLU   2          1HB       GLU   2 -14.490 -12.380  -1.588
   10   2HB   GLU   2          2HB       GLU   2 -15.396 -10.901  -1.954
   11   1HG   GLU   2          1HG       GLU   2 -16.397 -11.836  -3.769
   12   2HG   GLU   2          2HG       GLU   2 -14.905 -12.616  -4.319
   13    H    TYR   3           H        TYR   3 -14.126 -10.780  -0.461
   14    HA   TYR   3           HA       TYR   3 -12.044  -8.818   0.048
   15   1HB   TYR   3          1HB       TYR   3 -13.348  -8.984   2.349
   16   2HB   TYR   3          2HB       TYR   3 -14.215  -8.294   0.973
   17    HD1  TYR   3           HD1      TYR   3 -16.033  -9.528  -0.101
   18    HD2  TYR   3           HD2      TYR   3 -13.910 -11.186   3.224
   19    HE1  TYR   3           HE1      TYR   3 -17.854 -11.277   0.200
   20    HE2  TYR   3           HE2      TYR   3 -15.739 -12.928   3.513
   21    HH   TYR   3           HH       TYR   3 -18.440 -12.841   2.781
   22    H    VAL   4           H        VAL   4 -10.438 -10.730  -0.407
   23    HA   VAL   4           HA       VAL   4  -9.882 -11.945   2.203
   24    HB   VAL   4           HB       VAL   4 -10.904 -13.618   0.747
   25   1HG1  VAL   4          1HG1      VAL   4 -10.029 -14.274  -1.356
   26   2HG1  VAL   4          2HG1      VAL   4 -10.115 -12.496  -1.403
   27   3HG1  VAL   4          3HG1      VAL   4  -8.553 -13.305  -1.133
   28   1HG2  VAL   4          1HG2      VAL   4  -8.288 -14.786   0.574
   29   2HG2  VAL   4          2HG2      VAL   4  -8.387 -13.808   2.058
   30   3HG2  VAL   4          3HG2      VAL   4  -9.578 -15.097   1.759
   31    H    GLY   5           H        GLY   5  -8.659 -11.035  -1.082
   32   1HA   GLY   5          1HA       GLY   5  -5.919 -11.122  -0.346
   33   2HA   GLY   5          2HA       GLY   5  -6.617 -10.370  -1.767
   34    H    LEU   6           H        LEU   6  -8.373  -9.104   0.779
   35    HA   LEU   6           HA       LEU   6  -6.404  -7.029   1.377
   36   1HB   LEU   6          1HB       LEU   6  -8.136  -5.313   1.009
   37   2HB   LEU   6          2HB       LEU   6  -7.570  -6.111  -0.468
   38    HG   LEU   6           HG       LEU   6 -10.058  -5.605  -0.272
   39   1HD1  LEU   6          1HD1      LEU   6  -8.665  -7.861  -1.359
   40   2HD1  LEU   6          2HD1      LEU   6 -10.287  -8.372  -0.834
   41   3HD1  LEU   6          3HD1      LEU   6 -10.106  -7.019  -1.977
   42   1HD2  LEU   6          1HD2      LEU   6 -11.462  -7.027   1.026
   43   2HD2  LEU   6          2HD2      LEU   6 -10.087  -8.042   1.522
   44   3HD2  LEU   6          3HD2      LEU   6 -10.220  -6.369   2.117
   45    H    SER   7           H        SER   7  -7.807  -9.473   2.682
   46    HA   SER   7           HA       SER   7  -9.088  -7.993   4.836
   47   1HB   SER   7          1HB       SER   7 -10.354  -9.848   3.664
   48   2HB   SER   7          2HB       SER   7  -9.178 -10.996   4.325
   49    HG   SER   7           HG       SER   7  -9.815 -10.004   6.485
   50    H    ALA   8           H        ALA   8  -8.538  -8.614   7.091
   51    HA   ALA   8           HA       ALA   8  -5.762  -8.871   7.446
   52   1HB   ALA   8          1HB       ALA   8  -7.519  -9.510   9.740
   53   2HB   ALA   8          2HB       ALA   8  -6.268  -8.257   9.572
   54   3HB   ALA   8          3HB       ALA   8  -7.901  -7.977   8.922
   55    H    ASN   9           H        ASN   9  -5.557 -10.872   6.013
   56    HA   ASN   9           HA       ASN   9  -5.230 -13.079   7.725
   57   1HB   ASN   9          1HB       ASN   9  -7.774 -12.935   6.629
   58   2HB   ASN   9          2HB       ASN   9  -6.933 -13.931   5.431
   59   1HD2  ASN   9          1HD2      ASN   9  -5.522 -15.678   6.395
   60   2HD2  ASN   9          2HD2      ASN   9  -6.180 -16.609   7.699
   61    H    GLN  10           H        GLN  10  -5.376 -11.536   4.509
   62    HA   GLN  10           HA       GLN  10  -4.071 -13.455   3.034
   63   1HB   GLN  10          1HB       GLN  10  -5.257 -11.337   2.245
   64   2HB   GLN  10          2HB       GLN  10  -3.772 -10.452   2.635
   65   1HG   GLN  10          1HG       GLN  10  -2.919 -12.685   1.143
   66   2HG   GLN  10          2HG       GLN  10  -4.391 -12.148   0.324
   67   1HE2  GLN  10          1HE2      GLN  10  -4.197  -9.405   1.069
   68   2HE2  GLN  10          2HE2      GLN  10  -2.906  -8.677   0.172
   69    H    CYS  11           H        CYS  11  -2.850 -10.978   5.296
   70    HA   CYS  11           HA       CYS  11  -0.174 -11.087   4.501
   71   1HB   CYS  11          1HB       CYS  11  -0.977  -9.263   5.806
   72   2HB   CYS  11          2HB       CYS  11  -1.471 -10.331   7.122
   73    H    ALA  12           H        ALA  12  -2.222 -13.470   5.772
   74    HA   ALA  12           HA       ALA  12   0.009 -14.840   7.105
   75   1HB   ALA  12          1HB       ALA  12  -1.471 -15.381   8.705
   76   2HB   ALA  12          2HB       ALA  12  -2.668 -14.342   7.896
   77   3HB   ALA  12          3HB       ALA  12  -2.580 -16.075   7.499
   78    H    VAL  13           H        VAL  13  -0.845 -14.502   4.107
   79    HA   VAL  13           HA       VAL  13  -1.927 -16.701   3.019
   80    HB   VAL  13           HB       VAL  13  -0.383 -14.553   2.185
   81   1HG1  VAL  13          1HG1      VAL  13   1.658 -15.895   2.292
   82   2HG1  VAL  13          2HG1      VAL  13   0.916 -17.136   1.255
   83   3HG1  VAL  13          3HG1      VAL  13   1.247 -15.513   0.604
   84   1HG2  VAL  13          1HG2      VAL  13  -0.984 -16.244  -0.056
   85   2HG2  VAL  13          2HG2      VAL  13  -2.298 -16.375   1.138
   86   3HG2  VAL  13          3HG2      VAL  13  -1.828 -14.779   0.504
   87    HA   PRO  14           HA       PRO  14   0.616 -20.108   3.788
   88   1HB   PRO  14          1HB       PRO  14   0.539 -21.538   1.462
   89   2HB   PRO  14          2HB       PRO  14  -0.768 -21.550   2.645
   90   1HG   PRO  14          1HG       PRO  14  -0.571 -20.160   0.049
   91   2HG   PRO  14          2HG       PRO  14  -2.046 -20.558   1.002
   92   1HD   PRO  14          1HD       PRO  14  -0.748 -18.022   0.706
   93   2HD   PRO  14          2HD       PRO  14  -2.104 -18.395   1.779
   94    H    ALA  15           H        ALA  15   1.951 -17.665   2.827
   95    HA   ALA  15           HA       ALA  15   3.940 -17.022   2.079
   96   1HB   ALA  15          1HB       ALA  15   4.371 -18.611   4.125
   97   2HB   ALA  15          2HB       ALA  15   5.053 -19.705   2.898
   98   3HB   ALA  15          3HB       ALA  15   5.743 -18.081   3.124
   99    H    LYS  16           H        LYS  16   2.881 -17.237  -0.145
  100    HA   LYS  16           HA       LYS  16   4.605 -18.017  -2.022
  101   1HB   LYS  16          1HB       LYS  16   3.489 -20.250  -2.786
  102   2HB   LYS  16          2HB       LYS  16   4.776 -20.266  -1.567
  103   1HG   LYS  16          1HG       LYS  16   3.379 -21.116  -0.011
  104   2HG   LYS  16          2HG       LYS  16   2.153 -19.875  -0.328
  105   1HD   LYS  16          1HD       LYS  16   2.584 -22.304  -2.110
  106   2HD   LYS  16          2HD       LYS  16   1.439 -22.302  -0.758
  107   1HE   LYS  16          1HE       LYS  16   0.461 -20.162  -1.877
  108   2HE   LYS  16          2HE       LYS  16   1.369 -20.657  -3.314
  109   1HZ   LYS  16          1HZ       LYS  16   0.178 -22.679  -3.346
  110   2HZ   LYS  16          2HZ       LYS  16  -0.523 -22.398  -1.899
  111   3HZ   LYS  16          3HZ       LYS  16  -0.930 -21.488  -3.192
  112    H    ASP  17           H        ASP  17   2.914 -15.944  -1.765
  113    HA   ASP  17           HA       ASP  17   1.389 -16.193  -4.126
  114   1HB   ASP  17          1HB       ASP  17  -0.119 -17.142  -2.275
  115   2HB   ASP  17          2HB       ASP  17  -0.154 -15.512  -1.587
  116    H    ARG  18           H        ARG  18   2.610 -14.528  -1.258
  117    HA   ARG  18           HA       ARG  18   1.658 -12.045  -1.469
  118   1HB   ARG  18          1HB       ARG  18   4.577 -12.804  -0.989
  119   2HB   ARG  18          2HB       ARG  18   3.830 -11.277  -0.492
  120   1HG   ARG  18          1HG       ARG  18   2.811 -12.230   1.308
  121   2HG   ARG  18          2HG       ARG  18   2.384 -13.705   0.424
  122   1HD   ARG  18          1HD       ARG  18   4.728 -14.499   0.649
  123   2HD   ARG  18          2HD       ARG  18   5.151 -13.026   1.535
  124    HE   ARG  18           HE       ARG  18   2.904 -14.570   2.655
  125   1HH1  ARG  18          1HH1      ARG  18   6.373 -13.986   2.711
  126   2HH1  ARG  18          2HH1      ARG  18   6.588 -14.647   4.299
  127   1HH2  ARG  18          1HH2      ARG  18   3.186 -15.441   4.748
  128   2HH2  ARG  18          2HH2      ARG  18   4.763 -15.480   5.465
  129    H    VAL  19           H        VAL  19   3.196 -10.023  -2.202
  130    HA   VAL  19           HA       VAL  19   3.850 -10.559  -5.015
  131    HB   VAL  19           HB       VAL  19   2.867  -8.055  -3.635
  132   1HG1  VAL  19          1HG1      VAL  19   4.056  -8.521  -6.334
  133   2HG1  VAL  19          2HG1      VAL  19   2.656  -7.428  -6.226
  134   3HG1  VAL  19          3HG1      VAL  19   4.125  -7.088  -5.280
  135   1HG2  VAL  19          1HG2      VAL  19   0.988  -9.409  -3.886
  136   2HG2  VAL  19          2HG2      VAL  19   0.970  -8.436  -5.376
  137   3HG2  VAL  19          3HG2      VAL  19   1.570 -10.112  -5.415
  138    H    ASP  20           H        ASP  20   5.491 -10.812  -2.396
  139    HA   ASP  20           HA       ASP  20   7.385 -10.080  -1.532
  140   1HB   ASP  20          1HB       ASP  20   8.455 -11.493  -3.017
  141   2HB   ASP  20          2HB       ASP  20   7.821 -10.658  -4.443
  142    H    CYS  21           H        CYS  21   7.012  -7.899  -0.793
  143    HA   CYS  21           HA       CYS  21   6.770  -5.690  -2.410
  144   1HB   CYS  21          1HB       CYS  21   6.779  -6.221   0.306
  145   2HB   CYS  21          2HB       CYS  21   8.140  -5.116   0.099
  146    H    GLY  22           H        GLY  22   9.626  -7.482  -1.214
  147   1HA   GLY  22          1HA       GLY  22  11.811  -7.348  -1.715
  148   2HA   GLY  22          2HA       GLY  22  11.332  -6.602  -3.226
  149    H    TYR  23           H        TYR  23  11.238  -5.616   0.280
  150    HA   TYR  23           HA       TYR  23  12.093  -2.955  -0.512
  151   1HB   TYR  23          1HB       TYR  23  10.357  -4.100   1.362
  152   2HB   TYR  23          2HB       TYR  23  11.784  -3.795   2.358
  153    HD1  TYR  23           HD1      TYR  23  10.597  -1.712  -0.492
  154    HD2  TYR  23           HD2      TYR  23  10.957  -2.065   3.756
  155    HE1  TYR  23           HE1      TYR  23   9.875   0.711  -0.222
  156    HE2  TYR  23           HE2      TYR  23  10.235   0.359   4.013
  157    HH   TYR  23           HH       TYR  23  10.190   2.505   1.448
  158    HA   PRO  24           HA       PRO  24  16.204  -3.658   0.674
  159   1HB   PRO  24          1HB       PRO  24  17.075  -1.074   0.834
  160   2HB   PRO  24          2HB       PRO  24  16.954  -1.958  -0.686
  161   1HG   PRO  24          1HG       PRO  24  15.197   0.125   0.442
  162   2HG   PRO  24          2HG       PRO  24  15.346  -0.411  -1.271
  163   1HD   PRO  24          1HD       PRO  24  13.263  -1.000   0.605
  164   2HD   PRO  24          2HD       PRO  24  13.446  -1.681  -1.017
  165    H    HIS  25           H        HIS  25  13.901  -2.267   2.641
  166    HA   HIS  25           HA       HIS  25  15.737  -2.606   4.894
  167   1HB   HIS  25          1HB       HIS  25  13.862  -0.339   4.296
  168   2HB   HIS  25          2HB       HIS  25  14.259  -0.749   5.969
  169    HD1  HIS  25           HD1      HIS  25  15.096   1.987   4.861
  170    HD2  HIS  25           HD2      HIS  25  17.539  -1.420   4.712
  171    HE1  HIS  25           HE1      HIS  25  17.492   2.836   4.652
  172    HE2  HIS  25           HE2      HIS  25  18.951   0.699   4.621
  173    H    VAL  26           H        VAL  26  14.141  -4.669   3.805
  174    HA   VAL  26           HA       VAL  26  11.589  -4.847   4.881
  175    HB   VAL  26           HB       VAL  26  12.117  -6.351   3.208
  176   1HG1  VAL  26          1HG1      VAL  26  14.712  -6.660   4.659
  177   2HG1  VAL  26          2HG1      VAL  26  14.130  -8.034   3.690
  178   3HG1  VAL  26          3HG1      VAL  26  14.387  -6.449   2.922
  179   1HG2  VAL  26          1HG2      VAL  26  11.084  -7.326   5.455
  180   2HG2  VAL  26          2HG2      VAL  26  11.447  -8.372   4.062
  181   3HG2  VAL  26          3HG2      VAL  26  12.576  -8.297   5.436
  182    H    THR  27           H        THR  27  10.911  -4.865   6.955
  183    HA   THR  27           HA       THR  27  12.112  -6.517   8.902
  184    HB   THR  27           HB       THR  27  13.420  -4.019   8.492
  185    HG1  THR  27           HG1      THR  27  14.601  -4.951  10.272
  186   1HG2  THR  27          1HG2      THR  27  11.846  -2.750   9.816
  187   2HG2  THR  27          2HG2      THR  27  11.630  -4.092  10.965
  188   3HG2  THR  27          3HG2      THR  27  13.160  -3.183  10.935
  189    HA   PRO  28           HA       PRO  28   8.222  -5.877  10.591
  190   1HB   PRO  28          1HB       PRO  28   8.589  -6.710  13.166
  191   2HB   PRO  28          2HB       PRO  28   8.352  -7.821  11.818
  192   1HG   PRO  28          1HG       PRO  28  10.818  -7.095  13.267
  193   2HG   PRO  28          2HG       PRO  28  10.498  -8.546  12.249
  194   1HD   PRO  28          1HD       PRO  28  12.039  -6.220  11.602
  195   2HD   PRO  28          2HD       PRO  28  11.623  -7.548  10.510
  196    H    LYS  29           H        LYS  29   9.098  -3.479  10.160
  197    HA   LYS  29           HA       LYS  29   7.873  -1.977  12.132
  198   1HB   LYS  29          1HB       LYS  29   9.748  -2.648  13.555
  199   2HB   LYS  29          2HB       LYS  29  10.895  -1.954  12.395
  200   1HG   LYS  29          1HG       LYS  29  10.524   0.146  13.155
  201   2HG   LYS  29          2HG       LYS  29   8.765  -0.061  13.140
  202   1HD   LYS  29          1HD       LYS  29   9.155   0.201  15.414
  203   2HD   LYS  29          2HD       LYS  29   9.251  -1.564  15.287
  204   1HE   LYS  29          1HE       LYS  29  11.801  -0.129  14.774
  205   2HE   LYS  29          2HE       LYS  29  11.188   0.043  16.425
  206   1HZ   LYS  29          1HZ       LYS  29  12.537  -1.880  16.276
  207   2HZ   LYS  29          2HZ       LYS  29  10.996  -2.390  16.456
  208   3HZ   LYS  29          3HZ       LYS  29  11.715  -2.466  14.992
  209    H    GLU  30           H        GLU  30  10.070  -2.410   9.417
  210    HA   GLU  30           HA       GLU  30   9.698   0.369   8.684
  211   1HB   GLU  30          1HB       GLU  30  11.726  -1.691   8.177
  212   2HB   GLU  30          2HB       GLU  30  11.261  -0.829   6.699
  213   1HG   GLU  30          1HG       GLU  30  12.819   0.678   7.415
  214   2HG   GLU  30          2HG       GLU  30  11.502   1.271   8.438
  215    H    CYS  31           H        CYS  31   9.183  -2.998   7.466
  216    HA   CYS  31           HA       CYS  31   7.995  -2.232   5.061
  217   1HB   CYS  31          1HB       CYS  31   8.123  -4.723   6.686
  218   2HB   CYS  31          2HB       CYS  31   6.909  -4.631   5.407
  219    H    ASN  32           H        ASN  32   6.592  -3.334   8.238
  220    HA   ASN  32           HA       ASN  32   3.965  -2.916   7.487
  221   1HB   ASN  32          1HB       ASN  32   5.489  -3.358  10.005
  222   2HB   ASN  32          2HB       ASN  32   3.949  -2.517  10.237
  223   1HD2  ASN  32          1HD2      ASN  32   5.255  -5.160   8.228
  224   2HD2  ASN  32          2HD2      ASN  32   3.985  -6.301   8.517
  225    H    ASN  33           H        ASN  33   6.479  -0.689   7.826
  226    HA   ASN  33           HA       ASN  33   4.716   1.390   8.836
  227   1HB   ASN  33          1HB       ASN  33   6.809   1.318  10.040
  228   2HB   ASN  33          2HB       ASN  33   7.752   1.194   8.547
  229   1HD2  ASN  33          1HD2      ASN  33   8.813   2.963   8.135
  230   2HD2  ASN  33          2HD2      ASN  33   8.283   4.594   8.375
  231    H    ARG  34           H        ARG  34   6.554   0.154   6.067
  232    HA   ARG  34           HA       ARG  34   6.351   2.619   4.637
  233   1HB   ARG  34          1HB       ARG  34   7.700   1.593   2.996
  234   2HB   ARG  34          2HB       ARG  34   8.245   0.799   4.484
  235   1HG   ARG  34          1HG       ARG  34   7.930  -1.029   3.081
  236   2HG   ARG  34          2HG       ARG  34   6.348  -0.958   3.876
  237   1HD   ARG  34          1HD       ARG  34   5.405  -0.788   1.833
  238   2HD   ARG  34          2HD       ARG  34   6.175   0.795   1.642
  239    HE   ARG  34           HE       ARG  34   8.182  -1.012   1.002
  240   1HH1  ARG  34          1HH1      ARG  34   4.898  -0.486  -0.148
  241   2HH1  ARG  34          2HH1      ARG  34   5.226  -1.071  -1.744
  242   1HH2  ARG  34          1HH2      ARG  34   8.616  -1.785  -1.104
  243   2HH2  ARG  34          2HH2      ARG  34   7.356  -1.815  -2.292
  244    H    GLY  35           H        GLY  35   4.656  -0.486   4.954
  245   1HA   GLY  35          1HA       GLY  35   2.253  -0.223   4.309
  246   2HA   GLY  35          2HA       GLY  35   2.850   0.282   2.740
  247    H    CYS  36           H        CYS  36   4.682  -2.158   4.524
  248    HA   CYS  36           HA       CYS  36   3.559  -4.187   2.730
  249   1HB   CYS  36          1HB       CYS  36   6.417  -3.865   3.649
  250   2HB   CYS  36          2HB       CYS  36   5.799  -5.256   2.755
  251    H    CYS  37           H        CYS  37   4.256  -6.508   3.739
  252    HA   CYS  37           HA       CYS  37   3.726  -6.322   6.616
  253   1HB   CYS  37          1HB       CYS  37   1.873  -7.186   5.017
  254   2HB   CYS  37          2HB       CYS  37   2.840  -8.662   4.959
  255    H    PHE  38           H        PHE  38   5.312  -7.270   7.867
  256    HA   PHE  38           HA       PHE  38   7.404  -8.703   6.463
  257   1HB   PHE  38          1HB       PHE  38   7.803  -6.823   8.126
  258   2HB   PHE  38          2HB       PHE  38   7.022  -7.792   9.379
  259    HD1  PHE  38           HD1      PHE  38   9.947  -7.651   7.111
  260    HD2  PHE  38           HD2      PHE  38   8.253  -9.396  10.589
  261    HE1  PHE  38           HE1      PHE  38  12.166  -8.681   7.675
  262    HE2  PHE  38           HE2      PHE  38  10.472 -10.424  11.153
  263    HZ   PHE  38           HZ       PHE  38  12.402 -10.056   9.689
  264    H    ASP  39           H        ASP  39   7.472 -10.894   6.377
  265    HA   ASP  39           HA       ASP  39   5.650 -12.341   8.042
  266   1HB   ASP  39          1HB       ASP  39   5.814 -13.046   5.749
  267   2HB   ASP  39          2HB       ASP  39   7.582 -13.114   5.817
  268    H    SER  40           H        SER  40   8.966 -13.367   7.027
  269    HA   SER  40           HA       SER  40  10.812 -13.668   8.215
  270   1HB   SER  40          1HB       SER  40   9.604 -12.017   9.962
  271   2HB   SER  40          2HB       SER  40   9.525 -13.506  10.921
  272    HG   SER  40           HG       SER  40  11.497 -12.771  11.487
  273    H    ARG  41           H        ARG  41   7.730 -15.176   8.618
  274    HA   ARG  41           HA       ARG  41   8.402 -17.282  10.262
  275   1HB   ARG  41          1HB       ARG  41   6.430 -17.243   7.930
  276   2HB   ARG  41          2HB       ARG  41   6.410 -18.408   9.266
  277   1HG   ARG  41          1HG       ARG  41   6.279 -16.251  10.773
  278   2HG   ARG  41          2HG       ARG  41   5.734 -15.454   9.285
  279   1HD   ARG  41          1HD       ARG  41   4.476 -17.933  10.545
  280   2HD   ARG  41          2HD       ARG  41   3.823 -16.291  10.664
  281    HE   ARG  41           HE       ARG  41   4.047 -16.649   7.949
  282   1HH1  ARG  41          1HH1      ARG  41   2.596 -18.604  10.491
  283   2HH1  ARG  41          2HH1      ARG  41   1.397 -19.296   9.449
  284   1HH2  ARG  41          1HH2      ARG  41   2.465 -17.562   6.576
  285   2HH2  ARG  41          2HH2      ARG  41   1.322 -18.699   7.207
  286    H    ILE  42           H        ILE  42   8.533 -16.891   6.663
  287    HA   ILE  42           HA       ILE  42  10.222 -19.295   6.593
  288    HB   ILE  42           HB       ILE  42   8.630 -18.444   4.220
  289   1HG1  ILE  42          1HG1      ILE  42   7.520 -19.828   6.657
  290   2HG1  ILE  42          2HG1      ILE  42   6.889 -18.397   5.825
  291   1HG2  ILE  42          1HG2      ILE  42   8.853 -21.281   4.937
  292   2HG2  ILE  42          2HG2      ILE  42   9.205 -20.445   3.406
  293   3HG2  ILE  42          3HG2      ILE  42  10.419 -20.468   4.706
  294   1HD1  ILE  42          1HD1      ILE  42   5.473 -20.039   4.975
  295   2HD1  ILE  42          2HD1      ILE  42   6.770 -20.093   3.757
  296   3HD1  ILE  42          3HD1      ILE  42   6.720 -21.305   5.060
  297    HA   PRO  43           HA       PRO  43  13.047 -16.288   5.151
  298   1HB   PRO  43          1HB       PRO  43  15.267 -17.880   5.205
  299   2HB   PRO  43          2HB       PRO  43  14.688 -16.985   6.609
  300   1HG   PRO  43          1HG       PRO  43  14.462 -19.856   5.965
  301   2HG   PRO  43          2HG       PRO  43  14.312 -19.050   7.567
  302   1HD   PRO  43          1HD       PRO  43  12.232 -20.096   5.898
  303   2HD   PRO  43          2HD       PRO  43  12.023 -19.170   7.391
  304    H    GLY  44           H        GLY  44  11.917 -19.027   3.652
  305   1HA   GLY  44          1HA       GLY  44  13.568 -18.657   1.270
  306   2HA   GLY  44          2HA       GLY  44  12.413 -19.937   1.579
  307    H    VAL  45           H        VAL  45  10.814 -17.222   2.627
  308    HA   VAL  45           HA       VAL  45   9.719 -16.704  -0.053
  309    HB   VAL  45           HB       VAL  45   7.584 -16.796   0.751
  310   1HG1  VAL  45          1HG1      VAL  45   7.443 -18.749   2.414
  311   2HG1  VAL  45          2HG1      VAL  45   8.295 -19.040   0.878
  312   3HG1  VAL  45          3HG1      VAL  45   9.223 -18.755   2.371
  313   1HG2  VAL  45          1HG2      VAL  45   8.577 -16.423   3.597
  314   2HG2  VAL  45          2HG2      VAL  45   7.942 -15.128   2.554
  315   3HG2  VAL  45          3HG2      VAL  45   6.882 -16.467   3.054
  316    HA   PRO  46           HA       PRO  46  10.096 -12.469   0.802
  317   1HB   PRO  46          1HB       PRO  46   7.675 -11.309   0.297
  318   2HB   PRO  46          2HB       PRO  46   8.797 -11.793  -0.974
  319   1HG   PRO  46          1HG       PRO  46   6.315 -13.085  -0.039
  320   2HG   PRO  46          2HG       PRO  46   7.172 -13.301  -1.609
  321   1HD   PRO  46          1HD       PRO  46   7.108 -15.070   0.642
  322   2HD   PRO  46          2HD       PRO  46   8.094 -15.252  -0.815
  323    H    TRP  47           H        TRP  47  10.659 -11.559   2.665
  324    HA   TRP  47           HA       TRP  47   8.762 -11.912   4.842
  325   1HB   TRP  47          1HB       TRP  47  11.251 -10.509   5.422
  326   2HB   TRP  47          2HB       TRP  47  10.520 -11.911   6.205
  327    HD1  TRP  47           HD1      TRP  47  11.020 -14.357   4.821
  328    HE1  TRP  47           HE1      TRP  47  13.180 -15.226   3.578
  329    HE3  TRP  47           HE3      TRP  47  13.132  -9.776   4.182
  330    HZ2  TRP  47           HZ2      TRP  47  15.478 -13.928   2.492
  331    HZ3  TRP  47           HZ3      TRP  47  15.334  -9.665   3.020
  332    HH2  TRP  47           HH2      TRP  47  16.503 -11.644   2.188
  333    H    CYS  48           H        CYS  48   8.321 -10.086   2.454
  334    HA   CYS  48           HA       CYS  48   7.386  -7.876   3.925
  335   1HB   CYS  48          1HB       CYS  48   9.738  -7.225   3.863
  336   2HB   CYS  48          2HB       CYS  48   9.737  -7.330   2.100
  337    H    PHE  49           H        PHE  49   5.409  -7.819   2.903
  338    HA   PHE  49           HA       PHE  49   5.421  -7.527   0.015
  339   1HB   PHE  49          1HB       PHE  49   3.294  -9.209   0.341
  340   2HB   PHE  49          2HB       PHE  49   4.913  -9.826  -0.007
  341    HD1  PHE  49           HD1      PHE  49   6.385 -10.285   2.133
  342    HD2  PHE  49           HD2      PHE  49   2.148 -10.056   2.142
  343    HE1  PHE  49           HE1      PHE  49   6.318 -11.613   4.261
  344    HE2  PHE  49           HE2      PHE  49   2.081 -11.385   4.271
  345    HZ   PHE  49           HZ       PHE  49   4.167 -12.147   5.305
  346    H    LYS  50           H        LYS  50   2.682  -7.575  -0.456
  347    HA   LYS  50           HA       LYS  50   1.669  -5.572   1.440
  348   1HB   LYS  50          1HB       LYS  50   0.577  -4.494  -0.534
  349   2HB   LYS  50          2HB       LYS  50   2.344  -4.353  -0.491
  350   1HG   LYS  50          1HG       LYS  50   1.560  -6.783  -1.875
  351   2HG   LYS  50          2HG       LYS  50   0.725  -5.395  -2.591
  352   1HD   LYS  50          1HD       LYS  50   3.718  -5.785  -2.208
  353   2HD   LYS  50          2HD       LYS  50   2.845  -5.671  -3.746
  354   1HE   LYS  50          1HE       LYS  50   2.243  -3.332  -2.182
  355   2HE   LYS  50          2HE       LYS  50   4.000  -3.551  -2.176
  356   1HZ   LYS  50          1HZ       LYS  50   4.092  -3.223  -4.385
  357   2HZ   LYS  50          2HZ       LYS  50   2.628  -3.878  -4.697
  358   3HZ   LYS  50          3HZ       LYS  50   2.735  -2.356  -4.113
  359    HA   PRO  51           HA       PRO  51  -1.204  -9.054   1.080
  360   1HB   PRO  51          1HB       PRO  51  -1.390  -9.647   3.741
  361   2HB   PRO  51          2HB       PRO  51  -0.290 -10.478   2.643
  362   1HG   PRO  51          1HG       PRO  51   0.257  -8.396   4.660
  363   2HG   PRO  51          2HG       PRO  51   1.406  -9.559   3.907
  364   1HD   PRO  51          1HD       PRO  51   1.089  -6.766   3.364
  365   2HD   PRO  51          2HD       PRO  51   2.122  -7.901   2.485
  366    H    LEU  52           H        LEU  52  -1.996  -8.132   4.269
  367    HA   LEU  52           HA       LEU  52  -4.400  -6.895   3.197
  368   1HB   LEU  52          1HB       LEU  52  -5.421  -7.396   5.170
  369   2HB   LEU  52          2HB       LEU  52  -4.298  -8.754   4.980
  370    HG   LEU  52           HG       LEU  52  -2.966  -6.730   6.474
  371   1HD1  LEU  52          1HD1      LEU  52  -4.801  -7.087   8.459
  372   2HD1  LEU  52          2HD1      LEU  52  -4.659  -5.629   7.449
  373   3HD1  LEU  52          3HD1      LEU  52  -5.853  -6.883   7.037
  374   1HD2  LEU  52          1HD2      LEU  52  -2.257  -8.559   7.507
  375   2HD2  LEU  52          2HD2      LEU  52  -3.895  -8.915   8.105
  376   3HD2  LEU  52          3HD2      LEU  52  -3.380  -9.514   6.511
  377    H    GLN  53           H        GLN  53  -1.882  -5.497   2.848
  378    HA   GLN  53           HA       GLN  53  -1.278  -3.701   4.780
  379   1HB   GLN  53          1HB       GLN  53  -1.327  -3.341   1.763
  380   2HB   GLN  53          2HB       GLN  53  -0.525  -2.215   2.872
  381   1HG   GLN  53          1HG       GLN  53   0.096  -5.179   2.520
  382   2HG   GLN  53          2HG       GLN  53   1.096  -3.836   1.948
  383   1HE2  GLN  53          1HE2      GLN  53   0.840  -2.112   4.118
  384   2HE2  GLN  53          2HE2      GLN  53   1.656  -2.771   5.496
  385    H    GLU  54           H        GLU  54  -4.169  -3.897   2.785
  386    HA   GLU  54           HA       GLU  54  -5.100  -1.471   2.501
  387   1HB   GLU  54          1HB       GLU  54  -7.245  -2.368   2.500
  388   2HB   GLU  54          2HB       GLU  54  -6.263  -3.830   2.308
  389   1HG   GLU  54          1HG       GLU  54  -7.614  -4.530   4.036
  390   2HG   GLU  54          2HG       GLU  54  -6.349  -3.758   5.004
  391    H    ALA  55           H        ALA  55  -4.466  -3.034   5.619
  392    HA   ALA  55           HA       ALA  55  -5.946  -1.775   7.421
  393   1HB   ALA  55          1HB       ALA  55  -3.319  -1.495   8.417
  394   2HB   ALA  55          2HB       ALA  55  -4.415  -2.881   8.640
  395   3HB   ALA  55          3HB       ALA  55  -3.258  -2.870   7.287
  396    H    GLU  56           H        GLU  56  -2.834  -0.306   6.231
  397    HA   GLU  56           HA       GLU  56  -4.098   2.273   6.746
  398   1HB   GLU  56          1HB       GLU  56  -1.292   1.271   7.167
  399   2HB   GLU  56          2HB       GLU  56  -1.543   2.995   6.839
  400   1HG   GLU  56          1HG       GLU  56  -3.297   2.927   8.726
  401   2HG   GLU  56          2HG       GLU  56  -2.643   1.334   9.143
  402    H    CYS  57           H        CYS  57  -3.657   0.242   4.295
  403    HA   CYS  57           HA       CYS  57  -2.332   2.079   2.489
  404   1HB   CYS  57          1HB       CYS  57  -2.869  -0.782   2.568
  405   2HB   CYS  57          2HB       CYS  57  -3.238  -0.070   0.994
  406    H    THR  58           H        THR  58  -5.080  -0.062   1.645
  407    HA   THR  58           HA       THR  58  -6.399   1.683   0.040
  408    HB   THR  58           HB       THR  58  -6.745  -0.883   0.757
  409    HG1  THR  58           HG1      THR  58  -8.725   1.130  -0.036
  410   1HG2  THR  58          1HG2      THR  58  -7.713  -0.273   3.029
  411   2HG2  THR  58          2HG2      THR  58  -9.022   0.587   2.183
  412   3HG2  THR  58          3HG2      THR  58  -8.848  -1.175   1.998
  413    H    PHE  59           H        PHE  59  -6.261   1.721   3.565
  414    HA   PHE  59           HA       PHE  59  -8.410   2.922   4.442
  415   1HB   PHE  59          1HB       PHE  59  -6.029   2.616   5.466
  416   2HB   PHE  59          2HB       PHE  59  -5.627   4.182   4.753
  417    HD1  PHE  59           HD1      PHE  59  -6.541   6.225   5.680
  418    HD2  PHE  59           HD2      PHE  59  -7.551   2.455   7.347
  419    HE1  PHE  59           HE1      PHE  59  -7.458   7.370   7.717
  420    HE2  PHE  59           HE2      PHE  59  -8.467   3.600   9.383
  421    HZ   PHE  59           HZ       PHE  59  -8.410   6.044   9.544
  422   1H    GLU   1           H1       GLU   1 -21.007  -3.884  -3.692
  423    HA   GLU   1           HA       GLU   1 -18.119  -4.203  -3.582
  424   1HB   GLU   1          1HB       GLU   1 -18.017  -4.118  -6.057
  425   2HB   GLU   1          2HB       GLU   1 -18.892  -5.549  -5.486
  426   1HG   GLU   1          1HG       GLU   1 -20.897  -3.630  -5.723
  427   2HG   GLU   1          2HG       GLU   1 -19.843  -3.259  -7.096
  428    H    GLU   2           H        GLU   2 -19.217  -2.189  -2.185
  429    HA   GLU   2           HA       GLU   2 -19.604   0.081  -3.884
  430   1HB   GLU   2          1HB       GLU   2 -20.522  -0.630  -1.387
  431   2HB   GLU   2          2HB       GLU   2 -19.265   0.550  -0.976
  432   1HG   GLU   2          1HG       GLU   2 -20.303   2.192  -2.502
  433   2HG   GLU   2          2HG       GLU   2 -21.538   1.012  -2.966
  434    H    TYR   3           H        TYR   3 -17.389  -0.162  -4.894
  435    HA   TYR   3           HA       TYR   3 -15.186   0.571  -3.149
  436   1HB   TYR   3          1HB       TYR   3 -15.740  -0.451  -5.943
  437   2HB   TYR   3          2HB       TYR   3 -14.239   0.460  -5.740
  438    HD1  TYR   3           HD1      TYR   3 -12.329  -0.765  -5.273
  439    HD2  TYR   3           HD2      TYR   3 -16.121  -2.315  -4.038
  440    HE1  TYR   3           HE1      TYR   3 -11.196  -2.870  -4.409
  441    HE2  TYR   3           HE2      TYR   3 -14.974  -4.415  -3.178
  442    HH   TYR   3           HH       TYR   3 -12.966  -5.650  -3.556
  443    H    VAL   4           H        VAL   4 -15.647   2.749  -2.566
  444    HA   VAL   4           HA       VAL   4 -15.475   4.603  -4.841
  445    HB   VAL   4           HB       VAL   4 -16.650   6.043  -2.839
  446   1HG1  VAL   4          1HG1      VAL   4 -18.497   4.552  -4.639
  447   2HG1  VAL   4          2HG1      VAL   4 -18.351   6.299  -4.333
  448   3HG1  VAL   4          3HG1      VAL   4 -17.192   5.484  -5.410
  449   1HG2  VAL   4          1HG2      VAL   4 -16.883   3.895  -1.522
  450   2HG2  VAL   4          2HG2      VAL   4 -18.398   4.785  -1.810
  451   3HG2  VAL   4          3HG2      VAL   4 -18.017   3.339  -2.774
  452    H    GLY   5           H        GLY   5 -15.060   4.473  -1.227
  453   1HA   GLY   5          1HA       GLY   5 -13.059   6.482  -1.213
  454   2HA   GLY   5          2HA       GLY   5 -13.493   5.404   0.098
  455    H    LEU   6           H        LEU   6 -12.853   3.585  -2.734
  456    HA   LEU   6           HA       LEU   6  -9.999   3.506  -2.410
  457   1HB   LEU   6          1HB       LEU   6  -9.821   1.246  -1.722
  458   2HB   LEU   6          2HB       LEU   6 -10.784   2.133  -0.526
  459    HG   LEU   6           HG       LEU   6 -11.687   0.071  -2.536
  460   1HD1  LEU   6          1HD1      LEU   6 -12.116   0.222   0.457
  461   2HD1  LEU   6          2HD1      LEU   6 -12.463  -1.147  -0.628
  462   3HD1  LEU   6          3HD1      LEU   6 -10.779  -0.655  -0.325
  463   1HD2  LEU   6          1HD2      LEU   6 -13.384   1.643  -2.811
  464   2HD2  LEU   6          2HD2      LEU   6 -14.018   0.557  -1.551
  465   3HD2  LEU   6          3HD2      LEU   6 -13.339   2.140  -1.103
  466    H    SER   7           H        SER   7 -12.169   4.107  -4.430
  467    HA   SER   7           HA       SER   7 -11.981   1.895  -6.231
  468   1HB   SER   7          1HB       SER   7 -13.833   3.885  -5.826
  469   2HB   SER   7          2HB       SER   7 -12.996   4.488  -7.266
  470    HG   SER   7           HG       SER   7 -13.430   2.413  -8.280
  471    H    ALA   8           H        ALA   8 -11.313   2.415  -8.619
  472    HA   ALA   8           HA       ALA   8  -8.635   3.261  -8.589
  473   1HB   ALA   8          1HB       ALA   8  -9.319   3.252 -11.227
  474   2HB   ALA   8          2HB       ALA   8  -8.951   1.782 -10.295
  475   3HB   ALA   8          3HB       ALA   8 -10.643   2.276 -10.548
  476    H    ASN   9           H        ASN   9 -11.483   5.055  -8.363
  477    HA   ASN   9           HA       ASN   9 -10.457   7.235  -9.953
  478   1HB   ASN   9          1HB       ASN   9 -13.020   6.323  -9.461
  479   2HB   ASN   9          2HB       ASN   9 -12.912   7.656  -8.303
  480   1HD2  ASN   9          1HD2      ASN   9 -11.589   9.586  -9.375
  481   2HD2  ASN   9          2HD2      ASN   9 -12.228  10.138 -10.888
  482    H    GLN  10           H        GLN  10 -10.433   5.969  -6.733
  483    HA   GLN  10           HA       GLN  10 -10.602   8.263  -5.218
  484   1HB   GLN  10          1HB       GLN  10  -9.978   5.506  -4.838
  485   2HB   GLN  10          2HB       GLN  10  -8.695   6.437  -4.045
  486   1HG   GLN  10          1HG       GLN  10 -11.330   7.595  -3.535
  487   2HG   GLN  10          2HG       GLN  10 -11.285   5.895  -3.046
  488   1HE2  GLN  10          1HE2      GLN  10  -8.755   5.515  -2.234
  489   2HE2  GLN  10          2HE2      GLN  10  -8.359   6.496  -0.863
  490    H    CYS  11           H        CYS  11  -7.852   6.766  -6.977
  491    HA   CYS  11           HA       CYS  11  -5.932   8.533  -5.870
  492   1HB   CYS  11          1HB       CYS  11  -5.156   6.443  -6.603
  493   2HB   CYS  11          2HB       CYS  11  -5.912   6.610  -8.190
  494    H    ALA  12           H        ALA  12  -8.580   9.107  -7.779
  495    HA   ALA  12           HA       ALA  12  -7.191  11.164  -9.356
  496   1HB   ALA  12          1HB       ALA  12  -8.272  10.254 -11.104
  497   2HB   ALA  12          2HB       ALA  12  -9.158   9.141 -10.037
  498   3HB   ALA  12          3HB       ALA  12  -9.804  10.767 -10.358
  499    H    VAL  13           H        VAL  13  -8.391  10.949  -6.439
  500    HA   VAL  13           HA       VAL  13 -10.661  12.468  -6.239
  501    HB   VAL  13           HB       VAL  13  -8.808  11.330  -4.552
  502   1HG1  VAL  13          1HG1      VAL  13  -7.450  13.397  -4.599
  503   2HG1  VAL  13          2HG1      VAL  13  -8.848  14.313  -3.985
  504   3HG1  VAL  13          3HG1      VAL  13  -8.099  13.050  -2.978
  505   1HG2  VAL  13          1HG2      VAL  13 -10.706  11.197  -3.392
  506   2HG2  VAL  13          2HG2      VAL  13 -10.570  12.922  -2.971
  507   3HG2  VAL  13          3HG2      VAL  13 -11.448  12.430  -4.440
  508    HA   PRO  14           HA       PRO  14  -9.541  16.520  -7.235
  509   1HB   PRO  14          1HB       PRO  14 -10.927  18.049  -5.446
  510   2HB   PRO  14          2HB       PRO  14 -11.668  17.323  -6.871
  511   1HG   PRO  14          1HG       PRO  14 -11.810  16.514  -4.036
  512   2HG   PRO  14          2HG       PRO  14 -12.923  16.083  -5.385
  513   1HD   PRO  14          1HD       PRO  14 -10.918  14.460  -4.142
  514   2HD   PRO  14          2HD       PRO  14 -11.876  14.044  -5.568
  515    H    ALA  15           H        ALA  15  -7.744  15.087  -5.410
  516    HA   ALA  15           HA       ALA  15  -6.087  15.507  -3.976
  517   1HB   ALA  15          1HB       ALA  15  -5.157  18.022  -4.826
  518   2HB   ALA  15          2HB       ALA  15  -4.660  16.431  -5.450
  519   3HB   ALA  15          3HB       ALA  15  -5.973  17.329  -6.248
  520    H    LYS  16           H        LYS  16  -8.166  15.840  -2.455
  521    HA   LYS  16           HA       LYS  16  -7.429  17.829  -0.636
  522   1HB   LYS  16          1HB       LYS  16  -9.466  19.251  -0.777
  523   2HB   LYS  16          2HB       LYS  16  -8.344  19.453  -2.134
  524   1HG   LYS  16          1HG       LYS  16 -10.021  18.968  -3.554
  525   2HG   LYS  16          2HG       LYS  16 -10.160  17.351  -2.840
  526   1HD   LYS  16          1HD       LYS  16 -12.314  18.273  -2.578
  527   2HD   LYS  16          2HD       LYS  16 -11.576  18.529  -0.988
  528   1HE   LYS  16          1HE       LYS  16 -11.351  20.825  -1.319
  529   2HE   LYS  16          2HE       LYS  16 -11.292  20.685  -3.083
  530   1HZ   LYS  16          1HZ       LYS  16 -13.740  19.738  -2.221
  531   2HZ   LYS  16          2HZ       LYS  16 -13.493  21.159  -1.455
  532   3HZ   LYS  16          3HZ       LYS  16 -13.440  21.090  -3.086
  533    H    ASP  17           H        ASP  17  -7.954  14.964  -0.834
  534    HA   ASP  17           HA       ASP  17  -9.685  14.809   1.409
  535   1HB   ASP  17          1HB       ASP  17 -11.210  14.725  -0.654
  536   2HB   ASP  17          2HB       ASP  17 -10.436  13.187  -1.062
  537    H    ARG  18           H        ARG  18  -6.862  14.213   0.252
  538    HA   ARG  18           HA       ARG  18  -6.802  11.347   0.365
  539   1HB   ARG  18          1HB       ARG  18  -4.532  13.366   0.054
  540   2HB   ARG  18          2HB       ARG  18  -4.393  11.619  -0.201
  541   1HG   ARG  18          1HG       ARG  18  -5.411  11.716  -2.247
  542   2HG   ARG  18          2HG       ARG  18  -6.556  12.971  -1.748
  543   1HD   ARG  18          1HD       ARG  18  -4.933  14.706  -2.077
  544   2HD   ARG  18          2HD       ARG  18  -3.596  13.552  -2.187
  545    HE   ARG  18           HE       ARG  18  -5.628  13.107  -4.228
  546   1HH1  ARG  18          1HH1      ARG  18  -2.807  15.042  -3.406
  547   2HH1  ARG  18          2HH1      ARG  18  -2.409  15.393  -5.055
  548   1HH2  ARG  18          1HH2      ARG  18  -5.103  13.569  -6.403
  549   2HH2  ARG  18          2HH2      ARG  18  -3.724  14.549  -6.771
  550    H    VAL  19           H        VAL  19  -4.665  10.509   1.691
  551    HA   VAL  19           HA       VAL  19  -4.998  11.627   4.381
  552    HB   VAL  19           HB       VAL  19  -4.029   8.904   3.491
  553   1HG1  VAL  19          1HG1      VAL  19  -3.167   8.844   5.565
  554   2HG1  VAL  19          2HG1      VAL  19  -4.063  10.292   6.081
  555   3HG1  VAL  19          3HG1      VAL  19  -4.854   8.698   6.115
  556   1HG2  VAL  19          1HG2      VAL  19  -6.312   8.934   2.940
  557   2HG2  VAL  19          2HG2      VAL  19  -6.267   8.201   4.562
  558   3HG2  VAL  19          3HG2      VAL  19  -6.740   9.906   4.369
  559    H    ASP  20           H        ASP  20  -3.221  12.544   2.020
  560    HA   ASP  20           HA       ASP  20  -1.087  12.925   1.578
  561   1HB   ASP  20          1HB       ASP  20  -1.350  14.845   2.847
  562   2HB   ASP  20          2HB       ASP  20  -1.710  13.950   4.331
  563    H    CYS  21           H        CYS  21  -0.092  10.817   1.309
  564    HA   CYS  21           HA       CYS  21   0.534   9.052   3.283
  565   1HB   CYS  21          1HB       CYS  21   0.720   8.855   0.734
  566   2HB   CYS  21          2HB       CYS  21   2.348   9.511   0.924
  567    H    GLY  22           H        GLY  22   2.216  12.030   2.198
  568   1HA   GLY  22          1HA       GLY  22   3.898  13.220   3.091
  569   2HA   GLY  22          2HA       GLY  22   3.491  12.489   4.631
  570    H    TYR  23           H        TYR  23   4.761  11.062   1.537
  571    HA   TYR  23           HA       TYR  23   6.673   9.534   3.059
  572   1HB   TYR  23          1HB       TYR  23   5.184   9.297   0.701
  573   2HB   TYR  23          2HB       TYR  23   6.768   9.745   0.060
  574    HD1  TYR  23           HD1      TYR  23   6.034   7.640   3.055
  575    HD2  TYR  23           HD2      TYR  23   7.464   7.743  -0.976
  576    HE1  TYR  23           HE1      TYR  23   6.787   5.219   3.253
  577    HE2  TYR  23           HE2      TYR  23   8.211   5.322  -0.765
  578    HH   TYR  23           HH       TYR  23   7.484   3.459   2.147
  579    HA   PRO  24           HA       PRO  24   9.936  12.333   2.464
  580   1HB   PRO  24          1HB       PRO  24  12.013  10.738   3.238
  581   2HB   PRO  24          2HB       PRO  24  10.991  11.609   4.377
  582   1HG   PRO  24          1HG       PRO  24  11.008   8.750   3.648
  583   2HG   PRO  24          2HG       PRO  24  10.322   9.530   5.119
  584   1HD   PRO  24          1HD       PRO  24   8.933   8.515   2.830
  585   2HD   PRO  24          2HD       PRO  24   8.228   9.416   4.178
  586    H    HIS  25           H        HIS  25   9.387   9.625   0.624
  587    HA   HIS  25           HA       HIS  25  11.474  10.529  -1.223
  588   1HB   HIS  25          1HB       HIS  25  11.119   7.964  -0.029
  589   2HB   HIS  25          2HB       HIS  25  10.779   7.812  -1.756
  590    HD1  HIS  25           HD1      HIS  25  13.039   6.342  -1.788
  591    HD2  HIS  25           HD2      HIS  25  13.511  10.430  -0.975
  592    HE1  HIS  25           HE1      HIS  25  15.514   6.858  -2.133
  593    HE2  HIS  25           HE2      HIS  25  15.733   9.395  -1.673
  594    H    VAL  26           H        VAL  26   8.586  11.337  -0.822
  595    HA   VAL  26           HA       VAL  26   6.820  10.214  -2.524
  596    HB   VAL  26           HB       VAL  26   6.048  11.964  -1.242
  597   1HG1  VAL  26          1HG1      VAL  26   8.649  13.121  -1.773
  598   2HG1  VAL  26          2HG1      VAL  26   7.367  14.336  -1.993
  599   3HG1  VAL  26          3HG1      VAL  26   7.505  13.459  -0.451
  600   1HG2  VAL  26          1HG2      VAL  26   4.855  13.231  -2.720
  601   2HG2  VAL  26          2HG2      VAL  26   6.286  13.652  -3.692
  602   3HG2  VAL  26          3HG2      VAL  26   5.528  12.051  -3.869
  603    H    THR  27           H        THR  27   6.933   9.590  -4.612
  604    HA   THR  27           HA       THR  27   7.808  11.391  -6.625
  605    HB   THR  27           HB       THR  27   9.823   9.773  -5.340
  606    HG1  THR  27           HG1      THR  27  11.016  11.152  -6.736
  607   1HG2  THR  27          1HG2      THR  27   9.566   7.901  -6.787
  608   2HG2  THR  27          2HG2      THR  27   8.989   8.912  -8.134
  609   3HG2  THR  27          3HG2      THR  27  10.712   8.927  -7.684
  610    HA   PRO  28           HA       PRO  28   5.247   8.781  -8.867
  611   1HB   PRO  28          1HB       PRO  28   5.954   9.397 -11.433
  612   2HB   PRO  28          2HB       PRO  28   4.875  10.398 -10.465
  613   1HG   PRO  28          1HG       PRO  28   7.716  10.790 -11.159
  614   2HG   PRO  28          2HG       PRO  28   6.517  12.012 -10.601
  615   1HD   PRO  28          1HD       PRO  28   8.648  10.802  -9.120
  616   2HD   PRO  28          2HD       PRO  28   7.399  11.877  -8.482
  617    H    LYS  29           H        LYS  29   7.107   7.267  -7.708
  618    HA   LYS  29           HA       LYS  29   7.212   5.094  -9.445
  619   1HB   LYS  29          1HB       LYS  29   8.871   6.433 -10.652
  620   2HB   LYS  29          2HB       LYS  29   9.863   6.543  -9.188
  621   1HG   LYS  29          1HG       LYS  29  10.723   4.483  -9.530
  622   2HG   LYS  29          2HG       LYS  29   9.120   3.769  -9.779
  623   1HD   LYS  29          1HD       LYS  29   9.185   4.787 -12.128
  624   2HD   LYS  29          2HD       LYS  29  10.895   5.152 -11.836
  625   1HE   LYS  29          1HE       LYS  29  11.073   2.616 -11.206
  626   2HE   LYS  29          2HE       LYS  29   9.524   2.450 -12.051
  627   1HZ   LYS  29          1HZ       LYS  29  10.769   2.323 -13.855
  628   2HZ   LYS  29          2HZ       LYS  29  11.056   3.925 -13.713
  629   3HZ   LYS  29          3HZ       LYS  29  12.122   2.847 -13.106
  630    H    GLU  30           H        GLU  30   8.071   6.891  -6.567
  631    HA   GLU  30           HA       GLU  30   8.921   4.440  -5.275
  632   1HB   GLU  30          1HB       GLU  30   9.471   7.287  -4.929
  633   2HB   GLU  30          2HB       GLU  30   9.028   6.527  -3.392
  634   1HG   GLU  30          1HG       GLU  30  11.348   6.192  -3.486
  635   2HG   GLU  30          2HG       GLU  30  10.729   4.657  -4.114
  636    H    CYS  31           H        CYS  31   6.462   7.075  -5.088
  637    HA   CYS  31           HA       CYS  31   5.185   6.146  -2.800
  638   1HB   CYS  31          1HB       CYS  31   4.317   7.852  -5.114
  639   2HB   CYS  31          2HB       CYS  31   3.185   7.413  -3.832
  640    H    ASN  32           H        ASN  32   4.384   5.724  -6.332
  641    HA   ASN  32           HA       ASN  32   2.306   3.956  -5.869
  642   1HB   ASN  32          1HB       ASN  32   4.025   4.750  -8.198
  643   2HB   ASN  32          2HB       ASN  32   3.123   3.238  -8.375
  644   1HD2  ASN  32          1HD2      ASN  32   2.519   6.409  -6.861
  645   2HD2  ASN  32          2HD2      ASN  32   1.009   6.741  -7.644
  646    H    ASN  33           H        ASN  33   5.607   3.616  -5.247
  647    HA   ASN  33           HA       ASN  33   5.636   0.797  -5.936
  648   1HB   ASN  33          1HB       ASN  33   7.612   1.953  -6.696
  649   2HB   ASN  33          2HB       ASN  33   7.817   2.785  -5.147
  650   1HD2  ASN  33          1HD2      ASN  33   9.565   2.074  -4.203
  651   2HD2  ASN  33          2HD2      ASN  33  10.073   0.426  -4.033
  652    H    ARG  34           H        ARG  34   5.550   3.170  -3.303
  653    HA   ARG  34           HA       ARG  34   6.244   1.207  -1.336
  654   1HB   ARG  34          1HB       ARG  34   6.333   2.993   0.196
  655   2HB   ARG  34          2HB       ARG  34   6.793   3.785  -1.322
  656   1HG   ARG  34          1HG       ARG  34   5.185   5.258  -0.506
  657   2HG   ARG  34          2HG       ARG  34   4.182   4.219  -1.531
  658   1HD   ARG  34          1HD       ARG  34   2.904   3.863   0.304
  659   2HD   ARG  34          2HD       ARG  34   4.236   2.892   0.950
  660    HE   ARG  34           HE       ARG  34   4.770   5.651   1.474
  661   1HH1  ARG  34          1HH1      ARG  34   2.543   3.114   2.466
  662   2HH1  ARG  34          2HH1      ARG  34   2.274   3.788   4.038
  663   1HH2  ARG  34          1HH2      ARG  34   4.416   6.541   3.548
  664   2HH2  ARG  34          2HH2      ARG  34   3.347   5.751   4.658
  665    H    GLY  35           H        GLY  35   3.393   2.790  -2.753
  666   1HA   GLY  35          1HA       GLY  35   1.387   1.315  -2.540
  667   2HA   GLY  35          2HA       GLY  35   1.661   1.382  -0.810
  668    H    CYS  36           H        CYS  36   2.449   4.240  -2.730
  669    HA   CYS  36           HA       CYS  36  -0.017   5.478  -1.740
  670   1HB   CYS  36          1HB       CYS  36   2.730   6.703  -1.994
  671   2HB   CYS  36          2HB       CYS  36   1.260   7.595  -1.588
  672    H    CYS  37           H        CYS  37  -0.381   7.650  -3.131
  673    HA   CYS  37           HA       CYS  37   0.158   6.937  -5.923
  674   1HB   CYS  37          1HB       CYS  37  -2.278   6.845  -4.853
  675   2HB   CYS  37          2HB       CYS  37  -2.238   8.567  -5.242
  676    H    PHE  38           H        PHE  38   1.283   8.506  -7.046
  677    HA   PHE  38           HA       PHE  38   1.800  10.992  -5.644
  678   1HB   PHE  38          1HB       PHE  38   3.512   9.397  -6.797
  679   2HB   PHE  38          2HB       PHE  38   2.836   9.936  -8.338
  680    HD1  PHE  38           HD1      PHE  38   4.928  10.825  -5.488
  681    HD2  PHE  38           HD2      PHE  38   3.212  12.228  -9.107
  682    HE1  PHE  38           HE1      PHE  38   6.502  12.781  -5.476
  683    HE2  PHE  38           HE2      PHE  38   4.785  14.183  -9.095
  684    HZ   PHE  38           HZ       PHE  38   6.411  14.437  -7.280
  685    H    ASP  39           H        ASP  39   0.776  12.877  -6.123
  686    HA   ASP  39           HA       ASP  39  -0.997  12.860  -8.373
  687   1HB   ASP  39          1HB       ASP  39  -1.856  13.793  -6.329
  688   2HB   ASP  39          2HB       ASP  39  -0.436  14.829  -6.117
  689    H    SER  40           H        SER  40   0.943  15.630  -7.078
  690    HA   SER  40           HA       SER  40   2.630  16.752  -7.978
  691   1HB   SER  40          1HB       SER  40   2.907  14.540  -9.488
  692   2HB   SER  40          2HB       SER  40   2.354  15.649 -10.755
  693    HG   SER  40           HG       SER  40   4.687  15.613 -10.538
  694    H    ARG  41           H        ARG  41  -0.573  16.335  -9.174
  695    HA   ARG  41           HA       ARG  41  -0.586  18.361 -11.092
  696   1HB   ARG  41          1HB       ARG  41  -2.880  17.312  -9.371
  697   2HB   ARG  41          2HB       ARG  41  -3.064  18.209 -10.888
  698   1HG   ARG  41          1HG       ARG  41  -1.486  16.248 -11.803
  699   2HG   ARG  41          2HG       ARG  41  -2.173  15.369 -10.425
  700   1HD   ARG  41          1HD       ARG  41  -3.684  14.876 -12.154
  701   2HD   ARG  41          2HD       ARG  41  -4.481  16.240 -11.356
  702    HE   ARG  41           HE       ARG  41  -2.655  16.954 -13.559
  703   1HH1  ARG  41          1HH1      ARG  41  -5.966  16.234 -12.611
  704   2HH1  ARG  41          2HH1      ARG  41  -6.666  17.020 -13.986
  705   1HH2  ARG  41          1HH2      ARG  41  -3.578  17.991 -15.375
  706   2HH2  ARG  41          2HH2      ARG  41  -5.299  18.027 -15.568
  707    H    ILE  42           H        ILE  42  -1.271  18.227  -7.553
  708    HA   ILE  42           HA       ILE  42  -1.347  21.164  -7.576
  709    HB   ILE  42           HB       ILE  42  -2.727  19.554  -5.470
  710   1HG1  ILE  42          1HG1      ILE  42  -3.750  20.078  -8.258
  711   2HG1  ILE  42          2HG1      ILE  42  -3.659  18.532  -7.394
  712   1HG2  ILE  42          1HG2      ILE  42  -3.595  22.170  -6.678
  713   2HG2  ILE  42          2HG2      ILE  42  -3.943  21.496  -5.068
  714   3HG2  ILE  42          3HG2      ILE  42  -2.313  22.102  -5.447
  715   1HD1  ILE  42          1HD1      ILE  42  -5.922  19.079  -7.146
  716   2HD1  ILE  42          2HD1      ILE  42  -5.240  19.772  -5.655
  717   3HD1  ILE  42          3HD1      ILE  42  -5.594  20.826  -7.046
  718    HA   PRO  43           HA       PRO  43   2.213  20.397  -5.137
  719   1HB   PRO  43          1HB       PRO  43   3.190  22.947  -5.209
  720   2HB   PRO  43          2HB       PRO  43   3.547  21.743  -6.446
  721   1HG   PRO  43          1HG       PRO  43   1.688  24.034  -6.507
  722   2HG   PRO  43          2HG       PRO  43   2.396  23.125  -7.891
  723   1HD   PRO  43          1HD       PRO  43  -0.264  22.982  -6.841
  724   2HD   PRO  43          2HD       PRO  43   0.431  21.952  -8.100
  725    H    GLY  44           H        GLY  44  -0.537  22.116  -4.476
  726   1HA   GLY  44          1HA       GLY  44   0.401  22.997  -1.847
  727   2HA   GLY  44          2HA       GLY  44  -1.130  23.371  -2.613
  728    H    VAL  45           H        VAL  45  -0.740  20.137  -3.262
  729    HA   VAL  45           HA       VAL  45  -2.033  19.363  -0.738
  730    HB   VAL  45           HB       VAL  45  -3.641  18.200  -1.853
  731   1HG1  VAL  45          1HG1      VAL  45  -4.057  20.498  -2.392
  732   2HG1  VAL  45          2HG1      VAL  45  -2.896  20.455  -3.740
  733   3HG1  VAL  45          3HG1      VAL  45  -4.416  19.535  -3.845
  734   1HG2  VAL  45          1HG2      VAL  45  -3.474  17.258  -4.084
  735   2HG2  VAL  45          2HG2      VAL  45  -1.923  18.088  -4.354
  736   3HG2  VAL  45          3HG2      VAL  45  -2.041  16.796  -3.135
  737    HA   PRO  46           HA       PRO  46   0.688  15.989  -0.597
  738   1HB   PRO  46          1HB       PRO  46  -0.810  13.730  -0.248
  739   2HB   PRO  46          2HB       PRO  46  -0.466  14.870   1.052
  740   1HG   PRO  46          1HG       PRO  46  -2.930  14.474  -0.522
  741   2HG   PRO  46          2HG       PRO  46  -2.737  15.271   1.080
  742   1HD   PRO  46          1HD       PRO  46  -3.144  16.491  -1.478
  743   2HD   PRO  46          2HD       PRO  46  -2.801  17.323   0.045
  744    H    TRP  47           H        TRP  47   2.078  15.456  -2.148
  745    HA   TRP  47           HA       TRP  47   0.897  14.473  -4.610
  746   1HB   TRP  47          1HB       TRP  47   3.804  14.641  -4.473
  747   2HB   TRP  47          2HB       TRP  47   2.673  15.332  -5.638
  748    HD1  TRP  47           HD1      TRP  47   1.487  17.764  -4.760
  749    HE1  TRP  47           HE1      TRP  47   2.482  19.780  -3.379
  750    HE3  TRP  47           HE3      TRP  47   5.380  15.165  -2.773
  751    HZ2  TRP  47           HZ2      TRP  47   4.735  20.056  -1.649
  752    HZ3  TRP  47           HZ3      TRP  47   6.930  16.383  -1.248
  753    HH2  TRP  47           HH2      TRP  47   6.657  18.743  -0.677
  754    H    CYS  48           H        CYS  48   0.866  12.915  -2.013
  755    HA   CYS  48           HA       CYS  48   1.609  10.443  -3.109
  756   1HB   CYS  48          1HB       CYS  48   3.868  11.277  -2.539
  757   2HB   CYS  48          2HB       CYS  48   3.382  11.379  -0.844
  758    H    PHE  49           H        PHE  49  -0.376   9.612  -2.456
  759    HA   PHE  49           HA       PHE  49  -0.847   9.600   0.428
  760   1HB   PHE  49          1HB       PHE  49  -3.382   9.727  -0.621
  761   2HB   PHE  49          2HB       PHE  49  -2.494  11.175  -0.133
  762    HD1  PHE  49           HD1      PHE  49  -0.829  12.027  -2.098
  763    HD2  PHE  49           HD2      PHE  49  -4.401   9.807  -2.664
  764    HE1  PHE  49           HE1      PHE  49  -1.004  12.906  -4.443
  765    HE2  PHE  49           HE2      PHE  49  -4.576  10.686  -5.009
  766    HZ   PHE  49           HZ       PHE  49  -2.876  12.225  -5.870
  767    H    LYS  50           H        LYS  50  -3.228   8.156   0.467
  768    HA   LYS  50           HA       LYS  50  -2.515   5.721  -1.012
  769   1HB   LYS  50          1HB       LYS  50  -3.342   4.454   0.966
  770   2HB   LYS  50          2HB       LYS  50  -1.847   5.362   1.254
  771   1HG   LYS  50          1HG       LYS  50  -3.940   7.150   1.877
  772   2HG   LYS  50          2HG       LYS  50  -4.454   5.598   2.561
  773   1HD   LYS  50          1HD       LYS  50  -3.114   6.967   4.159
  774   2HD   LYS  50          2HD       LYS  50  -2.337   5.414   3.801
  775   1HE   LYS  50          1HE       LYS  50  -1.348   7.151   1.833
  776   2HE   LYS  50          2HE       LYS  50  -1.391   8.154   3.292
  777   1HZ   LYS  50          1HZ       LYS  50  -0.380   5.870   4.195
  778   2HZ   LYS  50          2HZ       LYS  50   0.235   5.883   2.683
  779   3HZ   LYS  50          3HZ       LYS  50   0.526   7.132   3.692
  780    HA   PRO  51           HA       PRO  51  -6.767   7.023  -1.931
  781   1HB   PRO  51          1HB       PRO  51  -6.523   7.224  -4.646
  782   2HB   PRO  51          2HB       PRO  51  -6.376   8.604  -3.560
  783   1HG   PRO  51          1HG       PRO  51  -4.288   7.069  -4.971
  784   2HG   PRO  51          2HG       PRO  51  -4.187   8.727  -4.276
  785   1HD   PRO  51          1HD       PRO  51  -3.096   6.291  -3.238
  786   2HD   PRO  51          2HD       PRO  51  -3.106   7.869  -2.438
  787    H    LEU  52           H        LEU  52  -5.801   5.493  -4.880
  788    HA   LEU  52           HA       LEU  52  -7.379   3.179  -4.014
  789   1HB   LEU  52          1HB       LEU  52  -8.195   2.981  -6.087
  790   2HB   LEU  52          2HB       LEU  52  -7.902   4.729  -6.085
  791    HG   LEU  52           HG       LEU  52  -7.007   4.220  -8.105
  792   1HD1  LEU  52          1HD1      LEU  52  -4.455   3.252  -7.128
  793   2HD1  LEU  52          2HD1      LEU  52  -4.882   4.818  -7.859
  794   3HD1  LEU  52          3HD1      LEU  52  -5.084   4.569  -6.108
  795   1HD2  LEU  52          1HD2      LEU  52  -5.596   1.731  -7.776
  796   2HD2  LEU  52          2HD2      LEU  52  -7.275   1.562  -7.210
  797   3HD2  LEU  52          3HD2      LEU  52  -6.946   2.137  -8.862
  798    H    GLN  53           H        GLN  53  -4.515   3.779  -3.314
  799    HA   GLN  53           HA       GLN  53  -2.728   2.476  -4.859
  800   1HB   GLN  53          1HB       GLN  53  -1.957   1.790  -2.268
  801   2HB   GLN  53          2HB       GLN  53  -1.531   3.286  -3.119
  802   1HG   GLN  53          1HG       GLN  53  -2.540   3.665  -0.854
  803   2HG   GLN  53          2HG       GLN  53  -3.460   4.436  -2.154
  804   1HE2  GLN  53          1HE2      GLN  53  -3.271   1.039  -1.147
  805   2HE2  GLN  53          2HE2      GLN  53  -4.943   0.829  -0.745
  806    H    GLU  54           H        GLU  54  -5.446   1.134  -3.139
  807    HA   GLU  54           HA       GLU  54  -4.763  -1.290  -2.363
  808   1HB   GLU  54          1HB       GLU  54  -7.006  -2.061  -3.049
  809   2HB   GLU  54          2HB       GLU  54  -7.075  -0.434  -2.347
  810   1HG   GLU  54          1HG       GLU  54  -7.938   0.403  -4.256
  811   2HG   GLU  54          2HG       GLU  54  -6.618  -0.275  -5.220
  812    H    ALA  55           H        ALA  55  -4.617  -0.084  -5.673
  813    HA   ALA  55           HA       ALA  55  -4.804  -2.193  -7.278
  814   1HB   ALA  55          1HB       ALA  55  -3.676  -0.873  -8.739
  815   2HB   ALA  55          2HB       ALA  55  -3.682   0.319  -7.416
  816   3HB   ALA  55          3HB       ALA  55  -2.263  -0.728  -7.666
  817    H    GLU  56           H        GLU  56  -1.548  -1.376  -5.890
  818    HA   GLU  56           HA       GLU  56  -1.129  -4.259  -5.710
  819   1HB   GLU  56          1HB       GLU  56   1.278  -3.797  -6.089
  820   2HB   GLU  56          2HB       GLU  56   0.282  -3.258  -7.452
  821   1HG   GLU  56          1HG       GLU  56   0.400  -0.951  -6.686
  822   2HG   GLU  56          2HG       GLU  56   1.211  -1.432  -5.188
  823    H    CYS  57           H        CYS  57  -2.204  -2.115  -3.751
  824    HA   CYS  57           HA       CYS  57  -0.114  -2.323  -1.724
  825   1HB   CYS  57          1HB       CYS  57  -1.489  -0.150  -2.480
  826   2HB   CYS  57          2HB       CYS  57  -2.570  -0.737  -1.214
  827    H    THR  58           H        THR  58  -3.711  -2.657  -2.198
  828    HA   THR  58           HA       THR  58  -3.976  -4.191   0.215
  829    HB   THR  58           HB       THR  58  -5.627  -2.543  -1.182
  830    HG1  THR  58           HG1      THR  58  -7.268  -3.711   0.119
  831   1HG2  THR  58          1HG2      THR  58  -5.866  -4.132  -3.117
  832   2HG2  THR  58          2HG2      THR  58  -6.409  -5.396  -1.987
  833   3HG2  THR  58          3HG2      THR  58  -7.399  -3.937  -2.233
  834    H    PHE  59           H        PHE  59  -3.841  -4.867  -3.314
  835    HA   PHE  59           HA       PHE  59  -4.650  -7.340  -3.586
  836   1HB   PHE  59          1HB       PHE  59  -2.550  -5.628  -4.627
  837   2HB   PHE  59          2HB       PHE  59  -1.888  -7.263  -4.526
  838    HD1  PHE  59           HD1      PHE  59  -2.038  -8.473  -6.469
  839    HD2  PHE  59           HD2      PHE  59  -5.104  -5.672  -5.596
  840    HE1  PHE  59           HE1      PHE  59  -3.184  -9.056  -8.625
  841    HE2  PHE  59           HE2      PHE  59  -6.249  -6.255  -7.752
  842    HZ   PHE  59           HZ       PHE  59  -5.277  -7.940  -9.240
  Start of MODEL   11
    1   1H    GLU   1           H1       GLU   1 -14.002  -8.894  -4.065
    2    HA   GLU   1           HA       GLU   1 -15.101  -6.498  -4.011
    3   1HB   GLU   1          1HB       GLU   1 -16.973  -8.221  -5.311
    4   2HB   GLU   1          2HB       GLU   1 -17.662  -7.796  -3.736
    5   1HG   GLU   1          1HG       GLU   1 -18.337  -5.888  -4.765
    6   2HG   GLU   1          2HG       GLU   1 -16.653  -5.362  -4.609
    7    H    GLU   2           H        GLU   2 -15.179  -9.846  -2.873
    8    HA   GLU   2           HA       GLU   2 -16.043  -9.023  -0.257
    9   1HB   GLU   2          1HB       GLU   2 -16.117 -11.426  -1.771
   10   2HB   GLU   2          2HB       GLU   2 -15.098 -11.763  -0.361
   11   1HG   GLU   2          1HG       GLU   2 -17.040 -10.516   0.946
   12   2HG   GLU   2          2HG       GLU   2 -18.004 -10.935  -0.479
   13    H    TYR   3           H        TYR   3 -14.184  -7.546   0.114
   14    HA   TYR   3           HA       TYR   3 -11.542  -8.257   0.018
   15   1HB   TYR   3          1HB       TYR   3 -13.002  -6.675   2.211
   16   2HB   TYR   3          2HB       TYR   3 -11.345  -6.397   1.667
   17    HD1  TYR   3           HD1      TYR   3 -11.894  -6.575  -1.335
   18    HD2  TYR   3           HD2      TYR   3 -13.915  -4.520   1.827
   19    HE1  TYR   3           HE1      TYR   3 -12.748  -4.848  -2.994
   20    HE2  TYR   3           HE2      TYR   3 -14.761  -2.799   0.158
   21    HH   TYR   3           HH       TYR   3 -13.504  -2.574  -2.991
   22    H    VAL   4           H        VAL   4 -11.370 -10.525   0.632
   23    HA   VAL   4           HA       VAL   4 -11.262 -10.807   3.548
   24    HB   VAL   4           HB       VAL   4 -12.259 -12.905   1.612
   25   1HG1  VAL   4          1HG1      VAL   4 -11.067 -13.490   3.876
   26   2HG1  VAL   4          2HG1      VAL   4 -12.614 -12.987   4.597
   27   3HG1  VAL   4          3HG1      VAL   4 -12.572 -14.320   3.418
   28   1HG2  VAL   4          1HG2      VAL   4 -13.981 -11.506   3.655
   29   2HG2  VAL   4          2HG2      VAL   4 -13.745 -10.816   2.031
   30   3HG2  VAL   4          3HG2      VAL   4 -14.465 -12.434   2.216
   31    H    GLY   5           H        GLY   5 -10.358 -12.334   0.374
   32   1HA   GLY   5          1HA       GLY   5  -8.071 -13.640   1.429
   33   2HA   GLY   5          2HA       GLY   5  -8.474 -13.395  -0.259
   34    H    LEU   6           H        LEU   6  -8.681 -10.343   1.079
   35    HA   LEU   6           HA       LEU   6  -5.811  -9.829   0.825
   36   1HB   LEU   6          1HB       LEU   6  -7.474  -7.747  -0.332
   37   2HB   LEU   6          2HB       LEU   6  -5.984  -8.492  -0.936
   38    HG   LEU   6           HG       LEU   6  -7.491 -10.461  -1.632
   39   1HD1  LEU   6          1HD1      LEU   6  -9.822  -8.897  -2.118
   40   2HD1  LEU   6          2HD1      LEU   6  -9.656 -10.392  -1.166
   41   3HD1  LEU   6          3HD1      LEU   6  -9.446  -8.808  -0.381
   42   1HD2  LEU   6          1HD2      LEU   6  -6.947  -7.899  -2.900
   43   2HD2  LEU   6          2HD2      LEU   6  -6.878  -9.549  -3.566
   44   3HD2  LEU   6          3HD2      LEU   6  -8.422  -8.664  -3.539
   45    H    SER   7           H        SER   7  -8.141 -10.027   2.944
   46    HA   SER   7           HA       SER   7  -7.795  -7.339   3.998
   47   1HB   SER   7          1HB       SER   7 -10.089  -8.784   3.686
   48   2HB   SER   7          2HB       SER   7  -9.671  -9.218   5.353
   49    HG   SER   7           HG       SER   7  -9.912  -7.119   5.997
   50    H    ALA   8           H        ALA   8  -8.609  -8.365   6.741
   51    HA   ALA   8           HA       ALA   8  -6.004  -8.844   7.712
   52   1HB   ALA   8          1HB       ALA   8  -7.492  -9.390   9.840
   53   2HB   ALA   8          2HB       ALA   8  -7.368  -7.726   9.221
   54   3HB   ALA   8          3HB       ALA   8  -8.794  -8.716   8.831
   55    H    ASN   9           H        ASN   9  -5.292 -10.711   6.470
   56    HA   ASN   9           HA       ASN   9  -5.360 -13.027   7.818
   57   1HB   ASN   9          1HB       ASN   9  -7.880 -12.698   6.597
   58   2HB   ASN   9          2HB       ASN   9  -7.032 -13.819   5.522
   59   1HD2  ASN   9          1HD2      ASN   9  -5.855 -15.616   6.632
   60   2HD2  ASN   9          2HD2      ASN   9  -6.636 -16.407   7.960
   61    H    GLN  10           H        GLN  10  -5.375 -11.285   4.718
   62    HA   GLN  10           HA       GLN  10  -4.144 -13.204   3.152
   63   1HB   GLN  10          1HB       GLN  10  -5.233 -11.236   2.210
   64   2HB   GLN  10          2HB       GLN  10  -4.056 -10.160   2.986
   65   1HG   GLN  10          1HG       GLN  10  -2.242 -11.222   1.652
   66   2HG   GLN  10          2HG       GLN  10  -3.433 -12.271   0.865
   67   1HE2  GLN  10          1HE2      GLN  10  -3.628  -8.857   1.813
   68   2HE2  GLN  10          2HE2      GLN  10  -3.877  -8.197   0.231
   69    H    CYS  11           H        CYS  11  -2.869 -10.808   5.481
   70    HA   CYS  11           HA       CYS  11  -0.191 -10.997   4.698
   71   1HB   CYS  11          1HB       CYS  11  -0.891  -9.149   5.996
   72   2HB   CYS  11          2HB       CYS  11  -1.512 -10.184   7.286
   73    H    ALA  12           H        ALA  12  -2.301 -13.350   5.850
   74    HA   ALA  12           HA       ALA  12  -0.152 -14.779   7.256
   75   1HB   ALA  12          1HB       ALA  12  -2.371 -14.217   8.437
   76   2HB   ALA  12          2HB       ALA  12  -3.118 -15.407   7.344
   77   3HB   ALA  12          3HB       ALA  12  -1.844 -15.916   8.477
   78    H    VAL  13           H        VAL  13  -1.063 -14.368   4.222
   79    HA   VAL  13           HA       VAL  13  -2.049 -16.645   3.156
   80    HB   VAL  13           HB       VAL  13  -0.789 -14.349   2.271
   81   1HG1  VAL  13          1HG1      VAL  13   0.867 -15.106   0.607
   82   2HG1  VAL  13          2HG1      VAL  13   1.396 -15.446   2.272
   83   3HG1  VAL  13          3HG1      VAL  13   0.755 -16.759   1.255
   84   1HG2  VAL  13          1HG2      VAL  13  -2.305 -14.738   0.684
   85   2HG2  VAL  13          2HG2      VAL  13  -1.285 -16.038   0.021
   86   3HG2  VAL  13          3HG2      VAL  13  -2.500 -16.408   1.268
   87    HA   PRO  14           HA       PRO  14   0.848 -19.807   3.697
   88   1HB   PRO  14          1HB       PRO  14   0.809 -21.176   1.333
   89   2HB   PRO  14          2HB       PRO  14  -0.437 -21.347   2.567
   90   1HG   PRO  14          1HG       PRO  14  -0.489 -19.877   0.011
   91   2HG   PRO  14          2HG       PRO  14  -1.876 -20.443   1.008
   92   1HD   PRO  14          1HD       PRO  14  -0.845 -17.786   0.736
   93   2HD   PRO  14          2HD       PRO  14  -2.109 -18.318   1.853
   94    H    ALA  15           H        ALA  15   1.894 -17.218   2.753
   95    HA   ALA  15           HA       ALA  15   3.750 -16.367   1.863
   96   1HB   ALA  15          1HB       ALA  15   5.713 -18.267   2.478
   97   2HB   ALA  15          2HB       ALA  15   5.149 -16.947   3.531
   98   3HB   ALA  15          3HB       ALA  15   4.424 -18.567   3.668
   99    H    LYS  16           H        LYS  16   2.502 -17.044  -0.274
  100    HA   LYS  16           HA       LYS  16   4.415 -17.750  -2.130
  101   1HB   LYS  16          1HB       LYS  16   3.488 -19.989  -2.845
  102   2HB   LYS  16          2HB       LYS  16   4.479 -19.986  -1.375
  103   1HG   LYS  16          1HG       LYS  16   2.770 -20.923  -0.254
  104   2HG   LYS  16          2HG       LYS  16   1.770 -19.495  -0.576
  105   1HD   LYS  16          1HD       LYS  16   0.616 -21.464  -1.403
  106   2HD   LYS  16          2HD       LYS  16   1.151 -20.514  -2.802
  107   1HE   LYS  16          1HE       LYS  16   3.097 -22.005  -3.079
  108   2HE   LYS  16          2HE       LYS  16   2.625 -22.930  -1.644
  109   1HZ   LYS  16          1HZ       LYS  16   1.413 -24.131  -3.016
  110   2HZ   LYS  16          2HZ       LYS  16   0.428 -22.850  -3.260
  111   3HZ   LYS  16          3HZ       LYS  16   1.674 -23.130  -4.280
  112    H    ASP  17           H        ASP  17   2.367 -15.783  -1.601
  113    HA   ASP  17           HA       ASP  17   1.112 -15.907  -4.144
  114   1HB   ASP  17          1HB       ASP  17  -0.415 -17.181  -2.494
  115   2HB   ASP  17          2HB       ASP  17  -0.704 -15.616  -1.716
  116    H    ARG  18           H        ARG  18   2.940 -14.329  -2.122
  117    HA   ARG  18           HA       ARG  18   1.428 -11.920  -1.795
  118   1HB   ARG  18          1HB       ARG  18   4.368 -12.485  -1.204
  119   2HB   ARG  18          2HB       ARG  18   3.445 -11.090  -0.619
  120   1HG   ARG  18          1HG       ARG  18   2.425 -12.304   1.024
  121   2HG   ARG  18          2HG       ARG  18   2.241 -13.741   0.002
  122   1HD   ARG  18          1HD       ARG  18   4.487 -14.448   0.436
  123   2HD   ARG  18          2HD       ARG  18   4.946 -12.874   1.107
  124    HE   ARG  18           HE       ARG  18   2.766 -14.151   2.571
  125   1HH1  ARG  18          1HH1      ARG  18   6.264 -13.996   2.221
  126   2HH1  ARG  18          2HH1      ARG  18   6.578 -14.554   3.830
  127   1HH2  ARG  18          1HH2      ARG  18   3.179 -14.888   4.695
  128   2HH2  ARG  18          2HH2      ARG  18   4.812 -15.064   5.247
  129    H    VAL  19           H        VAL  19   3.175  -9.849  -2.249
  130    HA   VAL  19           HA       VAL  19   3.824 -10.159  -5.098
  131    HB   VAL  19           HB       VAL  19   3.119  -7.606  -3.654
  132   1HG1  VAL  19          1HG1      VAL  19   4.048  -8.249  -6.306
  133   2HG1  VAL  19          2HG1      VAL  19   2.417  -7.542  -6.394
  134   3HG1  VAL  19          3HG1      VAL  19   3.729  -6.657  -5.577
  135   1HG2  VAL  19          1HG2      VAL  19   1.215  -9.253  -5.341
  136   2HG2  VAL  19          2HG2      VAL  19   1.269  -9.341  -3.564
  137   3HG2  VAL  19          3HG2      VAL  19   0.855  -7.806  -4.367
  138    H    ASP  20           H        ASP  20   5.444 -10.751  -2.572
  139    HA   ASP  20           HA       ASP  20   7.325 -10.101  -1.577
  140   1HB   ASP  20          1HB       ASP  20   8.372 -11.471  -3.112
  141   2HB   ASP  20          2HB       ASP  20   7.790 -10.546  -4.506
  142    H    CYS  21           H        CYS  21   6.884  -7.923  -0.774
  143    HA   CYS  21           HA       CYS  21   6.790  -5.634  -2.228
  144   1HB   CYS  21          1HB       CYS  21   6.558  -6.193   0.356
  145   2HB   CYS  21          2HB       CYS  21   8.197  -5.535   0.398
  146    H    GLY  22           H        GLY  22   9.591  -7.604  -1.209
  147   1HA   GLY  22          1HA       GLY  22  11.784  -7.484  -1.684
  148   2HA   GLY  22          2HA       GLY  22  11.305  -6.714  -3.183
  149    H    TYR  23           H        TYR  23  11.300  -5.770   0.337
  150    HA   TYR  23           HA       TYR  23  12.168  -3.109  -0.435
  151   1HB   TYR  23          1HB       TYR  23  10.501  -4.290   1.493
  152   2HB   TYR  23          2HB       TYR  23  11.967  -3.980   2.431
  153    HD1  TYR  23           HD1      TYR  23  10.567  -1.914  -0.344
  154    HD2  TYR  23           HD2      TYR  23  11.263  -2.241   3.864
  155    HE1  TYR  23           HE1      TYR  23   9.839   0.502  -0.029
  156    HE2  TYR  23           HE2      TYR  23  10.533   0.176   4.165
  157    HH   TYR  23           HH       TYR  23   9.581   2.135   1.354
  158    HA   PRO  24           HA       PRO  24  16.312  -3.904   0.567
  159   1HB   PRO  24          1HB       PRO  24  17.240  -1.337   0.663
  160   2HB   PRO  24          2HB       PRO  24  17.038  -2.234  -0.841
  161   1HG   PRO  24          1HG       PRO  24  15.371  -0.103   0.335
  162   2HG   PRO  24          2HG       PRO  24  15.439  -0.661  -1.375
  163   1HD   PRO  24          1HD       PRO  24  13.423  -1.189   0.590
  164   2HD   PRO  24          2HD       PRO  24  13.527  -1.889  -1.031
  165    H    HIS  25           H        HIS  25  14.097  -2.583   2.625
  166    HA   HIS  25           HA       HIS  25  16.027  -2.886   4.798
  167   1HB   HIS  25          1HB       HIS  25  14.869  -0.459   3.976
  168   2HB   HIS  25          2HB       HIS  25  14.009  -0.924   5.449
  169    HD1  HIS  25           HD1      HIS  25  15.719   1.540   5.652
  170    HD2  HIS  25           HD2      HIS  25  17.246  -2.309   6.323
  171    HE1  HIS  25           HE1      HIS  25  17.810   1.841   7.082
  172    HE2  HIS  25           HE2      HIS  25  18.673  -0.562   7.508
  173    H    VAL  26           H        VAL  26  14.288  -4.888   3.714
  174    HA   VAL  26           HA       VAL  26  11.812  -5.024   4.954
  175    HB   VAL  26           HB       VAL  26  12.168  -6.501   3.221
  176   1HG1  VAL  26          1HG1      VAL  26  14.261  -8.239   3.768
  177   2HG1  VAL  26          2HG1      VAL  26  14.300  -6.871   2.631
  178   3HG1  VAL  26          3HG1      VAL  26  14.884  -6.659   4.299
  179   1HG2  VAL  26          1HG2      VAL  26  11.288  -7.520   5.508
  180   2HG2  VAL  26          2HG2      VAL  26  11.536  -8.540   4.070
  181   3HG2  VAL  26          3HG2      VAL  26  12.759  -8.510   5.362
  182    H    THR  27           H        THR  27  11.226  -5.175   7.055
  183    HA   THR  27           HA       THR  27  12.641  -6.844   8.869
  184    HB   THR  27           HB       THR  27  13.607  -4.150   8.534
  185    HG1  THR  27           HG1      THR  27  15.146  -5.462   9.428
  186   1HG2  THR  27          1HG2      THR  27  11.634  -4.293  10.630
  187   2HG2  THR  27          2HG2      THR  27  13.237  -4.309  11.403
  188   3HG2  THR  27          3HG2      THR  27  12.788  -2.976  10.312
  189    HA   PRO  28           HA       PRO  28   8.770  -6.668  10.709
  190   1HB   PRO  28          1HB       PRO  28   9.313  -7.632  13.207
  191   2HB   PRO  28          2HB       PRO  28   9.117  -8.669  11.795
  192   1HG   PRO  28          1HG       PRO  28  11.568  -7.825  13.202
  193   2HG   PRO  28          2HG       PRO  28  11.333  -9.229  12.100
  194   1HD   PRO  28          1HD       PRO  28  12.641  -6.738  11.560
  195   2HD   PRO  28          2HD       PRO  28  12.296  -8.025  10.394
  196    H    LYS  29           H        LYS  29   9.525  -4.171  10.427
  197    HA   LYS  29           HA       LYS  29   8.189  -2.880  12.461
  198   1HB   LYS  29          1HB       LYS  29  10.008  -3.544  13.927
  199   2HB   LYS  29          2HB       LYS  29  11.195  -2.790  12.849
  200   1HG   LYS  29          1HG       LYS  29  10.747  -0.712  13.644
  201   2HG   LYS  29          2HG       LYS  29   8.993  -0.973  13.615
  202   1HD   LYS  29          1HD       LYS  29   8.981  -1.314  15.840
  203   2HD   LYS  29          2HD       LYS  29  10.174  -2.616  15.690
  204   1HE   LYS  29          1HE       LYS  29  11.744  -0.377  15.337
  205   2HE   LYS  29          2HE       LYS  29  10.538   0.227  16.483
  206   1HZ   LYS  29          1HZ       LYS  29  12.583  -0.933  17.375
  207   2HZ   LYS  29          2HZ       LYS  29  11.142  -1.374  18.006
  208   3HZ   LYS  29          3HZ       LYS  29  11.881  -2.332  16.909
  209    H    GLU  30           H        GLU  30  10.489  -3.007   9.802
  210    HA   GLU  30           HA       GLU  30  10.096  -0.192   9.288
  211   1HB   GLU  30          1HB       GLU  30  12.098  -2.212   8.611
  212   2HB   GLU  30          2HB       GLU  30  11.610  -1.280   7.184
  213   1HG   GLU  30          1HG       GLU  30  13.243   0.132   7.980
  214   2HG   GLU  30          2HG       GLU  30  11.892   0.761   8.936
  215    H    CYS  31           H        CYS  31   9.509  -3.434   7.794
  216    HA   CYS  31           HA       CYS  31   8.316  -2.462   5.473
  217   1HB   CYS  31          1HB       CYS  31   8.411  -5.063   6.907
  218   2HB   CYS  31          2HB       CYS  31   7.152  -4.854   5.687
  219    H    ASN  32           H        ASN  32   6.859  -3.830   8.524
  220    HA   ASN  32           HA       ASN  32   4.260  -3.270   7.851
  221   1HB   ASN  32          1HB       ASN  32   5.793  -3.901  10.319
  222   2HB   ASN  32          2HB       ASN  32   4.286  -3.025  10.623
  223   1HD2  ASN  32          1HD2      ASN  32   5.514  -5.618   8.505
  224   2HD2  ASN  32          2HD2      ASN  32   4.196  -6.721   8.723
  225    H    ASN  33           H        ASN  33   6.845  -1.129   8.379
  226    HA   ASN  33           HA       ASN  33   5.105   0.929   9.466
  227   1HB   ASN  33          1HB       ASN  33   7.160   0.739  10.716
  228   2HB   ASN  33          2HB       ASN  33   8.141   0.665   9.244
  229   1HD2  ASN  33          1HD2      ASN  33   9.180   2.432   8.774
  230   2HD2  ASN  33          2HD2      ASN  33   8.722   4.060   9.149
  231    H    ARG  34           H        ARG  34   6.931  -0.200   6.657
  232    HA   ARG  34           HA       ARG  34   6.830   2.360   5.381
  233   1HB   ARG  34          1HB       ARG  34   8.302   1.468   3.825
  234   2HB   ARG  34          2HB       ARG  34   8.640   0.380   5.182
  235   1HG   ARG  34          1HG       ARG  34   8.262  -1.211   3.574
  236   2HG   ARG  34          2HG       ARG  34   6.573  -0.966   4.053
  237   1HD   ARG  34          1HD       ARG  34   7.106   1.048   2.144
  238   2HD   ARG  34          2HD       ARG  34   7.888  -0.403   1.496
  239    HE   ARG  34           HE       ARG  34   5.114  -0.710   2.495
  240   1HH1  ARG  34          1HH1      ARG  34   7.250  -0.308  -0.273
  241   2HH1  ARG  34          2HH1      ARG  34   6.079  -0.867  -1.420
  242   1HH2  ARG  34          1HH2      ARG  34   3.569  -1.448   0.982
  243   2HH2  ARG  34          2HH2      ARG  34   3.971  -1.521  -0.702
  244    H    GLY  35           H        GLY  35   5.004  -0.651   5.567
  245   1HA   GLY  35          1HA       GLY  35   2.654  -0.328   4.850
  246   2HA   GLY  35          2HA       GLY  35   3.295   0.247   3.324
  247    H    CYS  36           H        CYS  36   5.074  -2.312   4.967
  248    HA   CYS  36           HA       CYS  36   3.917  -4.225   3.070
  249   1HB   CYS  36          1HB       CYS  36   6.780  -3.936   3.979
  250   2HB   CYS  36          2HB       CYS  36   6.164  -5.336   3.098
  251    H    CYS  37           H        CYS  37   4.456  -6.602   3.931
  252    HA   CYS  37           HA       CYS  37   3.988  -6.566   6.825
  253   1HB   CYS  37          1HB       CYS  37   2.079  -7.259   5.239
  254   2HB   CYS  37          2HB       CYS  37   3.000  -8.747   5.005
  255    H    PHE  38           H        PHE  38   5.504  -7.696   8.022
  256    HA   PHE  38           HA       PHE  38   7.587  -9.047   6.533
  257   1HB   PHE  38          1HB       PHE  38   7.812  -7.329   8.488
  258   2HB   PHE  38          2HB       PHE  38   7.227  -8.612   9.552
  259    HD1  PHE  38           HD1      PHE  38   8.733 -10.148  10.454
  260    HD2  PHE  38           HD2      PHE  38   9.929  -7.799   7.129
  261    HE1  PHE  38           HE1      PHE  38  11.083 -10.999  10.696
  262    HE2  PHE  38           HE2      PHE  38  12.278  -8.651   7.371
  263    HZ   PHE  38           HZ       PHE  38  12.826 -10.240   9.152
  264    H    ASP  39           H        ASP  39   7.716 -11.231   6.299
  265    HA   ASP  39           HA       ASP  39   5.715 -12.811   7.550
  266   1HB   ASP  39          1HB       ASP  39   6.355 -13.334   5.278
  267   2HB   ASP  39          2HB       ASP  39   8.068 -13.438   5.715
  268    H    SER  40           H        SER  40   9.169 -13.777   7.122
  269    HA   SER  40           HA       SER  40  10.766 -14.143   8.614
  270   1HB   SER  40          1HB       SER  40   9.504 -12.511  10.173
  271   2HB   SER  40          2HB       SER  40   8.815 -13.956  10.934
  272    HG   SER  40           HG       SER  40  11.464 -12.934  10.986
  273    H    ARG  41           H        ARG  41   7.521 -15.570   8.844
  274    HA   ARG  41           HA       ARG  41   8.242 -17.857  10.231
  275   1HB   ARG  41          1HB       ARG  41   6.053 -17.610   8.123
  276   2HB   ARG  41          2HB       ARG  41   6.087 -18.751   9.478
  277   1HG   ARG  41          1HG       ARG  41   6.338 -16.380  10.811
  278   2HG   ARG  41          2HG       ARG  41   5.371 -15.852   9.423
  279   1HD   ARG  41          1HD       ARG  41   3.729 -16.506  10.966
  280   2HD   ARG  41          2HD       ARG  41   3.899 -17.969   9.984
  281    HE   ARG  41           HE       ARG  41   4.923 -19.055  11.816
  282   1HH1  ARG  41          1HH1      ARG  41   4.548 -15.621  12.487
  283   2HH1  ARG  41          2HH1      ARG  41   4.941 -15.777  14.166
  284   1HH2  ARG  41          1HH2      ARG  41   5.442 -19.260  14.031
  285   2HH2  ARG  41          2HH2      ARG  41   5.453 -17.859  15.051
  286    H    ILE  42           H        ILE  42   8.184 -17.003   6.731
  287    HA   ILE  42           HA       ILE  42   9.581 -19.535   6.208
  288    HB   ILE  42           HB       ILE  42   7.980 -18.165   4.095
  289   1HG1  ILE  42          1HG1      ILE  42   6.882 -19.594   6.474
  290   2HG1  ILE  42          2HG1      ILE  42   6.228 -18.210   5.581
  291   1HG2  ILE  42          1HG2      ILE  42   7.838 -20.342   3.147
  292   2HG2  ILE  42          2HG2      ILE  42   9.528 -20.099   3.654
  293   3HG2  ILE  42          3HG2      ILE  42   8.438 -21.105   4.638
  294   1HD1  ILE  42          1HD1      ILE  42   6.148 -21.158   4.865
  295   2HD1  ILE  42          2HD1      ILE  42   4.800 -20.002   4.977
  296   3HD1  ILE  42          3HD1      ILE  42   5.940 -19.910   3.613
  297    HA   PRO  43           HA       PRO  43  12.570 -16.472   5.143
  298   1HB   PRO  43          1HB       PRO  43  14.756 -18.085   5.423
  299   2HB   PRO  43          2HB       PRO  43  14.075 -17.147   6.750
  300   1HG   PRO  43          1HG       PRO  43  13.864 -20.032   6.163
  301   2HG   PRO  43          2HG       PRO  43  13.593 -19.180   7.726
  302   1HD   PRO  43          1HD       PRO  43  11.646 -20.248   5.919
  303   2HD   PRO  43          2HD       PRO  43  11.325 -19.280   7.363
  304    H    GLY  44           H        GLY  44  11.422 -19.120   3.584
  305   1HA   GLY  44          1HA       GLY  44  13.324 -18.944   1.370
  306   2HA   GLY  44          2HA       GLY  44  12.036 -20.112   1.581
  307    H    VAL  45           H        VAL  45  10.553 -17.284   2.438
  308    HA   VAL  45           HA       VAL  45   9.830 -16.668  -0.344
  309    HB   VAL  45           HB       VAL  45   7.601 -16.645   0.170
  310   1HG1  VAL  45          1HG1      VAL  45   7.053 -18.724   1.138
  311   2HG1  VAL  45          2HG1      VAL  45   8.701 -18.943   0.500
  312   3HG1  VAL  45          3HG1      VAL  45   8.449 -18.678   2.242
  313   1HG2  VAL  45          1HG2      VAL  45   6.620 -16.355   2.369
  314   2HG2  VAL  45          2HG2      VAL  45   8.223 -16.457   3.137
  315   3HG2  VAL  45          3HG2      VAL  45   7.824 -15.076   2.088
  316    HA   PRO  46           HA       PRO  46  10.232 -12.472   0.707
  317   1HB   PRO  46          1HB       PRO  46   7.889 -11.196   0.120
  318   2HB   PRO  46          2HB       PRO  46   9.062 -11.669  -1.107
  319   1HG   PRO  46          1HG       PRO  46   6.485 -12.903  -0.371
  320   2HG   PRO  46          2HG       PRO  46   7.422 -13.085  -1.899
  321   1HD   PRO  46          1HD       PRO  46   7.164 -14.944   0.266
  322   2HD   PRO  46          2HD       PRO  46   8.224 -15.103  -1.142
  323    H    TRP  47           H        TRP  47  10.717 -11.652   2.633
  324    HA   TRP  47           HA       TRP  47   8.689 -12.028   4.686
  325   1HB   TRP  47          1HB       TRP  47  11.201 -10.747   5.446
  326   2HB   TRP  47          2HB       TRP  47  10.365 -12.134   6.150
  327    HD1  TRP  47           HD1      TRP  47  10.884 -14.579   4.846
  328    HE1  TRP  47           HE1      TRP  47  13.043 -15.511   3.649
  329    HE3  TRP  47           HE3      TRP  47  13.094 -10.052   4.158
  330    HZ2  TRP  47           HZ2      TRP  47  15.381 -14.277   2.572
  331    HZ3  TRP  47           HZ3      TRP  47  15.314 -10.003   3.025
  332    HH2  TRP  47           HH2      TRP  47  16.454 -12.019   2.243
  333    H    CYS  48           H        CYS  48   8.297 -10.131   2.420
  334    HA   CYS  48           HA       CYS  48   7.491  -7.913   3.959
  335   1HB   CYS  48          1HB       CYS  48   9.904  -7.405   3.783
  336   2HB   CYS  48          2HB       CYS  48   9.754  -7.380   2.024
  337    H    PHE  49           H        PHE  49   5.456  -8.051   3.011
  338    HA   PHE  49           HA       PHE  49   5.392  -7.654   0.115
  339   1HB   PHE  49          1HB       PHE  49   3.161  -9.202   0.644
  340   2HB   PHE  49          2HB       PHE  49   4.694  -9.887   0.092
  341    HD1  PHE  49           HD1      PHE  49   6.413 -10.255   2.160
  342    HD2  PHE  49           HD2      PHE  49   2.178 -10.231   2.429
  343    HE1  PHE  49           HE1      PHE  49   6.539 -11.622   4.262
  344    HE2  PHE  49           HE2      PHE  49   2.304 -11.598   4.531
  345    HZ   PHE  49           HZ       PHE  49   4.484 -12.277   5.422
  346    H    LYS  50           H        LYS  50   2.633  -7.564  -0.248
  347    HA   LYS  50           HA       LYS  50   1.809  -5.470   1.640
  348   1HB   LYS  50          1HB       LYS  50   0.682  -4.398  -0.343
  349   2HB   LYS  50          2HB       LYS  50   2.450  -4.296  -0.310
  350   1HG   LYS  50          1HG       LYS  50   1.663  -6.734  -1.643
  351   2HG   LYS  50          2HG       LYS  50   0.770  -5.382  -2.364
  352   1HD   LYS  50          1HD       LYS  50   3.781  -5.703  -2.073
  353   2HD   LYS  50          2HD       LYS  50   2.852  -5.608  -3.580
  354   1HE   LYS  50          1HE       LYS  50   2.216  -3.268  -2.095
  355   2HE   LYS  50          2HE       LYS  50   3.971  -3.458  -1.965
  356   1HZ   LYS  50          1HZ       LYS  50   3.700  -2.335  -3.917
  357   2HZ   LYS  50          2HZ       LYS  50   3.774  -3.869  -4.472
  358   3HZ   LYS  50          3HZ       LYS  50   2.331  -3.115  -4.346
  359    HA   PRO  51           HA       PRO  51  -1.261  -8.805   1.417
  360   1HB   PRO  51          1HB       PRO  51  -1.321  -9.439   4.074
  361   2HB   PRO  51          2HB       PRO  51  -0.342 -10.311   2.897
  362   1HG   PRO  51          1HG       PRO  51   0.451  -8.305   4.909
  363   2HG   PRO  51          2HG       PRO  51   1.481  -9.520   4.069
  364   1HD   PRO  51          1HD       PRO  51   1.299  -6.701   3.593
  365   2HD   PRO  51          2HD       PRO  51   2.207  -7.878   2.633
  366    H    LEU  52           H        LEU  52  -1.767  -7.858   4.666
  367    HA   LEU  52           HA       LEU  52  -4.182  -6.502   3.776
  368   1HB   LEU  52          1HB       LEU  52  -5.114  -7.145   5.683
  369   2HB   LEU  52          2HB       LEU  52  -3.810  -8.346   5.681
  370    HG   LEU  52           HG       LEU  52  -4.122  -5.855   7.338
  371   1HD1  LEU  52          1HD1      LEU  52  -3.173  -7.785   8.981
  372   2HD1  LEU  52          2HD1      LEU  52  -4.901  -7.496   8.670
  373   3HD1  LEU  52          3HD1      LEU  52  -4.041  -8.778   7.784
  374   1HD2  LEU  52          1HD2      LEU  52  -1.959  -5.377   7.290
  375   2HD2  LEU  52          2HD2      LEU  52  -1.598  -7.003   7.919
  376   3HD2  LEU  52          3HD2      LEU  52  -1.658  -6.721   6.163
  377    H    GLN  53           H        GLN  53  -1.599  -5.254   3.243
  378    HA   GLN  53           HA       GLN  53  -0.902  -3.428   5.175
  379   1HB   GLN  53          1HB       GLN  53  -0.751  -3.197   2.145
  380   2HB   GLN  53          2HB       GLN  53   0.128  -2.153   3.276
  381   1HG   GLN  53          1HG       GLN  53   0.425  -5.157   2.886
  382   2HG   GLN  53          2HG       GLN  53   1.637  -3.914   2.545
  383   1HE2  GLN  53          1HE2      GLN  53   0.108  -5.914   4.893
  384   2HE2  GLN  53          2HE2      GLN  53   1.077  -5.503   6.270
  385    H    GLU  54           H        GLU  54  -3.663  -3.545   2.995
  386    HA   GLU  54           HA       GLU  54  -4.341  -1.012   2.587
  387   1HB   GLU  54          1HB       GLU  54  -6.756  -1.779   2.902
  388   2HB   GLU  54          2HB       GLU  54  -5.775  -2.754   1.792
  389   1HG   GLU  54          1HG       GLU  54  -6.211  -4.579   3.036
  390   2HG   GLU  54          2HG       GLU  54  -5.422  -3.828   4.431
  391    H    ALA  55           H        ALA  55  -4.093  -2.617   5.707
  392    HA   ALA  55           HA       ALA  55  -5.756  -1.335   7.355
  393   1HB   ALA  55          1HB       ALA  55  -3.067  -2.490   7.511
  394   2HB   ALA  55          2HB       ALA  55  -3.321  -1.205   8.716
  395   3HB   ALA  55          3HB       ALA  55  -4.422  -2.603   8.658
  396    H    GLU  56           H        GLU  56  -2.458  -0.003   6.573
  397    HA   GLU  56           HA       GLU  56  -3.693   2.626   6.648
  398   1HB   GLU  56          1HB       GLU  56  -1.180   1.762   8.122
  399   2HB   GLU  56          2HB       GLU  56  -1.615   3.461   7.865
  400   1HG   GLU  56          1HG       GLU  56  -3.908   2.772   8.932
  401   2HG   GLU  56          2HG       GLU  56  -3.034   1.354   9.526
  402    H    CYS  57           H        CYS  57  -2.783   0.705   4.495
  403    HA   CYS  57           HA       CYS  57  -0.543   2.233   3.413
  404   1HB   CYS  57          1HB       CYS  57   0.126   0.411   2.269
  405   2HB   CYS  57          2HB       CYS  57  -0.652  -0.389   3.637
  406    H    THR  58           H        THR  58  -3.726   0.724   2.480
  407    HA   THR  58           HA       THR  58  -3.921   2.603   0.255
  408    HB   THR  58           HB       THR  58  -4.403  -0.036   0.332
  409    HG1  THR  58           HG1      THR  58  -5.316   0.583  -1.604
  410   1HG2  THR  58          1HG2      THR  58  -6.784  -0.515   0.621
  411   2HG2  THR  58          2HG2      THR  58  -6.207   0.233   2.130
  412   3HG2  THR  58          3HG2      THR  58  -7.134   1.198   0.956
  413    H    PHE  59           H        PHE  59  -5.265   1.955   3.474
  414    HA   PHE  59           HA       PHE  59  -7.619   3.138   3.536
  415   1HB   PHE  59          1HB       PHE  59  -6.533   2.435   5.574
  416   2HB   PHE  59          2HB       PHE  59  -5.119   3.449   5.269
  417    HD1  PHE  59           HD1      PHE  59  -4.903   5.291   6.623
  418    HD2  PHE  59           HD2      PHE  59  -8.806   3.882   5.736
  419    HE1  PHE  59           HE1      PHE  59  -5.881   7.071   8.098
  420    HE2  PHE  59           HE2      PHE  59  -9.784   5.661   7.210
  421    HZ   PHE  59           HZ       PHE  59  -8.310   7.235   8.373
  422   1H    GLU   1           H1       GLU   1 -21.309   6.122   0.821
  423    HA   GLU   1           HA       GLU   1 -20.419   5.538  -1.633
  424   1HB   GLU   1          1HB       GLU   1 -19.359   6.664   0.759
  425   2HB   GLU   1          2HB       GLU   1 -18.133   5.547   0.139
  426   1HG   GLU   1          1HG       GLU   1 -17.539   7.287  -1.197
  427   2HG   GLU   1          2HG       GLU   1 -18.940   6.822  -2.175
  428    H    GLU   2           H        GLU   2 -20.362   3.537  -2.590
  429    HA   GLU   2           HA       GLU   2 -19.658   1.269  -1.001
  430   1HB   GLU   2          1HB       GLU   2 -20.340   1.563  -3.951
  431   2HB   GLU   2          2HB       GLU   2 -20.091   0.008  -3.137
  432   1HG   GLU   2          1HG       GLU   2 -22.321   0.078  -2.730
  433   2HG   GLU   2          2HG       GLU   2 -21.929   1.263  -1.475
  434    H    TYR   3           H        TYR   3 -18.558   0.753  -4.175
  435    HA   TYR   3           HA       TYR   3 -15.806   0.838  -3.248
  436   1HB   TYR   3          1HB       TYR   3 -15.663  -0.251  -5.673
  437   2HB   TYR   3          2HB       TYR   3 -16.429  -1.190  -4.389
  438    HD1  TYR   3           HD1      TYR   3 -18.856  -1.531  -4.373
  439    HD2  TYR   3           HD2      TYR   3 -16.961   0.702  -7.492
  440    HE1  TYR   3           HE1      TYR   3 -20.960  -1.710  -5.790
  441    HE2  TYR   3           HE2      TYR   3 -19.071   0.515  -8.897
  442    HH   TYR   3           HH       TYR   3 -21.117  -0.164  -8.987
  443    H    VAL   4           H        VAL   4 -15.791   3.275  -3.221
  444    HA   VAL   4           HA       VAL   4 -15.154   4.229  -5.920
  445    HB   VAL   4           HB       VAL   4 -16.953   5.438  -3.843
  446   1HG1  VAL   4          1HG1      VAL   4 -15.431   6.952  -5.991
  447   2HG1  VAL   4          2HG1      VAL   4 -16.814   7.600  -5.076
  448   3HG1  VAL   4          3HG1      VAL   4 -15.309   7.172  -4.229
  449   1HG2  VAL   4          1HG2      VAL   4 -18.224   6.001  -6.016
  450   2HG2  VAL   4          2HG2      VAL   4 -17.110   4.860  -6.804
  451   3HG2  VAL   4          3HG2      VAL   4 -18.176   4.300  -5.493
  452    H    GLY   5           H        GLY   5 -14.924   4.881  -2.354
  453   1HA   GLY   5          1HA       GLY   5 -12.619   6.521  -2.588
  454   2HA   GLY   5          2HA       GLY   5 -13.268   5.797  -1.130
  455    H    LEU   6           H        LEU   6 -12.953   3.278  -3.340
  456    HA   LEU   6           HA       LEU   6 -10.137   2.821  -2.737
  457   1HB   LEU   6          1HB       LEU   6 -11.572   0.378  -2.395
  458   2HB   LEU   6          2HB       LEU   6 -10.472   1.207  -1.281
  459    HG   LEU   6           HG       LEU   6 -12.689   0.707  -0.310
  460   1HD1  LEU   6          1HD1      LEU   6 -12.409   2.462   1.023
  461   2HD1  LEU   6          2HD1      LEU   6 -11.218   3.080  -0.146
  462   3HD1  LEU   6          3HD1      LEU   6 -12.919   3.594  -0.252
  463   1HD2  LEU   6          1HD2      LEU   6 -14.643   1.200  -1.272
  464   2HD2  LEU   6          2HD2      LEU   6 -14.121   2.843  -1.711
  465   3HD2  LEU   6          3HD2      LEU   6 -13.700   1.465  -2.758
  466    H    SER   7           H        SER   7 -12.170   3.454  -5.059
  467    HA   SER   7           HA       SER   7 -11.458   1.149  -6.687
  468   1HB   SER   7          1HB       SER   7 -13.273   1.740  -8.146
  469   2HB   SER   7          2HB       SER   7 -13.900   1.814  -6.489
  470    HG   SER   7           HG       SER   7 -13.082   4.025  -8.172
  471    H    ALA   8           H        ALA   8 -10.595   1.549  -8.880
  472    HA   ALA   8           HA       ALA   8  -8.584   3.459  -8.923
  473   1HB   ALA   8          1HB       ALA   8  -8.347   2.791 -11.282
  474   2HB   ALA   8          2HB       ALA   8  -8.622   1.368 -10.248
  475   3HB   ALA   8          3HB       ALA   8  -9.952   2.022 -11.235
  476    H    ASN   9           H        ASN   9  -9.472   5.514  -8.335
  477    HA   ASN   9           HA       ASN   9 -10.064   7.141 -10.426
  478   1HB   ASN   9          1HB       ASN   9 -12.313   5.642 -10.008
  479   2HB   ASN   9          2HB       ASN   9 -12.636   6.972  -8.885
  480   1HD2  ASN   9          1HD2      ASN   9 -11.981   9.187  -9.888
  481   2HD2  ASN   9          2HD2      ASN   9 -12.613   9.512 -11.467
  482    H    GLN  10           H        GLN  10 -10.490   6.237  -6.999
  483    HA   GLN  10           HA       GLN  10 -11.014   8.740  -5.964
  484   1HB   GLN  10          1HB       GLN  10 -11.203   6.522  -4.784
  485   2HB   GLN  10          2HB       GLN  10  -9.438   6.507  -4.615
  486   1HG   GLN  10          1HG       GLN  10  -9.690   8.805  -3.482
  487   2HG   GLN  10          2HG       GLN  10 -11.428   8.477  -3.414
  488   1HE2  GLN  10          1HE2      GLN  10  -8.471   6.538  -2.963
  489   2HE2  GLN  10          2HE2      GLN  10  -8.856   5.912  -1.395
  490    H    CYS  11           H        CYS  11  -8.009   7.217  -7.083
  491    HA   CYS  11           HA       CYS  11  -6.233   8.922  -5.753
  492   1HB   CYS  11          1HB       CYS  11  -5.443   6.868  -6.625
  493   2HB   CYS  11          2HB       CYS  11  -5.978   7.264  -8.262
  494    H    ALA  12           H        ALA  12  -8.622   9.532  -8.088
  495    HA   ALA  12           HA       ALA  12  -7.109  11.742  -9.279
  496   1HB   ALA  12          1HB       ALA  12  -8.578   9.815 -10.498
  497   2HB   ALA  12          2HB       ALA  12  -9.844  11.038 -10.231
  498   3HB   ALA  12          3HB       ALA  12  -8.382  11.457 -11.157
  499    H    VAL  13           H        VAL  13  -8.501  11.373  -6.474
  500    HA   VAL  13           HA       VAL  13 -10.755  12.856  -6.246
  501    HB   VAL  13           HB       VAL  13  -8.783  11.809  -4.580
  502   1HG1  VAL  13          1HG1      VAL  13  -8.440  13.610  -2.896
  503   2HG1  VAL  13          2HG1      VAL  13  -7.628  13.936  -4.446
  504   3HG1  VAL  13          3HG1      VAL  13  -9.145  14.775  -4.041
  505   1HG2  VAL  13          1HG2      VAL  13 -11.520  12.377  -4.527
  506   2HG2  VAL  13          2HG2      VAL  13 -10.589  11.483  -3.303
  507   3HG2  VAL  13          3HG2      VAL  13 -10.857  13.232  -3.113
  508    HA   PRO  14           HA       PRO  14  -9.785  16.963  -7.174
  509   1HB   PRO  14          1HB       PRO  14 -11.222  18.411  -5.357
  510   2HB   PRO  14          2HB       PRO  14 -11.940  17.680  -6.792
  511   1HG   PRO  14          1HG       PRO  14 -12.047  16.821  -3.972
  512   2HG   PRO  14          2HG       PRO  14 -13.146  16.372  -5.326
  513   1HD   PRO  14          1HD       PRO  14 -11.082  14.802  -4.113
  514   2HD   PRO  14          2HD       PRO  14 -12.026  14.375  -5.545
  515    H    ALA  15           H        ALA  15  -7.949  15.558  -5.346
  516    HA   ALA  15           HA       ALA  15  -6.252  16.016  -3.990
  517   1HB   ALA  15          1HB       ALA  15  -5.016  17.129  -5.529
  518   2HB   ALA  15          2HB       ALA  15  -6.387  18.151  -6.027
  519   3HB   ALA  15          3HB       ALA  15  -5.432  18.582  -4.588
  520    H    LYS  16           H        LYS  16  -8.136  15.986  -2.303
  521    HA   LYS  16           HA       LYS  16  -7.567  17.784  -0.329
  522   1HB   LYS  16          1HB       LYS  16  -9.780  19.114  -0.393
  523   2HB   LYS  16          2HB       LYS  16  -8.423  19.656  -1.396
  524   1HG   LYS  16          1HG       LYS  16  -9.684  19.436  -3.245
  525   2HG   LYS  16          2HG       LYS  16  -9.964  17.722  -2.890
  526   1HD   LYS  16          1HD       LYS  16 -11.540  20.026  -1.667
  527   2HD   LYS  16          2HD       LYS  16 -12.078  19.103  -3.080
  528   1HE   LYS  16          1HE       LYS  16 -11.628  17.037  -1.435
  529   2HE   LYS  16          2HE       LYS  16 -11.887  18.267  -0.189
  530   1HZ   LYS  16          1HZ       LYS  16 -13.835  16.938  -1.313
  531   2HZ   LYS  16          2HZ       LYS  16 -14.030  18.467  -0.775
  532   3HZ   LYS  16          3HZ       LYS  16 -13.779  18.186  -2.364
  533    H    ASP  17           H        ASP  17  -8.035  14.990  -0.781
  534    HA   ASP  17           HA       ASP  17  -9.946  14.611   1.298
  535   1HB   ASP  17          1HB       ASP  17 -11.202  14.575  -0.970
  536   2HB   ASP  17          2HB       ASP  17 -10.351  13.056  -1.287
  537    H    ARG  18           H        ARG  18  -6.994  14.194   0.195
  538    HA   ARG  18           HA       ARG  18  -6.820  11.333   0.325
  539   1HB   ARG  18          1HB       ARG  18  -4.594  13.407   0.085
  540   2HB   ARG  18          2HB       ARG  18  -4.442  11.671  -0.245
  541   1HG   ARG  18          1HG       ARG  18  -5.395  11.864  -2.306
  542   2HG   ARG  18          2HG       ARG  18  -6.610  13.032  -1.757
  543   1HD   ARG  18          1HD       ARG  18  -5.018  14.853  -1.903
  544   2HD   ARG  18          2HD       ARG  18  -3.670  13.739  -2.176
  545    HE   ARG  18           HE       ARG  18  -5.834  13.554  -4.158
  546   1HH1  ARG  18          1HH1      ARG  18  -2.790  15.104  -3.311
  547   2HH1  ARG  18          2HH1      ARG  18  -2.412  15.541  -4.943
  548   1HH2  ARG  18          1HH2      ARG  18  -5.335  14.131  -6.312
  549   2HH2  ARG  18          2HH2      ARG  18  -3.869  14.984  -6.663
  550    H    VAL  19           H        VAL  19  -4.628  10.629   1.682
  551    HA   VAL  19           HA       VAL  19  -5.052  11.758   4.358
  552    HB   VAL  19           HB       VAL  19  -3.887   9.060   3.688
  553   1HG1  VAL  19          1HG1      VAL  19  -3.445   9.263   5.901
  554   2HG1  VAL  19          2HG1      VAL  19  -4.690  10.511   6.148
  555   3HG1  VAL  19          3HG1      VAL  19  -5.154   8.795   6.071
  556   1HG2  VAL  19          1HG2      VAL  19  -6.670   9.956   3.458
  557   2HG2  VAL  19          2HG2      VAL  19  -5.893   8.464   2.877
  558   3HG2  VAL  19          3HG2      VAL  19  -6.468   8.571   4.558
  559    H    ASP  20           H        ASP  20  -3.265  12.677   2.021
  560    HA   ASP  20           HA       ASP  20  -1.129  13.072   1.594
  561   1HB   ASP  20          1HB       ASP  20  -1.412  15.009   2.822
  562   2HB   ASP  20          2HB       ASP  20  -1.816  14.141   4.310
  563    H    CYS  21           H        CYS  21  -0.127  10.954   1.377
  564    HA   CYS  21           HA       CYS  21   0.517   9.257   3.416
  565   1HB   CYS  21          1HB       CYS  21   0.815   9.251   0.727
  566   2HB   CYS  21          2HB       CYS  21   2.499   9.425   1.231
  567    H    GLY  22           H        GLY  22   2.089  12.252   2.273
  568   1HA   GLY  22          1HA       GLY  22   3.809  13.460   3.065
  569   2HA   GLY  22          2HA       GLY  22   3.424  12.787   4.637
  570    H    TYR  23           H        TYR  23   4.790  11.439   1.540
  571    HA   TYR  23           HA       TYR  23   6.684   9.902   3.105
  572   1HB   TYR  23          1HB       TYR  23   5.200   9.602   0.750
  573   2HB   TYR  23          2HB       TYR  23   6.780  10.054   0.104
  574    HD1  TYR  23           HD1      TYR  23   6.085   8.011   3.149
  575    HD2  TYR  23           HD2      TYR  23   7.474   8.030  -0.898
  576    HE1  TYR  23           HE1      TYR  23   6.862   5.603   3.397
  577    HE2  TYR  23           HE2      TYR  23   8.245   5.621  -0.637
  578    HH   TYR  23           HH       TYR  23   7.554   3.818   2.318
  579    HA   PRO  24           HA       PRO  24   9.916  12.720   2.454
  580   1HB   PRO  24          1HB       PRO  24  12.021  11.147   3.201
  581   2HB   PRO  24          2HB       PRO  24  11.004  12.009   4.354
  582   1HG   PRO  24          1HG       PRO  24  11.044   9.150   3.623
  583   2HG   PRO  24          2HG       PRO  24  10.369   9.922   5.104
  584   1HD   PRO  24          1HD       PRO  24   8.961   8.891   2.833
  585   2HD   PRO  24          2HD       PRO  24   8.264   9.784   4.191
  586    H    HIS  25           H        HIS  25   9.396   9.980   0.637
  587    HA   HIS  25           HA       HIS  25  11.423  10.931  -1.254
  588   1HB   HIS  25          1HB       HIS  25  10.810   8.194  -0.271
  589   2HB   HIS  25          2HB       HIS  25  11.176   8.361  -1.992
  590    HD1  HIS  25           HD1      HIS  25  12.752   9.825   1.201
  591    HD2  HIS  25           HD2      HIS  25  13.824   7.866  -2.350
  592    HE1  HIS  25           HE1      HIS  25  15.292   9.596   1.249
  593    HE2  HIS  25           HE2      HIS  25  15.887   8.337  -0.932
  594    H    VAL  26           H        VAL  26   8.575  11.736  -0.867
  595    HA   VAL  26           HA       VAL  26   6.798  10.503  -2.513
  596    HB   VAL  26           HB       VAL  26   6.027  12.248  -1.196
  597   1HG1  VAL  26          1HG1      VAL  26   8.357  13.803  -2.292
  598   2HG1  VAL  26          2HG1      VAL  26   6.944  14.665  -1.639
  599   3HG1  VAL  26          3HG1      VAL  26   7.858  13.541  -0.604
  600   1HG2  VAL  26          1HG2      VAL  26   4.730  13.487  -2.643
  601   2HG2  VAL  26          2HG2      VAL  26   6.077  13.797  -3.764
  602   3HG2  VAL  26          3HG2      VAL  26   5.292  12.199  -3.735
  603    H    THR  27           H        THR  27   6.838   9.919  -4.615
  604    HA   THR  27           HA       THR  27   7.615  11.713  -6.649
  605    HB   THR  27           HB       THR  27   9.764  10.303  -5.374
  606    HG1  THR  27           HG1      THR  27  10.841  11.585  -7.002
  607   1HG2  THR  27          1HG2      THR  27  10.662   9.354  -7.662
  608   2HG2  THR  27          2HG2      THR  27   9.577   8.325  -6.696
  609   3HG2  THR  27          3HG2      THR  27   8.942   9.220  -8.097
  610    HA   PRO  28           HA       PRO  28   5.216   8.908  -8.835
  611   1HB   PRO  28          1HB       PRO  28   5.884   9.497 -11.418
  612   2HB   PRO  28          2HB       PRO  28   4.754  10.463 -10.470
  613   1HG   PRO  28          1HG       PRO  28   7.568  10.994 -11.182
  614   2HG   PRO  28          2HG       PRO  28   6.304  12.161 -10.651
  615   1HD   PRO  28          1HD       PRO  28   8.501  11.105  -9.146
  616   2HD   PRO  28          2HD       PRO  28   7.195  12.127  -8.531
  617    H    LYS  29           H        LYS  29   7.168   7.534  -7.645
  618    HA   LYS  29           HA       LYS  29   7.394   5.331  -9.340
  619   1HB   LYS  29          1HB       LYS  29   8.992   6.756 -10.546
  620   2HB   LYS  29          2HB       LYS  29   9.969   6.909  -9.076
  621   1HG   LYS  29          1HG       LYS  29  10.918   4.886  -9.406
  622   2HG   LYS  29          2HG       LYS  29   9.349   4.105  -9.670
  623   1HD   LYS  29          1HD       LYS  29   9.355   4.924 -12.015
  624   2HD   LYS  29          2HD       LYS  29  10.930   5.692 -11.749
  625   1HE   LYS  29          1HE       LYS  29  12.055   3.696 -11.844
  626   2HE   LYS  29          2HE       LYS  29  10.766   2.797 -11.031
  627   1HZ   LYS  29          1HZ       LYS  29   9.574   3.341 -13.276
  628   2HZ   LYS  29          2HZ       LYS  29  11.107   3.396 -13.838
  629   3HZ   LYS  29          3HZ       LYS  29  10.548   2.039 -13.125
  630    H    GLU  30           H        GLU  30   8.130   7.222  -6.488
  631    HA   GLU  30           HA       GLU  30   9.091   4.840  -5.144
  632   1HB   GLU  30          1HB       GLU  30   9.478   7.725  -4.835
  633   2HB   GLU  30          2HB       GLU  30   9.082   6.950  -3.292
  634   1HG   GLU  30          1HG       GLU  30  11.381   6.664  -3.318
  635   2HG   GLU  30          2HG       GLU  30  10.893   5.165  -4.123
  636    H    CYS  31           H        CYS  31   6.522   7.379  -4.975
  637    HA   CYS  31           HA       CYS  31   5.267   6.367  -2.706
  638   1HB   CYS  31          1HB       CYS  31   4.414   8.134  -4.970
  639   2HB   CYS  31          2HB       CYS  31   3.227   7.584  -3.784
  640    H    ASN  32           H        ASN  32   4.509   5.994  -6.252
  641    HA   ASN  32           HA       ASN  32   2.468   4.176  -5.859
  642   1HB   ASN  32          1HB       ASN  32   4.077   5.221  -8.092
  643   2HB   ASN  32          2HB       ASN  32   3.616   3.534  -8.358
  644   1HD2  ASN  32          1HD2      ASN  32   1.868   5.951  -6.479
  645   2HD2  ASN  32          2HD2      ASN  32   0.459   6.056  -7.481
  646    H    ASN  33           H        ASN  33   5.766   3.891  -5.170
  647    HA   ASN  33           HA       ASN  33   5.848   1.074  -5.863
  648   1HB   ASN  33          1HB       ASN  33   7.817   2.256  -6.600
  649   2HB   ASN  33          2HB       ASN  33   7.989   3.098  -5.052
  650   1HD2  ASN  33          1HD2      ASN  33   9.744   2.420  -4.095
  651   2HD2  ASN  33          2HD2      ASN  33  10.273   0.781  -3.906
  652    H    ARG  34           H        ARG  34   5.741   3.455  -3.226
  653    HA   ARG  34           HA       ARG  34   6.420   1.496  -1.256
  654   1HB   ARG  34          1HB       ARG  34   6.480   3.282   0.276
  655   2HB   ARG  34          2HB       ARG  34   6.941   4.081  -1.238
  656   1HG   ARG  34          1HG       ARG  34   5.312   5.534  -0.439
  657   2HG   ARG  34          2HG       ARG  34   4.322   4.479  -1.461
  658   1HD   ARG  34          1HD       ARG  34   3.048   4.097   0.367
  659   2HD   ARG  34          2HD       ARG  34   4.401   3.173   1.038
  660    HE   ARG  34           HE       ARG  34   4.804   5.984   1.501
  661   1HH1  ARG  34          1HH1      ARG  34   2.834   3.284   2.601
  662   2HH1  ARG  34          2HH1      ARG  34   2.580   3.946   4.181
  663   1HH2  ARG  34          1HH2      ARG  34   4.471   6.859   3.586
  664   2HH2  ARG  34          2HH2      ARG  34   3.518   5.993   4.745
  665    H    GLY  35           H        GLY  35   3.570   3.018  -2.723
  666   1HA   GLY  35          1HA       GLY  35   1.575   1.544  -2.526
  667   2HA   GLY  35          2HA       GLY  35   1.834   1.593  -0.794
  668    H    CYS  36           H        CYS  36   2.575   4.464  -2.734
  669    HA   CYS  36           HA       CYS  36   0.108   5.675  -1.714
  670   1HB   CYS  36          1HB       CYS  36   2.845   6.924  -1.978
  671   2HB   CYS  36          2HB       CYS  36   1.369   7.810  -1.580
  672    H    CYS  37           H        CYS  37  -0.410   7.761  -3.105
  673    HA   CYS  37           HA       CYS  37   0.135   7.067  -5.900
  674   1HB   CYS  37          1HB       CYS  37  -2.250   6.883  -4.930
  675   2HB   CYS  37          2HB       CYS  37  -2.258   8.649  -5.000
  676    H    PHE  38           H        PHE  38   1.175   8.641  -7.111
  677    HA   PHE  38           HA       PHE  38   1.784  11.122  -5.727
  678   1HB   PHE  38          1HB       PHE  38   3.482   9.556  -6.877
  679   2HB   PHE  38          2HB       PHE  38   2.721   9.964  -8.419
  680    HD1  PHE  38           HD1      PHE  38   3.275  11.972  -9.541
  681    HD2  PHE  38           HD2      PHE  38   4.637  11.343  -5.571
  682    HE1  PHE  38           HE1      PHE  38   4.790  13.963  -9.745
  683    HE2  PHE  38           HE2      PHE  38   6.152  13.334  -5.776
  684    HZ   PHE  38           HZ       PHE  38   6.211  14.619  -7.861
  685    H    ASP  39           H        ASP  39   0.627  12.943  -6.120
  686    HA   ASP  39           HA       ASP  39  -1.202  12.947  -8.292
  687   1HB   ASP  39          1HB       ASP  39  -2.159  14.125  -6.578
  688   2HB   ASP  39          2HB       ASP  39  -0.597  14.618  -5.904
  689    H    SER  40           H        SER  40   0.894  15.703  -7.229
  690    HA   SER  40           HA       SER  40   2.519  16.774  -8.273
  691   1HB   SER  40          1HB       SER  40   2.757  14.495  -9.643
  692   2HB   SER  40          2HB       SER  40   2.078  15.478 -10.954
  693    HG   SER  40           HG       SER  40   4.380  15.580 -10.984
  694    H    ARG  41           H        ARG  41  -0.690  16.191  -9.561
  695    HA   ARG  41           HA       ARG  41  -0.743  18.212 -11.457
  696   1HB   ARG  41          1HB       ARG  41  -3.137  17.350  -9.792
  697   2HB   ARG  41          2HB       ARG  41  -3.126  17.870 -11.486
  698   1HG   ARG  41          1HG       ARG  41  -1.408  15.717 -11.550
  699   2HG   ARG  41          2HG       ARG  41  -2.553  15.205 -10.298
  700   1HD   ARG  41          1HD       ARG  41  -3.762  14.473 -12.098
  701   2HD   ARG  41          2HD       ARG  41  -4.290  16.160 -12.189
  702    HE   ARG  41           HE       ARG  41  -3.160  16.291 -14.219
  703   1HH1  ARG  41          1HH1      ARG  41  -1.617  13.812 -12.254
  704   2HH1  ARG  41          2HH1      ARG  41  -0.467  13.381 -13.475
  705   1HH2  ARG  41          1HH2      ARG  41  -1.643  15.722 -15.829
  706   2HH2  ARG  41          2HH2      ARG  41  -0.481  14.475 -15.522
  707    H    ILE  42           H        ILE  42  -1.488  18.111  -7.928
  708    HA   ILE  42           HA       ILE  42  -1.642  21.045  -7.997
  709    HB   ILE  42           HB       ILE  42  -3.038  19.353  -5.948
  710   1HG1  ILE  42          1HG1      ILE  42  -3.925  19.982  -8.744
  711   2HG1  ILE  42          2HG1      ILE  42  -4.037  18.456  -7.850
  712   1HG2  ILE  42          1HG2      ILE  42  -4.384  21.313  -5.610
  713   2HG2  ILE  42          2HG2      ILE  42  -2.668  21.783  -5.548
  714   3HG2  ILE  42          3HG2      ILE  42  -3.635  22.129  -7.002
  715   1HD1  ILE  42          1HD1      ILE  42  -6.244  19.193  -7.720
  716   2HD1  ILE  42          2HD1      ILE  42  -5.585  19.922  -6.236
  717   3HD1  ILE  42          3HD1      ILE  42  -5.779  20.911  -7.703
  718    HA   PRO  43           HA       PRO  43   1.909  20.324  -5.502
  719   1HB   PRO  43          1HB       PRO  43   2.974  22.825  -5.772
  720   2HB   PRO  43          2HB       PRO  43   3.306  21.510  -6.895
  721   1HG   PRO  43          1HG       PRO  43   1.529  23.847  -7.183
  722   2HG   PRO  43          2HG       PRO  43   2.226  22.801  -8.473
  723   1HD   PRO  43          1HD       PRO  43  -0.453  22.835  -7.462
  724   2HD   PRO  43          2HD       PRO  43   0.224  21.679  -8.616
  725    H    GLY  44           H        GLY  44  -0.828  22.052  -4.993
  726   1HA   GLY  44          1HA       GLY  44   0.095  23.242  -2.487
  727   2HA   GLY  44          2HA       GLY  44  -1.460  23.461  -3.263
  728    H    VAL  45           H        VAL  45  -1.004  20.212  -3.593
  729    HA   VAL  45           HA       VAL  45  -2.143  19.643  -0.943
  730    HB   VAL  45           HB       VAL  45  -3.783  18.334  -1.857
  731   1HG1  VAL  45          1HG1      VAL  45  -3.543  20.896  -2.866
  732   2HG1  VAL  45          2HG1      VAL  45  -3.828  19.920  -4.327
  733   3HG1  VAL  45          3HG1      VAL  45  -4.988  19.863  -2.977
  734   1HG2  VAL  45          1HG2      VAL  45  -2.300  18.178  -4.501
  735   2HG2  VAL  45          2HG2      VAL  45  -2.209  16.950  -3.217
  736   3HG2  VAL  45          3HG2      VAL  45  -3.760  17.276  -4.026
  737    HA   PRO  46           HA       PRO  46   0.589  16.274  -0.727
  738   1HB   PRO  46          1HB       PRO  46  -0.864  14.010  -0.255
  739   2HB   PRO  46          2HB       PRO  46  -0.510  15.205   0.991
  740   1HG   PRO  46          1HG       PRO  46  -3.002  14.711  -0.508
  741   2HG   PRO  46          2HG       PRO  46  -2.786  15.575   1.056
  742   1HD   PRO  46          1HD       PRO  46  -3.271  16.685  -1.538
  743   2HD   PRO  46          2HD       PRO  46  -2.905  17.582  -0.059
  744    H    TRP  47           H        TRP  47   1.961  15.652  -2.259
  745    HA   TRP  47           HA       TRP  47   0.739  14.567  -4.663
  746   1HB   TRP  47          1HB       TRP  47   3.647  14.785  -4.592
  747   2HB   TRP  47          2HB       TRP  47   2.482  15.402  -5.765
  748    HD1  TRP  47           HD1      TRP  47   1.269  17.852  -4.977
  749    HE1  TRP  47           HE1      TRP  47   2.256  19.946  -3.712
  750    HE3  TRP  47           HE3      TRP  47   5.246  15.415  -2.953
  751    HZ2  TRP  47           HZ2      TRP  47   4.537  20.341  -2.043
  752    HZ3  TRP  47           HZ3      TRP  47   6.806  16.727  -1.517
  753    HH2  TRP  47           HH2      TRP  47   6.501  19.107  -1.051
  754    H    CYS  48           H        CYS  48   0.746  13.104  -2.032
  755    HA   CYS  48           HA       CYS  48   1.589  10.615  -3.046
  756   1HB   CYS  48          1HB       CYS  48   3.790  11.529  -2.398
  757   2HB   CYS  48          2HB       CYS  48   3.222  11.681  -0.733
  758    H    PHE  49           H        PHE  49  -0.353   9.675  -2.447
  759    HA   PHE  49           HA       PHE  49  -0.960   9.702   0.404
  760   1HB   PHE  49          1HB       PHE  49  -3.459   9.817  -0.719
  761   2HB   PHE  49          2HB       PHE  49  -2.597  11.271  -0.210
  762    HD1  PHE  49           HD1      PHE  49  -0.940  12.206  -2.100
  763    HD2  PHE  49           HD2      PHE  49  -4.365   9.808  -2.822
  764    HE1  PHE  49           HE1      PHE  49  -1.055  13.079  -4.451
  765    HE2  PHE  49           HE2      PHE  49  -4.480  10.681  -5.173
  766    HZ   PHE  49           HZ       PHE  49  -2.824  12.305  -5.959
  767    H    LYS  50           H        LYS  50  -3.350   8.247   0.327
  768    HA   LYS  50           HA       LYS  50  -2.572   5.828  -1.144
  769   1HB   LYS  50          1HB       LYS  50  -3.582   4.608   0.874
  770   2HB   LYS  50          2HB       LYS  50  -1.951   5.285   1.036
  771   1HG   LYS  50          1HG       LYS  50  -4.076   7.195   1.748
  772   2HG   LYS  50          2HG       LYS  50  -4.106   5.740   2.759
  773   1HD   LYS  50          1HD       LYS  50  -1.696   7.537   2.257
  774   2HD   LYS  50          2HD       LYS  50  -2.658   7.502   3.744
  775   1HE   LYS  50          1HE       LYS  50  -1.778   4.820   3.027
  776   2HE   LYS  50          2HE       LYS  50  -0.388   5.912   3.111
  777   1HZ   LYS  50          1HZ       LYS  50  -2.386   5.405   5.200
  778   2HZ   LYS  50          2HZ       LYS  50  -0.790   5.061   5.248
  779   3HZ   LYS  50          3HZ       LYS  50  -1.291   6.614   5.290
  780    HA   PRO  51           HA       PRO  51  -6.807   7.087  -2.151
  781   1HB   PRO  51          1HB       PRO  51  -6.515   7.228  -4.864
  782   2HB   PRO  51          2HB       PRO  51  -6.383   8.631  -3.807
  783   1HG   PRO  51          1HG       PRO  51  -4.276   7.059  -5.145
  784   2HG   PRO  51          2HG       PRO  51  -4.181   8.733  -4.486
  785   1HD   PRO  51          1HD       PRO  51  -3.115   6.318  -3.373
  786   2HD   PRO  51          2HD       PRO  51  -3.137   7.913  -2.610
  787    H    LEU  52           H        LEU  52  -5.897   5.535  -5.084
  788    HA   LEU  52           HA       LEU  52  -7.506   3.255  -4.215
  789   1HB   LEU  52          1HB       LEU  52  -8.120   2.943  -6.367
  790   2HB   LEU  52          2HB       LEU  52  -7.927   4.704  -6.332
  791    HG   LEU  52           HG       LEU  52  -5.423   3.685  -7.099
  792   1HD1  LEU  52          1HD1      LEU  52  -6.544   2.505  -9.288
  793   2HD1  LEU  52          2HD1      LEU  52  -5.852   1.635  -7.898
  794   3HD1  LEU  52          3HD1      LEU  52  -7.608   1.920  -7.986
  795   1HD2  LEU  52          1HD2      LEU  52  -5.646   5.331  -8.574
  796   2HD2  LEU  52          2HD2      LEU  52  -7.034   4.534  -9.353
  797   3HD2  LEU  52          3HD2      LEU  52  -7.290   5.587  -7.942
  798    H    GLN  53           H        GLN  53  -4.947   3.473  -3.041
  799    HA   GLN  53           HA       GLN  53  -2.926   2.272  -4.438
  800   1HB   GLN  53          1HB       GLN  53  -3.586   2.123  -1.472
  801   2HB   GLN  53          2HB       GLN  53  -2.022   1.662  -2.169
  802   1HG   GLN  53          1HG       GLN  53  -3.323   4.415  -2.333
  803   2HG   GLN  53          2HG       GLN  53  -1.978   3.980  -1.268
  804   1HE2  GLN  53          1HE2      GLN  53  -0.599   2.293  -3.056
  805   2HE2  GLN  53          2HE2      GLN  53   0.103   3.250  -4.318
  806    H    GLU  54           H        GLU  54  -5.946   0.949  -3.402
  807    HA   GLU  54           HA       GLU  54  -5.412  -1.582  -2.699
  808   1HB   GLU  54          1HB       GLU  54  -7.600  -0.449  -4.464
  809   2HB   GLU  54          2HB       GLU  54  -7.606  -2.143  -3.945
  810   1HG   GLU  54          1HG       GLU  54  -7.200  -0.996  -1.548
  811   2HG   GLU  54          2HG       GLU  54  -8.008   0.368  -2.335
  812    H    ALA  55           H        ALA  55  -4.776  -0.056  -5.789
  813    HA   ALA  55           HA       ALA  55  -4.914  -1.958  -7.650
  814   1HB   ALA  55          1HB       ALA  55  -2.396  -0.317  -7.207
  815   2HB   ALA  55          2HB       ALA  55  -3.103  -0.848  -8.752
  816   3HB   ALA  55          3HB       ALA  55  -3.926   0.393  -7.776
  817    H    GLU  56           H        GLU  56  -1.846  -1.552  -5.741
  818    HA   GLU  56           HA       GLU  56  -1.729  -4.455  -5.626
  819   1HB   GLU  56          1HB       GLU  56  -0.132  -2.899  -7.319
  820   2HB   GLU  56          2HB       GLU  56   0.925  -3.242  -5.939
  821   1HG   GLU  56          1HG       GLU  56   0.701  -5.599  -6.229
  822   2HG   GLU  56          2HG       GLU  56  -0.705  -5.426  -7.291
  823    H    CYS  57           H        CYS  57  -2.520  -2.310  -3.690
  824    HA   CYS  57           HA       CYS  57  -0.294  -2.488  -1.810
  825   1HB   CYS  57          1HB       CYS  57  -1.377  -0.263  -2.468
  826   2HB   CYS  57          2HB       CYS  57  -2.745  -0.771  -1.476
  827    H    THR  58           H        THR  58  -3.941  -2.462  -1.728
  828    HA   THR  58           HA       THR  58  -4.115  -3.925   0.654
  829    HB   THR  58           HB       THR  58  -5.890  -2.442  -0.334
  830    HG1  THR  58           HG1      THR  58  -6.124  -4.576   1.051
  831   1HG2  THR  58          1HG2      THR  58  -7.136  -3.045  -2.241
  832   2HG2  THR  58          2HG2      THR  58  -5.509  -3.573  -2.735
  833   3HG2  THR  58          3HG2      THR  58  -6.681  -4.760  -2.114
  834    H    PHE  59           H        PHE  59  -3.959  -4.946  -2.777
  835    HA   PHE  59           HA       PHE  59  -4.767  -7.520  -2.577
  836   1HB   PHE  59          1HB       PHE  59  -2.924  -5.838  -4.172
  837   2HB   PHE  59          2HB       PHE  59  -2.397  -7.525  -4.159
  838    HD1  PHE  59           HD1      PHE  59  -4.936  -5.169  -5.294
  839    HD2  PHE  59           HD2      PHE  59  -3.803  -9.257  -5.164
  840    HE1  PHE  59           HE1      PHE  59  -6.612  -5.692  -7.088
  841    HE2  PHE  59           HE2      PHE  59  -5.480  -9.779  -6.958
  842    HZ   PHE  59           HZ       PHE  59  -6.865  -7.990  -7.898
  Start of MODEL   12
    1   1H    GLU   1           H1       GLU   1 -18.461  -7.684  -0.408
    2    HA   GLU   1           HA       GLU   1 -16.600  -7.980  -2.214
    3   1HB   GLU   1          1HB       GLU   1 -17.715  -5.844  -3.261
    4   2HB   GLU   1          2HB       GLU   1 -16.764  -4.963  -2.054
    5   1HG   GLU   1          1HG       GLU   1 -15.130  -5.023  -3.639
    6   2HG   GLU   1          2HG       GLU   1 -14.870  -6.683  -3.079
    7    H    GLU   2           H        GLU   2 -16.881  -8.563   0.434
    8    HA   GLU   2           HA       GLU   2 -15.375  -6.646   1.949
    9   1HB   GLU   2          1HB       GLU   2 -16.672  -9.306   2.622
   10   2HB   GLU   2          2HB       GLU   2 -15.706  -8.400   3.799
   11   1HG   GLU   2          1HG       GLU   2 -17.974  -7.765   4.187
   12   2HG   GLU   2          2HG       GLU   2 -17.256  -6.402   3.315
   13    H    TYR   3           H        TYR   3 -13.400  -6.805   0.584
   14    HA   TYR   3           HA       TYR   3 -11.973  -9.004  -0.027
   15   1HB   TYR   3          1HB       TYR   3 -11.537  -6.148   0.727
   16   2HB   TYR   3          2HB       TYR   3 -10.092  -7.136   0.971
   17    HD1  TYR   3           HD1      TYR   3  -8.721  -6.195  -0.737
   18    HD2  TYR   3           HD2      TYR   3 -12.625  -7.655  -1.701
   19    HE1  TYR   3           HE1      TYR   3  -8.191  -5.996  -3.216
   20    HE2  TYR   3           HE2      TYR   3 -12.082  -7.451  -4.176
   21    HH   TYR   3           HH       TYR   3  -9.980  -7.487  -5.565
   22    H    VAL   4           H        VAL   4 -12.140 -10.738   1.464
   23    HA   VAL   4           HA       VAL   4 -10.912 -10.245   4.077
   24    HB   VAL   4           HB       VAL   4 -11.920 -12.616   4.447
   25   1HG1  VAL   4          1HG1      VAL   4 -14.075 -11.602   5.123
   26   2HG1  VAL   4          2HG1      VAL   4 -12.677 -10.618   5.616
   27   3HG1  VAL   4          3HG1      VAL   4 -13.655 -10.134   4.209
   28   1HG2  VAL   4          1HG2      VAL   4 -13.660 -11.660   2.149
   29   2HG2  VAL   4          2HG2      VAL   4 -12.475 -12.985   2.051
   30   3HG2  VAL   4          3HG2      VAL   4 -13.887 -13.131   3.125
   31    H    GLY   5           H        GLY   5 -10.893 -12.464   1.217
   32   1HA   GLY   5          1HA       GLY   5  -8.671 -13.987   2.108
   33   2HA   GLY   5          2HA       GLY   5  -9.341 -13.925   0.490
   34    H    LEU   6           H        LEU   6  -8.839 -10.721   1.279
   35    HA   LEU   6           HA       LEU   6  -6.091 -10.797   0.242
   36   1HB   LEU   6          1HB       LEU   6  -7.940  -8.525  -0.304
   37   2HB   LEU   6          2HB       LEU   6  -6.517  -9.068  -1.209
   38    HG   LEU   6           HG       LEU   6  -8.228  -9.640  -2.631
   39   1HD1  LEU   6          1HD1      LEU   6  -7.833 -11.815  -2.899
   40   2HD1  LEU   6          2HD1      LEU   6  -6.922 -11.735  -1.372
   41   3HD1  LEU   6          3HD1      LEU   6  -8.630 -12.235  -1.364
   42   1HD2  LEU   6          1HD2      LEU   6 -10.372  -9.593  -2.059
   43   2HD2  LEU   6          2HD2      LEU   6 -10.173 -10.987  -0.970
   44   3HD2  LEU   6          3HD2      LEU   6  -9.863  -9.338  -0.372
   45    H    SER   7           H        SER   7  -8.097 -10.133   2.871
   46    HA   SER   7           HA       SER   7  -6.291  -8.028   3.769
   47   1HB   SER   7          1HB       SER   7  -8.020  -7.241   5.217
   48   2HB   SER   7          2HB       SER   7  -8.794  -7.533   3.649
   49    HG   SER   7           HG       SER   7 -10.061  -8.375   5.413
   50    H    ALA   8           H        ALA   8  -7.729  -8.744   6.541
   51    HA   ALA   8           HA       ALA   8  -5.696  -9.939   7.811
   52   1HB   ALA   8          1HB       ALA   8  -7.243  -9.417   9.372
   53   2HB   ALA   8          2HB       ALA   8  -8.589  -9.616   8.225
   54   3HB   ALA   8          3HB       ALA   8  -7.920 -11.034   9.069
   55    H    ASN   9           H        ASN   9  -4.941 -12.037   8.256
   56    HA   ASN   9           HA       ASN   9  -4.910 -14.254   8.170
   57   1HB   ASN   9          1HB       ASN   9  -7.506 -14.010   7.499
   58   2HB   ASN   9          2HB       ASN   9  -6.901 -14.486   5.905
   59   1HD2  ASN   9          1HD2      ASN   9  -4.892 -16.197   6.486
   60   2HD2  ASN   9          2HD2      ASN   9  -5.476 -17.617   7.288
   61    H    GLN  10           H        GLN  10  -5.285 -12.203   5.264
   62    HA   GLN  10           HA       GLN  10  -4.020 -13.908   3.467
   63   1HB   GLN  10          1HB       GLN  10  -5.449 -11.781   3.062
   64   2HB   GLN  10          2HB       GLN  10  -3.938 -10.881   3.277
   65   1HG   GLN  10          1HG       GLN  10  -3.554 -13.154   1.491
   66   2HG   GLN  10          2HG       GLN  10  -4.879 -12.133   0.912
   67   1HE2  GLN  10          1HE2      GLN  10  -4.418  -9.740   1.003
   68   2HE2  GLN  10          2HE2      GLN  10  -2.864  -9.200   0.462
   69    H    CYS  11           H        CYS  11  -2.822 -11.368   5.714
   70    HA   CYS  11           HA       CYS  11  -0.195 -11.368   4.717
   71   1HB   CYS  11          1HB       CYS  11  -0.936  -9.491   5.935
   72   2HB   CYS  11          2HB       CYS  11  -1.413 -10.469   7.325
   73    H    ALA  12           H        ALA  12  -2.010 -13.798   6.162
   74    HA   ALA  12           HA       ALA  12   0.357 -14.959   7.465
   75   1HB   ALA  12          1HB       ALA  12  -0.986 -15.514   9.181
   76   2HB   ALA  12          2HB       ALA  12  -2.260 -14.525   8.427
   77   3HB   ALA  12          3HB       ALA  12  -2.166 -16.268   8.082
   78    H    VAL  13           H        VAL  13  -0.793 -14.844   4.518
   79    HA   VAL  13           HA       VAL  13  -1.778 -17.200   3.678
   80    HB   VAL  13           HB       VAL  13  -0.551 -14.972   2.565
   81   1HG1  VAL  13          1HG1      VAL  13   1.612 -16.069   2.482
   82   2HG1  VAL  13          2HG1      VAL  13   0.901 -17.487   1.673
   83   3HG1  VAL  13          3HG1      VAL  13   0.960 -15.919   0.832
   84   1HG2  VAL  13          1HG2      VAL  13  -1.229 -16.858   0.503
   85   2HG2  VAL  13          2HG2      VAL  13  -2.391 -17.011   1.843
   86   3HG2  VAL  13          3HG2      VAL  13  -2.135 -15.432   1.064
   87    HA   PRO  14           HA       PRO  14   1.166 -20.298   4.316
   88   1HB   PRO  14          1HB       PRO  14   1.014 -21.849   2.072
   89   2HB   PRO  14          2HB       PRO  14  -0.165 -21.927   3.379
   90   1HG   PRO  14          1HG       PRO  14  -0.360 -20.662   0.721
   91   2HG   PRO  14          2HG       PRO  14  -1.689 -21.153   1.831
   92   1HD   PRO  14          1HD       PRO  14  -0.694 -18.520   1.300
   93   2HD   PRO  14          2HD       PRO  14  -1.894 -18.969   2.518
   94    H    ALA  15           H        ALA  15   2.150 -17.792   3.136
   95    HA   ALA  15           HA       ALA  15   3.991 -16.994   2.189
   96   1HB   ALA  15          1HB       ALA  15   4.800 -18.413   4.209
   97   2HB   ALA  15          2HB       ALA  15   5.378 -19.565   2.982
   98   3HB   ALA  15          3HB       ALA  15   6.008 -17.901   3.006
   99    H    LYS  16           H        LYS  16   2.735 -17.366   0.093
  100    HA   LYS  16           HA       LYS  16   4.366 -18.106  -1.918
  101   1HB   LYS  16          1HB       LYS  16   3.226 -20.364  -2.555
  102   2HB   LYS  16          2HB       LYS  16   4.603 -20.344  -1.440
  103   1HG   LYS  16          1HG       LYS  16   3.340 -21.254   0.188
  104   2HG   LYS  16          2HG       LYS  16   2.141 -19.957   0.049
  105   1HD   LYS  16          1HD       LYS  16   0.856 -21.821  -0.484
  106   2HD   LYS  16          2HD       LYS  16   1.377 -21.322  -2.102
  107   1HE   LYS  16          1HE       LYS  16   3.314 -22.944  -1.872
  108   2HE   LYS  16          2HE       LYS  16   2.586 -23.524  -0.366
  109   1HZ   LYS  16          1HZ       LYS  16   1.853 -24.065  -3.046
  110   2HZ   LYS  16          2HZ       LYS  16   1.449 -24.863  -1.681
  111   3HZ   LYS  16          3HZ       LYS  16   0.572 -23.572  -2.163
  112    H    ASP  17           H        ASP  17   2.422 -16.155  -1.241
  113    HA   ASP  17           HA       ASP  17   0.842 -16.356  -3.601
  114   1HB   ASP  17          1HB       ASP  17  -0.468 -17.477  -1.666
  115   2HB   ASP  17          2HB       ASP  17  -0.613 -15.855  -0.974
  116    H    ARG  18           H        ARG  18   2.930 -14.751  -1.776
  117    HA   ARG  18           HA       ARG  18   1.534 -12.251  -1.572
  118   1HB   ARG  18          1HB       ARG  18   4.461 -12.883  -0.987
  119   2HB   ARG  18          2HB       ARG  18   3.573 -11.447  -0.449
  120   1HG   ARG  18          1HG       ARG  18   2.528 -12.577   1.246
  121   2HG   ARG  18          2HG       ARG  18   2.361 -14.069   0.304
  122   1HD   ARG  18          1HD       ARG  18   4.680 -14.659   0.721
  123   2HD   ARG  18          2HD       ARG  18   5.011 -13.083   1.459
  124    HE   ARG  18           HE       ARG  18   2.883 -14.697   2.729
  125   1HH1  ARG  18          1HH1      ARG  18   6.265 -13.725   2.750
  126   2HH1  ARG  18          2HH1      ARG  18   6.517 -14.176   4.403
  127   1HH2  ARG  18          1HH2      ARG  18   3.215 -15.293   4.910
  128   2HH2  ARG  18          2HH2      ARG  18   4.771 -15.075   5.640
  129    H    VAL  19           H        VAL  19   3.074 -10.236  -2.297
  130    HA   VAL  19           HA       VAL  19   3.855 -10.842  -5.062
  131    HB   VAL  19           HB       VAL  19   3.128  -8.130  -3.986
  132   1HG1  VAL  19          1HG1      VAL  19   3.676  -9.343  -6.618
  133   2HG1  VAL  19          2HG1      VAL  19   2.240  -8.293  -6.570
  134   3HG1  VAL  19          3HG1      VAL  19   3.827  -7.655  -6.075
  135   1HG2  VAL  19          1HG2      VAL  19   0.816  -8.467  -4.606
  136   2HG2  VAL  19          2HG2      VAL  19   1.165 -10.119  -5.169
  137   3HG2  VAL  19          3HG2      VAL  19   1.287  -9.724  -3.438
  138    H    ASP  20           H        ASP  20   5.421 -11.093  -2.435
  139    HA   ASP  20           HA       ASP  20   7.273 -10.324  -1.494
  140   1HB   ASP  20          1HB       ASP  20   8.408 -11.756  -2.902
  141   2HB   ASP  20          2HB       ASP  20   7.803 -10.976  -4.370
  142    H    CYS  21           H        CYS  21   6.778  -8.117  -0.844
  143    HA   CYS  21           HA       CYS  21   6.612  -5.944  -2.479
  144   1HB   CYS  21          1HB       CYS  21   6.424  -6.366   0.177
  145   2HB   CYS  21          2HB       CYS  21   7.960  -5.496   0.118
  146    H    GLY  22           H        GLY  22   9.454  -7.729  -1.257
  147   1HA   GLY  22          1HA       GLY  22  11.654  -7.560  -1.687
  148   2HA   GLY  22          2HA       GLY  22  11.185  -6.922  -3.251
  149    H    TYR  23           H        TYR  23  11.091  -5.736   0.195
  150    HA   TYR  23           HA       TYR  23  11.860  -3.102  -0.752
  151   1HB   TYR  23          1HB       TYR  23  10.206  -4.202   1.228
  152   2HB   TYR  23          2HB       TYR  23  11.645  -3.786   2.165
  153    HD1  TYR  23           HD1      TYR  23  10.021  -2.021  -0.717
  154    HD2  TYR  23           HD2      TYR  23  11.073  -1.910   3.429
  155    HE1  TYR  23           HE1      TYR  23   9.215   0.386  -0.568
  156    HE2  TYR  23           HE2      TYR  23  10.264   0.497   3.562
  157    HH   TYR  23           HH       TYR  23   8.423   1.919   1.068
  158    HA   PRO  24           HA       PRO  24  16.012  -3.610   0.378
  159   1HB   PRO  24          1HB       PRO  24  16.797  -0.995   0.444
  160   2HB   PRO  24          2HB       PRO  24  16.673  -1.926  -1.046
  161   1HG   PRO  24          1HG       PRO  24  14.869   0.127   0.061
  162   2HG   PRO  24          2HG       PRO  24  15.001  -0.453  -1.638
  163   1HD   PRO  24          1HD       PRO  24  12.980  -1.057   0.299
  164   2HD   PRO  24          2HD       PRO  24  13.153  -1.779  -1.307
  165    H    HIS  25           H        HIS  25  13.706  -2.243   2.356
  166    HA   HIS  25           HA       HIS  25  15.584  -2.494   4.581
  167   1HB   HIS  25          1HB       HIS  25  13.835  -0.196   3.852
  168   2HB   HIS  25          2HB       HIS  25  13.989  -0.594   5.567
  169    HD1  HIS  25           HD1      HIS  25  16.549  -0.605   6.510
  170    HD2  HIS  25           HD2      HIS  25  15.915   1.252   2.802
  171    HE1  HIS  25           HE1      HIS  25  18.596   0.857   6.084
  172    HE2  HIS  25           HE2      HIS  25  18.174   1.929   3.767
  173    H    VAL  26           H        VAL  26  14.055  -4.624   3.681
  174    HA   VAL  26           HA       VAL  26  11.483  -4.744   4.768
  175    HB   VAL  26           HB       VAL  26  11.985  -6.308   3.140
  176   1HG1  VAL  26          1HG1      VAL  26  14.030  -7.977   3.767
  177   2HG1  VAL  26          2HG1      VAL  26  14.209  -6.516   2.766
  178   3HG1  VAL  26          3HG1      VAL  26  14.616  -6.464   4.498
  179   1HG2  VAL  26          1HG2      VAL  26  11.466  -8.379   4.087
  180   2HG2  VAL  26          2HG2      VAL  26  12.438  -8.069   5.546
  181   3HG2  VAL  26          3HG2      VAL  26  10.891  -7.220   5.310
  182    H    THR  27           H        THR  27  10.813  -4.759   6.846
  183    HA   THR  27           HA       THR  27  12.103  -6.303   8.827
  184    HB   THR  27           HB       THR  27  13.261  -3.729   8.332
  185    HG1  THR  27           HG1      THR  27  14.582  -4.603  10.025
  186   1HG2  THR  27          1HG2      THR  27  11.721  -2.523   9.718
  187   2HG2  THR  27          2HG2      THR  27  11.527  -3.898  10.832
  188   3HG2  THR  27          3HG2      THR  27  13.042  -2.964  10.828
  189    HA   PRO  28           HA       PRO  28   8.199  -5.788  10.527
  190   1HB   PRO  28          1HB       PRO  28   8.618  -6.562  13.112
  191   2HB   PRO  28          2HB       PRO  28   8.414  -7.703  11.787
  192   1HG   PRO  28          1HG       PRO  28  10.861  -6.857  13.201
  193   2HG   PRO  28          2HG       PRO  28  10.591  -8.337  12.211
  194   1HD   PRO  28          1HD       PRO  28  12.036  -5.966  11.509
  195   2HD   PRO  28          2HD       PRO  28  11.661  -7.327  10.445
  196    H    LYS  29           H        LYS  29   8.952  -3.367  10.045
  197    HA   LYS  29           HA       LYS  29   7.691  -1.876  11.993
  198   1HB   LYS  29          1HB       LYS  29   9.533  -2.408  13.464
  199   2HB   LYS  29          2HB       LYS  29  10.710  -1.820  12.278
  200   1HG   LYS  29          1HG       LYS  29  10.281   0.374  12.759
  201   2HG   LYS  29          2HG       LYS  29   8.546   0.104  12.993
  202   1HD   LYS  29          1HD       LYS  29   9.821  -1.287  15.097
  203   2HD   LYS  29          2HD       LYS  29  10.692   0.251  14.973
  204   1HE   LYS  29          1HE       LYS  29   7.976   0.942  14.712
  205   2HE   LYS  29          2HE       LYS  29   7.985  -0.299  15.974
  206   1HZ   LYS  29          1HZ       LYS  29  10.054   1.666  16.192
  207   2HZ   LYS  29          2HZ       LYS  29   8.545   2.264  16.370
  208   3HZ   LYS  29          3HZ       LYS  29   9.066   1.059  17.342
  209    H    GLU  30           H        GLU  30   9.934  -2.263   9.300
  210    HA   GLU  30           HA       GLU  30   9.458   0.485   8.517
  211   1HB   GLU  30          1HB       GLU  30  11.566  -1.495   8.075
  212   2HB   GLU  30          2HB       GLU  30  11.064  -0.728   6.557
  213   1HG   GLU  30          1HG       GLU  30  12.679   0.771   7.287
  214   2HG   GLU  30          2HG       GLU  30  11.236   1.502   8.006
  215    H    CYS  31           H        CYS  31   9.055  -2.917   7.355
  216    HA   CYS  31           HA       CYS  31   7.852  -2.234   4.933
  217   1HB   CYS  31          1HB       CYS  31   8.075  -4.682   6.603
  218   2HB   CYS  31          2HB       CYS  31   6.825  -4.660   5.355
  219    H    ASN  32           H        ASN  32   6.453  -3.347   8.110
  220    HA   ASN  32           HA       ASN  32   3.826  -3.016   7.352
  221   1HB   ASN  32          1HB       ASN  32   5.354  -3.330   9.886
  222   2HB   ASN  32          2HB       ASN  32   3.783  -2.540  10.087
  223   1HD2  ASN  32          1HD2      ASN  32   5.202  -5.195   8.173
  224   2HD2  ASN  32          2HD2      ASN  32   3.970  -6.372   8.487
  225    H    ASN  33           H        ASN  33   6.284  -0.700   7.712
  226    HA   ASN  33           HA       ASN  33   4.426   1.347   8.605
  227   1HB   ASN  33          1HB       ASN  33   6.489   1.358   9.871
  228   2HB   ASN  33          2HB       ASN  33   7.475   1.248   8.405
  229   1HD2  ASN  33          1HD2      ASN  33   8.355   3.042   7.741
  230   2HD2  ASN  33          2HD2      ASN  33   7.804   4.658   8.031
  231    H    ARG  34           H        ARG  34   6.312   0.065   5.908
  232    HA   ARG  34           HA       ARG  34   6.111   2.500   4.415
  233   1HB   ARG  34          1HB       ARG  34   7.612   1.530   2.929
  234   2HB   ARG  34          2HB       ARG  34   8.005   0.598   4.385
  235   1HG   ARG  34          1HG       ARG  34   7.690  -1.171   2.966
  236   2HG   ARG  34          2HG       ARG  34   5.986  -0.935   3.393
  237   1HD   ARG  34          1HD       ARG  34   6.583   0.881   1.267
  238   2HD   ARG  34          2HD       ARG  34   7.267  -0.684   0.804
  239    HE   ARG  34           HE       ARG  34   4.506  -0.735   1.858
  240   1HH1  ARG  34          1HH1      ARG  34   6.578  -0.659  -0.984
  241   2HH1  ARG  34          2HH1      ARG  34   5.350  -1.249  -2.053
  242   1HH2  ARG  34          1HH2      ARG  34   2.885  -1.515   0.449
  243   2HH2  ARG  34          2HH2      ARG  34   3.235  -1.739  -1.233
  244    H    GLY  35           H        GLY  35   4.398  -0.545   4.872
  245   1HA   GLY  35          1HA       GLY  35   2.043  -0.395   4.134
  246   2HA   GLY  35          2HA       GLY  35   2.655   0.091   2.566
  247    H    CYS  36           H        CYS  36   4.537  -2.258   4.404
  248    HA   CYS  36           HA       CYS  36   3.473  -4.358   2.655
  249   1HB   CYS  36          1HB       CYS  36   6.320  -3.946   3.577
  250   2HB   CYS  36          2HB       CYS  36   5.737  -5.364   2.702
  251    H    CYS  37           H        CYS  37   4.253  -6.635   3.722
  252    HA   CYS  37           HA       CYS  37   3.718  -6.400   6.594
  253   1HB   CYS  37          1HB       CYS  37   1.845  -7.303   5.084
  254   2HB   CYS  37          2HB       CYS  37   2.839  -8.755   4.939
  255    H    PHE  38           H        PHE  38   5.342  -7.281   7.844
  256    HA   PHE  38           HA       PHE  38   7.436  -8.724   6.452
  257   1HB   PHE  38          1HB       PHE  38   7.811  -6.785   8.065
  258   2HB   PHE  38          2HB       PHE  38   7.088  -7.754   9.353
  259    HD1  PHE  38           HD1      PHE  38   9.970  -7.501   7.053
  260    HD2  PHE  38           HD2      PHE  38   8.378  -9.366  10.516
  261    HE1  PHE  38           HE1      PHE  38  12.232  -8.456   7.580
  262    HE2  PHE  38           HE2      PHE  38  10.638 -10.321  11.043
  263    HZ   PHE  38           HZ       PHE  38  12.539  -9.854   9.568
  264    H    ASP  39           H        ASP  39   7.587 -10.915   6.462
  265    HA   ASP  39           HA       ASP  39   5.802 -12.337   8.204
  266   1HB   ASP  39          1HB       ASP  39   5.897 -13.086   5.916
  267   2HB   ASP  39          2HB       ASP  39   7.666 -13.160   5.938
  268    H    SER  40           H        SER  40   9.107 -13.309   7.090
  269    HA   SER  40           HA       SER  40  11.000 -13.529   8.233
  270   1HB   SER  40          1HB       SER  40   9.813 -11.926  10.009
  271   2HB   SER  40          2HB       SER  40   9.727 -13.420  10.958
  272    HG   SER  40           HG       SER  40  11.745 -12.969  11.500
  273    H    ARG  41           H        ARG  41   7.987 -15.160   8.689
  274    HA   ARG  41           HA       ARG  41   8.710 -17.238  10.314
  275   1HB   ARG  41          1HB       ARG  41   6.775 -17.076   7.967
  276   2HB   ARG  41          2HB       ARG  41   6.880 -18.511   9.002
  277   1HG   ARG  41          1HG       ARG  41   6.708 -16.331  10.781
  278   2HG   ARG  41          2HG       ARG  41   5.553 -15.946   9.493
  279   1HD   ARG  41          1HD       ARG  41   4.380 -17.221  11.179
  280   2HD   ARG  41          2HD       ARG  41   4.594 -18.288   9.784
  281    HE   ARG  41           HE       ARG  41   6.837 -18.722  11.409
  282   1HH1  ARG  41          1HH1      ARG  41   3.350 -18.998  11.786
  283   2HH1  ARG  41          2HH1      ARG  41   3.448 -20.271  12.956
  284   1HH2  ARG  41          1HH2      ARG  41   6.968 -20.402  12.951
  285   2HH2  ARG  41          2HH2      ARG  41   5.520 -21.075  13.623
  286    H    ILE  42           H        ILE  42   8.707 -17.076   6.672
  287    HA   ILE  42           HA       ILE  42  10.640 -19.289   6.710
  288    HB   ILE  42           HB       ILE  42   9.160 -18.701   4.227
  289   1HG1  ILE  42          1HG1      ILE  42   7.774 -19.810   6.675
  290   2HG1  ILE  42          2HG1      ILE  42   7.338 -18.353   5.765
  291   1HG2  ILE  42          1HG2      ILE  42   9.780 -21.267   5.717
  292   2HG2  ILE  42          2HG2      ILE  42   9.129 -21.130   4.066
  293   3HG2  ILE  42          3HG2      ILE  42  10.771 -20.544   4.427
  294   1HD1  ILE  42          1HD1      ILE  42   7.047 -21.264   4.983
  295   2HD1  ILE  42          2HD1      ILE  42   5.834 -19.962   4.929
  296   3HD1  ILE  42          3HD1      ILE  42   7.144 -20.008   3.725
  297    HA   PRO  43           HA       PRO  43  13.348 -16.281   5.126
  298   1HB   PRO  43          1HB       PRO  43  15.546 -17.880   4.847
  299   2HB   PRO  43          2HB       PRO  43  15.105 -17.103   6.367
  300   1HG   PRO  43          1HG       PRO  43  14.788 -19.908   5.509
  301   2HG   PRO  43          2HG       PRO  43  14.793 -19.238   7.181
  302   1HD   PRO  43          1HD       PRO  43  12.561 -20.134   5.627
  303   2HD   PRO  43          2HD       PRO  43  12.496 -19.335   7.203
  304    H    GLY  44           H        GLY  44  12.217 -19.019   3.527
  305   1HA   GLY  44          1HA       GLY  44  13.586 -18.368   1.038
  306   2HA   GLY  44          2HA       GLY  44  12.509 -19.715   1.349
  307    H    VAL  45           H        VAL  45  10.807 -17.314   2.762
  308    HA   VAL  45           HA       VAL  45   9.413 -16.687   0.257
  309    HB   VAL  45           HB       VAL  45   8.524 -17.863   2.599
  310   1HG1  VAL  45          1HG1      VAL  45   8.539 -15.835   3.871
  311   2HG1  VAL  45          2HG1      VAL  45   7.734 -14.935   2.564
  312   3HG1  VAL  45          3HG1      VAL  45   6.844 -16.190   3.460
  313   1HG2  VAL  45          1HG2      VAL  45   6.263 -16.743   1.324
  314   2HG2  VAL  45          2HG2      VAL  45   7.480 -17.000   0.050
  315   3HG2  VAL  45          3HG2      VAL  45   6.969 -18.360   1.079
  316    HA   PRO  46           HA       PRO  46  10.058 -12.463   0.916
  317   1HB   PRO  46          1HB       PRO  46   7.678 -11.274   0.297
  318   2HB   PRO  46          2HB       PRO  46   8.816 -11.845  -0.921
  319   1HG   PRO  46          1HG       PRO  46   6.284 -13.036   0.016
  320   2HG   PRO  46          2HG       PRO  46   7.170 -13.347  -1.521
  321   1HD   PRO  46          1HD       PRO  46   7.015 -15.001   0.811
  322   2HD   PRO  46          2HD       PRO  46   8.028 -15.276  -0.612
  323    H    TRP  47           H        TRP  47  10.645 -11.641   2.817
  324    HA   TRP  47           HA       TRP  47   8.693 -11.807   4.944
  325   1HB   TRP  47          1HB       TRP  47  11.149 -10.379   5.538
  326   2HB   TRP  47          2HB       TRP  47  10.440 -11.800   6.310
  327    HD1  TRP  47           HD1      TRP  47  11.013 -14.230   4.903
  328    HE1  TRP  47           HE1      TRP  47  13.225 -15.044   3.716
  329    HE3  TRP  47           HE3      TRP  47  13.057  -9.604   4.381
  330    HZ2  TRP  47           HZ2      TRP  47  15.529 -13.691   2.714
  331    HZ3  TRP  47           HZ3      TRP  47  15.291  -9.438   3.287
  332    HH2  TRP  47           HH2      TRP  47  16.520 -11.384   2.468
  333    H    CYS  48           H        CYS  48   8.183 -10.114   2.524
  334    HA   CYS  48           HA       CYS  48   7.294  -7.825   3.883
  335   1HB   CYS  48          1HB       CYS  48   9.677  -7.220   3.730
  336   2HB   CYS  48          2HB       CYS  48   9.587  -7.340   1.970
  337    H    PHE  49           H        PHE  49   5.286  -8.076   2.907
  338    HA   PHE  49           HA       PHE  49   5.257  -7.832  -0.001
  339   1HB   PHE  49          1HB       PHE  49   3.162  -9.529   0.454
  340   2HB   PHE  49          2HB       PHE  49   4.781 -10.134   0.094
  341    HD1  PHE  49           HD1      PHE  49   6.316 -10.302   2.304
  342    HD2  PHE  49           HD2      PHE  49   2.077 -10.471   2.233
  343    HE1  PHE  49           HE1      PHE  49   6.328 -11.529   4.493
  344    HE2  PHE  49           HE2      PHE  49   2.089 -11.698   4.423
  345    HZ   PHE  49           HZ       PHE  49   4.214 -12.213   5.527
  346    H    LYS  50           H        LYS  50   2.504  -7.965  -0.414
  347    HA   LYS  50           HA       LYS  50   1.501  -5.857   1.370
  348   1HB   LYS  50          1HB       LYS  50   0.276  -5.035  -0.704
  349   2HB   LYS  50          2HB       LYS  50   2.017  -4.712  -0.613
  350   1HG   LYS  50          1HG       LYS  50   1.545  -7.300  -1.839
  351   2HG   LYS  50          2HG       LYS  50   0.590  -6.066  -2.679
  352   1HD   LYS  50          1HD       LYS  50   3.593  -6.095  -2.189
  353   2HD   LYS  50          2HD       LYS  50   2.765  -6.185  -3.752
  354   1HE   LYS  50          1HE       LYS  50   1.825  -3.826  -2.454
  355   2HE   LYS  50          2HE       LYS  50   3.581  -3.842  -2.240
  356   1HZ   LYS  50          1HZ       LYS  50   2.696  -2.828  -4.330
  357   2HZ   LYS  50          2HZ       LYS  50   3.871  -3.943  -4.534
  358   3HZ   LYS  50          3HZ       LYS  50   2.314  -4.333  -4.835
  359    HA   PRO  51           HA       PRO  51  -1.298  -9.425   1.351
  360   1HB   PRO  51          1HB       PRO  51  -1.336  -9.881   4.044
  361   2HB   PRO  51          2HB       PRO  51  -0.278 -10.748   2.935
  362   1HG   PRO  51          1HG       PRO  51   0.330  -8.554   4.811
  363   2HG   PRO  51          2HG       PRO  51   1.462  -9.736   4.061
  364   1HD   PRO  51          1HD       PRO  51   1.063  -6.981   3.392
  365   2HD   PRO  51          2HD       PRO  51   2.072  -8.141   2.520
  366    H    LEU  52           H        LEU  52  -1.896  -8.278   4.524
  367    HA   LEU  52           HA       LEU  52  -4.408  -7.193   3.532
  368   1HB   LEU  52          1HB       LEU  52  -5.306  -7.754   5.487
  369   2HB   LEU  52          2HB       LEU  52  -3.931  -8.871   5.550
  370    HG   LEU  52           HG       LEU  52  -4.367  -6.289   7.039
  371   1HD1  LEU  52          1HD1      LEU  52  -3.597  -7.840   8.942
  372   2HD1  LEU  52          2HD1      LEU  52  -5.220  -8.088   8.256
  373   3HD1  LEU  52          3HD1      LEU  52  -3.882  -9.165   7.790
  374   1HD2  LEU  52          1HD2      LEU  52  -2.214  -5.768   7.098
  375   2HD2  LEU  52          2HD2      LEU  52  -1.794  -7.410   7.646
  376   3HD2  LEU  52          3HD2      LEU  52  -1.894  -7.051   5.905
  377    H    GLN  53           H        GLN  53  -1.896  -5.796   2.952
  378    HA   GLN  53           HA       GLN  53  -1.366  -3.793   4.743
  379   1HB   GLN  53          1HB       GLN  53  -1.220  -3.779   1.706
  380   2HB   GLN  53          2HB       GLN  53  -0.461  -2.558   2.740
  381   1HG   GLN  53          1HG       GLN  53   0.135  -5.543   2.644
  382   2HG   GLN  53          2HG       GLN  53   1.213  -4.231   2.144
  383   1HE2  GLN  53          1HE2      GLN  53  -0.053  -6.122   4.718
  384   2HE2  GLN  53          2HE2      GLN  53   0.871  -5.459   6.024
  385    H    GLU  54           H        GLU  54  -4.156  -4.309   2.704
  386    HA   GLU  54           HA       GLU  54  -5.039  -1.888   2.058
  387   1HB   GLU  54          1HB       GLU  54  -7.221  -2.785   2.031
  388   2HB   GLU  54          2HB       GLU  54  -6.176  -4.202   1.828
  389   1HG   GLU  54          1HG       GLU  54  -7.483  -5.034   3.514
  390   2HG   GLU  54          2HG       GLU  54  -6.352  -4.143   4.546
  391    H    ALA  55           H        ALA  55  -4.557  -3.131   5.312
  392    HA   ALA  55           HA       ALA  55  -6.262  -1.795   6.883
  393   1HB   ALA  55          1HB       ALA  55  -3.863  -1.389   8.192
  394   2HB   ALA  55          2HB       ALA  55  -4.800  -2.903   8.209
  395   3HB   ALA  55          3HB       ALA  55  -3.458  -2.700   7.057
  396    H    GLU  56           H        GLU  56  -3.019  -0.330   6.155
  397    HA   GLU  56           HA       GLU  56  -4.431   2.212   5.928
  398   1HB   GLU  56          1HB       GLU  56  -2.530   1.434   7.900
  399   2HB   GLU  56          2HB       GLU  56  -1.719   2.610   6.852
  400   1HG   GLU  56          1HG       GLU  56  -4.526   3.170   7.798
  401   2HG   GLU  56          2HG       GLU  56  -3.189   3.401   8.935
  402    H    CYS  57           H        CYS  57  -3.541   0.199   3.878
  403    HA   CYS  57           HA       CYS  57  -1.440   1.756   2.574
  404   1HB   CYS  57          1HB       CYS  57  -1.252  -0.781   3.034
  405   2HB   CYS  57          2HB       CYS  57  -2.360  -0.958   1.670
  406    H    THR  58           H        THR  58  -4.490  -0.113   1.867
  407    HA   THR  58           HA       THR  58  -4.915   1.185  -0.616
  408    HB   THR  58           HB       THR  58  -5.752  -1.129   0.404
  409    HG1  THR  58           HG1      THR  58  -7.658  -0.746  -1.106
  410   1HG2  THR  58          1HG2      THR  58  -7.099   0.121   2.245
  411   2HG2  THR  58          2HG2      THR  58  -8.166   0.666   0.928
  412   3HG2  THR  58          3HG2      THR  58  -8.001  -1.072   1.278
  413    H    PHE  59           H        PHE  59  -6.003   1.806   2.741
  414    HA   PHE  59           HA       PHE  59  -8.039   3.450   2.519
  415   1HB   PHE  59          1HB       PHE  59  -6.252   2.890   4.432
  416   2HB   PHE  59          2HB       PHE  59  -5.516   4.420   3.939
  417    HD1  PHE  59           HD1      PHE  59  -6.008   6.104   5.422
  418    HD2  PHE  59           HD2      PHE  59  -9.027   3.262   4.519
  419    HE1  PHE  59           HE1      PHE  59  -7.612   7.336   6.908
  420    HE2  PHE  59           HE2      PHE  59 -10.632   4.495   6.004
  421    HZ   PHE  59           HZ       PHE  59  -9.905   6.517   7.181
  422   1H    GLU   1           H1       GLU   1 -23.495   4.883  -1.057
  423    HA   GLU   1           HA       GLU   1 -22.219   3.571  -2.557
  424   1HB   GLU   1          1HB       GLU   1 -20.964   5.974  -1.271
  425   2HB   GLU   1          2HB       GLU   1 -20.006   5.080  -2.466
  426   1HG   GLU   1          1HG       GLU   1 -21.087   6.382  -3.983
  427   2HG   GLU   1          2HG       GLU   1 -22.448   5.275  -3.744
  428    H    GLU   2           H        GLU   2 -20.590   2.022  -2.920
  429    HA   GLU   2           HA       GLU   2 -19.514   0.915  -0.495
  430   1HB   GLU   2          1HB       GLU   2 -19.339  -0.089  -3.362
  431   2HB   GLU   2          2HB       GLU   2 -18.908  -1.013  -1.913
  432   1HG   GLU   2          1HG       GLU   2 -21.659   0.189  -2.070
  433   2HG   GLU   2          2HG       GLU   2 -21.324  -1.229  -3.076
  434    H    TYR   3           H        TYR   3 -17.419  -0.114  -2.843
  435    HA   TYR   3           HA       TYR   3 -15.359   1.684  -1.901
  436   1HB   TYR   3          1HB       TYR   3 -15.691  -0.896  -3.482
  437   2HB   TYR   3          2HB       TYR   3 -14.158  -0.035  -3.637
  438    HD1  TYR   3           HD1      TYR   3 -12.505  -1.103  -2.415
  439    HD2  TYR   3           HD2      TYR   3 -16.426  -0.782  -0.733
  440    HE1  TYR   3           HE1      TYR   3 -11.688  -2.214  -0.278
  441    HE2  TYR   3           HE2      TYR   3 -15.596  -1.894   1.397
  442    HH   TYR   3           HH       TYR   3 -12.400  -2.176   2.153
  443    H    VAL   4           H        VAL   4 -16.142   3.665  -2.965
  444    HA   VAL   4           HA       VAL   4 -15.428   3.646  -5.815
  445    HB   VAL   4           HB       VAL   4 -17.677   3.935  -6.001
  446   1HG1  VAL   4          1HG1      VAL   4 -18.135   3.771  -3.575
  447   2HG1  VAL   4          2HG1      VAL   4 -17.739   5.498  -3.397
  448   3HG1  VAL   4          3HG1      VAL   4 -19.144   5.002  -4.372
  449   1HG2  VAL   4          1HG2      VAL   4 -16.939   6.797  -5.329
  450   2HG2  VAL   4          2HG2      VAL   4 -16.435   5.977  -6.826
  451   3HG2  VAL   4          3HG2      VAL   4 -18.165   6.222  -6.484
  452    H    GLY   5           H        GLY   5 -15.890   5.690  -2.850
  453   1HA   GLY   5          1HA       GLY   5 -14.232   7.796  -3.789
  454   2HA   GLY   5          2HA       GLY   5 -14.800   7.536  -2.151
  455    H    LEU   6           H        LEU   6 -13.417   4.620  -3.045
  456    HA   LEU   6           HA       LEU   6 -10.710   5.465  -2.328
  457   1HB   LEU   6          1HB       LEU   6 -10.657   3.376  -0.864
  458   2HB   LEU   6          2HB       LEU   6 -11.423   4.844  -0.232
  459    HG   LEU   6           HG       LEU   6 -12.626   2.740   0.312
  460   1HD1  LEU   6          1HD1      LEU   6 -13.666   5.137  -0.176
  461   2HD1  LEU   6          2HD1      LEU   6 -14.493   4.236  -1.470
  462   3HD1  LEU   6          3HD1      LEU   6 -14.677   3.729   0.226
  463   1HD2  LEU   6          1HD2      LEU   6 -13.617   2.527  -2.499
  464   2HD2  LEU   6          2HD2      LEU   6 -12.037   1.817  -2.095
  465   3HD2  LEU   6          3HD2      LEU   6 -13.497   1.290  -1.225
  466    H    SER   7           H        SER   7 -12.450   4.440  -4.745
  467    HA   SER   7           HA       SER   7 -10.796   2.115  -5.313
  468   1HB   SER   7          1HB       SER   7 -13.559   2.622  -5.662
  469   2HB   SER   7          2HB       SER   7 -12.868   2.623  -7.296
  470    HG   SER   7           HG       SER   7 -12.353   0.546  -5.350
  471    H    ALA   8           H        ALA   8 -11.211   2.267  -8.217
  472    HA   ALA   8           HA       ALA   8  -9.052   3.940  -8.875
  473   1HB   ALA   8          1HB       ALA   8 -10.256   3.377 -11.263
  474   2HB   ALA   8          2HB       ALA   8  -9.182   2.253 -10.397
  475   3HB   ALA   8          3HB       ALA   8 -10.948   2.103 -10.232
  476    H    ASN   9           H        ASN   9  -9.567   6.063  -8.094
  477    HA   ASN   9           HA       ASN   9 -10.483   7.793  -9.910
  478   1HB   ASN   9          1HB       ASN   9 -12.735   7.040  -9.908
  479   2HB   ASN   9          2HB       ASN   9 -12.743   6.749  -8.163
  480   1HD2  ASN   9          1HD2      ASN   9 -11.621   9.535 -10.056
  481   2HD2  ASN   9          2HD2      ASN   9 -12.687  10.718  -9.370
  482    H    GLN  10           H        GLN  10 -10.290   6.738  -6.521
  483    HA   GLN  10           HA       GLN  10 -10.486   9.242  -5.326
  484   1HB   GLN  10          1HB       GLN  10 -10.707   7.035  -4.170
  485   2HB   GLN  10          2HB       GLN  10  -8.958   6.796  -4.332
  486   1HG   GLN  10          1HG       GLN  10  -8.565   8.862  -3.016
  487   2HG   GLN  10          2HG       GLN  10 -10.311   9.110  -2.865
  488   1HE2  GLN  10          1HE2      GLN  10  -8.214   6.240  -2.660
  489   2HE2  GLN  10          2HE2      GLN  10  -8.685   5.735  -1.072
  490    H    CYS  11           H        CYS  11  -7.839   7.517  -6.950
  491    HA   CYS  11           HA       CYS  11  -5.766   9.100  -5.873
  492   1HB   CYS  11          1HB       CYS  11  -5.302   6.920  -6.748
  493   2HB   CYS  11          2HB       CYS  11  -5.913   7.366  -8.345
  494    H    ALA  12           H        ALA  12  -8.404   9.922  -7.740
  495    HA   ALA  12           HA       ALA  12  -6.890  12.017  -9.144
  496   1HB   ALA  12          1HB       ALA  12  -8.904  10.085 -10.063
  497   2HB   ALA  12          2HB       ALA  12  -9.334  11.769 -10.449
  498   3HB   ALA  12          3HB       ALA  12  -7.782  11.097 -11.004
  499    H    VAL  13           H        VAL  13  -8.487  11.509  -6.390
  500    HA   VAL  13           HA       VAL  13 -10.716  13.013  -6.244
  501    HB   VAL  13           HB       VAL  13  -8.894  11.884  -4.497
  502   1HG1  VAL  13          1HG1      VAL  13  -8.506  13.616  -2.770
  503   2HG1  VAL  13          2HG1      VAL  13  -7.643  13.963  -4.288
  504   3HG1  VAL  13          3HG1      VAL  13  -9.134  14.849  -3.889
  505   1HG2  VAL  13          1HG2      VAL  13 -11.607  12.824  -4.507
  506   2HG2  VAL  13          2HG2      VAL  13 -10.862  11.555  -3.504
  507   3HG2  VAL  13          3HG2      VAL  13 -10.852  13.247  -2.952
  508    HA   PRO  14           HA       PRO  14  -9.693  17.153  -6.947
  509   1HB   PRO  14          1HB       PRO  14 -11.124  18.549  -5.085
  510   2HB   PRO  14          2HB       PRO  14 -11.841  17.887  -6.552
  511   1HG   PRO  14          1HG       PRO  14 -11.982  16.917  -3.769
  512   2HG   PRO  14          2HG       PRO  14 -13.076  16.537  -5.148
  513   1HD   PRO  14          1HD       PRO  14 -11.043  14.891  -3.983
  514   2HD   PRO  14          2HD       PRO  14 -11.983  14.536  -5.439
  515    H    ALA  15           H        ALA  15  -7.911  15.641  -5.134
  516    HA   ALA  15           HA       ALA  15  -6.204  16.024  -3.771
  517   1HB   ALA  15          1HB       ALA  15  -6.311  18.257  -5.699
  518   2HB   ALA  15          2HB       ALA  15  -5.367  18.616  -4.233
  519   3HB   ALA  15          3HB       ALA  15  -4.949  17.207  -5.239
  520    H    LYS  16           H        LYS  16  -8.019  15.897  -2.057
  521    HA   LYS  16           HA       LYS  16  -7.472  17.620  -0.017
  522   1HB   LYS  16          1HB       LYS  16  -9.769  18.873  -0.042
  523   2HB   LYS  16          2HB       LYS  16  -8.372  19.535  -0.910
  524   1HG   LYS  16          1HG       LYS  16  -9.461  19.380  -2.877
  525   2HG   LYS  16          2HG       LYS  16  -9.823  17.665  -2.610
  526   1HD   LYS  16          1HD       LYS  16 -11.396  19.833  -1.197
  527   2HD   LYS  16          2HD       LYS  16 -11.807  19.369  -2.857
  528   1HE   LYS  16          1HE       LYS  16 -13.074  17.739  -1.926
  529   2HE   LYS  16          2HE       LYS  16 -11.555  16.911  -1.542
  530   1HZ   LYS  16          1HZ       LYS  16 -11.561  18.179   0.544
  531   2HZ   LYS  16          2HZ       LYS  16 -13.040  18.769   0.181
  532   3HZ   LYS  16          3HZ       LYS  16 -12.836  17.166   0.414
  533    H    ASP  17           H        ASP  17  -7.895  14.841  -0.581
  534    HA   ASP  17           HA       ASP  17  -9.786  14.344   1.492
  535   1HB   ASP  17          1HB       ASP  17 -11.089  14.377  -0.725
  536   2HB   ASP  17          2HB       ASP  17 -10.172  12.932  -1.181
  537    H    ARG  18           H        ARG  18  -6.836  14.020   0.326
  538    HA   ARG  18           HA       ARG  18  -6.622  11.155   0.398
  539   1HB   ARG  18          1HB       ARG  18  -4.418  13.245   0.104
  540   2HB   ARG  18          2HB       ARG  18  -4.287  11.520  -0.283
  541   1HG   ARG  18          1HG       ARG  18  -5.385  11.758  -2.277
  542   2HG   ARG  18          2HG       ARG  18  -6.498  12.988  -1.651
  543   1HD   ARG  18          1HD       ARG  18  -4.800  14.710  -1.854
  544   2HD   ARG  18          2HD       ARG  18  -3.548  13.519  -2.239
  545    HE   ARG  18           HE       ARG  18  -5.861  13.554  -4.068
  546   1HH1  ARG  18          1HH1      ARG  18  -2.616  14.755  -3.423
  547   2HH1  ARG  18          2HH1      ARG  18  -2.306  15.174  -5.074
  548   1HH2  ARG  18          1HH2      ARG  18  -5.450  14.106  -6.247
  549   2HH2  ARG  18          2HH2      ARG  18  -3.927  14.802  -6.692
  550    H    VAL  19           H        VAL  19  -4.514  10.352   1.709
  551    HA   VAL  19           HA       VAL  19  -4.829  11.457   4.400
  552    HB   VAL  19           HB       VAL  19  -3.611   8.829   3.547
  553   1HG1  VAL  19          1HG1      VAL  19  -3.860  10.210   6.072
  554   2HG1  VAL  19          2HG1      VAL  19  -4.769   8.680   6.117
  555   3HG1  VAL  19          3HG1      VAL  19  -3.040   8.676   5.698
  556   1HG2  VAL  19          1HG2      VAL  19  -6.475   9.602   4.035
  557   2HG2  VAL  19          2HG2      VAL  19  -5.781   8.534   2.793
  558   3HG2  VAL  19          3HG2      VAL  19  -5.911   7.973   4.478
  559    H    ASP  20           H        ASP  20  -3.130  12.471   1.999
  560    HA   ASP  20           HA       ASP  20  -1.027  12.979   1.540
  561   1HB   ASP  20          1HB       ASP  20  -1.398  14.896   2.782
  562   2HB   ASP  20          2HB       ASP  20  -1.707  14.004   4.279
  563    H    CYS  21           H        CYS  21  -0.011  10.841   1.331
  564    HA   CYS  21           HA       CYS  21   0.785   9.222   3.367
  565   1HB   CYS  21          1HB       CYS  21   0.961   9.136   0.690
  566   2HB   CYS  21          2HB       CYS  21   2.655   9.454   1.077
  567    H    GLY  22           H        GLY  22   2.295  12.188   2.025
  568   1HA   GLY  22          1HA       GLY  22   4.061  13.418   2.680
  569   2HA   GLY  22          2HA       GLY  22   3.606  12.959   4.309
  570    H    TYR  23           H        TYR  23   5.154  11.368   1.418
  571    HA   TYR  23           HA       TYR  23   6.892   9.901   3.229
  572   1HB   TYR  23          1HB       TYR  23   5.731   9.756   0.521
  573   2HB   TYR  23          2HB       TYR  23   7.479   9.502   0.438
  574    HD1  TYR  23           HD1      TYR  23   8.501   7.618   1.785
  575    HD2  TYR  23           HD2      TYR  23   4.273   8.063   1.302
  576    HE1  TYR  23           HE1      TYR  23   8.160   5.195   2.475
  577    HE2  TYR  23           HE2      TYR  23   3.947   5.638   1.993
  578    HH   TYR  23           HH       TYR  23   6.747   3.604   2.810
  579    HA   PRO  24           HA       PRO  24  10.224  12.593   2.556
  580   1HB   PRO  24          1HB       PRO  24  12.254  11.032   3.510
  581   2HB   PRO  24          2HB       PRO  24  11.199  11.986   4.552
  582   1HG   PRO  24          1HG       PRO  24  11.211   9.086   4.008
  583   2HG   PRO  24          2HG       PRO  24  10.481   9.965   5.399
  584   1HD   PRO  24          1HD       PRO  24   9.166   8.815   3.130
  585   2HD   PRO  24          2HD       PRO  24   8.421   9.808   4.390
  586    H    HIS  25           H        HIS  25   9.619   9.891   0.798
  587    HA   HIS  25           HA       HIS  25  11.833  10.599  -0.984
  588   1HB   HIS  25          1HB       HIS  25  11.715   8.261   0.379
  589   2HB   HIS  25          2HB       HIS  25  10.833   7.813  -1.087
  590    HD1  HIS  25           HD1      HIS  25  14.073   7.529   0.182
  591    HD2  HIS  25           HD2      HIS  25  12.574   8.984  -3.456
  592    HE1  HIS  25           HE1      HIS  25  16.006   7.424  -1.481
  593    HE2  HIS  25           HE2      HIS  25  15.009   8.279  -3.711
  594    H    VAL  26           H        VAL  26   8.767  11.224  -0.586
  595    HA   VAL  26           HA       VAL  26   7.166  10.127  -2.416
  596    HB   VAL  26           HB       VAL  26   6.322  11.835  -1.080
  597   1HG1  VAL  26          1HG1      VAL  26   7.527  13.583  -0.397
  598   2HG1  VAL  26          2HG1      VAL  26   8.836  13.066  -1.487
  599   3HG1  VAL  26          3HG1      VAL  26   7.610  14.225  -2.054
  600   1HG2  VAL  26          1HG2      VAL  26   5.621  11.792  -3.597
  601   2HG2  VAL  26          2HG2      VAL  26   5.090  13.138  -2.559
  602   3HG2  VAL  26          3HG2      VAL  26   6.461  13.360  -3.672
  603    H    THR  27           H        THR  27   7.150   9.754  -4.578
  604    HA   THR  27           HA       THR  27   8.217  11.595  -6.440
  605    HB   THR  27           HB       THR  27  10.081   9.734  -5.223
  606    HG1  THR  27           HG1      THR  27  11.402  11.201  -6.367
  607   1HG2  THR  27          1HG2      THR  27  11.022   9.087  -7.605
  608   2HG2  THR  27          2HG2      THR  27   9.766   8.054  -6.884
  609   3HG2  THR  27          3HG2      THR  27   9.329   9.246  -8.131
  610    HA   PRO  28           HA       PRO  28   5.594   9.288  -8.929
  611   1HB   PRO  28          1HB       PRO  28   6.462   9.957 -11.432
  612   2HB   PRO  28          2HB       PRO  28   5.421  10.997 -10.463
  613   1HG   PRO  28          1HG       PRO  28   8.311  11.196 -11.019
  614   2HG   PRO  28          2HG       PRO  28   7.185  12.482 -10.453
  615   1HD   PRO  28          1HD       PRO  28   9.148  11.045  -8.943
  616   2HD   PRO  28          2HD       PRO  28   7.956  12.187  -8.308
  617    H    LYS  29           H        LYS  29   7.403   7.640  -7.765
  618    HA   LYS  29           HA       LYS  29   7.334   5.478  -9.494
  619   1HB   LYS  29          1HB       LYS  29   9.139   7.057 -10.559
  620   2HB   LYS  29          2HB       LYS  29  10.186   6.381  -9.301
  621   1HG   LYS  29          1HG       LYS  29  10.245   4.325 -10.288
  622   2HG   LYS  29          2HG       LYS  29   8.537   4.377 -10.756
  623   1HD   LYS  29          1HD       LYS  29   9.464   6.266 -12.430
  624   2HD   LYS  29          2HD       LYS  29  10.970   5.353 -12.232
  625   1HE   LYS  29          1HE       LYS  29   9.862   4.396 -14.123
  626   2HE   LYS  29          2HE       LYS  29   9.597   3.249 -12.800
  627   1HZ   LYS  29          1HZ       LYS  29   7.669   5.363 -13.408
  628   2HZ   LYS  29          2HZ       LYS  29   7.629   3.929 -14.190
  629   3HZ   LYS  29          3HZ       LYS  29   7.428   3.981 -12.570
  630    H    GLU  30           H        GLU  30   8.202   7.205  -6.639
  631    HA   GLU  30           HA       GLU  30   9.146   4.756  -5.397
  632   1HB   GLU  30          1HB       GLU  30   9.647   7.620  -5.009
  633   2HB   GLU  30          2HB       GLU  30   9.305   6.789  -3.483
  634   1HG   GLU  30          1HG       GLU  30  11.600   6.466  -3.657
  635   2HG   GLU  30          2HG       GLU  30  11.017   4.994  -4.446
  636    H    CYS  31           H        CYS  31   6.692   7.391  -5.093
  637    HA   CYS  31           HA       CYS  31   5.469   6.507  -2.795
  638   1HB   CYS  31          1HB       CYS  31   4.454   8.012  -5.189
  639   2HB   CYS  31          2HB       CYS  31   3.397   7.624  -3.831
  640    H    ASN  32           H        ASN  32   4.667   5.798  -6.277
  641    HA   ASN  32           HA       ASN  32   2.640   4.017  -5.700
  642   1HB   ASN  32          1HB       ASN  32   4.373   4.675  -8.051
  643   2HB   ASN  32          2HB       ASN  32   3.576   3.096  -8.114
  644   1HD2  ASN  32          1HD2      ASN  32   2.650   6.272  -6.794
  645   2HD2  ASN  32          2HD2      ASN  32   1.171   6.456  -7.678
  646    H    ASN  33           H        ASN  33   6.026   3.818  -5.179
  647    HA   ASN  33           HA       ASN  33   6.123   0.962  -5.568
  648   1HB   ASN  33          1HB       ASN  33   8.013   2.631  -6.192
  649   2HB   ASN  33          2HB       ASN  33   8.341   2.741  -4.455
  650   1HD2  ASN  33          1HD2      ASN  33  10.438   1.946  -5.422
  651   2HD2  ASN  33          2HD2      ASN  33  10.696   0.234  -5.476
  652    H    ARG  34           H        ARG  34   5.839   3.490  -3.100
  653    HA   ARG  34           HA       ARG  34   6.522   1.689  -0.983
  654   1HB   ARG  34          1HB       ARG  34   5.304   4.465  -0.711
  655   2HB   ARG  34          2HB       ARG  34   6.303   3.607   0.475
  656   1HG   ARG  34          1HG       ARG  34   7.832   3.740  -1.917
  657   2HG   ARG  34          2HG       ARG  34   7.119   5.350  -1.709
  658   1HD   ARG  34          1HD       ARG  34   8.399   5.795   0.129
  659   2HD   ARG  34          2HD       ARG  34   8.207   4.166   0.790
  660    HE   ARG  34           HE       ARG  34   9.950   4.411  -1.586
  661   1HH1  ARG  34          1HH1      ARG  34   9.746   4.229   1.922
  662   2HH1  ARG  34          2HH1      ARG  34  11.399   3.755   2.121
  663   1HH2  ARG  34          1HH2      ARG  34  12.132   3.785  -1.324
  664   2HH2  ARG  34          2HH2      ARG  34  12.765   3.501   0.262
  665    H    GLY  35           H        GLY  35   3.694   2.892  -2.709
  666   1HA   GLY  35          1HA       GLY  35   1.731   1.448  -2.492
  667   2HA   GLY  35          2HA       GLY  35   1.941   1.525  -0.754
  668    H    CYS  36           H        CYS  36   2.623   4.387  -2.742
  669    HA   CYS  36           HA       CYS  36   0.094   5.529  -1.798
  670   1HB   CYS  36          1HB       CYS  36   2.734   6.970  -2.070
  671   2HB   CYS  36          2HB       CYS  36   1.207   7.670  -1.526
  672    H    CYS  37           H        CYS  37  -0.248   7.726  -3.219
  673    HA   CYS  37           HA       CYS  37   0.331   6.966  -5.991
  674   1HB   CYS  37          1HB       CYS  37  -2.090   6.773  -5.083
  675   2HB   CYS  37          2HB       CYS  37  -2.108   8.535  -5.215
  676    H    PHE  38           H        PHE  38   1.417   8.536  -7.160
  677    HA   PHE  38           HA       PHE  38   1.941  11.035  -5.779
  678   1HB   PHE  38          1HB       PHE  38   3.732   9.557  -6.819
  679   2HB   PHE  38          2HB       PHE  38   2.974   9.788  -8.397
  680    HD1  PHE  38           HD1      PHE  38   3.410  11.741  -9.671
  681    HD2  PHE  38           HD2      PHE  38   4.794  11.488  -5.668
  682    HE1  PHE  38           HE1      PHE  38   4.819  13.788 -10.030
  683    HE2  PHE  38           HE2      PHE  38   6.201  13.535  -6.025
  684    HZ   PHE  38           HZ       PHE  38   6.198  14.660  -8.202
  685    H    ASP  39           H        ASP  39   0.822  12.866  -6.233
  686    HA   ASP  39           HA       ASP  39  -0.872  12.835  -8.548
  687   1HB   ASP  39          1HB       ASP  39  -1.818  13.658  -6.473
  688   2HB   ASP  39          2HB       ASP  39  -0.482  14.797  -6.246
  689    H    SER  40           H        SER  40   0.906  15.634  -7.087
  690    HA   SER  40           HA       SER  40   2.569  16.860  -7.885
  691   1HB   SER  40          1HB       SER  40   3.015  14.711  -9.437
  692   2HB   SER  40          2HB       SER  40   2.455  15.822 -10.699
  693    HG   SER  40           HG       SER  40   4.151  17.242 -10.205
  694    H    ARG  41           H        ARG  41  -0.556  16.331  -9.246
  695    HA   ARG  41           HA       ARG  41  -0.614  18.359 -11.131
  696   1HB   ARG  41          1HB       ARG  41  -2.861  17.235  -9.396
  697   2HB   ARG  41          2HB       ARG  41  -3.110  18.199 -10.862
  698   1HG   ARG  41          1HG       ARG  41  -1.406  16.238 -11.771
  699   2HG   ARG  41          2HG       ARG  41  -2.333  15.343 -10.555
  700   1HD   ARG  41          1HD       ARG  41  -3.990  15.142 -12.077
  701   2HD   ARG  41          2HD       ARG  41  -4.234  16.893 -11.994
  702    HE   ARG  41           HE       ARG  41  -3.158  17.098 -14.063
  703   1HH1  ARG  41          1HH1      ARG  41  -2.441  13.934 -12.699
  704   2HH1  ARG  41          2HH1      ARG  41  -1.647  13.358 -14.127
  705   1HH2  ARG  41          1HH2      ARG  41  -2.111  16.338 -15.946
  706   2HH2  ARG  41          2HH2      ARG  41  -1.458  14.734 -15.986
  707    H    ILE  42           H        ILE  42  -1.340  18.263  -7.594
  708    HA   ILE  42           HA       ILE  42  -1.410  21.200  -7.652
  709    HB   ILE  42           HB       ILE  42  -2.867  19.597  -5.587
  710   1HG1  ILE  42          1HG1      ILE  42  -3.760  20.136  -8.410
  711   2HG1  ILE  42          2HG1      ILE  42  -3.801  18.613  -7.506
  712   1HG2  ILE  42          1HG2      ILE  42  -2.421  22.115  -5.463
  713   2HG2  ILE  42          2HG2      ILE  42  -3.599  22.266  -6.788
  714   3HG2  ILE  42          3HG2      ILE  42  -4.096  21.561  -5.232
  715   1HD1  ILE  42          1HD1      ILE  42  -5.627  21.008  -7.335
  716   2HD1  ILE  42          2HD1      ILE  42  -6.036  19.276  -7.367
  717   3HD1  ILE  42          3HD1      ILE  42  -5.389  20.010  -5.880
  718    HA   PRO  43           HA       PRO  43   2.077  20.424  -5.107
  719   1HB   PRO  43          1HB       PRO  43   3.094  22.957  -5.203
  720   2HB   PRO  43          2HB       PRO  43   3.467  21.723  -6.405
  721   1HG   PRO  43          1HG       PRO  43   1.646  24.039  -6.566
  722   2HG   PRO  43          2HG       PRO  43   2.380  23.091  -7.910
  723   1HD   PRO  43          1HD       PRO  43  -0.311  23.009  -6.934
  724   2HD   PRO  43          2HD       PRO  43   0.402  21.943  -8.150
  725    H    GLY  44           H        GLY  44  -0.671  22.175  -4.555
  726   1HA   GLY  44          1HA       GLY  44   0.197  23.159  -1.947
  727   2HA   GLY  44          2HA       GLY  44  -1.340  23.442  -2.740
  728    H    VAL  45           H        VAL  45  -0.908  20.223  -3.286
  729    HA   VAL  45           HA       VAL  45  -2.099  19.481  -0.703
  730    HB   VAL  45           HB       VAL  45  -3.706  18.204  -1.752
  731   1HG1  VAL  45          1HG1      VAL  45  -4.906  19.899  -2.571
  732   2HG1  VAL  45          2HG1      VAL  45  -3.421  20.880  -2.571
  733   3HG1  VAL  45          3HG1      VAL  45  -3.894  19.980  -4.033
  734   1HG2  VAL  45          1HG2      VAL  45  -1.698  17.956  -3.898
  735   2HG2  VAL  45          2HG2      VAL  45  -2.904  16.787  -3.311
  736   3HG2  VAL  45          3HG2      VAL  45  -3.381  18.052  -4.469
  737    HA   PRO  46           HA       PRO  46   0.633  16.111  -0.649
  738   1HB   PRO  46          1HB       PRO  46  -0.839  13.849  -0.229
  739   2HB   PRO  46          2HB       PRO  46  -0.451  14.997   1.049
  740   1HG   PRO  46          1HG       PRO  46  -2.971  14.583  -0.427
  741   2HG   PRO  46          2HG       PRO  46  -2.721  15.390   1.164
  742   1HD   PRO  46          1HD       PRO  46  -3.232  16.595  -1.383
  743   2HD   PRO  46          2HD       PRO  46  -2.835  17.435   0.120
  744    H    TRP  47           H        TRP  47   1.965  15.568  -2.246
  745    HA   TRP  47           HA       TRP  47   0.686  14.545  -4.649
  746   1HB   TRP  47          1HB       TRP  47   3.576  14.763  -4.708
  747   2HB   TRP  47          2HB       TRP  47   2.357  15.486  -5.759
  748    HD1  TRP  47           HD1      TRP  47   1.215  17.871  -4.666
  749    HE1  TRP  47           HE1      TRP  47   2.329  19.854  -3.329
  750    HE3  TRP  47           HE3      TRP  47   5.327  15.266  -3.199
  751    HZ2  TRP  47           HZ2      TRP  47   4.752  20.106  -1.841
  752    HZ3  TRP  47           HZ3      TRP  47   7.019  16.455  -1.807
  753    HH2  TRP  47           HH2      TRP  47   6.781  18.791  -1.128
  754    H    CYS  48           H        CYS  48   0.774  13.001  -2.069
  755    HA   CYS  48           HA       CYS  48   1.608  10.552  -3.178
  756   1HB   CYS  48          1HB       CYS  48   3.822  11.508  -2.561
  757   2HB   CYS  48          2HB       CYS  48   3.305  11.525  -0.873
  758    H    PHE  49           H        PHE  49  -0.290   9.559  -2.529
  759    HA   PHE  49           HA       PHE  49  -0.780   9.469   0.335
  760   1HB   PHE  49          1HB       PHE  49  -3.328   9.700  -0.603
  761   2HB   PHE  49          2HB       PHE  49  -2.392  11.124  -0.137
  762    HD1  PHE  49           HD1      PHE  49  -0.910  12.118  -2.104
  763    HD2  PHE  49           HD2      PHE  49  -4.348   9.693  -2.658
  764    HE1  PHE  49           HE1      PHE  49  -1.185  13.039  -4.422
  765    HE2  PHE  49           HE2      PHE  49  -4.623  10.614  -4.976
  766    HZ   PHE  49           HZ       PHE  49  -3.038  12.276  -5.831
  767    H    LYS  50           H        LYS  50  -3.198   8.058   0.296
  768    HA   LYS  50           HA       LYS  50  -2.479   5.687  -1.284
  769   1HB   LYS  50          1HB       LYS  50  -3.959   4.913   1.002
  770   2HB   LYS  50          2HB       LYS  50  -2.274   4.533   0.601
  771   1HG   LYS  50          1HG       LYS  50  -3.000   7.208   1.811
  772   2HG   LYS  50          2HG       LYS  50  -2.831   5.786   2.855
  773   1HD   LYS  50          1HD       LYS  50  -0.739   7.031   1.030
  774   2HD   LYS  50          2HD       LYS  50  -0.686   6.918   2.798
  775   1HE   LYS  50          1HE       LYS  50  -0.343   4.729   0.730
  776   2HE   LYS  50          2HE       LYS  50   0.751   5.172   2.050
  777   1HZ   LYS  50          1HZ       LYS  50  -1.359   4.508   3.421
  778   2HZ   LYS  50          2HZ       LYS  50  -1.660   3.581   2.110
  779   3HZ   LYS  50          3HZ       LYS  50  -0.267   3.393   2.941
  780    HA   PRO  51           HA       PRO  51  -6.643   7.091  -2.392
  781   1HB   PRO  51          1HB       PRO  51  -6.258   7.288  -5.089
  782   2HB   PRO  51          2HB       PRO  51  -6.120   8.661  -3.993
  783   1HG   PRO  51          1HG       PRO  51  -4.015   7.063  -5.304
  784   2HG   PRO  51          2HG       PRO  51  -3.895   8.715  -4.598
  785   1HD   PRO  51          1HD       PRO  51  -2.938   6.243  -3.516
  786   2HD   PRO  51          2HD       PRO  51  -2.937   7.818  -2.711
  787    H    LEU  52           H        LEU  52  -5.743   5.612  -5.353
  788    HA   LEU  52           HA       LEU  52  -7.440   3.364  -4.602
  789   1HB   LEU  52          1HB       LEU  52  -8.056   3.227  -6.734
  790   2HB   LEU  52          2HB       LEU  52  -7.544   4.924  -6.760
  791    HG   LEU  52           HG       LEU  52  -6.203   2.493  -7.914
  792   1HD1  LEU  52          1HD1      LEU  52  -7.398   5.013  -8.907
  793   2HD1  LEU  52          2HD1      LEU  52  -5.910   4.476  -9.723
  794   3HD1  LEU  52          3HD1      LEU  52  -7.325   3.397  -9.650
  795   1HD2  LEU  52          1HD2      LEU  52  -4.156   3.186  -7.430
  796   2HD2  LEU  52          2HD2      LEU  52  -4.484   4.731  -8.251
  797   3HD2  LEU  52          3HD2      LEU  52  -4.820   4.559  -6.511
  798    H    GLN  53           H        GLN  53  -4.886   3.515  -3.331
  799    HA   GLN  53           HA       GLN  53  -2.881   2.214  -4.654
  800   1HB   GLN  53          1HB       GLN  53  -3.645   2.157  -1.710
  801   2HB   GLN  53          2HB       GLN  53  -2.096   1.563  -2.337
  802   1HG   GLN  53          1HG       GLN  53  -3.185   4.400  -2.587
  803   2HG   GLN  53          2HG       GLN  53  -1.886   3.885  -1.500
  804   1HE2  GLN  53          1HE2      GLN  53  -0.431   2.205  -3.053
  805   2HE2  GLN  53          2HE2      GLN  53   0.288   3.041  -4.389
  806    H    GLU  54           H        GLU  54  -5.980   1.025  -3.676
  807    HA   GLU  54           HA       GLU  54  -5.544  -1.530  -2.961
  808   1HB   GLU  54          1HB       GLU  54  -7.764  -2.004  -3.711
  809   2HB   GLU  54          2HB       GLU  54  -7.763  -0.305  -3.209
  810   1HG   GLU  54          1HG       GLU  54  -7.530   0.402  -5.555
  811   2HG   GLU  54          2HG       GLU  54  -7.440  -1.285  -6.085
  812    H    ALA  55           H        ALA  55  -4.775  -0.023  -6.010
  813    HA   ALA  55           HA       ALA  55  -5.010  -1.811  -7.939
  814   1HB   ALA  55          1HB       ALA  55  -3.602  -0.345  -8.892
  815   2HB   ALA  55          2HB       ALA  55  -3.223   0.322  -7.285
  816   3HB   ALA  55          3HB       ALA  55  -2.247  -1.011  -7.947
  817    H    GLU  56           H        GLU  56  -2.141  -1.909  -5.697
  818    HA   GLU  56           HA       GLU  56  -2.390  -4.782  -5.694
  819   1HB   GLU  56          1HB       GLU  56  -0.741  -3.753  -7.552
  820   2HB   GLU  56          2HB       GLU  56   0.383  -3.747  -6.182
  821   1HG   GLU  56          1HG       GLU  56   0.732  -5.947  -6.509
  822   2HG   GLU  56          2HG       GLU  56  -0.968  -6.264  -6.128
  823    H    CYS  57           H        CYS  57  -2.697  -2.385  -3.828
  824    HA   CYS  57           HA       CYS  57  -0.543  -2.979  -1.952
  825   1HB   CYS  57          1HB       CYS  57  -1.523  -0.587  -2.747
  826   2HB   CYS  57          2HB       CYS  57  -2.504  -0.865  -1.305
  827    H    THR  58           H        THR  58  -4.152  -2.563  -2.175
  828    HA   THR  58           HA       THR  58  -4.681  -3.624   0.376
  829    HB   THR  58           HB       THR  58  -6.133  -2.157  -1.226
  830    HG1  THR  58           HG1      THR  58  -7.934  -3.092  -0.097
  831   1HG2  THR  58          1HG2      THR  58  -6.721  -4.985  -2.245
  832   2HG2  THR  58          2HG2      THR  58  -7.814  -3.601  -2.484
  833   3HG2  THR  58          3HG2      THR  58  -6.194  -3.593  -3.221
  834    H    PHE  59           H        PHE  59  -4.429  -5.132  -2.878
  835    HA   PHE  59           HA       PHE  59  -5.456  -7.526  -2.608
  836   1HB   PHE  59          1HB       PHE  59  -3.213  -6.280  -3.929
  837   2HB   PHE  59          2HB       PHE  59  -2.642  -7.853  -3.361
  838    HD1  PHE  59           HD1      PHE  59  -5.712  -6.475  -5.003
  839    HD2  PHE  59           HD2      PHE  59  -2.774  -9.536  -4.914
  840    HE1  PHE  59           HE1      PHE  59  -6.789  -7.566  -6.989
  841    HE2  PHE  59           HE2      PHE  59  -3.852 -10.628  -6.901
  842    HZ   PHE  59           HZ       PHE  59  -5.847  -9.630  -7.915
  Start of MODEL   13
    1   1H    GLU   1           H1       GLU   1 -16.705  -6.838  -4.767
    2    HA   GLU   1           HA       GLU   1 -16.295  -6.325  -2.652
    3   1HB   GLU   1          1HB       GLU   1 -18.990  -7.578  -2.223
    4   2HB   GLU   1          2HB       GLU   1 -17.923  -7.395  -0.820
    5   1HG   GLU   1          1HG       GLU   1 -18.813  -5.306  -0.693
    6   2HG   GLU   1          2HG       GLU   1 -17.702  -4.913  -2.014
    7    H    GLU   2           H        GLU   2 -15.270  -8.524  -4.206
    8    HA   GLU   2           HA       GLU   2 -15.142 -10.745  -2.397
    9   1HB   GLU   2          1HB       GLU   2 -15.126 -10.621  -5.087
   10   2HB   GLU   2          2HB       GLU   2 -13.376 -10.605  -4.815
   11   1HG   GLU   2          1HG       GLU   2 -13.423 -12.712  -3.717
   12   2HG   GLU   2          2HG       GLU   2 -15.171 -12.643  -3.451
   13    H    TYR   3           H        TYR   3 -14.176  -8.503  -1.092
   14    HA   TYR   3           HA       TYR   3 -11.290  -8.475  -1.405
   15   1HB   TYR   3          1HB       TYR   3 -11.829  -6.852   0.685
   16   2HB   TYR   3          2HB       TYR   3 -12.197  -6.314  -0.957
   17    HD1  TYR   3           HD1      TYR   3 -14.130  -5.028  -0.896
   18    HD2  TYR   3           HD2      TYR   3 -13.979  -8.637   1.396
   19    HE1  TYR   3           HE1      TYR   3 -16.562  -4.712  -0.225
   20    HE2  TYR   3           HE2      TYR   3 -16.411  -8.310   2.059
   21    HH   TYR   3           HH       TYR   3 -18.099  -5.353   1.315
   22    H    VAL   4           H        VAL   4 -11.452 -10.947  -0.782
   23    HA   VAL   4           HA       VAL   4 -11.130 -11.058   2.136
   24    HB   VAL   4           HB       VAL   4 -12.387 -13.128   0.323
   25   1HG1  VAL   4          1HG1      VAL   4 -11.110 -14.221   2.068
   26   2HG1  VAL   4          2HG1      VAL   4 -11.836 -13.172   3.309
   27   3HG1  VAL   4          3HG1      VAL   4 -12.844 -14.355   2.441
   28   1HG2  VAL   4          1HG2      VAL   4 -14.469 -12.602   1.255
   29   2HG2  VAL   4          2HG2      VAL   4 -13.745 -11.718   2.620
   30   3HG2  VAL   4          3HG2      VAL   4 -13.719 -11.010   0.987
   31    H    GLY   5           H        GLY   5 -10.386 -12.607  -1.059
   32   1HA   GLY   5          1HA       GLY   5  -8.145 -14.054  -0.065
   33   2HA   GLY   5          2HA       GLY   5  -8.582 -13.779  -1.739
   34    H    LEU   6           H        LEU   6  -8.570 -10.752  -0.244
   35    HA   LEU   6           HA       LEU   6  -5.701 -10.369  -0.637
   36   1HB   LEU   6          1HB       LEU   6  -7.520  -8.303  -1.733
   37   2HB   LEU   6          2HB       LEU   6  -5.882  -8.764  -2.229
   38    HG   LEU   6           HG       LEU   6  -7.452  -9.274  -3.985
   39   1HD1  LEU   6          1HD1      LEU   6  -5.673 -11.118  -2.849
   40   2HD1  LEU   6          2HD1      LEU   6  -7.134 -12.053  -3.250
   41   3HD1  LEU   6          3HD1      LEU   6  -6.311 -11.104  -4.512
   42   1HD2  LEU   6          1HD2      LEU   6  -9.262  -9.786  -1.957
   43   2HD2  LEU   6          2HD2      LEU   6  -9.516 -10.065  -3.697
   44   3HD2  LEU   6          3HD2      LEU   6  -8.957 -11.395  -2.655
   45    H    SER   7           H        SER   7  -8.083 -10.434   1.503
   46    HA   SER   7           HA       SER   7  -7.311  -7.887   2.698
   47   1HB   SER   7          1HB       SER   7  -9.805  -8.471   2.100
   48   2HB   SER   7          2HB       SER   7  -9.745  -9.457   3.571
   49    HG   SER   7           HG       SER   7 -10.065  -7.653   4.661
   50    H    ALA   8           H        ALA   8  -8.505  -8.729   5.318
   51    HA   ALA   8           HA       ALA   8  -6.316  -9.622   6.628
   52   1HB   ALA   8          1HB       ALA   8  -9.283  -9.910   7.159
   53   2HB   ALA   8          2HB       ALA   8  -8.073 -10.511   8.318
   54   3HB   ALA   8          3HB       ALA   8  -8.119  -8.783   7.896
   55    H    ASN   9           H        ASN   9  -5.434 -11.625   7.270
   56    HA   ASN   9           HA       ASN   9  -5.358 -13.857   7.427
   57   1HB   ASN   9          1HB       ASN   9  -7.890 -13.863   6.676
   58   2HB   ASN   9          2HB       ASN   9  -7.246 -14.241   5.071
   59   1HD2  ASN   9          1HD2      ASN   9  -5.599 -16.030   5.037
   60   2HD2  ASN   9          2HD2      ASN   9  -5.919 -17.442   5.988
   61    H    GLN  10           H        GLN  10  -5.597 -12.047   4.356
   62    HA   GLN  10           HA       GLN  10  -4.232 -13.791   2.720
   63   1HB   GLN  10          1HB       GLN  10  -5.526 -11.643   2.145
   64   2HB   GLN  10          2HB       GLN  10  -4.033 -10.764   2.523
   65   1HG   GLN  10          1HG       GLN  10  -3.629 -13.091   0.748
   66   2HG   GLN  10          2HG       GLN  10  -4.697 -11.864   0.051
   67   1HE2  GLN  10          1HE2      GLN  10  -3.927  -9.858  -0.453
   68   2HE2  GLN  10          2HE2      GLN  10  -2.246  -9.441  -0.482
   69    H    CYS  11           H        CYS  11  -3.090 -11.391   5.115
   70    HA   CYS  11           HA       CYS  11  -0.402 -11.440   4.279
   71   1HB   CYS  11          1HB       CYS  11  -1.259  -9.593   5.542
   72   2HB   CYS  11          2HB       CYS  11  -1.687 -10.641   6.896
   73    H    ALA  12           H        ALA  12  -2.362 -13.882   5.423
   74    HA   ALA  12           HA       ALA  12  -0.217 -15.123   6.993
   75   1HB   ALA  12          1HB       ALA  12  -2.955 -16.306   6.860
   76   2HB   ALA  12          2HB       ALA  12  -1.842 -16.151   8.241
   77   3HB   ALA  12          3HB       ALA  12  -2.797 -14.747   7.703
   78    H    VAL  13           H        VAL  13  -0.914 -14.804   3.876
   79    HA   VAL  13           HA       VAL  13  -1.554 -17.176   2.758
   80    HB   VAL  13           HB       VAL  13  -0.487 -14.760   1.952
   81   1HG1  VAL  13          1HG1      VAL  13   1.404 -16.978   1.096
   82   2HG1  VAL  13          2HG1      VAL  13   1.388 -15.319   0.454
   83   3HG1  VAL  13          3HG1      VAL  13   1.801 -15.608   2.161
   84   1HG2  VAL  13          1HG2      VAL  13  -1.820 -17.039   0.814
   85   2HG2  VAL  13          2HG2      VAL  13  -1.839 -15.342   0.279
   86   3HG2  VAL  13          3HG2      VAL  13  -0.586 -16.452  -0.327
   87    HA   PRO  14           HA       PRO  14   1.612 -20.006   3.567
   88   1HB   PRO  14          1HB       PRO  14   1.923 -21.370   1.220
   89   2HB   PRO  14          2HB       PRO  14   0.602 -21.676   2.345
   90   1HG   PRO  14          1HG       PRO  14   0.610 -20.218  -0.220
   91   2HG   PRO  14          2HG       PRO  14  -0.788 -20.932   0.662
   92   1HD   PRO  14          1HD       PRO  14  -0.031 -18.177   0.457
   93   2HD   PRO  14          2HD       PRO  14  -1.321 -18.844   1.465
   94    H    ALA  15           H        ALA  15   2.452 -17.320   2.702
   95    HA   ALA  15           HA       ALA  15   4.269 -16.275   1.935
   96   1HB   ALA  15          1HB       ALA  15   4.860 -17.885   4.087
   97   2HB   ALA  15          2HB       ALA  15   6.115 -18.366   2.919
   98   3HB   ALA  15          3HB       ALA  15   5.955 -16.660   3.403
   99    H    LYS  16           H        LYS  16   3.198 -17.372  -0.233
  100    HA   LYS  16           HA       LYS  16   5.440 -17.898  -1.862
  101   1HB   LYS  16          1HB       LYS  16   4.632 -20.173  -2.634
  102   2HB   LYS  16          2HB       LYS  16   5.464 -20.116  -1.071
  103   1HG   LYS  16          1HG       LYS  16   3.668 -21.098  -0.135
  104   2HG   LYS  16          2HG       LYS  16   2.697 -19.670  -0.535
  105   1HD   LYS  16          1HD       LYS  16   1.554 -21.489  -1.541
  106   2HD   LYS  16          2HD       LYS  16   2.432 -20.736  -2.885
  107   1HE   LYS  16          1HE       LYS  16   4.131 -22.440  -2.832
  108   2HE   LYS  16          2HE       LYS  16   3.553 -23.077  -1.285
  109   1HZ   LYS  16          1HZ       LYS  16   1.554 -23.761  -2.378
  110   2HZ   LYS  16          2HZ       LYS  16   2.025 -23.101  -3.795
  111   3HZ   LYS  16          3HZ       LYS  16   2.833 -24.382  -3.182
  112    H    ASP  17           H        ASP  17   3.153 -16.050  -1.529
  113    HA   ASP  17           HA       ASP  17   2.289 -16.195  -4.242
  114   1HB   ASP  17          1HB       ASP  17   0.614 -17.555  -2.862
  115   2HB   ASP  17          2HB       ASP  17   0.183 -16.046  -2.040
  116    H    ARG  18           H        ARG  18   3.782 -14.538  -2.040
  117    HA   ARG  18           HA       ARG  18   2.124 -12.210  -1.875
  118   1HB   ARG  18          1HB       ARG  18   5.000 -12.681  -0.961
  119   2HB   ARG  18          2HB       ARG  18   4.009 -11.278  -0.524
  120   1HG   ARG  18          1HG       ARG  18   2.767 -12.469   0.992
  121   2HG   ARG  18          2HG       ARG  18   2.810 -13.959   0.036
  122   1HD   ARG  18          1HD       ARG  18   5.005 -14.506   0.822
  123   2HD   ARG  18          2HD       ARG  18   5.272 -12.880   1.472
  124    HE   ARG  18           HE       ARG  18   2.978 -14.264   2.657
  125   1HH1  ARG  18          1HH1      ARG  18   6.458 -13.779   2.846
  126   2HH1  ARG  18          2HH1      ARG  18   6.558 -14.219   4.518
  127   1HH2  ARG  18          1HH2      ARG  18   3.108 -14.844   4.863
  128   2HH2  ARG  18          2HH2      ARG  18   4.639 -14.830   5.673
  129    H    VAL  19           H        VAL  19   3.466  -9.996  -2.295
  130    HA   VAL  19           HA       VAL  19   4.515 -10.270  -5.015
  131    HB   VAL  19           HB       VAL  19   3.481  -7.830  -3.559
  132   1HG1  VAL  19          1HG1      VAL  19   4.728  -8.284  -6.190
  133   2HG1  VAL  19          2HG1      VAL  19   3.198  -7.377  -6.254
  134   3HG1  VAL  19          3HG1      VAL  19   4.541  -6.785  -5.248
  135   1HG2  VAL  19          1HG2      VAL  19   2.088 -10.006  -5.008
  136   2HG2  VAL  19          2HG2      VAL  19   1.486  -8.873  -3.774
  137   3HG2  VAL  19          3HG2      VAL  19   1.618  -8.353  -5.471
  138    H    ASP  20           H        ASP  20   5.920 -10.756  -2.302
  139    HA   ASP  20           HA       ASP  20   7.679 -10.008  -1.168
  140   1HB   ASP  20          1HB       ASP  20   8.875 -11.395  -2.594
  141   2HB   ASP  20          2HB       ASP  20   8.445 -10.469  -4.040
  142    H    CYS  21           H        CYS  21   7.055  -7.825  -0.491
  143    HA   CYS  21           HA       CYS  21   7.015  -5.584  -2.007
  144   1HB   CYS  21          1HB       CYS  21   6.697  -6.144   0.622
  145   2HB   CYS  21          2HB       CYS  21   8.207  -5.228   0.673
  146    H    GLY  22           H        GLY  22   9.798  -7.389  -0.664
  147   1HA   GLY  22          1HA       GLY  22  12.027  -7.103  -0.849
  148   2HA   GLY  22          2HA       GLY  22  11.660  -6.637  -2.499
  149    H    TYR  23           H        TYR  23  11.370  -5.177   0.828
  150    HA   TYR  23           HA       TYR  23  12.043  -2.590  -0.311
  151   1HB   TYR  23          1HB       TYR  23  10.638  -3.803   1.976
  152   2HB   TYR  23          2HB       TYR  23  11.799  -2.606   2.561
  153    HD1  TYR  23           HD1      TYR  23  11.580  -0.222   1.847
  154    HD2  TYR  23           HD2      TYR  23   8.629  -3.156   0.855
  155    HE1  TYR  23           HE1      TYR  23   9.914   1.624   1.311
  156    HE2  TYR  23           HE2      TYR  23   6.973  -1.302   0.323
  157    HH   TYR  23           HH       TYR  23   6.560   0.872   0.596
  158    HA   PRO  24           HA       PRO  24  16.163  -2.817   1.014
  159   1HB   PRO  24          1HB       PRO  24  16.838  -0.174   0.864
  160   2HB   PRO  24          2HB       PRO  24  16.816  -1.245  -0.536
  161   1HG   PRO  24          1HG       PRO  24  14.884   0.821   0.304
  162   2HG   PRO  24          2HG       PRO  24  15.112   0.093  -1.328
  163   1HD   PRO  24          1HD       PRO  24  13.037  -0.419   0.579
  164   2HD   PRO  24          2HD       PRO  24  13.306  -1.277  -0.943
  165    H    HIS  25           H        HIS  25  13.711  -1.481   2.787
  166    HA   HIS  25           HA       HIS  25  15.547  -1.262   5.059
  167   1HB   HIS  25          1HB       HIS  25  14.221   0.849   3.955
  168   2HB   HIS  25          2HB       HIS  25  13.068   0.334   5.191
  169    HD1  HIS  25           HD1      HIS  25  15.388   2.833   4.907
  170    HD2  HIS  25           HD2      HIS  25  15.035  -0.287   7.688
  171    HE1  HIS  25           HE1      HIS  25  16.670   3.579   6.983
  172    HE2  HIS  25           HE2      HIS  25  16.371   1.645   8.677
  173    H    VAL  26           H        VAL  26  13.756  -3.450   3.784
  174    HA   VAL  26           HA       VAL  26  11.484  -3.951   5.131
  175    HB   VAL  26           HB       VAL  26  12.132  -5.441   3.471
  176   1HG1  VAL  26          1HG1      VAL  26  14.263  -5.909   3.004
  177   2HG1  VAL  26          2HG1      VAL  26  14.750  -5.037   4.478
  178   3HG1  VAL  26          3HG1      VAL  26  14.442  -6.789   4.541
  179   1HG2  VAL  26          1HG2      VAL  26  11.234  -6.415   5.786
  180   2HG2  VAL  26          2HG2      VAL  26  11.634  -7.468   4.408
  181   3HG2  VAL  26          3HG2      VAL  26  12.796  -7.266   5.742
  182    H    THR  27           H        THR  27  10.848  -4.233   7.214
  183    HA   THR  27           HA       THR  27  12.537  -5.461   9.141
  184    HB   THR  27           HB       THR  27  12.742  -2.566   8.739
  185    HG1  THR  27           HG1      THR  27  13.781  -4.674  10.490
  186   1HG2  THR  27          1HG2      THR  27  10.962  -3.073  10.796
  187   2HG2  THR  27          2HG2      THR  27  12.520  -3.201  11.647
  188   3HG2  THR  27          3HG2      THR  27  12.098  -1.703  10.783
  189    HA   PRO  28           HA       PRO  28   8.672  -6.083  10.893
  190   1HB   PRO  28          1HB       PRO  28   9.327  -6.734  13.464
  191   2HB   PRO  28          2HB       PRO  28   9.436  -7.874  12.124
  192   1HG   PRO  28          1HG       PRO  28  11.563  -6.387  13.527
  193   2HG   PRO  28          2HG       PRO  28  11.708  -7.872  12.519
  194   1HD   PRO  28          1HD       PRO  28  12.416  -5.181  11.838
  195   2HD   PRO  28          2HD       PRO  28  12.428  -6.581  10.758
  196    H    LYS  29           H        LYS  29   8.920  -3.473  10.474
  197    HA   LYS  29           HA       LYS  29   7.176  -2.395  12.296
  198   1HB   LYS  29          1HB       LYS  29   9.466  -2.720  13.655
  199   2HB   LYS  29          2HB       LYS  29   9.774  -1.116  12.966
  200   1HG   LYS  29          1HG       LYS  29   8.442  -0.218  14.540
  201   2HG   LYS  29          2HG       LYS  29   7.065  -1.126  13.890
  202   1HD   LYS  29          1HD       LYS  29   7.061  -2.002  16.011
  203   2HD   LYS  29          2HD       LYS  29   8.260  -3.104  15.313
  204   1HE   LYS  29          1HE       LYS  29   9.544  -0.651  16.193
  205   2HE   LYS  29          2HE       LYS  29   8.593  -1.331  17.521
  206   1HZ   LYS  29          1HZ       LYS  29  10.949  -2.337  16.266
  207   2HZ   LYS  29          2HZ       LYS  29  10.367  -2.618  17.765
  208   3HZ   LYS  29          3HZ       LYS  29   9.800  -3.474  16.495
  209    H    GLU  30           H        GLU  30   9.631  -2.226   9.821
  210    HA   GLU  30           HA       GLU  30   8.829   0.470   9.147
  211   1HB   GLU  30          1HB       GLU  30  11.222  -1.094   8.850
  212   2HB   GLU  30          2HB       GLU  30  10.687  -0.589   7.237
  213   1HG   GLU  30          1HG       GLU  30  12.220   1.061   8.310
  214   2HG   GLU  30          2HG       GLU  30  10.631   1.760   7.960
  215    H    CYS  31           H        CYS  31   8.855  -2.895   7.841
  216    HA   CYS  31           HA       CYS  31   7.835  -2.349   5.347
  217   1HB   CYS  31          1HB       CYS  31   7.676  -4.735   7.158
  218   2HB   CYS  31          2HB       CYS  31   6.841  -4.730   5.603
  219    H    ASN  32           H        ASN  32   6.134  -3.166   8.457
  220    HA   ASN  32           HA       ASN  32   3.587  -2.910   7.369
  221   1HB   ASN  32          1HB       ASN  32   4.820  -3.150  10.066
  222   2HB   ASN  32          2HB       ASN  32   3.251  -2.333  10.065
  223   1HD2  ASN  32          1HD2      ASN  32   4.799  -5.055   8.355
  224   2HD2  ASN  32          2HD2      ASN  32   3.530  -6.211   8.591
  225    H    ASN  33           H        ASN  33   5.998  -0.606   7.777
  226    HA   ASN  33           HA       ASN  33   4.164   1.492   8.573
  227   1HB   ASN  33          1HB       ASN  33   6.663   1.091   9.434
  228   2HB   ASN  33          2HB       ASN  33   7.093   1.967   7.958
  229   1HD2  ASN  33          1HD2      ASN  33   7.977   3.411   9.668
  230   2HD2  ASN  33          2HD2      ASN  33   6.959   4.664  10.297
  231    H    ARG  34           H        ARG  34   6.192   0.218   5.914
  232    HA   ARG  34           HA       ARG  34   5.849   2.531   4.310
  233   1HB   ARG  34          1HB       ARG  34   6.676  -0.209   3.295
  234   2HB   ARG  34          2HB       ARG  34   7.184   1.378   2.689
  235   1HG   ARG  34          1HG       ARG  34   7.920   1.278   5.436
  236   2HG   ARG  34          2HG       ARG  34   8.399  -0.281   4.743
  237   1HD   ARG  34          1HD       ARG  34  10.063   0.666   3.511
  238   2HD   ARG  34          2HD       ARG  34   9.049   2.025   3.004
  239    HE   ARG  34           HE       ARG  34   9.678   2.345   5.769
  240   1HH1  ARG  34          1HH1      ARG  34  11.282   2.414   2.638
  241   2HH1  ARG  34          2HH1      ARG  34  12.516   3.515   3.151
  242   1HH2  ARG  34          1HH2      ARG  34  11.305   3.799   6.447
  243   2HH2  ARG  34          2HH2      ARG  34  12.530   4.308   5.333
  244    H    GLY  35           H        GLY  35   4.105  -0.442   4.974
  245   1HA   GLY  35          1HA       GLY  35   1.757  -0.370   4.297
  246   2HA   GLY  35          2HA       GLY  35   2.292   0.121   2.703
  247    H    CYS  36           H        CYS  36   4.195  -2.235   4.554
  248    HA   CYS  36           HA       CYS  36   3.192  -4.308   2.741
  249   1HB   CYS  36          1HB       CYS  36   5.966  -4.143   3.916
  250   2HB   CYS  36          2HB       CYS  36   5.375  -5.306   2.726
  251    H    CYS  37           H        CYS  37   4.082  -6.592   3.889
  252    HA   CYS  37           HA       CYS  37   3.280  -6.390   6.698
  253   1HB   CYS  37          1HB       CYS  37   1.532  -7.305   5.025
  254   2HB   CYS  37          2HB       CYS  37   2.536  -8.758   5.005
  255    H    PHE  38           H        PHE  38   4.850  -7.235   8.032
  256    HA   PHE  38           HA       PHE  38   7.047  -8.635   6.783
  257   1HB   PHE  38          1HB       PHE  38   7.269  -6.757   8.482
  258   2HB   PHE  38          2HB       PHE  38   6.437  -7.763   9.672
  259    HD1  PHE  38           HD1      PHE  38   7.622  -9.407  10.901
  260    HD2  PHE  38           HD2      PHE  38   9.517  -7.435   7.655
  261    HE1  PHE  38           HE1      PHE  38   9.831 -10.369  11.605
  262    HE2  PHE  38           HE2      PHE  38  11.726  -8.397   8.361
  263    HZ   PHE  38           HZ       PHE  38  11.856  -9.853  10.327
  264    H    ASP  39           H        ASP  39   7.234 -10.823   6.727
  265    HA   ASP  39           HA       ASP  39   5.339 -12.333   8.267
  266   1HB   ASP  39          1HB       ASP  39   5.585 -13.049   6.004
  267   2HB   ASP  39          2HB       ASP  39   7.352 -12.993   6.085
  268    H    SER  40           H        SER  40   8.712 -13.283   7.382
  269    HA   SER  40           HA       SER  40  10.520 -13.507   8.661
  270   1HB   SER  40          1HB       SER  40   9.255 -11.944  10.373
  271   2HB   SER  40          2HB       SER  40   8.979 -13.455  11.258
  272    HG   SER  40           HG       SER  40  10.936 -13.109  12.050
  273    H    ARG  41           H        ARG  41   7.465 -15.150   8.935
  274    HA   ARG  41           HA       ARG  41   8.140 -17.289  10.498
  275   1HB   ARG  41          1HB       ARG  41   6.331 -17.220   8.038
  276   2HB   ARG  41          2HB       ARG  41   6.299 -18.485   9.278
  277   1HG   ARG  41          1HG       ARG  41   5.948 -16.462  10.930
  278   2HG   ARG  41          2HG       ARG  41   5.442 -15.587   9.474
  279   1HD   ARG  41          1HD       ARG  41   4.251 -18.173  10.568
  280   2HD   ARG  41          2HD       ARG  41   3.477 -16.581  10.569
  281    HE   ARG  41           HE       ARG  41   4.218 -17.297   7.887
  282   1HH1  ARG  41          1HH1      ARG  41   1.889 -18.139  10.387
  283   2HH1  ARG  41          2HH1      ARG  41   0.684 -18.673   9.263
  284   1HH2  ARG  41          1HH2      ARG  41   2.630 -18.002   6.404
  285   2HH2  ARG  41          2HH2      ARG  41   1.109 -18.595   6.982
  286    H    ILE  42           H        ILE  42   8.530 -16.759   6.937
  287    HA   ILE  42           HA       ILE  42  10.322 -19.087   6.914
  288    HB   ILE  42           HB       ILE  42   8.950 -18.235   4.423
  289   1HG1  ILE  42          1HG1      ILE  42   7.562 -19.679   6.686
  290   2HG1  ILE  42          2HG1      ILE  42   7.070 -18.163   5.911
  291   1HG2  ILE  42          1HG2      ILE  42   9.128 -20.538   3.856
  292   2HG2  ILE  42          2HG2      ILE  42  10.680 -20.056   4.581
  293   3HG2  ILE  42          3HG2      ILE  42   9.507 -20.993   5.535
  294   1HD1  ILE  42          1HD1      ILE  42   7.205 -19.831   3.737
  295   2HD1  ILE  42          2HD1      ILE  42   6.728 -20.981   5.009
  296   3HD1  ILE  42          3HD1      ILE  42   5.721 -19.550   4.680
  297    HA   PRO  43           HA       PRO  43  13.092 -15.872   5.837
  298   1HB   PRO  43          1HB       PRO  43  15.386 -17.320   6.149
  299   2HB   PRO  43          2HB       PRO  43  14.598 -16.467   7.474
  300   1HG   PRO  43          1HG       PRO  43  14.628 -19.343   6.819
  301   2HG   PRO  43          2HG       PRO  43  14.247 -18.553   8.392
  302   1HD   PRO  43          1HD       PRO  43  12.439 -19.725   6.505
  303   2HD   PRO  43          2HD       PRO  43  12.005 -18.818   7.959
  304    H    GLY  44           H        GLY  44  12.236 -18.602   4.202
  305   1HA   GLY  44          1HA       GLY  44  14.149 -18.154   2.031
  306   2HA   GLY  44          2HA       GLY  44  13.035 -19.494   2.207
  307    H    VAL  45           H        VAL  45  11.183 -16.882   3.072
  308    HA   VAL  45           HA       VAL  45  10.386 -16.380   0.287
  309    HB   VAL  45           HB       VAL  45   8.168 -16.597   0.827
  310   1HG1  VAL  45          1HG1      VAL  45   7.917 -18.660   2.265
  311   2HG1  VAL  45          2HG1      VAL  45   9.095 -18.798   0.937
  312   3HG1  VAL  45          3HG1      VAL  45   9.660 -18.547   2.606
  313   1HG2  VAL  45          1HG2      VAL  45   7.389 -15.463   2.587
  314   2HG2  VAL  45          2HG2      VAL  45   7.860 -16.843   3.607
  315   3HG2  VAL  45          3HG2      VAL  45   8.983 -15.481   3.380
  316    HA   PRO  46           HA       PRO  46  10.355 -12.153   1.262
  317   1HB   PRO  46          1HB       PRO  46   7.928 -11.142   0.516
  318   2HB   PRO  46          2HB       PRO  46   9.212 -11.515  -0.632
  319   1HG   PRO  46          1HG       PRO  46   6.739 -12.997  -0.002
  320   2HG   PRO  46          2HG       PRO  46   7.773 -13.111  -1.472
  321   1HD   PRO  46          1HD       PRO  46   7.589 -14.943   0.722
  322   2HD   PRO  46          2HD       PRO  46   8.737 -15.017  -0.622
  323    H    TRP  47           H        TRP  47  10.686 -11.364   3.234
  324    HA   TRP  47           HA       TRP  47   8.559 -11.848   5.154
  325   1HB   TRP  47          1HB       TRP  47  10.875 -10.382   6.109
  326   2HB   TRP  47          2HB       TRP  47  10.158 -11.887   6.690
  327    HD1  TRP  47           HD1      TRP  47  11.071 -14.195   5.382
  328    HE1  TRP  47           HE1      TRP  47  13.394 -14.815   4.293
  329    HE3  TRP  47           HE3      TRP  47  12.727  -9.410   4.923
  330    HZ2  TRP  47           HZ2      TRP  47  15.613 -13.269   3.383
  331    HZ3  TRP  47           HZ3      TRP  47  14.983  -9.052   3.925
  332    HH2  TRP  47           HH2      TRP  47  16.410 -10.886   3.167
  333    H    CYS  48           H        CYS  48   8.211  -9.986   2.834
  334    HA   CYS  48           HA       CYS  48   7.102  -7.845   4.273
  335   1HB   CYS  48          1HB       CYS  48   9.476  -7.159   4.363
  336   2HB   CYS  48          2HB       CYS  48   9.513  -7.118   2.598
  337    H    PHE  49           H        PHE  49   5.202  -7.862   3.108
  338    HA   PHE  49           HA       PHE  49   5.409  -7.460   0.243
  339   1HB   PHE  49          1HB       PHE  49   3.389  -9.276   0.310
  340   2HB   PHE  49          2HB       PHE  49   5.067  -9.792   0.117
  341    HD1  PHE  49           HD1      PHE  49   6.337 -10.258   2.373
  342    HD2  PHE  49           HD2      PHE  49   2.113 -10.229   1.971
  343    HE1  PHE  49           HE1      PHE  49   6.131 -11.659   4.445
  344    HE2  PHE  49           HE2      PHE  49   1.906 -11.630   4.043
  345    HZ   PHE  49           HZ       PHE  49   3.917 -12.329   5.255
  346    H    LYS  50           H        LYS  50   2.736  -7.625  -0.454
  347    HA   LYS  50           HA       LYS  50   1.472  -5.754   1.425
  348   1HB   LYS  50          1HB       LYS  50   0.372  -5.101  -0.972
  349   2HB   LYS  50          2HB       LYS  50   1.735  -4.252  -0.222
  350   1HG   LYS  50          1HG       LYS  50   2.348  -6.689  -1.856
  351   2HG   LYS  50          2HG       LYS  50   1.834  -5.241  -2.740
  352   1HD   LYS  50          1HD       LYS  50   4.203  -5.556  -0.861
  353   2HD   LYS  50          2HD       LYS  50   4.247  -5.172  -2.591
  354   1HE   LYS  50          1HE       LYS  50   3.480  -3.424  -0.251
  355   2HE   LYS  50          2HE       LYS  50   4.592  -3.067  -1.581
  356   1HZ   LYS  50          1HZ       LYS  50   2.301  -3.413  -2.859
  357   2HZ   LYS  50          2HZ       LYS  50   1.741  -2.799  -1.453
  358   3HZ   LYS  50          3HZ       LYS  50   2.829  -1.959  -2.336
  359    HA   PRO  51           HA       PRO  51  -1.158  -9.391   0.884
  360   1HB   PRO  51          1HB       PRO  51  -1.510  -9.972   3.528
  361   2HB   PRO  51          2HB       PRO  51  -0.279 -10.741   2.529
  362   1HG   PRO  51          1HG       PRO  51  -0.019  -8.611   4.554
  363   2HG   PRO  51          2HG       PRO  51   1.256  -9.705   3.906
  364   1HD   PRO  51          1HD       PRO  51   0.806  -6.942   3.304
  365   2HD   PRO  51          2HD       PRO  51   1.972  -8.017   2.520
  366    H    LEU  52           H        LEU  52  -2.229  -8.462   3.994
  367    HA   LEU  52           HA       LEU  52  -4.619  -7.389   2.723
  368   1HB   LEU  52          1HB       LEU  52  -5.766  -7.940   4.615
  369   2HB   LEU  52          2HB       LEU  52  -4.570  -9.243   4.501
  370    HG   LEU  52           HG       LEU  52  -3.404  -7.231   6.100
  371   1HD1  LEU  52          1HD1      LEU  52  -6.346  -7.473   6.532
  372   2HD1  LEU  52          2HD1      LEU  52  -5.289  -7.381   7.960
  373   3HD1  LEU  52          3HD1      LEU  52  -5.262  -6.079   6.747
  374   1HD2  LEU  52          1HD2      LEU  52  -2.819  -9.059   7.210
  375   2HD2  LEU  52          2HD2      LEU  52  -4.508  -9.367   7.682
  376   3HD2  LEU  52          3HD2      LEU  52  -3.882 -10.008   6.143
  377    H    GLN  53           H        GLN  53  -2.187  -5.836   2.557
  378    HA   GLN  53           HA       GLN  53  -1.910  -4.001   4.566
  379   1HB   GLN  53          1HB       GLN  53  -1.545  -3.644   1.566
  380   2HB   GLN  53          2HB       GLN  53  -0.905  -2.536   2.792
  381   1HG   GLN  53          1HG       GLN  53  -0.221  -5.491   2.482
  382   2HG   GLN  53          2HG       GLN  53   0.834  -4.135   2.058
  383   1HE2  GLN  53          1HE2      GLN  53  -0.433  -6.163   4.525
  384   2HE2  GLN  53          2HE2      GLN  53   0.456  -5.538   5.875
  385    H    GLU  54           H        GLU  54  -4.473  -4.395   2.200
  386    HA   GLU  54           HA       GLU  54  -5.433  -1.964   1.764
  387   1HB   GLU  54          1HB       GLU  54  -7.391  -3.002   1.197
  388   2HB   GLU  54          2HB       GLU  54  -6.401  -4.457   1.396
  389   1HG   GLU  54          1HG       GLU  54  -8.219  -5.018   2.716
  390   2HG   GLU  54          2HG       GLU  54  -7.206  -4.234   3.939
  391    H    ALA  55           H        ALA  55  -5.207  -3.575   4.889
  392    HA   ALA  55           HA       ALA  55  -7.115  -2.467   6.414
  393   1HB   ALA  55          1HB       ALA  55  -4.151  -2.851   6.975
  394   2HB   ALA  55          2HB       ALA  55  -5.341  -2.446   8.236
  395   3HB   ALA  55          3HB       ALA  55  -5.486  -3.974   7.334
  396    H    GLU  56           H        GLU  56  -3.850  -0.891   6.329
  397    HA   GLU  56           HA       GLU  56  -5.295   1.644   6.326
  398   1HB   GLU  56          1HB       GLU  56  -3.577   0.649   8.275
  399   2HB   GLU  56          2HB       GLU  56  -2.534   1.746   7.351
  400   1HG   GLU  56          1HG       GLU  56  -5.003   3.101   7.661
  401   2HG   GLU  56          2HG       GLU  56  -4.673   2.369   9.238
  402    H    CYS  57           H        CYS  57  -4.305  -0.072   4.033
  403    HA   CYS  57           HA       CYS  57  -2.191   1.655   3.007
  404   1HB   CYS  57          1HB       CYS  57  -1.917  -0.835   3.005
  405   2HB   CYS  57          2HB       CYS  57  -3.226  -0.926   1.824
  406    H    THR  58           H        THR  58  -4.965  -0.151   1.500
  407    HA   THR  58           HA       THR  58  -5.392   1.759  -0.495
  408    HB   THR  58           HB       THR  58  -6.095  -0.731  -0.351
  409    HG1  THR  58           HG1      THR  58  -6.939   1.342  -1.687
  410   1HG2  THR  58          1HG2      THR  58  -8.658   0.417   0.810
  411   2HG2  THR  58          2HG2      THR  58  -8.165  -1.287   0.672
  412   3HG2  THR  58          3HG2      THR  58  -7.412  -0.239   1.898
  413    H    PHE  59           H        PHE  59  -6.355   1.679   2.883
  414    HA   PHE  59           HA       PHE  59  -8.594   2.988   3.148
  415   1HB   PHE  59          1HB       PHE  59  -6.428   2.567   4.696
  416   2HB   PHE  59          2HB       PHE  59  -6.098   4.265   4.342
  417    HD1  PHE  59           HD1      PHE  59  -8.042   5.920   4.846
  418    HD2  PHE  59           HD2      PHE  59  -7.791   2.010   6.475
  419    HE1  PHE  59           HE1      PHE  59  -9.593   6.594   6.699
  420    HE2  PHE  59           HE2      PHE  59  -9.344   2.683   8.329
  421    HZ   PHE  59           HZ       PHE  59 -10.226   4.968   8.420
  422   1H    GLU   1           H1       GLU   1 -21.637  -1.725   2.658
  423    HA   GLU   1           HA       GLU   1 -19.080  -0.611   3.146
  424   1HB   GLU   1          1HB       GLU   1 -20.203  -2.923   1.609
  425   2HB   GLU   1          2HB       GLU   1 -18.583  -2.360   1.158
  426   1HG   GLU   1          1HG       GLU   1 -18.467  -4.142   2.860
  427   2HG   GLU   1          2HG       GLU   1 -17.844  -2.621   3.517
  428    H    GLU   2           H        GLU   2 -19.509   1.620   2.376
  429    HA   GLU   2           HA       GLU   2 -19.948   1.870  -0.452
  430   1HB   GLU   2          1HB       GLU   2 -19.694   3.835   1.839
  431   2HB   GLU   2          2HB       GLU   2 -19.751   4.385   0.155
  432   1HG   GLU   2          1HG       GLU   2 -21.894   2.872   0.009
  433   2HG   GLU   2          2HG       GLU   2 -21.883   2.961   1.776
  434    H    TYR   3           H        TYR   3 -17.858   0.636  -0.893
  435    HA   TYR   3           HA       TYR   3 -15.440   2.135  -0.340
  436   1HB   TYR   3          1HB       TYR   3 -16.189  -0.456  -1.820
  437   2HB   TYR   3          2HB       TYR   3 -14.516   0.069  -1.603
  438    HD1  TYR   3           HD1      TYR   3 -14.839   1.098   1.269
  439    HD2  TYR   3           HD2      TYR   3 -16.090  -2.518  -0.644
  440    HE1  TYR   3           HE1      TYR   3 -14.768  -0.115   3.501
  441    HE2  TYR   3           HE2      TYR   3 -16.016  -3.719   1.595
  442    HH   TYR   3           HH       TYR   3 -15.075  -1.973   4.548
  443    H    VAL   4           H        VAL   4 -16.335   4.035  -1.665
  444    HA   VAL   4           HA       VAL   4 -15.648   3.568  -4.483
  445    HB   VAL   4           HB       VAL   4 -17.301   5.312  -5.039
  446   1HG1  VAL   4          1HG1      VAL   4 -19.080   3.462  -3.642
  447   2HG1  VAL   4          2HG1      VAL   4 -18.820   3.704  -5.386
  448   3HG1  VAL   4          3HG1      VAL   4 -17.741   2.628  -4.466
  449   1HG2  VAL   4          1HG2      VAL   4 -19.033   5.896  -3.332
  450   2HG2  VAL   4          2HG2      VAL   4 -18.017   5.116  -2.096
  451   3HG2  VAL   4          3HG2      VAL   4 -17.416   6.547  -2.969
  452    H    GLY   5           H        GLY   5 -15.895   5.969  -1.779
  453   1HA   GLY   5          1HA       GLY   5 -14.219   7.887  -3.047
  454   2HA   GLY   5          2HA       GLY   5 -14.723   7.851  -1.368
  455    H    LEU   6           H        LEU   6 -13.467   4.795  -2.015
  456    HA   LEU   6           HA       LEU   6 -10.729   5.632  -1.395
  457   1HB   LEU   6          1HB       LEU   6 -10.699   3.587   0.134
  458   2HB   LEU   6          2HB       LEU   6 -11.438   5.087   0.723
  459    HG   LEU   6           HG       LEU   6 -12.672   3.022   1.338
  460   1HD1  LEU   6          1HD1      LEU   6 -13.666   5.450   0.626
  461   2HD1  LEU   6          2HD1      LEU   6 -14.613   4.371  -0.427
  462   3HD1  LEU   6          3HD1      LEU   6 -14.626   4.129   1.337
  463   1HD2  LEU   6          1HD2      LEU   6 -13.460   1.491  -0.123
  464   2HD2  LEU   6          2HD2      LEU   6 -13.782   2.698  -1.392
  465   3HD2  LEU   6          3HD2      LEU   6 -12.125   2.100  -1.132
  466    H    SER   7           H        SER   7 -12.597   4.446  -3.707
  467    HA   SER   7           HA       SER   7 -10.875   2.163  -4.248
  468   1HB   SER   7          1HB       SER   7 -12.585   1.332  -5.701
  469   2HB   SER   7          2HB       SER   7 -13.404   1.860  -4.222
  470    HG   SER   7           HG       SER   7 -13.350   3.995  -5.829
  471    H    ALA   8           H        ALA   8 -11.352   2.085  -7.103
  472    HA   ALA   8           HA       ALA   8  -9.338   3.788  -7.990
  473   1HB   ALA   8          1HB       ALA   8 -11.319   2.871  -9.993
  474   2HB   ALA   8          2HB       ALA   8  -9.564   2.587  -9.905
  475   3HB   ALA   8          3HB       ALA   8 -10.677   1.587  -8.941
  476    H    ASN   9           H        ASN   9  -9.864   5.924  -7.203
  477    HA   ASN   9           HA       ASN   9 -10.915   7.579  -9.037
  478   1HB   ASN   9          1HB       ASN   9 -13.048   6.191  -7.785
  479   2HB   ASN   9          2HB       ASN   9 -13.055   7.796  -7.039
  480   1HD2  ASN   9          1HD2      ASN   9 -12.456   9.549  -8.823
  481   2HD2  ASN   9          2HD2      ASN   9 -13.469   9.518 -10.228
  482    H    GLN  10           H        GLN  10 -10.529   6.676  -5.608
  483    HA   GLN  10           HA       GLN  10 -10.612   9.242  -4.541
  484   1HB   GLN  10          1HB       GLN  10 -10.831   7.154  -3.224
  485   2HB   GLN  10          2HB       GLN  10  -9.124   6.781  -3.519
  486   1HG   GLN  10          1HG       GLN  10  -8.451   8.823  -2.331
  487   2HG   GLN  10          2HG       GLN  10 -10.142   9.297  -2.118
  488   1HE2  GLN  10          1HE2      GLN  10  -8.196   6.335  -1.719
  489   2HE2  GLN  10          2HE2      GLN  10  -8.711   5.949  -0.110
  490    H    CYS  11           H        CYS  11  -8.118   7.411  -6.261
  491    HA   CYS  11           HA       CYS  11  -5.932   8.945  -5.358
  492   1HB   CYS  11          1HB       CYS  11  -5.602   6.740  -6.240
  493   2HB   CYS  11          2HB       CYS  11  -6.300   7.198  -7.797
  494    H    ALA  12           H        ALA  12  -8.668   9.821  -7.059
  495    HA   ALA  12           HA       ALA  12  -7.195  11.843  -8.607
  496   1HB   ALA  12          1HB       ALA  12  -8.519  10.060  -9.887
  497   2HB   ALA  12          2HB       ALA  12  -9.984  10.804  -9.203
  498   3HB   ALA  12          3HB       ALA  12  -8.912  11.755 -10.258
  499    H    VAL  13           H        VAL  13  -8.483  11.490  -5.702
  500    HA   VAL  13           HA       VAL  13 -10.646  13.068  -5.364
  501    HB   VAL  13           HB       VAL  13  -8.687  11.921  -3.788
  502   1HG1  VAL  13          1HG1      VAL  13  -7.347  13.959  -3.793
  503   2HG1  VAL  13          2HG1      VAL  13  -8.750  14.909  -3.249
  504   3HG1  VAL  13          3HG1      VAL  13  -8.037  13.680  -2.177
  505   1HG2  VAL  13          1HG2      VAL  13 -10.544  11.704  -2.574
  506   2HG2  VAL  13          2HG2      VAL  13 -10.411  13.411  -2.087
  507   3HG2  VAL  13          3HG2      VAL  13 -11.347  12.969  -3.535
  508    HA   PRO  14           HA       PRO  14  -9.575  17.148  -6.305
  509   1HB   PRO  14          1HB       PRO  14 -10.749  18.644  -4.345
  510   2HB   PRO  14          2HB       PRO  14 -11.642  17.967  -5.704
  511   1HG   PRO  14          1HG       PRO  14 -11.509  17.082  -2.893
  512   2HG   PRO  14          2HG       PRO  14 -12.759  16.703  -4.132
  513   1HD   PRO  14          1HD       PRO  14 -10.664  15.019  -3.143
  514   2HD   PRO  14          2HD       PRO  14 -11.769  14.656  -4.477
  515    H    ALA  15           H        ALA  15  -7.647  15.629  -4.665
  516    HA   ALA  15           HA       ALA  15  -5.812  15.989  -3.463
  517   1HB   ALA  15          1HB       ALA  15  -5.999  18.099  -5.519
  518   2HB   ALA  15          2HB       ALA  15  -4.895  18.493  -4.179
  519   3HB   ALA  15          3HB       ALA  15  -4.653  17.004  -5.123
  520    H    LYS  16           H        LYS  16  -7.537  16.103  -1.613
  521    HA   LYS  16           HA       LYS  16  -6.671  17.902   0.261
  522   1HB   LYS  16          1HB       LYS  16  -8.778  19.356   0.403
  523   2HB   LYS  16          2HB       LYS  16  -7.551  19.781  -0.803
  524   1HG   LYS  16          1HG       LYS  16  -9.095  19.592  -2.428
  525   2HG   LYS  16          2HG       LYS  16  -9.354  17.892  -2.007
  526   1HD   LYS  16          1HD       LYS  16 -10.634  20.043  -0.328
  527   2HD   LYS  16          2HD       LYS  16 -11.353  19.652  -1.899
  528   1HE   LYS  16          1HE       LYS  16 -12.386  17.900  -0.929
  529   2HE   LYS  16          2HE       LYS  16 -10.807  17.159  -0.629
  530   1HZ   LYS  16          1HZ       LYS  16 -11.308  19.175   1.243
  531   2HZ   LYS  16          2HZ       LYS  16 -12.573  18.143   1.222
  532   3HZ   LYS  16          3HZ       LYS  16 -11.065  17.581   1.500
  533    H    ASP  17           H        ASP  17  -7.313  15.123  -0.087
  534    HA   ASP  17           HA       ASP  17  -8.989  14.863   2.196
  535   1HB   ASP  17          1HB       ASP  17 -10.508  14.894   0.090
  536   2HB   ASP  17          2HB       ASP  17  -9.798  13.320  -0.298
  537    H    ARG  18           H        ARG  18  -6.216  14.276   0.790
  538    HA   ARG  18           HA       ARG  18  -6.198  11.408   0.910
  539   1HB   ARG  18          1HB       ARG  18  -3.878  13.324   0.411
  540   2HB   ARG  18          2HB       ARG  18  -3.907  11.592   0.041
  541   1HG   ARG  18          1HG       ARG  18  -5.108  11.901  -1.877
  542   2HG   ARG  18          2HG       ARG  18  -6.117  13.177  -1.175
  543   1HD   ARG  18          1HD       ARG  18  -4.408  14.836  -1.542
  544   2HD   ARG  18          2HD       ARG  18  -3.192  13.609  -1.925
  545    HE   ARG  18           HE       ARG  18  -5.527  13.549  -3.694
  546   1HH1  ARG  18          1HH1      ARG  18  -2.367  14.996  -3.143
  547   2HH1  ARG  18          2HH1      ARG  18  -2.129  15.420  -4.804
  548   1HH2  ARG  18          1HH2      ARG  18  -5.214  14.109  -5.887
  549   2HH2  ARG  18          2HH2      ARG  18  -3.760  14.913  -6.376
  550    H    VAL  19           H        VAL  19  -4.043  10.479   2.063
  551    HA   VAL  19           HA       VAL  19  -4.088  11.616   4.758
  552    HB   VAL  19           HB       VAL  19  -3.183   8.913   3.744
  553   1HG1  VAL  19          1HG1      VAL  19  -3.763   8.773   6.482
  554   2HG1  VAL  19          2HG1      VAL  19  -2.156   8.728   5.720
  555   3HG1  VAL  19          3HG1      VAL  19  -2.827  10.275   6.287
  556   1HG2  VAL  19          1HG2      VAL  19  -5.675   9.508   5.356
  557   2HG2  VAL  19          2HG2      VAL  19  -5.672   9.471   3.576
  558   3HG2  VAL  19          3HG2      VAL  19  -5.236   8.011   4.497
  559    H    ASP  20           H        ASP  20  -2.532  12.548   2.236
  560    HA   ASP  20           HA       ASP  20  -0.437  12.924   1.610
  561   1HB   ASP  20          1HB       ASP  20  -0.655  14.889   2.817
  562   2HB   ASP  20          2HB       ASP  20  -0.880  14.050   4.361
  563    H    CYS  21           H        CYS  21   0.402  10.685   1.437
  564    HA   CYS  21           HA       CYS  21   1.277   9.108   3.452
  565   1HB   CYS  21          1HB       CYS  21   1.276   8.928   0.780
  566   2HB   CYS  21          2HB       CYS  21   3.002   9.200   1.038
  567    H    GLY  22           H        GLY  22   2.818  11.978   1.959
  568   1HA   GLY  22          1HA       GLY  22   4.637  13.178   2.509
  569   2HA   GLY  22          2HA       GLY  22   4.336  12.673   4.161
  570    H    TYR  23           H        TYR  23   5.511  11.085   1.097
  571    HA   TYR  23           HA       TYR  23   7.415   9.570   2.684
  572   1HB   TYR  23          1HB       TYR  23   5.931   9.453   0.151
  573   2HB   TYR  23          2HB       TYR  23   7.650   9.215  -0.177
  574    HD1  TYR  23           HD1      TYR  23   4.602   7.732   1.076
  575    HD2  TYR  23           HD2      TYR  23   8.861   7.326   1.011
  576    HE1  TYR  23           HE1      TYR  23   4.387   5.295   1.768
  577    HE2  TYR  23           HE2      TYR  23   8.631   4.891   1.703
  578    HH   TYR  23           HH       TYR  23   7.263   3.357   2.456
  579    HA   PRO  24           HA       PRO  24  10.697  12.216   1.658
  580   1HB   PRO  24          1HB       PRO  24  12.786  10.632   2.427
  581   2HB   PRO  24          2HB       PRO  24  11.857  11.617   3.554
  582   1HG   PRO  24          1HG       PRO  24  11.767   8.711   3.054
  583   2HG   PRO  24          2HG       PRO  24  11.194   9.620   4.499
  584   1HD   PRO  24          1HD       PRO  24   9.641   8.465   2.388
  585   2HD   PRO  24          2HD       PRO  24   9.041   9.486   3.702
  586    H    HIS  25           H        HIS  25   9.892   9.484   0.019
  587    HA   HIS  25           HA       HIS  25  11.929  10.130  -1.985
  588   1HB   HIS  25          1HB       HIS  25  11.775   7.770  -0.578
  589   2HB   HIS  25          2HB       HIS  25  10.899   7.383  -2.064
  590    HD1  HIS  25           HD1      HIS  25  14.243   7.493  -0.681
  591    HD2  HIS  25           HD2      HIS  25  12.561   8.088  -4.476
  592    HE1  HIS  25           HE1      HIS  25  16.155   7.261  -2.354
  593    HE2  HIS  25           HE2      HIS  25  15.050   7.583  -4.672
  594    H    VAL  26           H        VAL  26   8.933  10.842  -1.303
  595    HA   VAL  26           HA       VAL  26   7.131   9.771  -2.951
  596    HB   VAL  26           HB       VAL  26   6.462  11.523  -1.580
  597   1HG1  VAL  26          1HG1      VAL  26   7.751  13.853  -2.698
  598   2HG1  VAL  26          2HG1      VAL  26   7.774  13.240  -1.027
  599   3HG1  VAL  26          3HG1      VAL  26   8.973  12.655  -2.206
  600   1HG2  VAL  26          1HG2      VAL  26   5.517  11.480  -3.999
  601   2HG2  VAL  26          2HG2      VAL  26   5.172  12.888  -2.967
  602   3HG2  VAL  26          3HG2      VAL  26   6.436  12.990  -4.215
  603    H    THR  27           H        THR  27   6.876   9.381  -5.096
  604    HA   THR  27           HA       THR  27   7.859  11.157  -7.077
  605    HB   THR  27           HB       THR  27   9.683   9.133  -6.045
  606    HG1  THR  27           HG1      THR  27  10.479  11.140  -6.714
  607   1HG2  THR  27          1HG2      THR  27   9.810   7.603  -7.734
  608   2HG2  THR  27          2HG2      THR  27   8.342   8.307  -8.453
  609   3HG2  THR  27          3HG2      THR  27   9.946   8.918  -8.925
  610    HA   PRO  28           HA       PRO  28   4.822   9.047  -9.250
  611   1HB   PRO  28          1HB       PRO  28   5.437   9.704 -11.828
  612   2HB   PRO  28          2HB       PRO  28   4.576  10.786 -10.738
  613   1HG   PRO  28          1HG       PRO  28   7.390  10.827 -11.619
  614   2HG   PRO  28          2HG       PRO  28   6.414  12.168 -10.918
  615   1HD   PRO  28          1HD       PRO  28   8.449  10.599  -9.654
  616   2HD   PRO  28          2HD       PRO  28   7.404  11.797  -8.878
  617    H    LYS  29           H        LYS  29   6.671   7.288  -8.316
  618    HA   LYS  29           HA       LYS  29   6.269   5.151 -10.028
  619   1HB   LYS  29          1HB       LYS  29   7.959   6.590 -11.364
  620   2HB   LYS  29          2HB       LYS  29   9.156   5.983 -10.209
  621   1HG   LYS  29          1HG       LYS  29   8.983   3.806 -10.976
  622   2HG   LYS  29          2HG       LYS  29   7.293   3.988 -11.473
  623   1HD   LYS  29          1HD       LYS  29   8.988   5.775 -13.009
  624   2HD   LYS  29          2HD       LYS  29   9.621   4.123 -13.111
  625   1HE   LYS  29          1HE       LYS  29   7.518   3.290 -13.946
  626   2HE   LYS  29          2HE       LYS  29   6.685   4.807 -13.575
  627   1HZ   LYS  29          1HZ       LYS  29   7.456   4.372 -15.938
  628   2HZ   LYS  29          2HZ       LYS  29   7.746   5.851 -15.309
  629   3HZ   LYS  29          3HZ       LYS  29   8.953   4.756 -15.412
  630    H    GLU  30           H        GLU  30   7.760   6.819  -7.356
  631    HA   GLU  30           HA       GLU  30   8.699   4.323  -6.243
  632   1HB   GLU  30          1HB       GLU  30   9.320   7.163  -5.905
  633   2HB   GLU  30          2HB       GLU  30   9.120   6.347  -4.344
  634   1HG   GLU  30          1HG       GLU  30  11.412   6.072  -4.867
  635   2HG   GLU  30          2HG       GLU  30  10.690   4.518  -5.313
  636    H    CYS  31           H        CYS  31   6.361   7.002  -5.589
  637    HA   CYS  31           HA       CYS  31   5.418   6.124  -3.171
  638   1HB   CYS  31          1HB       CYS  31   4.139   7.640  -5.424
  639   2HB   CYS  31          2HB       CYS  31   3.235   7.249  -3.958
  640    H    ASN  32           H        ASN  32   4.093   5.463  -6.503
  641    HA   ASN  32           HA       ASN  32   2.159   3.704  -5.697
  642   1HB   ASN  32          1HB       ASN  32   3.646   4.291  -8.224
  643   2HB   ASN  32          2HB       ASN  32   2.833   2.720  -8.179
  644   1HD2  ASN  32          1HD2      ASN  32   2.160   6.017  -6.994
  645   2HD2  ASN  32          2HD2      ASN  32   0.570   6.170  -7.667
  646    H    ASN  33           H        ASN  33   5.603   3.426  -5.636
  647    HA   ASN  33           HA       ASN  33   5.591   0.568  -5.948
  648   1HB   ASN  33          1HB       ASN  33   7.443   2.250  -6.736
  649   2HB   ASN  33          2HB       ASN  33   7.961   2.258  -5.044
  650   1HD2  ASN  33          1HD2      ASN  33   9.901   1.451  -6.319
  651   2HD2  ASN  33          2HD2      ASN  33  10.091  -0.264  -6.470
  652    H    ARG  34           H        ARG  34   5.736   3.142  -3.483
  653    HA   ARG  34           HA       ARG  34   6.524   1.315  -1.434
  654   1HB   ARG  34          1HB       ARG  34   5.444   4.112  -0.969
  655   2HB   ARG  34          2HB       ARG  34   6.648   3.232  -0.013
  656   1HG   ARG  34          1HG       ARG  34   7.771   3.361  -2.574
  657   2HG   ARG  34          2HG       ARG  34   7.004   4.947  -2.379
  658   1HD   ARG  34          1HD       ARG  34   8.439   5.572  -0.693
  659   2HD   ARG  34          2HD       ARG  34   8.561   3.937  -0.029
  660    HE   ARG  34           HE       ARG  34   9.843   3.814  -2.511
  661   1HH1  ARG  34          1HH1      ARG  34  10.237   5.708   0.428
  662   2HH1  ARG  34          2HH1      ARG  34  11.944   5.919   0.216
  663   1HH2  ARG  34          1HH2      ARG  34  12.093   4.092  -2.793
  664   2HH2  ARG  34          2HH2      ARG  34  13.007   4.993  -1.629
  665    H    GLY  35           H        GLY  35   3.588   2.605  -2.880
  666   1HA   GLY  35          1HA       GLY  35   1.602   1.249  -2.420
  667   2HA   GLY  35          2HA       GLY  35   1.991   1.368  -0.715
  668    H    CYS  36           H        CYS  36   2.670   4.184  -2.716
  669    HA   CYS  36           HA       CYS  36   0.237   5.430  -1.660
  670   1HB   CYS  36          1HB       CYS  36   2.923   6.747  -2.063
  671   2HB   CYS  36          2HB       CYS  36   1.460   7.519  -1.446
  672    H    CYS  37           H        CYS  37  -0.406   7.412  -3.060
  673    HA   CYS  37           HA       CYS  37   0.103   6.713  -5.856
  674   1HB   CYS  37          1HB       CYS  37  -2.261   6.632  -4.766
  675   2HB   CYS  37          2HB       CYS  37  -2.220   8.387  -4.965
  676    H    PHE  38           H        PHE  38   0.935   8.323  -7.226
  677    HA   PHE  38           HA       PHE  38   1.751  10.770  -5.868
  678   1HB   PHE  38          1HB       PHE  38   3.296   9.134  -7.171
  679   2HB   PHE  38          2HB       PHE  38   2.461   9.649  -8.640
  680    HD1  PHE  38           HD1      PHE  38   2.786  11.914  -9.507
  681    HD2  PHE  38           HD2      PHE  38   4.872  10.568  -6.066
  682    HE1  PHE  38           HE1      PHE  38   4.383  13.839  -9.721
  683    HE2  PHE  38           HE2      PHE  38   6.467  12.493  -6.280
  684    HZ   PHE  38           HZ       PHE  38   6.205  14.106  -8.106
  685    H    ASP  39           H        ASP  39   0.552  12.585  -6.144
  686    HA   ASP  39           HA       ASP  39  -1.457  12.643  -8.118
  687   1HB   ASP  39          1HB       ASP  39  -2.132  13.933  -6.351
  688   2HB   ASP  39          2HB       ASP  39  -0.477  14.374  -5.902
  689    H    SER  40           H        SER  40   0.883  15.324  -7.443
  690    HA   SER  40           HA       SER  40   2.430  16.246  -8.729
  691   1HB   SER  40          1HB       SER  40   2.434  13.950 -10.010
  692   2HB   SER  40          2HB       SER  40   1.508  14.831 -11.238
  693    HG   SER  40           HG       SER  40   3.654  15.065 -11.823
  694    H    ARG  41           H        ARG  41  -0.952  15.836  -9.567
  695    HA   ARG  41           HA       ARG  41  -1.127  17.822 -11.497
  696   1HB   ARG  41          1HB       ARG  41  -3.340  17.129  -9.532
  697   2HB   ARG  41          2HB       ARG  41  -3.510  17.614 -11.229
  698   1HG   ARG  41          1HG       ARG  41  -1.945  15.370 -11.464
  699   2HG   ARG  41          2HG       ARG  41  -2.918  14.944 -10.046
  700   1HD   ARG  41          1HD       ARG  41  -4.297  14.184 -11.757
  701   2HD   ARG  41          2HD       ARG  41  -4.923  15.830 -11.576
  702    HE   ARG  41           HE       ARG  41  -2.721  15.685 -13.474
  703   1HH1  ARG  41          1HH1      ARG  41  -6.182  15.163 -13.109
  704   2HH1  ARG  41          2HH1      ARG  41  -6.523  15.396 -14.792
  705   1HH2  ARG  41          1HH2      ARG  41  -3.171  15.992 -15.693
  706   2HH2  ARG  41          2HH2      ARG  41  -4.799  15.870 -16.271
  707    H    ILE  42           H        ILE  42  -1.494  17.820  -7.902
  708    HA   ILE  42           HA       ILE  42  -1.456  20.756  -8.018
  709    HB   ILE  42           HB       ILE  42  -2.723  19.197  -5.790
  710   1HG1  ILE  42          1HG1      ILE  42  -3.879  19.831  -8.489
  711   2HG1  ILE  42          2HG1      ILE  42  -3.969  18.325  -7.558
  712   1HG2  ILE  42          1HG2      ILE  42  -3.280  21.978  -6.851
  713   2HG2  ILE  42          2HG2      ILE  42  -3.893  21.241  -5.351
  714   3HG2  ILE  42          3HG2      ILE  42  -2.160  21.614  -5.515
  715   1HD1  ILE  42          1HD1      ILE  42  -5.246  19.892  -5.810
  716   2HD1  ILE  42          2HD1      ILE  42  -5.547  20.876  -7.262
  717   3HD1  ILE  42          3HD1      ILE  42  -6.106  19.187  -7.200
  718    HA   PRO  43           HA       PRO  43   2.292  19.831  -5.905
  719   1HB   PRO  43          1HB       PRO  43   3.493  22.242  -6.362
  720   2HB   PRO  43          2HB       PRO  43   3.609  20.880  -7.475
  721   1HG   PRO  43          1HG       PRO  43   1.978  23.333  -7.641
  722   2HG   PRO  43          2HG       PRO  43   2.455  22.210  -8.966
  723   1HD   PRO  43          1HD       PRO  43  -0.089  22.461  -7.675
  724   2HD   PRO  43          2HD       PRO  43   0.377  21.234  -8.860
  725    H    GLY  44           H        GLY  44  -0.245  21.766  -5.158
  726   1HA   GLY  44          1HA       GLY  44   1.023  22.952  -2.808
  727   2HA   GLY  44          2HA       GLY  44  -0.594  23.246  -3.413
  728    H    VAL  45           H        VAL  45  -0.366  19.965  -3.680
  729    HA   VAL  45           HA       VAL  45  -1.226  19.540  -0.901
  730    HB   VAL  45           HB       VAL  45  -3.035  18.314  -1.580
  731   1HG1  VAL  45          1HG1      VAL  45  -2.891  20.818  -2.538
  732   2HG1  VAL  45          2HG1      VAL  45  -3.094  19.944  -4.075
  733   3HG1  VAL  45          3HG1      VAL  45  -4.310  19.771  -2.785
  734   1HG2  VAL  45          1HG2      VAL  45  -3.319  17.174  -3.676
  735   2HG2  VAL  45          2HG2      VAL  45  -1.904  17.995  -4.378
  736   3HG2  VAL  45          3HG2      VAL  45  -1.686  16.808  -3.070
  737    HA   PRO  46           HA       PRO  46   1.320  16.023  -0.878
  738   1HB   PRO  46          1HB       PRO  46  -0.193  13.874  -0.135
  739   2HB   PRO  46          2HB       PRO  46   0.382  15.088   1.005
  740   1HG   PRO  46          1HG       PRO  46  -2.301  14.699  -0.159
  741   2HG   PRO  46          2HG       PRO  46  -1.843  15.602   1.331
  742   1HD   PRO  46          1HD       PRO  46  -2.578  16.648  -1.231
  743   2HD   PRO  46          2HD       PRO  46  -1.982  17.573   0.154
  744    H    TRP  47           H        TRP  47   2.460  15.220  -2.512
  745    HA   TRP  47           HA       TRP  47   0.877  14.119  -4.696
  746   1HB   TRP  47          1HB       TRP  47   3.761  14.206  -5.055
  747   2HB   TRP  47          2HB       TRP  47   2.466  14.862  -6.059
  748    HD1  TRP  47           HD1      TRP  47   1.524  17.395  -5.190
  749    HE1  TRP  47           HE1      TRP  47   2.792  19.457  -4.141
  750    HE3  TRP  47           HE3      TRP  47   5.607  14.777  -3.665
  751    HZ2  TRP  47           HZ2      TRP  47   5.305  19.755  -2.821
  752    HZ3  TRP  47           HZ3      TRP  47   7.423  16.030  -2.504
  753    HH2  TRP  47           HH2      TRP  47   7.319  18.434  -2.075
  754    H    CYS  48           H        CYS  48   1.122  12.746  -2.064
  755    HA   CYS  48           HA       CYS  48   1.845  10.205  -3.072
  756   1HB   CYS  48          1HB       CYS  48   4.076  11.289  -2.457
  757   2HB   CYS  48          2HB       CYS  48   3.562  11.130  -0.775
  758    H    PHE  49           H        PHE  49  -0.081   9.319  -2.348
  759    HA   PHE  49           HA       PHE  49  -0.508   9.358   0.526
  760   1HB   PHE  49          1HB       PHE  49  -3.068   9.657  -0.377
  761   2HB   PHE  49          2HB       PHE  49  -2.071  11.052   0.049
  762    HD1  PHE  49           HD1      PHE  49  -0.601  11.981  -1.940
  763    HD2  PHE  49           HD2      PHE  49  -4.092   9.619  -2.434
  764    HE1  PHE  49           HE1      PHE  49  -0.872  12.868  -4.272
  765    HE2  PHE  49           HE2      PHE  49  -4.362  10.506  -4.767
  766    HZ   PHE  49           HZ       PHE  49  -2.748  12.120  -5.658
  767    H    LYS  50           H        LYS  50  -2.950   8.034   0.636
  768    HA   LYS  50           HA       LYS  50  -2.420   5.606  -0.930
  769   1HB   LYS  50          1HB       LYS  50  -3.745   4.967   1.510
  770   2HB   LYS  50          2HB       LYS  50  -2.150   4.443   0.942
  771   1HG   LYS  50          1HG       LYS  50  -2.528   7.191   2.150
  772   2HG   LYS  50          2HG       LYS  50  -2.349   5.778   3.206
  773   1HD   LYS  50          1HD       LYS  50  -0.389   6.851   1.145
  774   2HD   LYS  50          2HD       LYS  50  -0.143   6.711   2.895
  775   1HE   LYS  50          1HE       LYS  50  -0.252   4.513   0.805
  776   2HE   LYS  50          2HE       LYS  50   1.063   4.880   1.933
  777   1HZ   LYS  50          1HZ       LYS  50  -0.904   4.387   3.601
  778   2HZ   LYS  50          2HZ       LYS  50  -1.383   3.427   2.370
  779   3HZ   LYS  50          3HZ       LYS  50   0.090   3.217   3.044
  780    HA   PRO  51           HA       PRO  51  -6.606   7.125  -1.745
  781   1HB   PRO  51          1HB       PRO  51  -6.431   7.229  -4.469
  782   2HB   PRO  51          2HB       PRO  51  -6.157   8.626  -3.431
  783   1HG   PRO  51          1HG       PRO  51  -4.223   6.908  -4.851
  784   2HG   PRO  51          2HG       PRO  51  -3.986   8.575  -4.213
  785   1HD   PRO  51          1HD       PRO  51  -3.037   6.100  -3.129
  786   2HD   PRO  51          2HD       PRO  51  -2.914   7.697  -2.378
  787    H    LEU  52           H        LEU  52  -6.058   5.553  -4.731
  788    HA   LEU  52           HA       LEU  52  -7.668   3.334  -3.713
  789   1HB   LEU  52          1HB       LEU  52  -8.576   3.118  -5.764
  790   2HB   LEU  52          2HB       LEU  52  -8.265   4.862  -5.742
  791    HG   LEU  52           HG       LEU  52  -5.953   3.687  -6.831
  792   1HD1  LEU  52          1HD1      LEU  52  -7.821   2.689  -8.767
  793   2HD1  LEU  52          2HD1      LEU  52  -6.487   1.846  -7.943
  794   3HD1  LEU  52          3HD1      LEU  52  -8.104   1.890  -7.202
  795   1HD2  LEU  52          1HD2      LEU  52  -6.244   5.323  -8.316
  796   2HD2  LEU  52          2HD2      LEU  52  -7.842   4.713  -8.808
  797   3HD2  LEU  52          3HD2      LEU  52  -7.693   5.765  -7.380
  798    H    GLN  53           H        GLN  53  -5.011   3.363  -2.834
  799    HA   GLN  53           HA       GLN  53  -3.180   2.182  -4.461
  800   1HB   GLN  53          1HB       GLN  53  -3.614   1.762  -1.479
  801   2HB   GLN  53          2HB       GLN  53  -2.123   1.357  -2.345
  802   1HG   GLN  53          1HG       GLN  53  -3.377   4.123  -2.076
  803   2HG   GLN  53          2HG       GLN  53  -1.924   3.558  -1.237
  804   1HE2  GLN  53          1HE2      GLN  53  -3.366   4.403  -4.319
  805   2HE2  GLN  53          2HE2      GLN  53  -1.903   4.688  -5.203
  806    H    GLU  54           H        GLU  54  -6.184   0.903  -3.365
  807    HA   GLU  54           HA       GLU  54  -5.737  -1.700  -2.897
  808   1HB   GLU  54          1HB       GLU  54  -7.999  -2.067  -4.062
  809   2HB   GLU  54          2HB       GLU  54  -7.968  -0.889  -2.740
  810   1HG   GLU  54          1HG       GLU  54  -8.589   0.782  -4.128
  811   2HG   GLU  54          2HG       GLU  54  -7.318   0.381  -5.293
  812    H    ALA  55           H        ALA  55  -5.099   0.043  -5.848
  813    HA   ALA  55           HA       ALA  55  -5.441  -1.635  -7.883
  814   1HB   ALA  55          1HB       ALA  55  -2.736  -0.745  -8.082
  815   2HB   ALA  55          2HB       ALA  55  -4.190  -0.013  -8.800
  816   3HB   ALA  55          3HB       ALA  55  -3.640   0.501  -7.188
  817    H    GLU  56           H        GLU  56  -2.203  -1.688  -6.259
  818    HA   GLU  56           HA       GLU  56  -2.371  -4.596  -6.429
  819   1HB   GLU  56          1HB       GLU  56  -0.345  -2.715  -7.476
  820   2HB   GLU  56          2HB       GLU  56   0.339  -4.081  -6.580
  821   1HG   GLU  56          1HG       GLU  56  -0.773  -5.670  -8.025
  822   2HG   GLU  56          2HG       GLU  56  -1.737  -4.399  -8.793
  823    H    CYS  57           H        CYS  57  -2.791  -2.356  -4.269
  824    HA   CYS  57           HA       CYS  57  -0.694  -3.082  -2.410
  825   1HB   CYS  57          1HB       CYS  57  -1.695  -0.723  -2.795
  826   2HB   CYS  57          2HB       CYS  57  -3.015  -1.289  -1.767
  827    H    THR  58           H        THR  58  -4.333  -2.839  -2.325
  828    HA   THR  58           HA       THR  58  -4.732  -4.429  -0.119
  829    HB   THR  58           HB       THR  58  -6.363  -2.942  -1.479
  830    HG1  THR  58           HG1      THR  58  -7.058  -5.714  -0.803
  831   1HG2  THR  58          1HG2      THR  58  -7.514  -3.850  -3.317
  832   2HG2  THR  58          2HG2      THR  58  -5.888  -4.509  -3.615
  833   3HG2  THR  58          3HG2      THR  58  -7.134  -5.525  -2.851
  834    H    PHE  59           H        PHE  59  -4.113  -5.397  -3.505
  835    HA   PHE  59           HA       PHE  59  -4.878  -7.888  -3.709
  836   1HB   PHE  59          1HB       PHE  59  -2.668  -6.243  -4.566
  837   2HB   PHE  59          2HB       PHE  59  -1.981  -7.820  -4.163
  838    HD1  PHE  59           HD1      PHE  59  -4.535  -6.128  -6.249
  839    HD2  PHE  59           HD2      PHE  59  -2.230  -9.638  -5.638
  840    HE1  PHE  59           HE1      PHE  59  -5.271  -7.001  -8.485
  841    HE2  PHE  59           HE2      PHE  59  -2.967 -10.511  -7.872
  842    HZ   PHE  59           HZ       PHE  59  -4.478  -9.183  -9.269
  Start of MODEL   14
    1   1H    GLU   1           H1       GLU   1 -14.988 -14.839  -5.466
    2    HA   GLU   1           HA       GLU   1 -13.787 -12.347  -5.733
    3   1HB   GLU   1          1HB       GLU   1 -16.661 -12.549  -6.541
    4   2HB   GLU   1          2HB       GLU   1 -16.200 -11.150  -5.554
    5   1HG   GLU   1          1HG       GLU   1 -14.533 -10.478  -7.179
    6   2HG   GLU   1          2HG       GLU   1 -14.731 -11.979  -8.097
    7    H    GLU   2           H        GLU   2 -14.020 -14.618  -3.891
    8    HA   GLU   2           HA       GLU   2 -15.624 -13.574  -1.740
    9   1HB   GLU   2          1HB       GLU   2 -14.252 -16.150  -2.370
   10   2HB   GLU   2          2HB       GLU   2 -14.428 -15.752  -0.652
   11   1HG   GLU   2          1HG       GLU   2 -16.720 -15.956  -0.709
   12   2HG   GLU   2          2HG       GLU   2 -16.850 -15.354  -2.369
   13    H    TYR   3           H        TYR   3 -14.433 -11.599  -1.304
   14    HA   TYR   3           HA       TYR   3 -11.849 -11.131  -1.022
   15   1HB   TYR   3          1HB       TYR   3 -13.952 -10.587   1.154
   16   2HB   TYR   3          2HB       TYR   3 -12.569  -9.555   0.777
   17    HD1  TYR   3           HD1      TYR   3 -12.569  -8.939  -1.931
   18    HD2  TYR   3           HD2      TYR   3 -15.989  -9.734   0.514
   19    HE1  TYR   3           HE1      TYR   3 -14.030  -7.606  -3.528
   20    HE2  TYR   3           HE2      TYR   3 -17.439  -8.397  -1.092
   21    HH   TYR   3           HH       TYR   3 -16.032  -6.498  -3.634
   22    H    VAL   4           H        VAL   4 -10.664 -13.094  -0.551
   23    HA   VAL   4           HA       VAL   4 -10.550 -13.590   2.334
   24    HB   VAL   4           HB       VAL   4 -10.578 -15.680   0.147
   25   1HG1  VAL   4          1HG1      VAL   4 -10.749 -16.635   2.904
   26   2HG1  VAL   4          2HG1      VAL   4  -9.697 -17.169   1.570
   27   3HG1  VAL   4          3HG1      VAL   4  -9.222 -15.780   2.575
   28   1HG2  VAL   4          1HG2      VAL   4 -12.758 -16.000   0.544
   29   2HG2  VAL   4          2HG2      VAL   4 -12.525 -15.956   2.308
   30   3HG2  VAL   4          3HG2      VAL   4 -12.730 -14.440   1.399
   31    H    GLY   5           H        GLY   5  -9.003 -13.993  -0.916
   32   1HA   GLY   5          1HA       GLY   5  -6.396 -14.432   0.129
   33   2HA   GLY   5          2HA       GLY   5  -6.831 -14.035  -1.522
   34    H    LEU   6           H        LEU   6  -8.354 -11.695   0.310
   35    HA   LEU   6           HA       LEU   6  -5.977  -9.983   0.404
   36   1HB   LEU   6          1HB       LEU   6  -8.366  -8.558  -0.379
   37   2HB   LEU   6          2HB       LEU   6  -6.740  -8.541  -1.087
   38    HG   LEU   6           HG       LEU   6  -7.330 -10.611  -2.342
   39   1HD1  LEU   6          1HD1      LEU   6  -9.064 -11.824  -1.673
   40   2HD1  LEU   6          2HD1      LEU   6  -9.649 -10.517  -0.616
   41   3HD1  LEU   6          3HD1      LEU   6 -10.131 -10.558  -2.329
   42   1HD2  LEU   6          1HD2      LEU   6  -8.609  -9.514  -4.043
   43   2HD2  LEU   6          2HD2      LEU   6  -9.256  -8.336  -2.877
   44   3HD2  LEU   6          3HD2      LEU   6  -7.526  -8.313  -3.301
   45    H    SER   7           H        SER   7  -8.159 -11.579   2.177
   46    HA   SER   7           HA       SER   7  -9.317  -9.508   3.681
   47   1HB   SER   7          1HB       SER   7  -9.640 -12.253   3.457
   48   2HB   SER   7          2HB       SER   7  -8.942 -12.086   5.077
   49    HG   SER   7           HG       SER   7 -10.734 -10.214   5.081
   50    H    ALA   8           H        ALA   8  -8.866 -10.010   6.357
   51    HA   ALA   8           HA       ALA   8  -6.294  -8.846   6.723
   52   1HB   ALA   8          1HB       ALA   8  -8.689  -9.543   8.366
   53   2HB   ALA   8          2HB       ALA   8  -7.136  -9.416   9.228
   54   3HB   ALA   8          3HB       ALA   8  -7.752  -8.032   8.293
   55    H    ASN   9           H        ASN   9  -7.278 -12.002   6.093
   56    HA   ASN   9           HA       ASN   9  -5.246 -13.124   7.833
   57   1HB   ASN   9          1HB       ASN   9  -7.811 -14.000   7.077
   58   2HB   ASN   9          2HB       ASN   9  -6.728 -15.024   6.123
   59   1HD2  ASN   9          1HD2      ASN   9  -4.954 -16.079   7.282
   60   2HD2  ASN   9          2HD2      ASN   9  -5.213 -16.654   8.895
   61    H    GLN  10           H        GLN  10  -5.588 -11.779   4.776
   62    HA   GLN  10           HA       GLN  10  -4.415 -13.679   3.125
   63   1HB   GLN  10          1HB       GLN  10  -4.275 -11.957   1.517
   64   2HB   GLN  10          2HB       GLN  10  -5.672 -11.504   2.509
   65   1HG   GLN  10          1HG       GLN  10  -4.258  -9.941   3.793
   66   2HG   GLN  10          2HG       GLN  10  -2.835 -10.423   2.858
   67   1HE2  GLN  10          1HE2      GLN  10  -2.898 -10.082   0.535
   68   2HE2  GLN  10          2HE2      GLN  10  -3.737  -8.713  -0.118
   69    H    CYS  11           H        CYS  11  -3.062 -11.105   5.238
   70    HA   CYS  11           HA       CYS  11  -0.450 -11.236   4.311
   71   1HB   CYS  11          1HB       CYS  11  -1.086  -9.402   5.635
   72   2HB   CYS  11          2HB       CYS  11  -1.645 -10.429   6.957
   73    H    ALA  12           H        ALA  12  -2.409 -13.583   5.848
   74    HA   ALA  12           HA       ALA  12  -0.119 -14.909   7.095
   75   1HB   ALA  12          1HB       ALA  12  -1.614 -15.621   8.618
   76   2HB   ALA  12          2HB       ALA  12  -2.798 -14.533   7.854
   77   3HB   ALA  12          3HB       ALA  12  -2.703 -16.238   7.352
   78    H    VAL  13           H        VAL  13  -0.690 -14.581   4.097
   79    HA   VAL  13           HA       VAL  13  -1.695 -16.754   2.877
   80    HB   VAL  13           HB       VAL  13   0.511 -16.347   1.376
   81   1HG1  VAL  13          1HG1      VAL  13  -0.831 -14.396   0.360
   82   2HG1  VAL  13          2HG1      VAL  13  -1.618 -15.991   0.444
   83   3HG1  VAL  13          3HG1      VAL  13  -2.029 -14.732   1.633
   84   1HG2  VAL  13          1HG2      VAL  13   0.148 -13.648   2.671
   85   2HG2  VAL  13          2HG2      VAL  13   1.335 -14.813   3.302
   86   3HG2  VAL  13          3HG2      VAL  13   1.465 -14.229   1.625
   87    HA   PRO  14           HA       PRO  14   0.761 -20.194   3.784
   88   1HB   PRO  14          1HB       PRO  14   0.994 -21.526   1.410
   89   2HB   PRO  14          2HB       PRO  14  -0.455 -21.588   2.411
   90   1HG   PRO  14          1HG       PRO  14   0.071 -20.090  -0.076
   91   2HG   PRO  14          2HG       PRO  14  -1.515 -20.528   0.657
   92   1HD   PRO  14          1HD       PRO  14  -0.204 -17.982   0.639
   93   2HD   PRO  14          2HD       PRO  14  -1.684 -18.399   1.510
   94    H    ALA  15           H        ALA  15   2.050 -17.690   2.243
   95    HA   ALA  15           HA       ALA  15   4.198 -17.042   2.230
   96   1HB   ALA  15          1HB       ALA  15   4.382 -19.297   3.816
   97   2HB   ALA  15          2HB       ALA  15   5.483 -19.688   2.473
   98   3HB   ALA  15          3HB       ALA  15   5.731 -18.204   3.424
   99    H    LYS  16           H        LYS  16   2.712 -17.421  -0.046
  100    HA   LYS  16           HA       LYS  16   4.614 -17.580  -2.018
  101   1HB   LYS  16          1HB       LYS  16   3.541 -19.849  -2.995
  102   2HB   LYS  16          2HB       LYS  16   5.055 -19.790  -2.074
  103   1HG   LYS  16          1HG       LYS  16   4.094 -20.703  -0.186
  104   2HG   LYS  16          2HG       LYS  16   2.499 -19.999  -0.511
  105   1HD   LYS  16          1HD       LYS  16   2.114 -22.258  -0.937
  106   2HD   LYS  16          2HD       LYS  16   2.502 -21.673  -2.564
  107   1HE   LYS  16          1HE       LYS  16   4.968 -22.302  -1.924
  108   2HE   LYS  16          2HE       LYS  16   4.226 -23.275  -0.645
  109   1HZ   LYS  16          1HZ       LYS  16   2.854 -23.781  -2.975
  110   2HZ   LYS  16          2HZ       LYS  16   4.438 -23.834  -3.370
  111   3HZ   LYS  16          3HZ       LYS  16   3.860 -24.789  -2.177
  112    H    ASP  17           H        ASP  17   2.588 -15.831  -1.347
  113    HA   ASP  17           HA       ASP  17   1.051 -15.971  -3.753
  114   1HB   ASP  17          1HB       ASP  17  -0.362 -17.178  -2.096
  115   2HB   ASP  17          2HB       ASP  17  -0.300 -15.774  -1.019
  116    H    ARG  18           H        ARG  18   3.115 -14.385  -1.886
  117    HA   ARG  18           HA       ARG  18   1.679 -11.904  -1.659
  118   1HB   ARG  18          1HB       ARG  18   4.606 -12.435  -1.000
  119   2HB   ARG  18          2HB       ARG  18   3.595 -11.118  -0.385
  120   1HG   ARG  18          1HG       ARG  18   2.699 -12.427   1.242
  121   2HG   ARG  18          2HG       ARG  18   2.485 -13.809   0.152
  122   1HD   ARG  18          1HD       ARG  18   4.885 -14.364   0.385
  123   2HD   ARG  18          2HD       ARG  18   5.128 -12.959   1.437
  124    HE   ARG  18           HE       ARG  18   3.081 -14.937   2.272
  125   1HH1  ARG  18          1HH1      ARG  18   6.340 -13.672   2.667
  126   2HH1  ARG  18          2HH1      ARG  18   6.573 -14.403   4.221
  127   1HH2  ARG  18          1HH2      ARG  18   3.387 -15.901   4.321
  128   2HH2  ARG  18          2HH2      ARG  18   4.881 -15.679   5.168
  129    H    VAL  19           H        VAL  19   3.289  -9.876  -2.263
  130    HA   VAL  19           HA       VAL  19   4.123 -10.408  -5.028
  131    HB   VAL  19           HB       VAL  19   3.421  -7.726  -3.853
  132   1HG1  VAL  19          1HG1      VAL  19   4.087  -7.070  -5.884
  133   2HG1  VAL  19          2HG1      VAL  19   4.202  -8.749  -6.464
  134   3HG1  VAL  19          3HG1      VAL  19   2.646  -7.888  -6.535
  135   1HG2  VAL  19          1HG2      VAL  19   1.489  -9.652  -5.191
  136   2HG2  VAL  19          2HG2      VAL  19   1.519  -9.261  -3.455
  137   3HG2  VAL  19          3HG2      VAL  19   1.133  -7.996  -4.645
  138    H    ASP  20           H        ASP  20   5.605 -10.756  -2.342
  139    HA   ASP  20           HA       ASP  20   7.462 -10.087  -1.351
  140   1HB   ASP  20          1HB       ASP  20   8.584 -11.494  -2.799
  141   2HB   ASP  20          2HB       ASP  20   8.048 -10.622  -4.243
  142    H    CYS  21           H        CYS  21   7.077  -7.910  -0.594
  143    HA   CYS  21           HA       CYS  21   6.973  -5.662  -2.152
  144   1HB   CYS  21          1HB       CYS  21   6.789  -6.227   0.514
  145   2HB   CYS  21          2HB       CYS  21   8.275  -5.273   0.455
  146    H    GLY  22           H        GLY  22   9.743  -7.554  -0.911
  147   1HA   GLY  22          1HA       GLY  22  11.950  -7.449  -1.316
  148   2HA   GLY  22          2HA       GLY  22  11.539  -6.690  -2.841
  149    H    TYR  23           H        TYR  23  11.379  -5.730   0.671
  150    HA   TYR  23           HA       TYR  23  12.276  -3.072  -0.078
  151   1HB   TYR  23          1HB       TYR  23  10.505  -4.225   1.763
  152   2HB   TYR  23          2HB       TYR  23  11.921  -3.934   2.779
  153    HD1  TYR  23           HD1      TYR  23  10.746  -1.834  -0.068
  154    HD2  TYR  23           HD2      TYR  23  11.117  -2.202   4.178
  155    HE1  TYR  23           HE1      TYR  23  10.033   0.590   0.211
  156    HE2  TYR  23           HE2      TYR  23  10.402   0.224   4.442
  157    HH   TYR  23           HH       TYR  23   9.151   2.035   1.771
  158    HA   PRO  24           HA       PRO  24  16.359  -3.807   1.173
  159   1HB   PRO  24          1HB       PRO  24  17.230  -1.234   1.452
  160   2HB   PRO  24          2HB       PRO  24  17.133  -2.054  -0.104
  161   1HG   PRO  24          1HG       PRO  24  15.359  -0.016   1.079
  162   2HG   PRO  24          2HG       PRO  24  15.537  -0.482  -0.652
  163   1HD   PRO  24          1HD       PRO  24  13.422  -1.144   1.162
  164   2HD   PRO  24          2HD       PRO  24  13.633  -1.758  -0.483
  165    H    HIS  25           H        HIS  25  14.045  -2.403   3.150
  166    HA   HIS  25           HA       HIS  25  15.818  -2.909   5.423
  167   1HB   HIS  25          1HB       HIS  25  14.487  -0.443   4.659
  168   2HB   HIS  25          2HB       HIS  25  13.992  -0.971   6.273
  169    HD1  HIS  25           HD1      HIS  25  16.218  -1.640   7.871
  170    HD2  HIS  25           HD2      HIS  25  16.773   1.018   4.673
  171    HE1  HIS  25           HE1      HIS  25  18.384  -0.380   8.355
  172    HE2  HIS  25           HE2      HIS  25  18.701   1.199   6.331
  173    H    VAL  26           H        VAL  26  14.243  -4.913   4.322
  174    HA   VAL  26           HA       VAL  26  11.630  -5.007   5.304
  175    HB   VAL  26           HB       VAL  26  12.136  -6.485   3.604
  176   1HG1  VAL  26          1HG1      VAL  26  14.684  -6.965   5.108
  177   2HG1  VAL  26          2HG1      VAL  26  14.078  -8.236   4.020
  178   3HG1  VAL  26          3HG1      VAL  26  14.424  -6.610   3.384
  179   1HG2  VAL  26          1HG2      VAL  26  11.446  -8.547   4.392
  180   2HG2  VAL  26          2HG2      VAL  26  12.478  -8.461   5.840
  181   3HG2  VAL  26          3HG2      VAL  26  10.990  -7.489   5.749
  182    H    THR  27           H        THR  27  10.898  -5.072   7.359
  183    HA   THR  27           HA       THR  27  12.041  -6.802   9.286
  184    HB   THR  27           HB       THR  27  13.325  -4.264   8.989
  185    HG1  THR  27           HG1      THR  27  14.613  -5.579  10.220
  186   1HG2  THR  27          1HG2      THR  27  13.019  -3.600  11.500
  187   2HG2  THR  27          2HG2      THR  27  11.759  -3.064  10.361
  188   3HG2  THR  27          3HG2      THR  27  11.474  -4.478  11.403
  189    HA   PRO  28           HA       PRO  28   8.099  -6.231  10.878
  190   1HB   PRO  28          1HB       PRO  28   8.396  -7.141  13.437
  191   2HB   PRO  28          2HB       PRO  28   8.204  -8.210  12.050
  192   1HG   PRO  28          1HG       PRO  28  10.622  -7.518  13.591
  193   2HG   PRO  28          2HG       PRO  28  10.341  -8.939  12.521
  194   1HD   PRO  28          1HD       PRO  28  11.888  -6.589  11.989
  195   2HD   PRO  28          2HD       PRO  28  11.510  -7.884  10.847
  196    H    LYS  29           H        LYS  29   8.998  -3.818  10.551
  197    HA   LYS  29           HA       LYS  29   7.696  -2.373  12.514
  198   1HB   LYS  29          1HB       LYS  29   9.497  -3.090  13.999
  199   2HB   LYS  29          2HB       LYS  29  10.703  -2.380  12.911
  200   1HG   LYS  29          1HG       LYS  29  10.277  -0.270  13.640
  201   2HG   LYS  29          2HG       LYS  29   8.522  -0.519  13.668
  202   1HD   LYS  29          1HD       LYS  29   8.688  -0.568  15.918
  203   2HD   LYS  29          2HD       LYS  29   9.488  -2.141  15.754
  204   1HE   LYS  29          1HE       LYS  29  11.445  -0.127  15.213
  205   2HE   LYS  29          2HE       LYS  29  10.588   0.374  16.678
  206   1HZ   LYS  29          1HZ       LYS  29  11.989  -1.053  17.622
  207   2HZ   LYS  29          2HZ       LYS  29  10.971  -2.219  17.101
  208   3HZ   LYS  29          3HZ       LYS  29  12.316  -1.865  16.244
  209    H    GLU  30           H        GLU  30  10.000  -2.732   9.880
  210    HA   GLU  30           HA       GLU  30   9.685   0.073   9.225
  211   1HB   GLU  30          1HB       GLU  30  11.715  -1.978   8.754
  212   2HB   GLU  30          2HB       GLU  30  11.295  -1.127   7.257
  213   1HG   GLU  30          1HG       GLU  30  12.394   0.726   7.930
  214   2HG   GLU  30          2HG       GLU  30  11.549   0.749   9.485
  215    H    CYS  31           H        CYS  31   9.167  -3.244   7.877
  216    HA   CYS  31           HA       CYS  31   8.072  -2.380   5.460
  217   1HB   CYS  31          1HB       CYS  31   8.125  -4.924   7.001
  218   2HB   CYS  31          2HB       CYS  31   6.939  -4.776   5.700
  219    H    ASN  32           H        ASN  32   6.541  -3.580   8.541
  220    HA   ASN  32           HA       ASN  32   3.950  -3.099   7.722
  221   1HB   ASN  32          1HB       ASN  32   5.382  -3.659  10.264
  222   2HB   ASN  32          2HB       ASN  32   3.864  -2.778  10.488
  223   1HD2  ASN  32          1HD2      ASN  32   5.135  -5.388   8.415
  224   2HD2  ASN  32          2HD2      ASN  32   3.825  -6.499   8.635
  225    H    ASN  33           H        ASN  33   6.480  -0.916   8.227
  226    HA   ASN  33           HA       ASN  33   4.704   1.152   9.236
  227   1HB   ASN  33          1HB       ASN  33   6.754   1.007  10.513
  228   2HB   ASN  33          2HB       ASN  33   7.747   0.932   9.049
  229   1HD2  ASN  33          1HD2      ASN  33   8.815   2.708   8.693
  230   2HD2  ASN  33          2HD2      ASN  33   8.297   4.333   8.995
  231    H    ARG  34           H        ARG  34   6.629  -0.019   6.498
  232    HA   ARG  34           HA       ARG  34   6.514   2.492   5.143
  233   1HB   ARG  34          1HB       ARG  34   7.906   1.498   3.520
  234   2HB   ARG  34          2HB       ARG  34   8.380   0.641   4.997
  235   1HG   ARG  34          1HG       ARG  34   8.086  -1.124   3.502
  236   2HG   ARG  34          2HG       ARG  34   6.485  -1.062   4.263
  237   1HD   ARG  34          1HD       ARG  34   5.606  -0.818   2.197
  238   2HD   ARG  34          2HD       ARG  34   6.367   0.779   2.107
  239    HE   ARG  34           HE       ARG  34   8.338  -1.172   1.465
  240   1HH1  ARG  34          1HH1      ARG  34   5.342   0.108   0.133
  241   2HH1  ARG  34          2HH1      ARG  34   5.781  -0.224  -1.509
  242   1HH2  ARG  34          1HH2      ARG  34   8.917  -1.611  -0.701
  243   2HH2  ARG  34          2HH2      ARG  34   7.828  -1.209  -1.987
  244    H    GLY  35           H        GLY  35   4.756  -0.588   5.300
  245   1HA   GLY  35          1HA       GLY  35   2.384  -0.265   4.580
  246   2HA   GLY  35          2HA       GLY  35   3.042   0.282   3.052
  247    H    CYS  36           H        CYS  36   4.757  -2.252   4.826
  248    HA   CYS  36           HA       CYS  36   3.676  -4.197   2.916
  249   1HB   CYS  36          1HB       CYS  36   6.500  -3.955   3.958
  250   2HB   CYS  36          2HB       CYS  36   5.893  -5.310   3.000
  251    H    CYS  37           H        CYS  37   4.301  -6.564   3.874
  252    HA   CYS  37           HA       CYS  37   3.653  -6.465   6.732
  253   1HB   CYS  37          1HB       CYS  37   1.822  -7.213   5.096
  254   2HB   CYS  37          2HB       CYS  37   2.774  -8.687   4.903
  255    H    PHE  38           H        PHE  38   5.151  -7.513   8.017
  256    HA   PHE  38           HA       PHE  38   7.281  -8.923   6.646
  257   1HB   PHE  38          1HB       PHE  38   7.546  -7.099   8.450
  258   2HB   PHE  38          2HB       PHE  38   6.823  -8.222   9.607
  259    HD1  PHE  38           HD1      PHE  38   8.156  -9.815  10.698
  260    HD2  PHE  38           HD2      PHE  38   9.715  -7.760   7.328
  261    HE1  PHE  38           HE1      PHE  38  10.429 -10.772  11.166
  262    HE2  PHE  38           HE2      PHE  38  11.988  -8.717   7.796
  263    HZ   PHE  38           HZ       PHE  38  12.318 -10.212   9.709
  264    H    ASP  39           H        ASP  39   7.314 -11.110   6.468
  265    HA   ASP  39           HA       ASP  39   5.358 -12.603   7.893
  266   1HB   ASP  39          1HB       ASP  39   5.620 -13.629   5.870
  267   2HB   ASP  39          2HB       ASP  39   7.271 -13.025   5.663
  268    H    SER  40           H        SER  40   8.812 -13.530   7.308
  269    HA   SER  40           HA       SER  40  10.477 -13.882   8.717
  270   1HB   SER  40          1HB       SER  40   8.964 -12.308  10.343
  271   2HB   SER  40          2HB       SER  40   8.917 -13.823  11.262
  272    HG   SER  40           HG       SER  40  10.743 -12.797  11.996
  273    H    ARG  41           H        ARG  41   7.301 -15.355   8.912
  274    HA   ARG  41           HA       ARG  41   7.931 -17.542  10.478
  275   1HB   ARG  41          1HB       ARG  41   5.985 -17.585   8.138
  276   2HB   ARG  41          2HB       ARG  41   5.868 -18.496   9.654
  277   1HG   ARG  41          1HG       ARG  41   5.783 -16.153  10.792
  278   2HG   ARG  41          2HG       ARG  41   5.417 -15.530   9.174
  279   1HD   ARG  41          1HD       ARG  41   3.833 -17.550  10.811
  280   2HD   ARG  41          2HD       ARG  41   3.302 -15.946  10.285
  281    HE   ARG  41           HE       ARG  41   3.004 -16.792   8.065
  282   1HH1  ARG  41          1HH1      ARG  41   4.220 -19.253  10.267
  283   2HH1  ARG  41          2HH1      ARG  41   3.843 -20.570   9.206
  284   1HH2  ARG  41          1HH2      ARG  41   2.506 -18.529   6.665
  285   2HH2  ARG  41          2HH2      ARG  41   2.862 -20.154   7.144
  286    H    ILE  42           H        ILE  42   8.125 -16.954   6.915
  287    HA   ILE  42           HA       ILE  42   9.696 -19.429   6.718
  288    HB   ILE  42           HB       ILE  42   8.138 -18.301   4.422
  289   1HG1  ILE  42          1HG1      ILE  42   7.058 -19.682   6.819
  290   2HG1  ILE  42          2HG1      ILE  42   6.287 -18.512   5.732
  291   1HG2  ILE  42          1HG2      ILE  42   9.948 -20.141   4.284
  292   2HG2  ILE  42          2HG2      ILE  42   8.719 -21.193   5.027
  293   3HG2  ILE  42          3HG2      ILE  42   8.389 -20.406   3.464
  294   1HD1  ILE  42          1HD1      ILE  42   6.602 -21.502   5.433
  295   2HD1  ILE  42          2HD1      ILE  42   5.162 -20.489   5.174
  296   3HD1  ILE  42          3HD1      ILE  42   6.475 -20.492   3.973
  297    HA   PRO  43           HA       PRO  43  12.665 -16.409   5.583
  298   1HB   PRO  43          1HB       PRO  43  14.852 -18.029   5.813
  299   2HB   PRO  43          2HB       PRO  43  14.176 -17.123   7.166
  300   1HG   PRO  43          1HG       PRO  43  13.965 -19.991   6.510
  301   2HG   PRO  43          2HG       PRO  43  13.701 -19.179   8.094
  302   1HD   PRO  43          1HD       PRO  43  11.747 -20.205   6.270
  303   2HD   PRO  43          2HD       PRO  43  11.431 -19.272   7.740
  304    H    GLY  44           H        GLY  44  11.602 -19.117   3.997
  305   1HA   GLY  44          1HA       GLY  44  13.453 -18.802   1.759
  306   2HA   GLY  44          2HA       GLY  44  12.230 -20.040   1.969
  307    H    VAL  45           H        VAL  45  10.667 -17.247   2.882
  308    HA   VAL  45           HA       VAL  45   9.823 -16.688   0.123
  309    HB   VAL  45           HB       VAL  45   7.624 -16.745   0.715
  310   1HG1  VAL  45          1HG1      VAL  45   8.418 -19.005   0.947
  311   2HG1  VAL  45          2HG1      VAL  45   8.952 -18.701   2.617
  312   3HG1  VAL  45          3HG1      VAL  45   7.215 -18.706   2.225
  313   1HG2  VAL  45          1HG2      VAL  45   7.869 -15.071   2.548
  314   2HG2  VAL  45          2HG2      VAL  45   6.697 -16.360   2.916
  315   3HG2  VAL  45          3HG2      VAL  45   8.319 -16.395   3.650
  316    HA   PRO  46           HA       PRO  46  10.217 -12.473   1.071
  317   1HB   PRO  46          1HB       PRO  46   7.865 -11.244   0.422
  318   2HB   PRO  46          2HB       PRO  46   9.059 -11.736  -0.778
  319   1HG   PRO  46          1HG       PRO  46   6.489 -12.980  -0.039
  320   2HG   PRO  46          2HG       PRO  46   7.446 -13.193  -1.548
  321   1HD   PRO  46          1HD       PRO  46   7.184 -14.994   0.663
  322   2HD   PRO  46          2HD       PRO  46   8.263 -15.179  -0.727
  323    H    TRP  47           H        TRP  47  10.676 -11.622   2.990
  324    HA   TRP  47           HA       TRP  47   8.633 -11.965   5.028
  325   1HB   TRP  47          1HB       TRP  47  11.107 -10.607   5.776
  326   2HB   TRP  47          2HB       TRP  47  10.298 -11.995   6.506
  327    HD1  TRP  47           HD1      TRP  47  10.853 -14.454   5.200
  328    HE1  TRP  47           HE1      TRP  47  13.057 -15.366   4.072
  329    HE3  TRP  47           HE3      TRP  47  13.044  -9.907   4.584
  330    HZ2  TRP  47           HZ2      TRP  47  15.417 -14.111   3.071
  331    HZ3  TRP  47           HZ3      TRP  47  15.298  -9.838   3.523
  332    HH2  TRP  47           HH2      TRP  47  16.481 -11.843   2.777
  333    H    CYS  48           H        CYS  48   8.295 -10.119   2.675
  334    HA   CYS  48           HA       CYS  48   7.352  -7.902   4.127
  335   1HB   CYS  48          1HB       CYS  48   9.731  -7.302   4.124
  336   2HB   CYS  48          2HB       CYS  48   9.750  -7.364   2.359
  337    H    PHE  49           H        PHE  49   5.396  -7.910   3.051
  338    HA   PHE  49           HA       PHE  49   5.503  -7.582   0.160
  339   1HB   PHE  49          1HB       PHE  49   3.320  -9.219   0.472
  340   2HB   PHE  49          2HB       PHE  49   4.926  -9.857   0.104
  341    HD1  PHE  49           HD1      PHE  49   6.416 -10.247   2.296
  342    HD2  PHE  49           HD2      PHE  49   2.173 -10.178   2.205
  343    HE1  PHE  49           HE1      PHE  49   6.348 -11.596   4.412
  344    HE2  PHE  49           HE2      PHE  49   2.106 -11.527   4.321
  345    HZ   PHE  49           HZ       PHE  49   4.194 -12.219   5.399
  346    H    LYS  50           H        LYS  50   2.772  -7.591  -0.381
  347    HA   LYS  50           HA       LYS  50   1.755  -5.542   1.462
  348   1HB   LYS  50          1HB       LYS  50   0.684  -4.541  -0.604
  349   2HB   LYS  50          2HB       LYS  50   2.434  -4.323  -0.434
  350   1HG   LYS  50          1HG       LYS  50   1.873  -6.807  -1.821
  351   2HG   LYS  50          2HG       LYS  50   1.016  -5.478  -2.623
  352   1HD   LYS  50          1HD       LYS  50   3.992  -5.673  -2.012
  353   2HD   LYS  50          2HD       LYS  50   3.234  -5.683  -3.614
  354   1HE   LYS  50          1HE       LYS  50   2.297  -3.328  -2.383
  355   2HE   LYS  50          2HE       LYS  50   4.005  -3.414  -1.921
  356   1HZ   LYS  50          1HZ       LYS  50   3.387  -3.996  -4.672
  357   2HZ   LYS  50          2HZ       LYS  50   3.167  -2.445  -4.211
  358   3HZ   LYS  50          3HZ       LYS  50   4.631  -3.149  -4.040
  359    HA   PRO  51           HA       PRO  51  -1.165  -8.992   1.090
  360   1HB   PRO  51          1HB       PRO  51  -1.367  -9.597   3.747
  361   2HB   PRO  51          2HB       PRO  51  -0.281 -10.441   2.646
  362   1HG   PRO  51          1HG       PRO  51   0.303  -8.380   4.676
  363   2HG   PRO  51          2HG       PRO  51   1.431  -9.561   3.918
  364   1HD   PRO  51          1HD       PRO  51   1.167  -6.758   3.389
  365   2HD   PRO  51          2HD       PRO  51   2.180  -7.908   2.507
  366    H    LEU  52           H        LEU  52  -1.930  -8.052   4.285
  367    HA   LEU  52           HA       LEU  52  -4.328  -6.797   3.226
  368   1HB   LEU  52          1HB       LEU  52  -5.356  -7.467   5.074
  369   2HB   LEU  52          2HB       LEU  52  -4.000  -8.605   5.178
  370    HG   LEU  52           HG       LEU  52  -4.540  -6.110   6.771
  371   1HD1  LEU  52          1HD1      LEU  52  -4.367  -9.019   7.266
  372   2HD1  LEU  52          2HD1      LEU  52  -3.621  -7.979   8.503
  373   3HD1  LEU  52          3HD1      LEU  52  -5.336  -7.764   8.074
  374   1HD2  LEU  52          1HD2      LEU  52  -2.401  -5.537   6.863
  375   2HD2  LEU  52          2HD2      LEU  52  -2.015  -7.135   7.544
  376   3HD2  LEU  52          3HD2      LEU  52  -1.963  -6.882   5.783
  377    H    GLN  53           H        GLN  53  -1.726  -5.470   2.889
  378    HA   GLN  53           HA       GLN  53  -1.212  -3.607   4.813
  379   1HB   GLN  53          1HB       GLN  53  -0.964  -3.392   1.789
  380   2HB   GLN  53          2HB       GLN  53  -0.207  -2.263   2.928
  381   1HG   GLN  53          1HG       GLN  53   0.310  -5.252   2.652
  382   2HG   GLN  53          2HG       GLN  53   1.441  -3.942   2.280
  383   1HE2  GLN  53          1HE2      GLN  53   0.004  -5.944   4.683
  384   2HE2  GLN  53          2HE2      GLN  53   0.907  -5.405   6.059
  385    H    GLU  54           H        GLU  54  -3.990  -3.918   2.756
  386    HA   GLU  54           HA       GLU  54  -4.788  -1.454   2.180
  387   1HB   GLU  54          1HB       GLU  54  -7.104  -2.243   2.438
  388   2HB   GLU  54          2HB       GLU  54  -6.093  -3.504   1.712
  389   1HG   GLU  54          1HG       GLU  54  -6.219  -4.858   3.577
  390   2HG   GLU  54          2HG       GLU  54  -6.322  -3.497   4.704
  391    H    ALA  55           H        ALA  55  -4.336  -2.793   5.402
  392    HA   ALA  55           HA       ALA  55  -5.966  -1.439   7.024
  393   1HB   ALA  55          1HB       ALA  55  -4.194  -2.965   7.770
  394   2HB   ALA  55          2HB       ALA  55  -2.953  -1.769   7.324
  395   3HB   ALA  55          3HB       ALA  55  -4.089  -1.421   8.649
  396    H    GLU  56           H        GLU  56  -2.704  -0.046   6.231
  397    HA   GLU  56           HA       GLU  56  -4.049   2.540   6.133
  398   1HB   GLU  56          1HB       GLU  56  -1.760   1.621   7.762
  399   2HB   GLU  56          2HB       GLU  56  -1.474   3.160   6.929
  400   1HG   GLU  56          1HG       GLU  56  -3.502   4.109   7.915
  401   2HG   GLU  56          2HG       GLU  56  -3.926   2.554   8.648
  402    H    CYS  57           H        CYS  57  -3.214   0.478   4.034
  403    HA   CYS  57           HA       CYS  57  -1.176   2.041   2.649
  404   1HB   CYS  57          1HB       CYS  57  -1.007  -0.494   3.042
  405   2HB   CYS  57          2HB       CYS  57  -2.218  -0.641   1.766
  406    H    THR  58           H        THR  58  -4.296   0.258   2.026
  407    HA   THR  58           HA       THR  58  -4.791   1.711  -0.377
  408    HB   THR  58           HB       THR  58  -5.545  -0.705   0.516
  409    HG1  THR  58           HG1      THR  58  -7.513  -0.203  -0.959
  410   1HG2  THR  58          1HG2      THR  58  -6.946   0.305   2.405
  411   2HG2  THR  58          2HG2      THR  58  -7.957   1.069   1.155
  412   3HG2  THR  58          3HG2      THR  58  -7.873  -0.705   1.270
  413    H    PHE  59           H        PHE  59  -5.698   2.078   3.052
  414    HA   PHE  59           HA       PHE  59  -7.816   3.627   3.081
  415   1HB   PHE  59          1HB       PHE  59  -5.762   3.083   4.772
  416   2HB   PHE  59          2HB       PHE  59  -5.292   4.736   4.363
  417    HD1  PHE  59           HD1      PHE  59  -6.591   6.613   5.149
  418    HD2  PHE  59           HD2      PHE  59  -7.804   2.640   6.018
  419    HE1  PHE  59           HE1      PHE  59  -8.191   7.479   6.877
  420    HE2  PHE  59           HE2      PHE  59  -9.404   3.508   7.747
  421    HZ   PHE  59           HZ       PHE  59  -9.579   5.916   8.156
  422   1H    GLU   1           H1       GLU   1 -21.348   6.666   2.206
  423    HA   GLU   1           HA       GLU   1 -20.489   6.609  -0.272
  424   1HB   GLU   1          1HB       GLU   1 -18.135   6.438   0.658
  425   2HB   GLU   1          2HB       GLU   1 -19.162   7.652   1.441
  426   1HG   GLU   1          1HG       GLU   1 -19.729   5.672   3.098
  427   2HG   GLU   1          2HG       GLU   1 -18.227   4.967   2.482
  428    H    GLU   2           H        GLU   2 -20.425   5.045  -1.822
  429    HA   GLU   2           HA       GLU   2 -20.108   2.319  -0.959
  430   1HB   GLU   2          1HB       GLU   2 -21.838   3.168  -2.666
  431   2HB   GLU   2          2HB       GLU   2 -20.494   3.283  -3.815
  432   1HG   GLU   2          1HG       GLU   2 -20.921   1.108  -4.280
  433   2HG   GLU   2          2HG       GLU   2 -20.166   0.738  -2.723
  434    H    TYR   3           H        TYR   3 -19.023   2.158  -4.036
  435    HA   TYR   3           HA       TYR   3 -16.313   1.792  -3.213
  436   1HB   TYR   3          1HB       TYR   3 -17.433   1.990  -6.051
  437   2HB   TYR   3          2HB       TYR   3 -16.157   0.912  -5.479
  438    HD1  TYR   3           HD1      TYR   3 -17.781   0.024  -2.950
  439    HD2  TYR   3           HD2      TYR   3 -18.717   0.248  -7.119
  440    HE1  TYR   3           HE1      TYR   3 -19.499  -1.829  -2.671
  441    HE2  TYR   3           HE2      TYR   3 -20.432  -1.606  -6.826
  442    HH   TYR   3           HH       TYR   3 -20.575  -3.498  -4.001
  443    H    VAL   4           H        VAL   4 -15.968   4.083  -2.447
  444    HA   VAL   4           HA       VAL   4 -15.131   5.714  -4.738
  445    HB   VAL   4           HB       VAL   4 -15.768   7.703  -3.355
  446   1HG1  VAL   4          1HG1      VAL   4 -18.342   6.301  -3.762
  447   2HG1  VAL   4          2HG1      VAL   4 -17.739   7.826  -4.454
  448   3HG1  VAL   4          3HG1      VAL   4 -17.231   6.271  -5.153
  449   1HG2  VAL   4          1HG2      VAL   4 -16.000   7.004  -1.156
  450   2HG2  VAL   4          2HG2      VAL   4 -17.697   7.119  -1.683
  451   3HG2  VAL   4          3HG2      VAL   4 -16.894   5.531  -1.605
  452    H    GLY   5           H        GLY   5 -14.897   5.402  -1.119
  453   1HA   GLY   5          1HA       GLY   5 -12.318   6.567  -0.992
  454   2HA   GLY   5          2HA       GLY   5 -13.138   5.659   0.262
  455    H    LEU   6           H        LEU   6 -13.167   3.778  -2.563
  456    HA   LEU   6           HA       LEU   6 -10.509   2.703  -2.232
  457   1HB   LEU   6          1HB       LEU   6 -12.035   0.410  -2.091
  458   2HB   LEU   6          2HB       LEU   6 -11.056   1.125  -0.798
  459    HG   LEU   6           HG       LEU   6 -13.427   0.478  -0.208
  460   1HD1  LEU   6          1HD1      LEU   6 -13.253   1.907   1.488
  461   2HD1  LEU   6          2HD1      LEU   6 -11.843   2.595   0.646
  462   3HD1  LEU   6          3HD1      LEU   6 -13.454   3.319   0.422
  463   1HD2  LEU   6          1HD2      LEU   6 -15.170   1.219  -1.364
  464   2HD2  LEU   6          2HD2      LEU   6 -14.663   2.910  -1.140
  465   3HD2  LEU   6          3HD2      LEU   6 -14.039   1.968  -2.516
  466    H    SER   7           H        SER   7 -12.124   4.143  -4.281
  467    HA   SER   7           HA       SER   7 -12.401   1.997  -6.226
  468   1HB   SER   7          1HB       SER   7 -14.155   3.122  -7.084
  469   2HB   SER   7          2HB       SER   7 -14.106   4.107  -5.611
  470    HG   SER   7           HG       SER   7 -14.094   5.436  -7.512
  471    H    ALA   8           H        ALA   8 -11.778   2.784  -8.586
  472    HA   ALA   8           HA       ALA   8  -9.034   3.517  -8.473
  473   1HB   ALA   8          1HB       ALA   8 -10.230   1.908 -10.090
  474   2HB   ALA   8          2HB       ALA   8 -10.790   3.367 -10.942
  475   3HB   ALA   8          3HB       ALA   8  -9.048   3.034 -10.798
  476    H    ASN   9           H        ASN   9 -11.800   5.340  -8.090
  477    HA   ASN   9           HA       ASN   9 -10.762   7.566  -9.626
  478   1HB   ASN   9          1HB       ASN   9 -13.361   6.637  -9.121
  479   2HB   ASN   9          2HB       ASN   9 -13.224   8.043  -8.053
  480   1HD2  ASN   9          1HD2      ASN   9 -12.737  10.078  -8.933
  481   2HD2  ASN   9          2HD2      ASN   9 -13.058  10.469 -10.590
  482    H    GLN  10           H        GLN  10 -10.397   6.150  -6.610
  483    HA   GLN  10           HA       GLN  10 -10.777   8.291  -4.875
  484   1HB   GLN  10          1HB       GLN  10 -10.000   5.593  -4.709
  485   2HB   GLN  10          2HB       GLN  10  -8.633   6.492  -4.028
  486   1HG   GLN  10          1HG       GLN  10 -11.322   7.422  -3.167
  487   2HG   GLN  10          2HG       GLN  10 -10.901   5.788  -2.631
  488   1HE2  GLN  10          1HE2      GLN  10  -8.578   5.601  -1.815
  489   2HE2  GLN  10          2HE2      GLN  10  -8.037   6.820  -0.709
  490    H    CYS  11           H        CYS  11  -7.956   7.163  -6.809
  491    HA   CYS  11           HA       CYS  11  -6.146   8.986  -5.657
  492   1HB   CYS  11          1HB       CYS  11  -5.432   6.945  -6.761
  493   2HB   CYS  11          2HB       CYS  11  -6.053   7.531  -8.308
  494    H    ALA  12           H        ALA  12  -8.929   9.465  -7.473
  495    HA   ALA  12           HA       ALA  12  -7.818  11.791  -8.875
  496   1HB   ALA  12          1HB       ALA  12 -10.533  10.485  -9.267
  497   2HB   ALA  12          2HB       ALA  12  -9.692  11.619 -10.352
  498   3HB   ALA  12          3HB       ALA  12  -9.074   9.964 -10.141
  499    H    VAL  13           H        VAL  13  -8.502  11.410  -5.895
  500    HA   VAL  13           HA       VAL  13 -10.815  12.550  -5.120
  501    HB   VAL  13           HB       VAL  13  -9.115  13.717  -3.389
  502   1HG1  VAL  13          1HG1      VAL  13  -9.163  11.540  -2.130
  503   2HG1  VAL  13          2HG1      VAL  13 -10.748  12.084  -2.732
  504   3HG1  VAL  13          3HG1      VAL  13  -9.873  10.785  -3.578
  505   1HG2  VAL  13          1HG2      VAL  13  -7.505  11.340  -4.325
  506   2HG2  VAL  13          2HG2      VAL  13  -7.201  12.977  -4.954
  507   3HG2  VAL  13          3HG2      VAL  13  -7.034  12.647  -3.213
  508    HA   PRO  14           HA       PRO  14 -10.854  16.692  -6.356
  509   1HB   PRO  14          1HB       PRO  14 -11.866  18.049  -4.212
  510   2HB   PRO  14          2HB       PRO  14 -12.868  17.118  -5.323
  511   1HG   PRO  14          1HG       PRO  14 -11.947  16.466  -2.596
  512   2HG   PRO  14          2HG       PRO  14 -13.328  15.762  -3.515
  513   1HD   PRO  14          1HD       PRO  14 -10.763  14.601  -2.990
  514   2HD   PRO  14          2HD       PRO  14 -12.027  13.938  -4.031
  515    H    ALA  15           H        ALA  15  -8.578  15.664  -4.336
  516    HA   ALA  15           HA       ALA  15  -6.519  16.499  -4.040
  517   1HB   ALA  15          1HB       ALA  15  -5.829  18.261  -5.286
  518   2HB   ALA  15          2HB       ALA  15  -7.475  18.233  -5.965
  519   3HB   ALA  15          3HB       ALA  15  -7.083  19.338  -4.625
  520    H    LYS  16           H        LYS  16  -8.345  16.084  -1.999
  521    HA   LYS  16           HA       LYS  16  -7.266  17.501   0.082
  522   1HB   LYS  16          1HB       LYS  16  -9.588  18.787   0.547
  523   2HB   LYS  16          2HB       LYS  16  -8.172  19.545  -0.205
  524   1HG   LYS  16          1HG       LYS  16  -9.166  19.643  -2.262
  525   2HG   LYS  16          2HG       LYS  16  -9.986  18.083  -2.069
  526   1HD   LYS  16          1HD       LYS  16 -11.740  19.670  -2.078
  527   2HD   LYS  16          2HD       LYS  16 -11.504  19.323  -0.356
  528   1HE   LYS  16          1HE       LYS  16  -9.840  21.360  -0.451
  529   2HE   LYS  16          2HE       LYS  16 -10.699  21.780  -1.941
  530   1HZ   LYS  16          1HZ       LYS  16 -11.505  22.155   0.696
  531   2HZ   LYS  16          2HZ       LYS  16 -12.264  22.626  -0.672
  532   3HZ   LYS  16          3HZ       LYS  16 -12.581  21.161  -0.025
  533    H    ASP  17           H        ASP  17  -7.866  14.839  -0.561
  534    HA   ASP  17           HA       ASP  17  -9.634  14.273   1.640
  535   1HB   ASP  17          1HB       ASP  17 -11.103  14.196  -0.340
  536   2HB   ASP  17          2HB       ASP  17  -9.987  13.088  -1.154
  537    H    ARG  18           H        ARG  18  -6.684  14.068   0.387
  538    HA   ARG  18           HA       ARG  18  -6.344  11.218   0.531
  539   1HB   ARG  18          1HB       ARG  18  -4.182  13.327   0.146
  540   2HB   ARG  18          2HB       ARG  18  -4.107  11.620  -0.320
  541   1HG   ARG  18          1HG       ARG  18  -5.275  11.970  -2.249
  542   2HG   ARG  18          2HG       ARG  18  -6.371  13.149  -1.506
  543   1HD   ARG  18          1HD       ARG  18  -4.649  14.888  -1.655
  544   2HD   ARG  18          2HD       ARG  18  -3.466  13.722  -2.266
  545    HE   ARG  18           HE       ARG  18  -5.974  14.060  -3.818
  546   1HH1  ARG  18          1HH1      ARG  18  -2.540  14.759  -3.501
  547   2HH1  ARG  18          2HH1      ARG  18  -2.353  15.232  -5.157
  548   1HH2  ARG  18          1HH2      ARG  18  -5.728  14.683  -6.002
  549   2HH2  ARG  18          2HH2      ARG  18  -4.178  15.189  -6.590
  550    H    VAL  19           H        VAL  19  -4.072  10.618   1.751
  551    HA   VAL  19           HA       VAL  19  -4.338  11.807   4.421
  552    HB   VAL  19           HB       VAL  19  -3.058   9.167   3.752
  553   1HG1  VAL  19          1HG1      VAL  19  -2.591   9.981   5.972
  554   2HG1  VAL  19          2HG1      VAL  19  -4.311  10.336   6.257
  555   3HG1  VAL  19          3HG1      VAL  19  -3.766   8.649   6.098
  556   1HG2  VAL  19          1HG2      VAL  19  -5.445   8.334   4.604
  557   2HG2  VAL  19          2HG2      VAL  19  -5.964   9.860   3.849
  558   3HG2  VAL  19          3HG2      VAL  19  -5.108   8.635   2.882
  559    H    ASP  20           H        ASP  20  -2.760  12.714   1.909
  560    HA   ASP  20           HA       ASP  20  -0.692  13.226   1.328
  561   1HB   ASP  20          1HB       ASP  20  -0.992  15.167   2.554
  562   2HB   ASP  20          2HB       ASP  20  -1.205  14.302   4.084
  563    H    CYS  21           H        CYS  21   0.273  11.053   1.117
  564    HA   CYS  21           HA       CYS  21   1.193   9.478   3.122
  565   1HB   CYS  21          1HB       CYS  21   1.207   9.320   0.457
  566   2HB   CYS  21          2HB       CYS  21   2.915   9.693   0.708
  567    H    GLY  22           H        GLY  22   2.615  12.434   1.676
  568   1HA   GLY  22          1HA       GLY  22   4.451  13.640   2.184
  569   2HA   GLY  22          2HA       GLY  22   4.038  13.266   3.845
  570    H    TYR  23           H        TYR  23   5.497  11.549   0.982
  571    HA   TYR  23           HA       TYR  23   7.255  10.123   2.808
  572   1HB   TYR  23          1HB       TYR  23   5.970   9.825   0.203
  573   2HB   TYR  23          2HB       TYR  23   7.715   9.675  -0.031
  574    HD1  TYR  23           HD1      TYR  23   4.707   8.158   1.414
  575    HD2  TYR  23           HD2      TYR  23   8.951   7.811   1.003
  576    HE1  TYR  23           HE1      TYR  23   4.591   5.739   2.191
  577    HE2  TYR  23           HE2      TYR  23   8.822   5.394   1.780
  578    HH   TYR  23           HH       TYR  23   7.558   3.831   2.585
  579    HA   PRO  24           HA       PRO  24  10.640  12.680   1.931
  580   1HB   PRO  24          1HB       PRO  24  12.683  11.052   2.726
  581   2HB   PRO  24          2HB       PRO  24  11.724  12.013   3.850
  582   1HG   PRO  24          1HG       PRO  24  11.624   9.123   3.262
  583   2HG   PRO  24          2HG       PRO  24  11.006   9.996   4.710
  584   1HD   PRO  24          1HD       PRO  24   9.520   8.921   2.512
  585   2HD   PRO  24          2HD       PRO  24   8.884   9.912   3.833
  586    H    HIS  25           H        HIS  25   9.954   9.899   0.248
  587    HA   HIS  25           HA       HIS  25  12.035  10.620  -1.686
  588   1HB   HIS  25          1HB       HIS  25  11.378   8.070  -0.456
  589   2HB   HIS  25          2HB       HIS  25  11.301   7.982  -2.220
  590    HD1  HIS  25           HD1      HIS  25  13.687  10.041  -2.739
  591    HD2  HIS  25           HD2      HIS  25  13.789   6.737  -0.156
  592    HE1  HIS  25           HE1      HIS  25  16.146   9.418  -2.473
  593    HE2  HIS  25           HE2      HIS  25  16.151   7.418  -0.832
  594    H    VAL  26           H        VAL  26   8.960  11.222  -1.061
  595    HA   VAL  26           HA       VAL  26   7.260  10.217  -2.838
  596    HB   VAL  26           HB       VAL  26   6.511  11.895  -1.411
  597   1HG1  VAL  26          1HG1      VAL  26   7.924  14.227  -2.517
  598   2HG1  VAL  26          2HG1      VAL  26   7.629  13.756  -0.825
  599   3HG1  VAL  26          3HG1      VAL  26   8.992  13.045  -1.722
  600   1HG2  VAL  26          1HG2      VAL  26   5.220  13.266  -2.782
  601   2HG2  VAL  26          2HG2      VAL  26   6.522  13.474  -3.976
  602   3HG2  VAL  26          3HG2      VAL  26   5.653  11.925  -3.870
  603    H    THR  27           H        THR  27   7.118   9.905  -5.005
  604    HA   THR  27           HA       THR  27   8.100  11.788  -6.873
  605    HB   THR  27           HB       THR  27   9.999   9.854  -5.823
  606    HG1  THR  27           HG1      THR  27  10.521  12.020  -6.435
  607   1HG2  THR  27          1HG2      THR  27  10.785   9.350  -8.321
  608   2HG2  THR  27          2HG2      THR  27   9.637   8.249  -7.522
  609   3HG2  THR  27          3HG2      THR  27   9.045   9.468  -8.677
  610    HA   PRO  28           HA       PRO  28   5.307   9.587  -9.270
  611   1HB   PRO  28          1HB       PRO  28   6.035  10.321 -11.798
  612   2HB   PRO  28          2HB       PRO  28   5.066  11.343 -10.740
  613   1HG   PRO  28          1HG       PRO  28   7.922  11.525 -11.457
  614   2HG   PRO  28          2HG       PRO  28   6.847  12.807 -10.791
  615   1HD   PRO  28          1HD       PRO  28   8.876  11.303  -9.440
  616   2HD   PRO  28          2HD       PRO  28   7.738  12.440  -8.703
  617    H    LYS  29           H        LYS  29   7.134   7.875  -8.261
  618    HA   LYS  29           HA       LYS  29   6.947   5.771 -10.047
  619   1HB   LYS  29          1HB       LYS  29   8.720   7.367 -11.154
  620   2HB   LYS  29          2HB       LYS  29   9.820   6.615  -9.989
  621   1HG   LYS  29          1HG       LYS  29   9.866   4.680 -11.158
  622   2HG   LYS  29          2HG       LYS  29   8.102   4.633 -11.313
  623   1HD   LYS  29          1HD       LYS  29   8.241   6.249 -13.193
  624   2HD   LYS  29          2HD       LYS  29  10.005   6.285 -13.040
  625   1HE   LYS  29          1HE       LYS  29  10.082   4.534 -14.460
  626   2HE   LYS  29          2HE       LYS  29   9.321   3.539 -13.209
  627   1HZ   LYS  29          1HZ       LYS  29   8.157   3.657 -15.386
  628   2HZ   LYS  29          2HZ       LYS  29   7.225   4.029 -14.097
  629   3HZ   LYS  29          3HZ       LYS  29   7.790   5.215 -15.066
  630    H    GLU  30           H        GLU  30   8.064   7.409  -7.209
  631    HA   GLU  30           HA       GLU  30   9.018   4.907  -6.093
  632   1HB   GLU  30          1HB       GLU  30   9.575   7.756  -5.646
  633   2HB   GLU  30          2HB       GLU  30   9.317   6.874  -4.131
  634   1HG   GLU  30          1HG       GLU  30  11.132   5.434  -4.519
  635   2HG   GLU  30          2HG       GLU  30  11.118   5.708  -6.269
  636    H    CYS  31           H        CYS  31   6.608   7.548  -5.583
  637    HA   CYS  31           HA       CYS  31   5.515   6.635  -3.237
  638   1HB   CYS  31          1HB       CYS  31   4.359   8.159  -5.554
  639   2HB   CYS  31          2HB       CYS  31   3.389   7.765  -4.132
  640    H    ASN  32           H        ASN  32   4.510   5.966  -6.674
  641    HA   ASN  32           HA       ASN  32   2.519   4.178  -6.004
  642   1HB   ASN  32          1HB       ASN  32   4.122   4.856  -8.439
  643   2HB   ASN  32          2HB       ASN  32   3.322   3.279  -8.474
  644   1HD2  ASN  32          1HD2      ASN  32   2.473   6.444  -7.081
  645   2HD2  ASN  32          2HD2      ASN  32   0.950   6.636  -7.881
  646    H    ASN  33           H        ASN  33   5.924   3.971  -5.659
  647    HA   ASN  33           HA       ASN  33   6.008   1.122  -6.094
  648   1HB   ASN  33          1HB       ASN  33   7.862   2.886  -6.713
  649   2HB   ASN  33          2HB       ASN  33   8.291   2.812  -4.998
  650   1HD2  ASN  33          1HD2      ASN  33  10.316   2.091  -6.145
  651   2HD2  ASN  33          2HD2      ASN  33  10.537   0.391  -6.396
  652    H    ARG  34           H        ARG  34   5.924   3.625  -3.560
  653    HA   ARG  34           HA       ARG  34   6.648   1.766  -1.515
  654   1HB   ARG  34          1HB       ARG  34   5.458   4.521  -1.056
  655   2HB   ARG  34          2HB       ARG  34   6.612   3.647  -0.035
  656   1HG   ARG  34          1HG       ARG  34   7.892   3.878  -2.529
  657   2HG   ARG  34          2HG       ARG  34   7.103   5.447  -2.299
  658   1HD   ARG  34          1HD       ARG  34   8.496   6.017  -0.581
  659   2HD   ARG  34          2HD       ARG  34   8.473   4.392   0.121
  660    HE   ARG  34           HE       ARG  34  10.485   5.475  -1.631
  661   1HH1  ARG  34          1HH1      ARG  34   8.739   2.492  -0.971
  662   2HH1  ARG  34          2HH1      ARG  34  10.002   1.469  -1.570
  663   1HH2  ARG  34          1HH2      ARG  34  12.152   4.127  -2.422
  664   2HH2  ARG  34          2HH2      ARG  34  11.957   2.406  -2.401
  665    H    GLY  35           H        GLY  35   3.762   3.039  -3.087
  666   1HA   GLY  35          1HA       GLY  35   1.790   1.617  -2.799
  667   2HA   GLY  35          2HA       GLY  35   2.080   1.669  -1.072
  668    H    CYS  36           H        CYS  36   2.725   4.552  -3.031
  669    HA   CYS  36           HA       CYS  36   0.262   5.720  -1.951
  670   1HB   CYS  36          1HB       CYS  36   2.923   7.091  -2.349
  671   2HB   CYS  36          2HB       CYS  36   1.440   7.854  -1.772
  672    H    CYS  37           H        CYS  37  -0.325   7.796  -3.333
  673    HA   CYS  37           HA       CYS  37   0.139   7.090  -6.140
  674   1HB   CYS  37          1HB       CYS  37  -2.217   6.923  -5.069
  675   2HB   CYS  37          2HB       CYS  37  -2.225   8.683  -5.197
  676    H    PHE  38           H        PHE  38   1.108   8.667  -7.409
  677    HA   PHE  38           HA       PHE  38   1.759  11.160  -6.060
  678   1HB   PHE  38          1HB       PHE  38   3.444   9.616  -7.230
  679   2HB   PHE  38          2HB       PHE  38   2.622   9.953  -8.757
  680    HD1  PHE  38           HD1      PHE  38   4.752  11.351  -6.110
  681    HD2  PHE  38           HD2      PHE  38   2.947  12.051  -9.886
  682    HE1  PHE  38           HE1      PHE  38   6.217  13.362  -6.437
  683    HE2  PHE  38           HE2      PHE  38   4.412  14.062 -10.213
  684    HZ   PHE  38           HZ       PHE  38   6.031  14.693  -8.485
  685    H    ASP  39           H        ASP  39   0.560  12.960  -6.424
  686    HA   ASP  39           HA       ASP  39  -1.277  12.934  -8.608
  687   1HB   ASP  39          1HB       ASP  39  -2.035  13.845  -6.503
  688   2HB   ASP  39          2HB       ASP  39  -0.643  14.934  -6.396
  689    H    SER  40           H        SER  40   0.710  15.714  -7.391
  690    HA   SER  40           HA       SER  40   2.346  16.842  -8.382
  691   1HB   SER  40          1HB       SER  40   2.549  14.689  -9.941
  692   2HB   SER  40          2HB       SER  40   1.821  15.766 -11.145
  693    HG   SER  40           HG       SER  40   4.057  15.997 -11.324
  694    H    ARG  41           H        ARG  41  -0.929  16.424  -9.454
  695    HA   ARG  41           HA       ARG  41  -1.181  18.384 -11.326
  696   1HB   ARG  41          1HB       ARG  41  -3.108  17.467  -9.148
  697   2HB   ARG  41          2HB       ARG  41  -3.597  18.527 -10.481
  698   1HG   ARG  41          1HG       ARG  41  -2.401  16.559 -11.902
  699   2HG   ARG  41          2HG       ARG  41  -2.908  15.608 -10.494
  700   1HD   ARG  41          1HD       ARG  41  -4.743  15.458 -11.981
  701   2HD   ARG  41          2HD       ARG  41  -5.243  16.722 -10.847
  702    HE   ARG  41           HE       ARG  41  -4.353  17.110 -13.662
  703   1HH1  ARG  41          1HH1      ARG  41  -5.520  18.512 -10.653
  704   2HH1  ARG  41          2HH1      ARG  41  -5.952  20.025 -11.377
  705   1HH2  ARG  41          1HH2      ARG  41  -4.924  19.105 -14.618
  706   2HH2  ARG  41          2HH2      ARG  41  -5.611  20.365 -13.647
  707    H    ILE  42           H        ILE  42  -1.871  18.655  -7.753
  708    HA   ILE  42           HA       ILE  42  -1.421  21.542  -8.021
  709    HB   ILE  42           HB       ILE  42  -2.715  20.544  -5.584
  710   1HG1  ILE  42          1HG1      ILE  42  -4.060  20.214  -8.270
  711   2HG1  ILE  42          2HG1      ILE  42  -3.709  18.941  -7.089
  712   1HG2  ILE  42          1HG2      ILE  42  -3.572  22.666  -7.565
  713   2HG2  ILE  42          2HG2      ILE  42  -4.087  22.478  -5.872
  714   3HG2  ILE  42          3HG2      ILE  42  -2.410  22.941  -6.245
  715   1HD1  ILE  42          1HD1      ILE  42  -6.065  19.586  -6.918
  716   2HD1  ILE  42          2HD1      ILE  42  -5.213  20.129  -5.454
  717   3HD1  ILE  42          3HD1      ILE  42  -5.616  21.298  -6.734
  718    HA   PRO  43           HA       PRO  43   2.174  20.790  -5.695
  719   1HB   PRO  43          1HB       PRO  43   3.045  23.373  -5.523
  720   2HB   PRO  43          2HB       PRO  43   3.372  22.336  -6.910
  721   1HG   PRO  43          1HG       PRO  43   1.426  24.532  -6.601
  722   2HG   PRO  43          2HG       PRO  43   2.083  23.819  -8.119
  723   1HD   PRO  43          1HD       PRO  43  -0.500  23.437  -6.946
  724   2HD   PRO  43          2HD       PRO  43   0.155  22.589  -8.352
  725    H    GLY  44           H        GLY  44  -0.540  22.509  -4.713
  726   1HA   GLY  44          1HA       GLY  44   0.517  23.002  -2.037
  727   2HA   GLY  44          2HA       GLY  44  -1.042  23.483  -2.677
  728    H    VAL  45           H        VAL  45  -0.887  20.408  -3.788
  729    HA   VAL  45           HA       VAL  45  -2.162  19.365  -1.360
  730    HB   VAL  45           HB       VAL  45  -3.077  19.582  -3.964
  731   1HG1  VAL  45          1HG1      VAL  45  -1.732  17.794  -4.812
  732   2HG1  VAL  45          2HG1      VAL  45  -2.148  16.744  -3.437
  733   3HG1  VAL  45          3HG1      VAL  45  -3.390  17.169  -4.639
  734   1HG2  VAL  45          1HG2      VAL  45  -4.576  17.531  -2.732
  735   2HG2  VAL  45          2HG2      VAL  45  -3.955  18.551  -1.412
  736   3HG2  VAL  45          3HG2      VAL  45  -4.908  19.280  -2.726
  737    HA   PRO  46           HA       PRO  46   0.783  16.208  -1.123
  738   1HB   PRO  46          1HB       PRO  46  -0.640  13.959  -0.506
  739   2HB   PRO  46          2HB       PRO  46  -0.241  15.202   0.676
  740   1HG   PRO  46          1HG       PRO  46  -2.789  14.644  -0.703
  741   2HG   PRO  46          2HG       PRO  46  -2.514  15.566   0.819
  742   1HD   PRO  46          1HD       PRO  46  -3.108  16.578  -1.793
  743   2HD   PRO  46          2HD       PRO  46  -2.688  17.529  -0.364
  744    H    TRP  47           H        TRP  47   2.044  15.707  -2.798
  745    HA   TRP  47           HA       TRP  47   0.738  14.450  -5.054
  746   1HB   TRP  47          1HB       TRP  47   3.612  14.705  -5.237
  747   2HB   TRP  47          2HB       TRP  47   2.343  15.374  -6.265
  748    HD1  TRP  47           HD1      TRP  47   1.257  17.813  -5.275
  749    HE1  TRP  47           HE1      TRP  47   2.408  19.854  -4.060
  750    HE3  TRP  47           HE3      TRP  47   5.390  15.263  -3.768
  751    HZ2  TRP  47           HZ2      TRP  47   4.861  20.166  -2.637
  752    HZ3  TRP  47           HZ3      TRP  47   7.115  16.510  -2.471
  753    HH2  TRP  47           HH2      TRP  47   6.901  18.878  -1.902
  754    H    CYS  48           H        CYS  48   0.888  13.056  -2.416
  755    HA   CYS  48           HA       CYS  48   1.771  10.569  -3.384
  756   1HB   CYS  48          1HB       CYS  48   3.962  11.678  -2.813
  757   2HB   CYS  48          2HB       CYS  48   3.456  11.646  -1.122
  758    H    PHE  49           H        PHE  49  -0.140   9.632  -2.673
  759    HA   PHE  49           HA       PHE  49  -0.568   9.646   0.203
  760   1HB   PHE  49          1HB       PHE  49  -3.133   9.857  -0.673
  761   2HB   PHE  49          2HB       PHE  49  -2.178  11.297  -0.303
  762    HD1  PHE  49           HD1      PHE  49  -0.714  12.138  -2.380
  763    HD2  PHE  49           HD2      PHE  49  -4.250   9.810  -2.671
  764    HE1  PHE  49           HE1      PHE  49  -1.056  12.950  -4.730
  765    HE2  PHE  49           HE2      PHE  49  -4.591  10.621  -5.022
  766    HZ   PHE  49           HZ       PHE  49  -2.989  12.182  -6.023
  767    H    LYS  50           H        LYS  50  -2.959   8.230   0.306
  768    HA   LYS  50           HA       LYS  50  -2.356   5.833  -1.281
  769   1HB   LYS  50          1HB       LYS  50  -3.531   4.936   1.066
  770   2HB   LYS  50          2HB       LYS  50  -1.822   4.804   0.620
  771   1HG   LYS  50          1HG       LYS  50  -2.817   7.372   1.834
  772   2HG   LYS  50          2HG       LYS  50  -2.581   5.978   2.901
  773   1HD   LYS  50          1HD       LYS  50  -0.521   7.328   1.115
  774   2HD   LYS  50          2HD       LYS  50  -0.525   7.278   2.886
  775   1HE   LYS  50          1HE       LYS  50   0.084   5.076   0.903
  776   2HE   LYS  50          2HE       LYS  50   1.046   5.607   2.291
  777   1HZ   LYS  50          1HZ       LYS  50  -0.017   3.578   2.812
  778   2HZ   LYS  50          2HZ       LYS  50  -0.765   4.736   3.687
  779   3HZ   LYS  50          3HZ       LYS  50  -1.487   4.123   2.358
  780    HA   PRO  51           HA       PRO  51  -6.622   7.185  -1.960
  781   1HB   PRO  51          1HB       PRO  51  -6.531   7.314  -4.687
  782   2HB   PRO  51          2HB       PRO  51  -6.282   8.715  -3.646
  783   1HG   PRO  51          1HG       PRO  51  -4.325   7.087  -5.135
  784   2HG   PRO  51          2HG       PRO  51  -4.137   8.758  -4.490
  785   1HD   PRO  51          1HD       PRO  51  -3.054   6.317  -3.456
  786   2HD   PRO  51          2HD       PRO  51  -2.976   7.910  -2.694
  787    H    LEU  52           H        LEU  52  -5.945   5.592  -4.940
  788    HA   LEU  52           HA       LEU  52  -7.531   3.347  -3.935
  789   1HB   LEU  52          1HB       LEU  52  -8.362   3.057  -6.017
  790   2HB   LEU  52          2HB       LEU  52  -8.147   4.817  -5.987
  791    HG   LEU  52           HG       LEU  52  -5.749   3.864  -7.021
  792   1HD1  LEU  52          1HD1      LEU  52  -7.747   1.838  -7.421
  793   2HD1  LEU  52          2HD1      LEU  52  -7.290   2.548  -8.989
  794   3HD1  LEU  52          3HD1      LEU  52  -6.040   1.860  -7.924
  795   1HD2  LEU  52          1HD2      LEU  52  -7.965   5.504  -7.816
  796   2HD2  LEU  52          2HD2      LEU  52  -6.267   5.564  -8.345
  797   3HD2  LEU  52          3HD2      LEU  52  -7.428   4.523  -9.201
  798    H    GLN  53           H        GLN  53  -4.799   3.602  -3.096
  799    HA   GLN  53           HA       GLN  53  -2.946   2.403  -4.642
  800   1HB   GLN  53          1HB       GLN  53  -3.399   2.081  -1.651
  801   2HB   GLN  53          2HB       GLN  53  -1.892   1.654  -2.481
  802   1HG   GLN  53          1HG       GLN  53  -3.175   4.420  -2.430
  803   2HG   GLN  53          2HG       GLN  53  -1.798   3.924  -1.435
  804   1HE2  GLN  53          1HE2      GLN  53  -0.533   2.294  -3.384
  805   2HE2  GLN  53          2HE2      GLN  53   0.148   3.312  -4.610
  806    H    GLU  54           H        GLU  54  -5.858   1.006  -3.324
  807    HA   GLU  54           HA       GLU  54  -5.353  -1.533  -2.832
  808   1HB   GLU  54          1HB       GLU  54  -7.569  -2.077  -3.682
  809   2HB   GLU  54          2HB       GLU  54  -7.617  -0.474  -2.928
  810   1HG   GLU  54          1HG       GLU  54  -8.403   0.385  -4.854
  811   2HG   GLU  54          2HG       GLU  54  -6.917  -0.102  -5.684
  812    H    ALA  55           H        ALA  55  -4.885   0.082  -5.932
  813    HA   ALA  55           HA       ALA  55  -5.038  -1.679  -7.861
  814   1HB   ALA  55          1HB       ALA  55  -2.746  -0.804  -8.644
  815   2HB   ALA  55          2HB       ALA  55  -3.996   0.412  -8.286
  816   3HB   ALA  55          3HB       ALA  55  -2.697   0.098  -7.111
  817    H    GLU  56           H        GLU  56  -2.109  -1.659  -5.698
  818    HA   GLU  56           HA       GLU  56  -2.167  -4.543  -5.811
  819   1HB   GLU  56          1HB       GLU  56  -0.106  -2.808  -7.069
  820   2HB   GLU  56          2HB       GLU  56   0.525  -4.159  -6.114
  821   1HG   GLU  56          1HG       GLU  56  -0.675  -5.763  -7.442
  822   2HG   GLU  56          2HG       GLU  56  -1.645  -4.505  -8.224
  823    H    CYS  57           H        CYS  57  -2.588  -2.184  -3.863
  824    HA   CYS  57           HA       CYS  57  -0.402  -2.660  -2.015
  825   1HB   CYS  57          1HB       CYS  57  -1.871  -0.418  -2.645
  826   2HB   CYS  57          2HB       CYS  57  -2.576  -0.923  -1.109
  827    H    THR  58           H        THR  58  -4.047  -2.684  -2.093
  828    HA   THR  58           HA       THR  58  -4.295  -4.067   0.356
  829    HB   THR  58           HB       THR  58  -6.026  -2.589  -0.765
  830    HG1  THR  58           HG1      THR  58  -7.557  -3.942   0.197
  831   1HG2  THR  58          1HG2      THR  58  -7.490  -3.706  -2.466
  832   2HG2  THR  58          2HG2      THR  58  -5.849  -3.445  -3.102
  833   3HG2  THR  58          3HG2      THR  58  -6.342  -5.063  -2.547
  834    H    PHE  59           H        PHE  59  -3.916  -5.121  -3.032
  835    HA   PHE  59           HA       PHE  59  -4.743  -7.725  -2.773
  836   1HB   PHE  59          1HB       PHE  59  -2.740  -6.123  -4.372
  837   2HB   PHE  59          2HB       PHE  59  -2.605  -7.881  -4.498
  838    HD1  PHE  59           HD1      PHE  59  -3.502  -8.610  -6.484
  839    HD2  PHE  59           HD2      PHE  59  -5.497  -5.512  -4.379
  840    HE1  PHE  59           HE1      PHE  59  -5.326  -8.612  -8.209
  841    HE2  PHE  59           HE2      PHE  59  -7.320  -5.514  -6.104
  842    HZ   PHE  59           HZ       PHE  59  -7.213  -7.064  -7.999
  Start of MODEL   15
    1   1H    GLU   1           H1       GLU   1 -17.287  -6.259   0.150
    2    HA   GLU   1           HA       GLU   1 -18.189  -7.872  -0.989
    3   1HB   GLU   1          1HB       GLU   1 -17.229  -6.441  -2.879
    4   2HB   GLU   1          2HB       GLU   1 -15.930  -7.640  -3.017
    5   1HG   GLU   1          1HG       GLU   1 -17.945  -9.355  -3.122
    6   2HG   GLU   1          2HG       GLU   1 -18.886  -7.933  -3.595
    7    H    GLU   2           H        GLU   2 -16.041  -9.503  -2.865
    8    HA   GLU   2           HA       GLU   2 -15.733 -11.520  -0.838
    9   1HB   GLU   2          1HB       GLU   2 -16.567 -11.896  -3.250
   10   2HB   GLU   2          2HB       GLU   2 -14.873 -11.737  -3.744
   11   1HG   GLU   2          1HG       GLU   2 -14.320 -13.558  -2.059
   12   2HG   GLU   2          2HG       GLU   2 -16.059 -13.791  -1.823
   13    H    TYR   3           H        TYR   3 -14.161  -9.140  -0.437
   14    HA   TYR   3           HA       TYR   3 -11.484  -9.830  -1.328
   15   1HB   TYR   3          1HB       TYR   3 -13.026  -7.574  -0.028
   16   2HB   TYR   3          2HB       TYR   3 -11.300  -7.646   0.348
   17    HD1  TYR   3           HD1      TYR   3 -13.013  -8.467  -2.873
   18    HD2  TYR   3           HD2      TYR   3 -10.432  -5.773  -0.779
   19    HE1  TYR   3           HE1      TYR   3 -12.502  -7.255  -5.048
   20    HE2  TYR   3           HE2      TYR   3  -9.931  -4.569  -2.962
   21    HH   TYR   3           HH       TYR   3 -10.032  -4.781  -5.195
   22    H    VAL   4           H        VAL   4 -11.339 -11.883  -0.113
   23    HA   VAL   4           HA       VAL   4 -10.968 -11.402   2.763
   24    HB   VAL   4           HB       VAL   4 -12.562 -12.994   2.798
   25   1HG1  VAL   4          1HG1      VAL   4 -12.991 -14.648   1.021
   26   2HG1  VAL   4          2HG1      VAL   4 -12.958 -12.987   0.383
   27   3HG1  VAL   4          3HG1      VAL   4 -11.562 -14.063   0.136
   28   1HG2  VAL   4          1HG2      VAL   4 -11.663 -15.151   3.224
   29   2HG2  VAL   4          2HG2      VAL   4 -10.296 -14.885   2.115
   30   3HG2  VAL   4          3HG2      VAL   4 -10.383 -13.991   3.653
   31    H    GLY   5           H        GLY   5  -9.729 -13.234  -0.113
   32   1HA   GLY   5          1HA       GLY   5  -7.292 -13.971   1.161
   33   2HA   GLY   5          2HA       GLY   5  -7.683 -14.086  -0.543
   34    H    LEU   6           H        LEU   6  -8.379 -10.920   0.476
   35    HA   LEU   6           HA       LEU   6  -5.653 -10.013  -0.094
   36   1HB   LEU   6          1HB       LEU   6  -7.946  -8.497  -1.216
   37   2HB   LEU   6          2HB       LEU   6  -6.269  -8.613  -1.780
   38    HG   LEU   6           HG       LEU   6  -7.679  -9.641  -3.404
   39   1HD1  LEU   6          1HD1      LEU   6  -6.880 -12.223  -2.404
   40   2HD1  LEU   6          2HD1      LEU   6  -6.208 -11.265  -3.746
   41   3HD1  LEU   6          3HD1      LEU   6  -5.608 -11.018  -2.088
   42   1HD2  LEU   6          1HD2      LEU   6  -8.763 -11.757  -1.629
   43   2HD2  LEU   6          2HD2      LEU   6  -9.450 -10.127  -1.439
   44   3HD2  LEU   6          3HD2      LEU   6  -9.495 -10.932  -3.026
   45    H    SER   7           H        SER   7  -8.159 -10.216   2.065
   46    HA   SER   7           HA       SER   7  -7.678  -7.520   3.055
   47   1HB   SER   7          1HB       SER   7 -10.036  -8.058   2.647
   48   2HB   SER   7          2HB       SER   7  -9.923  -9.487   3.691
   49    HG   SER   7           HG       SER   7 -10.786  -7.899   4.992
   50    H    ALA   8           H        ALA   8  -8.793  -8.419   5.753
   51    HA   ALA   8           HA       ALA   8  -6.366  -8.951   7.004
   52   1HB   ALA   8          1HB       ALA   8  -8.583  -9.850   8.601
   53   2HB   ALA   8          2HB       ALA   8  -7.645  -8.345   8.746
   54   3HB   ALA   8          3HB       ALA   8  -9.081  -8.401   7.697
   55    H    ASN   9           H        ASN   9  -5.332 -10.828   7.666
   56    HA   ASN   9           HA       ASN   9  -5.197 -13.011   8.166
   57   1HB   ASN   9          1HB       ASN   9  -7.810 -13.125   7.878
   58   2HB   ASN   9          2HB       ASN   9  -7.455 -13.722   6.250
   59   1HD2  ASN   9          1HD2      ASN   9  -5.649 -15.442   6.251
   60   2HD2  ASN   9          2HD2      ASN   9  -5.820 -16.731   7.396
   61    H    GLN  10           H        GLN  10  -5.720 -11.491   5.039
   62    HA   GLN  10           HA       GLN  10  -4.771 -13.510   3.390
   63   1HB   GLN  10          1HB       GLN  10  -4.970 -11.966   1.706
   64   2HB   GLN  10          2HB       GLN  10  -5.926 -11.124   2.940
   65   1HG   GLN  10          1HG       GLN  10  -4.520  -9.393   2.435
   66   2HG   GLN  10          2HG       GLN  10  -3.432 -10.209   3.567
   67   1HE2  GLN  10          1HE2      GLN  10  -3.902  -9.055   0.443
   68   2HE2  GLN  10          2HE2      GLN  10  -2.530  -9.755  -0.349
   69    H    CYS  11           H        CYS  11  -3.153 -11.110   5.452
   70    HA   CYS  11           HA       CYS  11  -0.629 -11.303   4.226
   71   1HB   CYS  11          1HB       CYS  11  -1.178  -9.410   5.575
   72   2HB   CYS  11          2HB       CYS  11  -1.474 -10.424   6.990
   73    H    ALA  12           H        ALA  12  -2.528 -13.599   5.790
   74    HA   ALA  12           HA       ALA  12  -0.239 -14.940   7.028
   75   1HB   ALA  12          1HB       ALA  12  -2.695 -14.473   8.041
   76   2HB   ALA  12          2HB       ALA  12  -3.019 -16.019   7.222
   77   3HB   ALA  12          3HB       ALA  12  -1.742 -15.917   8.459
   78    H    VAL  13           H        VAL  13  -1.045 -14.600   4.018
   79    HA   VAL  13           HA       VAL  13  -2.000 -16.884   2.927
   80    HB   VAL  13           HB       VAL  13  -0.714 -14.587   2.078
   81   1HG1  VAL  13          1HG1      VAL  13   1.470 -15.673   2.147
   82   2HG1  VAL  13          2HG1      VAL  13   0.865 -17.004   1.132
   83   3HG1  VAL  13          3HG1      VAL  13   0.990 -15.360   0.462
   84   1HG2  VAL  13          1HG2      VAL  13  -2.395 -16.646   1.028
   85   2HG2  VAL  13          2HG2      VAL  13  -2.176 -14.979   0.443
   86   3HG2  VAL  13          3HG2      VAL  13  -1.140 -16.284  -0.181
   87    HA   PRO  14           HA       PRO  14   0.890 -20.035   3.566
   88   1HB   PRO  14          1HB       PRO  14   0.964 -21.391   1.195
   89   2HB   PRO  14          2HB       PRO  14  -0.336 -21.575   2.371
   90   1HG   PRO  14          1HG       PRO  14  -0.281 -20.090  -0.178
   91   2HG   PRO  14          2HG       PRO  14  -1.708 -20.669   0.754
   92   1HD   PRO  14          1HD       PRO  14  -0.680 -18.005   0.544
   93   2HD   PRO  14          2HD       PRO  14  -1.991 -18.550   1.599
   94    H    ALA  15           H        ALA  15   1.956 -17.432   2.663
   95    HA   ALA  15           HA       ALA  15   3.862 -16.564   1.924
   96   1HB   ALA  15          1HB       ALA  15   4.534 -18.979   3.508
   97   2HB   ALA  15          2HB       ALA  15   5.854 -18.354   2.491
   98   3HB   ALA  15          3HB       ALA  15   5.083 -17.297   3.696
   99    H    LYS  16           H        LYS  16   2.737 -17.017  -0.294
  100    HA   LYS  16           HA       LYS  16   4.656 -17.646  -2.134
  101   1HB   LYS  16          1HB       LYS  16   3.596 -19.869  -2.971
  102   2HB   LYS  16          2HB       LYS  16   4.806 -19.902  -1.677
  103   1HG   LYS  16          1HG       LYS  16   3.316 -20.925  -0.338
  104   2HG   LYS  16          2HG       LYS  16   2.240 -19.521  -0.449
  105   1HD   LYS  16          1HD       LYS  16   0.919 -21.317  -1.223
  106   2HD   LYS  16          2HD       LYS  16   1.479 -20.552  -2.721
  107   1HE   LYS  16          1HE       LYS  16   3.148 -22.247  -3.061
  108   2HE   LYS  16          2HE       LYS  16   2.946 -22.887  -1.423
  109   1HZ   LYS  16          1HZ       LYS  16   1.796 -24.262  -2.937
  110   2HZ   LYS  16          2HZ       LYS  16   0.661 -23.452  -2.086
  111   3HZ   LYS  16          3HZ       LYS  16   1.003 -23.007  -3.620
  112    H    ASP  17           H        ASP  17   2.600 -15.724  -1.569
  113    HA   ASP  17           HA       ASP  17   1.333 -15.806  -4.124
  114   1HB   ASP  17          1HB       ASP  17  -0.190 -17.004  -2.388
  115   2HB   ASP  17          2HB       ASP  17  -0.439 -15.398  -1.686
  116    H    ARG  18           H        ARG  18   3.207 -14.284  -2.042
  117    HA   ARG  18           HA       ARG  18   1.785 -11.800  -1.847
  118   1HB   ARG  18          1HB       ARG  18   4.655 -12.455  -1.042
  119   2HB   ARG  18          2HB       ARG  18   3.716 -11.046  -0.515
  120   1HG   ARG  18          1HG       ARG  18   2.581 -12.247   1.055
  121   2HG   ARG  18          2HG       ARG  18   2.415 -13.669   0.010
  122   1HD   ARG  18          1HD       ARG  18   4.673 -14.387   0.526
  123   2HD   ARG  18          2HD       ARG  18   5.032 -12.871   1.366
  124    HE   ARG  18           HE       ARG  18   2.747 -14.338   2.475
  125   1HH1  ARG  18          1HH1      ARG  18   6.241 -13.932   2.570
  126   2HH1  ARG  18          2HH1      ARG  18   6.401 -14.575   4.170
  127   1HH2  ARG  18          1HH2      ARG  18   2.957 -15.186   4.586
  128   2HH2  ARG  18          2HH2      ARG  18   4.520 -15.293   5.324
  129    H    VAL  19           H        VAL  19   3.390  -9.753  -2.328
  130    HA   VAL  19           HA       VAL  19   4.344 -10.199  -5.066
  131    HB   VAL  19           HB       VAL  19   3.584  -7.585  -3.762
  132   1HG1  VAL  19          1HG1      VAL  19   3.122  -7.688  -6.585
  133   2HG1  VAL  19          2HG1      VAL  19   4.270  -6.675  -5.677
  134   3HG1  VAL  19          3HG1      VAL  19   4.771  -8.279  -6.262
  135   1HG2  VAL  19          1HG2      VAL  19   1.382  -7.769  -4.685
  136   2HG2  VAL  19          2HG2      VAL  19   1.790  -9.286  -5.521
  137   3HG2  VAL  19          3HG2      VAL  19   1.688  -9.247  -3.744
  138    H    ASP  20           H        ASP  20   5.717 -10.666  -2.331
  139    HA   ASP  20           HA       ASP  20   7.542 -10.047  -1.245
  140   1HB   ASP  20          1HB       ASP  20   8.652 -11.488  -2.685
  141   2HB   ASP  20          2HB       ASP  20   8.251 -10.541  -4.125
  142    H    CYS  21           H        CYS  21   7.085  -7.844  -0.533
  143    HA   CYS  21           HA       CYS  21   7.132  -5.594  -2.045
  144   1HB   CYS  21          1HB       CYS  21   6.840  -6.162   0.597
  145   2HB   CYS  21          2HB       CYS  21   8.378  -5.291   0.610
  146    H    GLY  22           H        GLY  22   9.830  -7.546  -0.732
  147   1HA   GLY  22          1HA       GLY  22  12.070  -7.375  -0.937
  148   2HA   GLY  22          2HA       GLY  22  11.711  -6.905  -2.587
  149    H    TYR  23           H        TYR  23  11.521  -5.399   0.726
  150    HA   TYR  23           HA       TYR  23  12.320  -2.861  -0.445
  151   1HB   TYR  23          1HB       TYR  23  10.891  -3.984   1.882
  152   2HB   TYR  23          2HB       TYR  23  12.099  -2.815   2.422
  153    HD1  TYR  23           HD1      TYR  23   8.894  -3.297   0.758
  154    HD2  TYR  23           HD2      TYR  23  11.947  -0.441   1.670
  155    HE1  TYR  23           HE1      TYR  23   7.295  -1.399   0.204
  156    HE2  TYR  23           HE2      TYR  23  10.338   1.446   1.112
  157    HH   TYR  23           HH       TYR  23   8.210   1.952   0.772
  158    HA   PRO  24           HA       PRO  24  16.434  -3.285   0.851
  159   1HB   PRO  24          1HB       PRO  24  17.241  -0.681   0.677
  160   2HB   PRO  24          2HB       PRO  24  17.151  -1.758  -0.716
  161   1HG   PRO  24          1HG       PRO  24  15.334   0.408   0.125
  162   2HG   PRO  24          2HG       PRO  24  15.511  -0.341  -1.502
  163   1HD   PRO  24          1HD       PRO  24  13.429  -0.735   0.424
  164   2HD   PRO  24          2HD       PRO  24  13.641  -1.616  -1.094
  165    H    HIS  25           H        HIS  25  14.060  -1.891   2.650
  166    HA   HIS  25           HA       HIS  25  15.930  -1.712   4.896
  167   1HB   HIS  25          1HB       HIS  25  13.747   0.174   4.065
  168   2HB   HIS  25          2HB       HIS  25  14.198   0.033   5.767
  169    HD1  HIS  25           HD1      HIS  25  15.349   1.400   2.479
  170    HD2  HIS  25           HD2      HIS  25  16.823   0.993   6.385
  171    HE1  HIS  25           HE1      HIS  25  17.405   2.902   2.628
  172    HE2  HIS  25           HE2      HIS  25  18.236   2.651   5.066
  173    H    VAL  26           H        VAL  26  14.004  -3.811   3.628
  174    HA   VAL  26           HA       VAL  26  11.748  -4.221   5.031
  175    HB   VAL  26           HB       VAL  26  12.286  -5.717   3.334
  176   1HG1  VAL  26          1HG1      VAL  26  14.376  -6.291   2.813
  177   2HG1  VAL  26          2HG1      VAL  26  14.941  -5.458   4.281
  178   3HG1  VAL  26          3HG1      VAL  26  14.548  -7.193   4.338
  179   1HG2  VAL  26          1HG2      VAL  26  12.922  -7.680   5.459
  180   2HG2  VAL  26          2HG2      VAL  26  11.485  -6.671   5.751
  181   3HG2  VAL  26          3HG2      VAL  26  11.595  -7.656   4.273
  182    H    THR  27           H        THR  27  11.150  -4.535   7.123
  183    HA   THR  27           HA       THR  27  12.811  -5.866   8.990
  184    HB   THR  27           HB       THR  27  13.306  -3.044   8.578
  185    HG1  THR  27           HG1      THR  27  14.886  -3.685  10.257
  186   1HG2  THR  27          1HG2      THR  27  12.444  -2.001  10.421
  187   2HG2  THR  27          2HG2      THR  27  11.409  -3.428  10.667
  188   3HG2  THR  27          3HG2      THR  27  12.991  -3.327  11.476
  189    HA   PRO  28           HA       PRO  28   8.976  -6.228  10.877
  190   1HB   PRO  28          1HB       PRO  28   9.661  -6.869  13.444
  191   2HB   PRO  28          2HB       PRO  28   9.671  -8.036  12.123
  192   1HG   PRO  28          1HG       PRO  28  11.913  -6.644  13.445
  193   2HG   PRO  28          2HG       PRO  28  11.950  -8.154  12.462
  194   1HD   PRO  28          1HD       PRO  28  12.788  -5.521  11.712
  195   2HD   PRO  28          2HD       PRO  28  12.694  -6.937  10.659
  196    H    LYS  29           H        LYS  29   9.341  -3.647  10.399
  197    HA   LYS  29           HA       LYS  29   7.709  -2.438  12.234
  198   1HB   LYS  29          1HB       LYS  29  10.024  -2.872  13.544
  199   2HB   LYS  29          2HB       LYS  29  10.368  -1.278  12.849
  200   1HG   LYS  29          1HG       LYS  29   9.048  -0.307  14.392
  201   2HG   LYS  29          2HG       LYS  29   7.664  -1.284  13.872
  202   1HD   LYS  29          1HD       LYS  29   7.831  -2.625  15.685
  203   2HD   LYS  29          2HD       LYS  29   9.575  -2.848  15.464
  204   1HE   LYS  29          1HE       LYS  29   9.693  -1.672  17.422
  205   2HE   LYS  29          2HE       LYS  29   9.525  -0.263  16.362
  206   1HZ   LYS  29          1HZ       LYS  29   7.008  -1.307  16.934
  207   2HZ   LYS  29          2HZ       LYS  29   7.809  -1.112  18.344
  208   3HZ   LYS  29          3HZ       LYS  29   7.614   0.156  17.334
  209    H    GLU  30           H        GLU  30  10.103  -2.465   9.704
  210    HA   GLU  30           HA       GLU  30   9.460   0.269   9.005
  211   1HB   GLU  30          1HB       GLU  30  11.736  -1.483   8.643
  212   2HB   GLU  30          2HB       GLU  30  11.207  -0.869   7.066
  213   1HG   GLU  30          1HG       GLU  30  12.791   0.711   7.931
  214   2HG   GLU  30          2HG       GLU  30  11.202   1.465   8.114
  215    H    CYS  31           H        CYS  31   9.260  -3.111   7.752
  216    HA   CYS  31           HA       CYS  31   8.233  -2.552   5.269
  217   1HB   CYS  31          1HB       CYS  31   7.905  -4.882   7.135
  218   2HB   CYS  31          2HB       CYS  31   7.098  -4.849   5.563
  219    H    ASN  32           H        ASN  32   6.514  -3.214   8.408
  220    HA   ASN  32           HA       ASN  32   3.983  -2.772   7.338
  221   1HB   ASN  32          1HB       ASN  32   5.214  -3.101  10.030
  222   2HB   ASN  32          2HB       ASN  32   3.697  -2.188  10.033
  223   1HD2  ASN  32          1HD2      ASN  32   5.103  -5.023   8.384
  224   2HD2  ASN  32          2HD2      ASN  32   3.757  -6.091   8.599
  225    H    ASN  33           H        ASN  33   6.553  -0.655   7.696
  226    HA   ASN  33           HA       ASN  33   4.911   1.569   8.560
  227   1HB   ASN  33          1HB       ASN  33   7.399   0.994   9.324
  228   2HB   ASN  33          2HB       ASN  33   7.843   1.811   7.819
  229   1HD2  ASN  33          1HD2      ASN  33   8.900   3.168   9.530
  230   2HD2  ASN  33          2HD2      ASN  33   8.016   4.522  10.154
  231    H    ARG  34           H        ARG  34   6.759   0.182   5.818
  232    HA   ARG  34           HA       ARG  34   6.480   2.517   4.233
  233   1HB   ARG  34          1HB       ARG  34   7.126  -0.262   3.189
  234   2HB   ARG  34          2HB       ARG  34   7.687   1.297   2.558
  235   1HG   ARG  34          1HG       ARG  34   8.502   1.102   5.303
  236   2HG   ARG  34          2HG       ARG  34   8.942  -0.419   4.507
  237   1HD   ARG  34          1HD       ARG  34  10.598   0.584   3.325
  238   2HD   ARG  34          2HD       ARG  34   9.554   1.928   2.838
  239    HE   ARG  34           HE       ARG  34  10.086   2.423   5.518
  240   1HH1  ARG  34          1HH1      ARG  34  12.088   1.866   2.678
  241   2HH1  ARG  34          2HH1      ARG  34  13.405   2.829   3.260
  242   1HH2  ARG  34          1HH2      ARG  34  11.823   3.694   6.286
  243   2HH2  ARG  34          2HH2      ARG  34  13.253   3.876   5.326
  244    H    GLY  35           H        GLY  35   4.627  -0.392   4.930
  245   1HA   GLY  35          1HA       GLY  35   2.253  -0.180   4.345
  246   2HA   GLY  35          2HA       GLY  35   2.760   0.281   2.733
  247    H    CYS  36           H        CYS  36   4.600  -2.171   4.522
  248    HA   CYS  36           HA       CYS  36   3.442  -4.184   2.733
  249   1HB   CYS  36          1HB       CYS  36   6.226  -4.229   3.886
  250   2HB   CYS  36          2HB       CYS  36   5.552  -5.290   2.647
  251    H    CYS  37           H        CYS  37   4.258  -6.514   3.883
  252    HA   CYS  37           HA       CYS  37   3.476  -6.273   6.693
  253   1HB   CYS  37          1HB       CYS  37   1.651  -7.082   5.088
  254   2HB   CYS  37          2HB       CYS  37   2.594  -8.570   4.957
  255    H    PHE  38           H        PHE  38   5.042  -7.157   8.003
  256    HA   PHE  38           HA       PHE  38   7.130  -8.704   6.736
  257   1HB   PHE  38          1HB       PHE  38   7.514  -6.796   8.364
  258   2HB   PHE  38          2HB       PHE  38   6.644  -7.704   9.606
  259    HD1  PHE  38           HD1      PHE  38   7.741  -9.394  10.861
  260    HD2  PHE  38           HD2      PHE  38   9.700  -7.634   7.535
  261    HE1  PHE  38           HE1      PHE  38   9.896 -10.474  11.560
  262    HE2  PHE  38           HE2      PHE  38  11.856  -8.715   8.233
  263    HZ   PHE  38           HZ       PHE  38  11.928 -10.121  10.238
  264    H    ASP  39           H        ASP  39   7.119 -10.897   6.684
  265    HA   ASP  39           HA       ASP  39   5.228 -12.247   8.368
  266   1HB   ASP  39          1HB       ASP  39   5.358 -12.950   6.056
  267   2HB   ASP  39          2HB       ASP  39   7.114 -13.159   6.151
  268    H    SER  40           H        SER  40   8.519 -13.345   7.317
  269    HA   SER  40           HA       SER  40  10.360 -13.706   8.492
  270   1HB   SER  40          1HB       SER  40   9.193 -12.052  10.265
  271   2HB   SER  40          2HB       SER  40   9.089 -13.550  11.207
  272    HG   SER  40           HG       SER  40  11.570 -13.478  10.206
  273    H    ARG  41           H        ARG  41   7.242 -15.146   8.924
  274    HA   ARG  41           HA       ARG  41   7.892 -17.291  10.526
  275   1HB   ARG  41          1HB       ARG  41   5.886 -17.201   8.227
  276   2HB   ARG  41          2HB       ARG  41   5.852 -18.345   9.580
  277   1HG   ARG  41          1HG       ARG  41   5.786 -16.189  11.069
  278   2HG   ARG  41          2HG       ARG  41   5.286 -15.365   9.582
  279   1HD   ARG  41          1HD       ARG  41   3.908 -17.758  10.879
  280   2HD   ARG  41          2HD       ARG  41   3.313 -16.091  10.897
  281    HE   ARG  41           HE       ARG  41   3.596 -16.602   8.210
  282   1HH1  ARG  41          1HH1      ARG  41   1.998 -18.353  10.810
  283   2HH1  ARG  41          2HH1      ARG  41   0.798 -19.051   9.776
  284   1HH2  ARG  41          1HH2      ARG  41   2.012 -17.523   6.844
  285   2HH2  ARG  41          2HH2      ARG  41   0.807 -18.575   7.503
  286    H    ILE  42           H        ILE  42   8.105 -16.771   6.962
  287    HA   ILE  42           HA       ILE  42   9.649 -19.265   6.811
  288    HB   ILE  42           HB       ILE  42   8.067 -18.214   4.498
  289   1HG1  ILE  42          1HG1      ILE  42   7.013 -19.789   6.839
  290   2HG1  ILE  42          2HG1      ILE  42   6.345 -18.319   6.106
  291   1HG2  ILE  42          1HG2      ILE  42   8.706 -21.071   5.226
  292   2HG2  ILE  42          2HG2      ILE  42   8.257 -20.390   3.645
  293   3HG2  ILE  42          3HG2      ILE  42   9.854 -20.035   4.346
  294   1HD1  ILE  42          1HD1      ILE  42   4.943 -19.928   5.176
  295   2HD1  ILE  42          2HD1      ILE  42   6.222 -19.886   3.939
  296   3HD1  ILE  42          3HD1      ILE  42   6.211 -21.177   5.164
  297    HA   PRO  43           HA       PRO  43  12.579 -16.245   5.560
  298   1HB   PRO  43          1HB       PRO  43  14.790 -17.814   5.893
  299   2HB   PRO  43          2HB       PRO  43  14.091 -16.846   7.190
  300   1HG   PRO  43          1HG       PRO  43  13.931 -19.749   6.693
  301   2HG   PRO  43          2HG       PRO  43  13.640 -18.856   8.227
  302   1HD   PRO  43          1HD       PRO  43  11.716 -20.011   6.449
  303   2HD   PRO  43          2HD       PRO  43  11.375 -19.004   7.863
  304    H    GLY  44           H        GLY  44  11.470 -18.948   4.076
  305   1HA   GLY  44          1HA       GLY  44  13.379 -18.819   1.865
  306   2HA   GLY  44          2HA       GLY  44  12.102 -19.994   2.106
  307    H    VAL  45           H        VAL  45  10.525 -17.223   2.877
  308    HA   VAL  45           HA       VAL  45   9.858 -16.639   0.074
  309    HB   VAL  45           HB       VAL  45   7.614 -16.694   0.527
  310   1HG1  VAL  45          1HG1      VAL  45   7.329 -18.867   1.012
  311   2HG1  VAL  45          2HG1      VAL  45   9.086 -18.909   1.295
  312   3HG1  VAL  45          3HG1      VAL  45   7.970 -18.674   2.662
  313   1HG2  VAL  45          1HG2      VAL  45   6.563 -16.440   2.693
  314   2HG2  VAL  45          2HG2      VAL  45   8.141 -16.504   3.512
  315   3HG2  VAL  45          3HG2      VAL  45   7.739 -15.125   2.460
  316    HA   PRO  46           HA       PRO  46  10.093 -12.432   1.121
  317   1HB   PRO  46          1HB       PRO  46   7.742 -11.235   0.411
  318   2HB   PRO  46          2HB       PRO  46   8.988 -11.677  -0.753
  319   1HG   PRO  46          1HG       PRO  46   6.420 -12.990  -0.135
  320   2HG   PRO  46          2HG       PRO  46   7.435 -13.149  -1.614
  321   1HD   PRO  46          1HD       PRO  46   7.132 -15.004   0.547
  322   2HD   PRO  46          2HD       PRO  46   8.265 -15.136  -0.806
  323    H    TRP  47           H        TRP  47  10.488 -11.706   3.106
  324    HA   TRP  47           HA       TRP  47   8.342 -12.075   5.029
  325   1HB   TRP  47          1HB       TRP  47  10.739 -10.794   6.023
  326   2HB   TRP  47          2HB       TRP  47   9.947 -12.283   6.540
  327    HD1  TRP  47           HD1      TRP  47  10.796 -14.587   5.249
  328    HE1  TRP  47           HE1      TRP  47  13.065 -15.273   4.087
  329    HE3  TRP  47           HE3      TRP  47  12.564  -9.850   4.715
  330    HZ2  TRP  47           HZ2      TRP  47  15.293 -13.791   3.098
  331    HZ3  TRP  47           HZ3      TRP  47  14.795  -9.557   3.642
  332    HH2  TRP  47           HH2      TRP  47  16.146 -11.431   2.846
  333    H    CYS  48           H        CYS  48   8.130 -10.146   2.741
  334    HA   CYS  48           HA       CYS  48   7.178  -7.959   4.230
  335   1HB   CYS  48          1HB       CYS  48   9.592  -7.442   4.312
  336   2HB   CYS  48          2HB       CYS  48   9.623  -7.378   2.548
  337    H    PHE  49           H        PHE  49   5.267  -7.860   3.083
  338    HA   PHE  49           HA       PHE  49   5.471  -7.374   0.232
  339   1HB   PHE  49          1HB       PHE  49   3.384  -9.110   0.238
  340   2HB   PHE  49          2HB       PHE  49   5.039  -9.687   0.030
  341    HD1  PHE  49           HD1      PHE  49   6.283 -10.299   2.259
  342    HD2  PHE  49           HD2      PHE  49   2.064 -10.049   1.874
  343    HE1  PHE  49           HE1      PHE  49   6.011 -11.761   4.281
  344    HE2  PHE  49           HE2      PHE  49   1.792 -11.511   3.896
  345    HZ   PHE  49           HZ       PHE  49   3.769 -12.350   5.076
  346    H    LYS  50           H        LYS  50   2.787  -7.409  -0.449
  347    HA   LYS  50           HA       LYS  50   1.626  -5.537   1.496
  348   1HB   LYS  50          1HB       LYS  50   0.495  -4.774  -0.832
  349   2HB   LYS  50          2HB       LYS  50   1.955  -4.035  -0.151
  350   1HG   LYS  50          1HG       LYS  50   2.287  -6.484  -1.853
  351   2HG   LYS  50          2HG       LYS  50   1.851  -4.978  -2.679
  352   1HD   LYS  50          1HD       LYS  50   4.271  -5.509  -0.914
  353   2HD   LYS  50          2HD       LYS  50   4.274  -5.141  -2.648
  354   1HE   LYS  50          1HE       LYS  50   3.761  -3.320  -0.294
  355   2HE   LYS  50          2HE       LYS  50   4.838  -3.066  -1.675
  356   1HZ   LYS  50          1HZ       LYS  50   1.995  -2.632  -1.450
  357   2HZ   LYS  50          2HZ       LYS  50   3.116  -1.784  -2.282
  358   3HZ   LYS  50          3HZ       LYS  50   2.529  -3.180  -2.893
  359    HA   PRO  51           HA       PRO  51  -1.149  -9.068   0.954
  360   1HB   PRO  51          1HB       PRO  51  -1.448  -9.696   3.595
  361   2HB   PRO  51          2HB       PRO  51  -0.276 -10.487   2.544
  362   1HG   PRO  51          1HG       PRO  51   0.122  -8.416   4.606
  363   2HG   PRO  51          2HG       PRO  51   1.334  -9.543   3.897
  364   1HD   PRO  51          1HD       PRO  51   0.973  -6.750   3.370
  365   2HD   PRO  51          2HD       PRO  51   2.076  -7.850   2.529
  366    H    LEU  52           H        LEU  52  -2.089  -8.161   4.116
  367    HA   LEU  52           HA       LEU  52  -4.485  -6.997   2.945
  368   1HB   LEU  52          1HB       LEU  52  -5.578  -7.557   4.851
  369   2HB   LEU  52          2HB       LEU  52  -4.372  -8.853   4.753
  370    HG   LEU  52           HG       LEU  52  -3.280  -6.696   6.286
  371   1HD1  LEU  52          1HD1      LEU  52  -5.002  -5.811   7.367
  372   2HD1  LEU  52          2HD1      LEU  52  -6.138  -6.943   6.595
  373   3HD1  LEU  52          3HD1      LEU  52  -5.306  -7.404   8.099
  374   1HD2  LEU  52          1HD2      LEU  52  -3.060  -9.362   6.263
  375   2HD2  LEU  52          2HD2      LEU  52  -2.639  -8.368   7.679
  376   3HD2  LEU  52          3HD2      LEU  52  -4.215  -9.192   7.607
  377    H    GLN  53           H        GLN  53  -2.030  -5.513   2.663
  378    HA   GLN  53           HA       GLN  53  -1.639  -3.682   4.671
  379   1HB   GLN  53          1HB       GLN  53  -1.288  -3.397   1.664
  380   2HB   GLN  53          2HB       GLN  53  -0.622  -2.263   2.852
  381   1HG   GLN  53          1HG       GLN  53   0.004  -5.239   2.635
  382   2HG   GLN  53          2HG       GLN  53   1.081  -3.919   2.156
  383   1HE2  GLN  53          1HE2      GLN  53  -0.127  -5.888   4.675
  384   2HE2  GLN  53          2HE2      GLN  53   0.758  -5.217   6.005
  385    H    GLU  54           H        GLU  54  -4.340  -4.102   2.551
  386    HA   GLU  54           HA       GLU  54  -5.182  -1.578   2.066
  387   1HB   GLU  54          1HB       GLU  54  -7.151  -2.556   1.448
  388   2HB   GLU  54          2HB       GLU  54  -6.207  -4.044   1.631
  389   1HG   GLU  54          1HG       GLU  54  -7.020  -4.159   4.027
  390   2HG   GLU  54          2HG       GLU  54  -8.087  -2.789   3.683
  391    H    ALA  55           H        ALA  55  -4.786  -3.146   5.140
  392    HA   ALA  55           HA       ALA  55  -6.667  -2.280   6.793
  393   1HB   ALA  55          1HB       ALA  55  -4.045  -1.537   7.851
  394   2HB   ALA  55          2HB       ALA  55  -5.132  -2.861   8.336
  395   3HB   ALA  55          3HB       ALA  55  -3.991  -3.093   6.989
  396    H    GLU  56           H        GLU  56  -3.763  -0.177   6.175
  397    HA   GLU  56           HA       GLU  56  -5.613   2.074   6.295
  398   1HB   GLU  56          1HB       GLU  56  -3.195   1.503   7.883
  399   2HB   GLU  56          2HB       GLU  56  -3.197   3.123   7.168
  400   1HG   GLU  56          1HG       GLU  56  -4.584   3.788   8.813
  401   2HG   GLU  56          2HG       GLU  56  -5.826   2.699   8.178
  402    H    CYS  57           H        CYS  57  -4.166   0.341   4.115
  403    HA   CYS  57           HA       CYS  57  -2.594   2.444   2.869
  404   1HB   CYS  57          1HB       CYS  57  -1.571   0.271   2.945
  405   2HB   CYS  57          2HB       CYS  57  -2.972  -0.473   2.171
  406    H    THR  58           H        THR  58  -4.537  -0.066   1.195
  407    HA   THR  58           HA       THR  58  -5.491   1.313  -0.847
  408    HB   THR  58           HB       THR  58  -5.973  -1.133   0.141
  409    HG1  THR  58           HG1      THR  58  -7.657   0.623  -1.492
  410   1HG2  THR  58          1HG2      THR  58  -8.473   0.503   0.812
  411   2HG2  THR  58          2HG2      THR  58  -8.476  -1.266   0.612
  412   3HG2  THR  58          3HG2      THR  58  -7.539  -0.521   1.929
  413    H    PHE  59           H        PHE  59  -6.714   1.643   2.508
  414    HA   PHE  59           HA       PHE  59  -8.974   2.947   2.321
  415   1HB   PHE  59          1HB       PHE  59  -7.254   2.640   4.275
  416   2HB   PHE  59          2HB       PHE  59  -6.547   4.173   3.749
  417    HD1  PHE  59           HD1      PHE  59  -8.835   2.688   5.935
  418    HD2  PHE  59           HD2      PHE  59  -8.318   6.140   3.522
  419    HE1  PHE  59           HE1      PHE  59 -10.502   3.925   7.346
  420    HE2  PHE  59           HE2      PHE  59  -9.985   7.377   4.933
  421    HZ   PHE  59           HZ       PHE  59 -11.057   6.254   6.829
  422   1H    GLU   1           H1       GLU   1 -22.795   2.209  -2.104
  423    HA   GLU   1           HA       GLU   1 -20.742   1.336  -3.979
  424   1HB   GLU   1          1HB       GLU   1 -21.668   4.144  -3.261
  425   2HB   GLU   1          2HB       GLU   1 -20.371   3.770  -4.411
  426   1HG   GLU   1          1HG       GLU   1 -21.842   3.061  -6.031
  427   2HG   GLU   1          2HG       GLU   1 -22.992   2.394  -4.863
  428    H    GLU   2           H        GLU   2 -19.888   0.202  -1.918
  429    HA   GLU   2           HA       GLU   2 -18.752   2.002  -0.003
  430   1HB   GLU   2          1HB       GLU   2 -19.245  -0.897  -0.241
  431   2HB   GLU   2          2HB       GLU   2 -17.716  -0.508   0.565
  432   1HG   GLU   2          1HG       GLU   2 -19.249   1.239   1.872
  433   2HG   GLU   2          2HG       GLU   2 -20.548   0.138   1.391
  434    H    TYR   3           H        TYR   3 -17.917   0.864  -3.092
  435    HA   TYR   3           HA       TYR   3 -15.062   0.751  -2.547
  436   1HB   TYR   3          1HB       TYR   3 -15.250   0.397  -5.177
  437   2HB   TYR   3          2HB       TYR   3 -15.854  -0.888  -4.126
  438    HD1  TYR   3           HD1      TYR   3 -18.273  -1.257  -3.874
  439    HD2  TYR   3           HD2      TYR   3 -16.753   1.766  -6.493
  440    HE1  TYR   3           HE1      TYR   3 -20.544  -1.082  -5.004
  441    HE2  TYR   3           HE2      TYR   3 -19.028   1.930  -7.614
  442    HH   TYR   3           HH       TYR   3 -20.992   0.365  -7.934
  443    H    VAL   4           H        VAL   4 -14.743   2.993  -1.901
  444    HA   VAL   4           HA       VAL   4 -14.583   4.723  -4.248
  445    HB   VAL   4           HB       VAL   4 -15.362   6.615  -2.782
  446   1HG1  VAL   4          1HG1      VAL   4 -17.466   6.425  -3.624
  447   2HG1  VAL   4          2HG1      VAL   4 -16.739   5.049  -4.488
  448   3HG1  VAL   4          3HG1      VAL   4 -17.685   4.770  -3.007
  449   1HG2  VAL   4          1HG2      VAL   4 -16.059   4.292  -0.983
  450   2HG2  VAL   4          2HG2      VAL   4 -15.230   5.816  -0.582
  451   3HG2  VAL   4          3HG2      VAL   4 -16.977   5.816  -0.928
  452    H    GLY   5           H        GLY   5 -13.870   4.466  -0.691
  453   1HA   GLY   5          1HA       GLY   5 -11.556   6.084  -0.811
  454   2HA   GLY   5          2HA       GLY   5 -12.024   4.996   0.481
  455    H    LEU   6           H        LEU   6 -12.100   3.130  -2.307
  456    HA   LEU   6           HA       LEU   6  -9.263   2.649  -2.485
  457   1HB   LEU   6          1HB       LEU   6  -9.571   0.223  -1.956
  458   2HB   LEU   6          2HB       LEU   6  -9.599   1.340  -0.579
  459    HG   LEU   6           HG       LEU   6 -11.252  -0.517  -0.451
  460   1HD1  LEU   6          1HD1      LEU   6 -11.510   2.051   0.369
  461   2HD1  LEU   6          2HD1      LEU   6 -12.985   1.874  -0.612
  462   3HD1  LEU   6          3HD1      LEU   6 -12.676   0.758   0.741
  463   1HD2  LEU   6          1HD2      LEU   6 -11.709  -0.515  -2.946
  464   2HD2  LEU   6          2HD2      LEU   6 -13.126  -0.673  -1.879
  465   3HD2  LEU   6          3HD2      LEU   6 -12.766   0.888  -2.656
  466    H    SER   7           H        SER   7 -11.635   3.571  -4.128
  467    HA   SER   7           HA       SER   7 -11.657   1.373  -6.036
  468   1HB   SER   7          1HB       SER   7 -13.885   1.982  -5.401
  469   2HB   SER   7          2HB       SER   7 -13.553   3.711  -5.599
  470    HG   SER   7           HG       SER   7 -14.641   2.126  -7.389
  471    H    ALA   8           H        ALA   8 -11.178   1.819  -8.289
  472    HA   ALA   8           HA       ALA   8  -9.104   3.610  -8.704
  473   1HB   ALA   8          1HB       ALA   8  -9.013   2.133 -10.405
  474   2HB   ALA   8          2HB       ALA   8 -10.737   1.720 -10.236
  475   3HB   ALA   8          3HB       ALA   8 -10.250   3.131 -11.206
  476    H    ASN   9           H        ASN   9  -9.748   5.671  -7.836
  477    HA   ASN   9           HA       ASN   9 -10.588   7.458  -9.680
  478   1HB   ASN   9          1HB       ASN   9 -12.830   6.007  -8.843
  479   2HB   ASN   9          2HB       ASN   9 -12.907   7.458  -7.833
  480   1HD2  ASN   9          1HD2      ASN   9 -12.668   9.542  -8.944
  481   2HD2  ASN   9          2HD2      ASN   9 -13.369   9.750 -10.514
  482    H    GLN  10           H        GLN  10 -10.476   6.323  -6.309
  483    HA   GLN  10           HA       GLN  10 -10.727   8.762  -5.033
  484   1HB   GLN  10          1HB       GLN  10 -10.542   6.198  -4.218
  485   2HB   GLN  10          2HB       GLN  10  -8.885   6.715  -3.855
  486   1HG   GLN  10          1HG       GLN  10 -10.725   8.762  -2.987
  487   2HG   GLN  10          2HG       GLN  10 -11.277   7.207  -2.348
  488   1HE2  GLN  10          1HE2      GLN  10  -9.145   5.798  -1.802
  489   2HE2  GLN  10          2HE2      GLN  10  -8.083   6.562  -0.667
  490    H    CYS  11           H        CYS  11  -8.061   7.288  -6.817
  491    HA   CYS  11           HA       CYS  11  -6.030   8.886  -5.657
  492   1HB   CYS  11          1HB       CYS  11  -5.496   6.769  -6.656
  493   2HB   CYS  11          2HB       CYS  11  -6.125   7.289  -8.221
  494    H    ALA  12           H        ALA  12  -8.721   9.631  -7.525
  495    HA   ALA  12           HA       ALA  12  -7.321  11.826  -8.890
  496   1HB   ALA  12          1HB       ALA  12  -8.335  10.721 -10.634
  497   2HB   ALA  12          2HB       ALA  12  -9.622  10.048  -9.605
  498   3HB   ALA  12          3HB       ALA  12  -9.703  11.745 -10.135
  499    H    VAL  13           H        VAL  13  -8.565  11.322  -6.007
  500    HA   VAL  13           HA       VAL  13 -10.806  12.779  -5.605
  501    HB   VAL  13           HB       VAL  13  -8.770  11.677  -4.082
  502   1HG1  VAL  13          1HG1      VAL  13  -9.027  14.630  -3.424
  503   2HG1  VAL  13          2HG1      VAL  13  -8.249  13.410  -2.389
  504   3HG1  VAL  13          3HG1      VAL  13  -7.563  13.787  -3.988
  505   1HG2  VAL  13          1HG2      VAL  13 -10.633  13.034  -2.369
  506   2HG2  VAL  13          2HG2      VAL  13 -11.493  12.448  -3.814
  507   3HG2  VAL  13          3HG2      VAL  13 -10.564  11.310  -2.810
  508    HA   PRO  14           HA       PRO  14  -9.928  16.932  -6.417
  509   1HB   PRO  14          1HB       PRO  14 -11.219  18.299  -4.437
  510   2HB   PRO  14          2HB       PRO  14 -12.047  17.622  -5.838
  511   1HG   PRO  14          1HG       PRO  14 -11.926  16.652  -3.054
  512   2HG   PRO  14          2HG       PRO  14 -13.129  16.250  -4.333
  513   1HD   PRO  14          1HD       PRO  14 -10.970  14.645  -3.352
  514   2HD   PRO  14          2HD       PRO  14 -12.025  14.270  -4.719
  515    H    ALA  15           H        ALA  15  -7.958  15.461  -4.782
  516    HA   ALA  15           HA       ALA  15  -6.169  15.876  -3.532
  517   1HB   ALA  15          1HB       ALA  15  -6.445  18.127  -5.456
  518   2HB   ALA  15          2HB       ALA  15  -5.299  18.391  -4.120
  519   3HB   ALA  15          3HB       ALA  15  -5.096  16.994  -5.205
  520    H    LYS  16           H        LYS  16  -7.969  15.840  -1.734
  521    HA   LYS  16           HA       LYS  16  -7.230  17.602   0.233
  522   1HB   LYS  16          1HB       LYS  16  -9.481  18.901   0.337
  523   2HB   LYS  16          2HB       LYS  16  -8.167  19.494  -0.693
  524   1HG   LYS  16          1HG       LYS  16  -9.520  19.355  -2.484
  525   2HG   LYS  16          2HG       LYS  16  -9.711  17.612  -2.226
  526   1HD   LYS  16          1HD       LYS  16 -11.321  19.719  -0.735
  527   2HD   LYS  16          2HD       LYS  16 -11.875  18.982  -2.247
  528   1HE   LYS  16          1HE       LYS  16 -11.281  16.735  -0.862
  529   2HE   LYS  16          2HE       LYS  16 -11.649  17.800   0.504
  530   1HZ   LYS  16          1HZ       LYS  16 -13.490  17.870  -1.708
  531   2HZ   LYS  16          2HZ       LYS  16 -13.472  16.480  -0.848
  532   3HZ   LYS  16          3HZ       LYS  16 -13.787  17.898  -0.101
  533    H    ASP  17           H        ASP  17  -7.743  14.808  -0.253
  534    HA   ASP  17           HA       ASP  17  -9.474  14.388   1.972
  535   1HB   ASP  17          1HB       ASP  17 -10.910  14.403  -0.191
  536   2HB   ASP  17          2HB       ASP  17 -10.098  12.883  -0.599
  537    H    ARG  18           H        ARG  18  -6.625  13.992   0.630
  538    HA   ARG  18           HA       ARG  18  -6.451  11.127   0.688
  539   1HB   ARG  18          1HB       ARG  18  -4.235  13.188   0.301
  540   2HB   ARG  18          2HB       ARG  18  -4.141  11.463  -0.094
  541   1HG   ARG  18          1HG       ARG  18  -5.288  11.727  -2.049
  542   2HG   ARG  18          2HG       ARG  18  -6.408  12.918  -1.362
  543   1HD   ARG  18          1HD       ARG  18  -4.833  14.702  -1.661
  544   2HD   ARG  18          2HD       ARG  18  -3.496  13.582  -1.973
  545    HE   ARG  18           HE       ARG  18  -5.727  13.355  -3.868
  546   1HH1  ARG  18          1HH1      ARG  18  -2.689  14.982  -3.152
  547   2HH1  ARG  18          2HH1      ARG  18  -2.385  15.413  -4.802
  548   1HH2  ARG  18          1HH2      ARG  18  -5.325  13.924  -6.044
  549   2HH2  ARG  18          2HH2      ARG  18  -3.893  14.807  -6.458
  550    H    VAL  19           H        VAL  19  -4.216  10.341   1.860
  551    HA   VAL  19           HA       VAL  19  -4.405  11.417   4.581
  552    HB   VAL  19           HB       VAL  19  -3.296   8.760   3.668
  553   1HG1  VAL  19          1HG1      VAL  19  -4.427   8.941   6.355
  554   2HG1  VAL  19          2HG1      VAL  19  -2.837   8.347   5.821
  555   3HG1  VAL  19          3HG1      VAL  19  -3.087  10.086   6.107
  556   1HG2  VAL  19          1HG2      VAL  19  -6.108   9.630   4.187
  557   2HG2  VAL  19          2HG2      VAL  19  -5.473   8.416   3.050
  558   3HG2  VAL  19          3HG2      VAL  19  -5.608   8.029   4.783
  559    H    ASP  20           H        ASP  20  -2.838  12.480   2.161
  560    HA   ASP  20           HA       ASP  20  -0.740  12.914   1.570
  561   1HB   ASP  20          1HB       ASP  20  -1.009  14.826   2.846
  562   2HB   ASP  20          2HB       ASP  20  -1.251  13.926   4.351
  563    H    CYS  21           H        CYS  21   0.217  10.756   1.292
  564    HA   CYS  21           HA       CYS  21   1.081   9.098   3.264
  565   1HB   CYS  21          1HB       CYS  21   1.173   9.110   0.549
  566   2HB   CYS  21          2HB       CYS  21   2.886   9.277   0.939
  567    H    GLY  22           H        GLY  22   2.510  12.108   1.979
  568   1HA   GLY  22          1HA       GLY  22   4.362  13.271   2.530
  569   2HA   GLY  22          2HA       GLY  22   3.954  12.813   4.171
  570    H    TYR  23           H        TYR  23   5.347  11.171   1.232
  571    HA   TYR  23           HA       TYR  23   7.128   9.681   2.978
  572   1HB   TYR  23          1HB       TYR  23   5.866   9.555   0.311
  573   2HB   TYR  23          2HB       TYR  23   7.600   9.250   0.174
  574    HD1  TYR  23           HD1      TYR  23   8.610   7.326   1.442
  575    HD2  TYR  23           HD2      TYR  23   4.381   7.931   1.209
  576    HE1  TYR  23           HE1      TYR  23   8.219   4.919   2.158
  577    HE2  TYR  23           HE2      TYR  23   4.005   5.522   1.927
  578    HH   TYR  23           HH       TYR  23   4.913   3.642   2.459
  579    HA   PRO  24           HA       PRO  24  10.498  12.282   2.158
  580   1HB   PRO  24          1HB       PRO  24  12.532  10.660   2.991
  581   2HB   PRO  24          2HB       PRO  24  11.556  11.627   4.095
  582   1HG   PRO  24          1HG       PRO  24  11.468   8.734   3.523
  583   2HG   PRO  24          2HG       PRO  24  10.830   9.615   4.956
  584   1HD   PRO  24          1HD       PRO  24   9.375   8.524   2.745
  585   2HD   PRO  24          2HD       PRO  24   8.719   9.521   4.050
  586    H    HIS  25           H        HIS  25   9.774   9.569   0.431
  587    HA   HIS  25           HA       HIS  25  11.928  10.229  -1.442
  588   1HB   HIS  25          1HB       HIS  25  11.208   7.706  -0.230
  589   2HB   HIS  25          2HB       HIS  25  11.067   7.609  -1.989
  590    HD1  HIS  25           HD1      HIS  25  13.411   6.807   0.463
  591    HD2  HIS  25           HD2      HIS  25  13.674   9.054  -3.070
  592    HE1  HIS  25           HE1      HIS  25  15.881   6.845  -0.178
  593    HE2  HIS  25           HE2      HIS  25  15.972   8.193  -2.385
  594    H    VAL  26           H        VAL  26   8.856  10.918  -0.874
  595    HA   VAL  26           HA       VAL  26   7.171   9.994  -2.709
  596    HB   VAL  26           HB       VAL  26   6.433  11.665  -1.269
  597   1HG1  VAL  26          1HG1      VAL  26   7.642  13.420  -0.580
  598   2HG1  VAL  26          2HG1      VAL  26   8.969  12.773  -1.574
  599   3HG1  VAL  26          3HG1      VAL  26   7.877  14.009  -2.243
  600   1HG2  VAL  26          1HG2      VAL  26   5.196  13.061  -2.644
  601   2HG2  VAL  26          2HG2      VAL  26   6.547  13.329  -3.771
  602   3HG2  VAL  26          3HG2      VAL  26   5.677  11.777  -3.778
  603    H    THR  27           H        THR  27   7.108   9.689  -4.876
  604    HA   THR  27           HA       THR  27   8.173  11.589  -6.690
  605    HB   THR  27           HB       THR  27  10.017   9.652  -5.605
  606    HG1  THR  27           HG1      THR  27  11.099  11.395  -6.430
  607   1HG2  THR  27          1HG2      THR  27   8.817   8.723  -8.065
  608   2HG2  THR  27          2HG2      THR  27  10.440   9.347  -8.447
  609   3HG2  THR  27          3HG2      THR  27  10.243   8.063  -7.229
  610    HA   PRO  28           HA       PRO  28   5.426   9.493  -9.231
  611   1HB   PRO  28          1HB       PRO  28   6.329  10.128 -11.729
  612   2HB   PRO  28          2HB       PRO  28   5.368  11.228 -10.743
  613   1HG   PRO  28          1HG       PRO  28   8.263  11.229 -11.310
  614   2HG   PRO  28          2HG       PRO  28   7.233  12.585 -10.725
  615   1HD   PRO  28          1HD       PRO  28   9.095  10.995  -9.239
  616   2HD   PRO  28          2HD       PRO  28   7.989  12.211  -8.587
  617    H    LYS  29           H        LYS  29   7.126   7.711  -8.094
  618    HA   LYS  29           HA       LYS  29   6.877   5.561  -9.798
  619   1HB   LYS  29          1HB       LYS  29   8.814   7.110 -10.852
  620   2HB   LYS  29          2HB       LYS  29   9.791   6.109  -9.765
  621   1HG   LYS  29          1HG       LYS  29   9.517   4.271 -11.058
  622   2HG   LYS  29          2HG       LYS  29   7.778   4.549 -11.253
  623   1HD   LYS  29          1HD       LYS  29   8.516   6.469 -12.870
  624   2HD   LYS  29          2HD       LYS  29  10.085   5.646 -12.894
  625   1HE   LYS  29          1HE       LYS  29   9.280   3.893 -14.128
  626   2HE   LYS  29          2HE       LYS  29   7.716   3.881 -13.301
  627   1HZ   LYS  29          1HZ       LYS  29   6.871   5.242 -14.823
  628   2HZ   LYS  29          2HZ       LYS  29   8.201   6.185 -14.922
  629   3HZ   LYS  29          3HZ       LYS  29   8.126   4.788 -15.764
  630    H    GLU  30           H        GLU  30   8.137   7.263  -7.040
  631    HA   GLU  30           HA       GLU  30   9.014   4.797  -5.822
  632   1HB   GLU  30          1HB       GLU  30   9.535   7.654  -5.450
  633   2HB   GLU  30          2HB       GLU  30   9.219   6.838  -3.910
  634   1HG   GLU  30          1HG       GLU  30  11.623   6.796  -4.471
  635   2HG   GLU  30          2HG       GLU  30  10.963   5.154  -4.451
  636    H    CYS  31           H        CYS  31   6.563   7.421  -5.410
  637    HA   CYS  31           HA       CYS  31   5.427   6.552  -3.076
  638   1HB   CYS  31          1HB       CYS  31   4.263   7.957  -5.468
  639   2HB   CYS  31          2HB       CYS  31   3.307   7.619  -4.023
  640    H    ASN  32           H        ASN  32   4.443   5.789  -6.502
  641    HA   ASN  32           HA       ASN  32   2.503   3.968  -5.812
  642   1HB   ASN  32          1HB       ASN  32   4.095   4.655  -8.237
  643   2HB   ASN  32          2HB       ASN  32   3.415   3.021  -8.249
  644   1HD2  ASN  32          1HD2      ASN  32   2.304   6.138  -6.936
  645   2HD2  ASN  32          2HD2      ASN  32   0.785   6.200  -7.768
  646    H    ASN  33           H        ASN  33   5.924   3.837  -5.467
  647    HA   ASN  33           HA       ASN  33   6.127   1.011  -5.872
  648   1HB   ASN  33          1HB       ASN  33   7.924   3.057  -6.098
  649   2HB   ASN  33          2HB       ASN  33   8.307   2.520  -4.456
  650   1HD2  ASN  33          1HD2      ASN  33  10.372   1.992  -5.426
  651   2HD2  ASN  33          2HD2      ASN  33  10.600   0.467  -6.214
  652    H    ARG  34           H        ARG  34   5.922   3.455  -3.249
  653    HA   ARG  34           HA       ARG  34   6.453   1.520  -1.230
  654   1HB   ARG  34          1HB       ARG  34   5.216   4.240  -0.726
  655   2HB   ARG  34          2HB       ARG  34   6.353   3.344   0.296
  656   1HG   ARG  34          1HG       ARG  34   7.600   3.785  -2.250
  657   2HG   ARG  34          2HG       ARG  34   6.915   5.331  -1.717
  658   1HD   ARG  34          1HD       ARG  34   8.501   5.562  -0.116
  659   2HD   ARG  34          2HD       ARG  34   8.242   3.919   0.489
  660    HE   ARG  34           HE       ARG  34   9.628   3.614  -1.928
  661   1HH1  ARG  34          1HH1      ARG  34  10.211   5.247   1.134
  662   2HH1  ARG  34          2HH1      ARG  34  11.934   5.092   1.035
  663   1HH2  ARG  34          1HH2      ARG  34  11.899   3.409  -2.059
  664   2HH2  ARG  34          2HH2      ARG  34  12.901   4.040  -0.794
  665    H    GLY  35           H        GLY  35   3.685   2.838  -2.963
  666   1HA   GLY  35          1HA       GLY  35   1.699   1.412  -2.860
  667   2HA   GLY  35          2HA       GLY  35   1.866   1.408  -1.116
  668    H    CYS  36           H        CYS  36   2.677   4.370  -2.857
  669    HA   CYS  36           HA       CYS  36   0.159   5.512  -1.887
  670   1HB   CYS  36          1HB       CYS  36   2.795   6.933  -2.267
  671   2HB   CYS  36          2HB       CYS  36   1.307   7.624  -1.613
  672    H    CYS  37           H        CYS  37  -0.377   7.619  -3.263
  673    HA   CYS  37           HA       CYS  37   0.116   6.923  -6.066
  674   1HB   CYS  37          1HB       CYS  37  -2.265   6.812  -4.973
  675   2HB   CYS  37          2HB       CYS  37  -2.239   8.562  -5.214
  676    H    PHE  38           H        PHE  38   1.084   8.514  -7.329
  677    HA   PHE  38           HA       PHE  38   1.794  10.966  -5.945
  678   1HB   PHE  38          1HB       PHE  38   3.403   9.408  -7.222
  679   2HB   PHE  38          2HB       PHE  38   2.552   9.846  -8.709
  680    HD1  PHE  38           HD1      PHE  38   3.163  11.777  -9.886
  681    HD2  PHE  38           HD2      PHE  38   4.543  11.253  -5.908
  682    HE1  PHE  38           HE1      PHE  38   4.682  13.758 -10.153
  683    HE2  PHE  38           HE2      PHE  38   6.063  13.234  -6.174
  684    HZ   PHE  38           HZ       PHE  38   6.114  14.462  -8.293
  685    H    ASP  39           H        ASP  39   0.668  12.824  -6.248
  686    HA   ASP  39           HA       ASP  39  -1.289  12.882  -8.318
  687   1HB   ASP  39          1HB       ASP  39  -2.159  14.003  -6.521
  688   2HB   ASP  39          2HB       ASP  39  -0.566  14.481  -5.913
  689    H    SER  40           H        SER  40   0.852  15.607  -7.268
  690    HA   SER  40           HA       SER  40   2.423  16.719  -8.348
  691   1HB   SER  40          1HB       SER  40   2.530  14.448  -9.828
  692   2HB   SER  40          2HB       SER  40   1.948  15.572 -11.069
  693    HG   SER  40           HG       SER  40   3.868  16.554 -11.101
  694    H    ARG  41           H        ARG  41  -0.828  16.141  -9.525
  695    HA   ARG  41           HA       ARG  41  -0.970  18.190 -11.382
  696   1HB   ARG  41          1HB       ARG  41  -3.278  17.283  -9.619
  697   2HB   ARG  41          2HB       ARG  41  -3.359  17.854 -11.295
  698   1HG   ARG  41          1HG       ARG  41  -1.624  15.702 -11.476
  699   2HG   ARG  41          2HG       ARG  41  -2.757  15.156 -10.228
  700   1HD   ARG  41          1HD       ARG  41  -3.714  14.444 -12.287
  701   2HD   ARG  41          2HD       ARG  41  -4.634  15.894 -11.859
  702    HE   ARG  41           HE       ARG  41  -2.377  16.649 -13.454
  703   1HH1  ARG  41          1HH1      ARG  41  -5.458  14.977 -13.753
  704   2HH1  ARG  41          2HH1      ARG  41  -5.656  15.374 -15.427
  705   1HH2  ARG  41          1HH2      ARG  41  -2.637  17.172 -15.663
  706   2HH2  ARG  41          2HH2      ARG  41  -4.042  16.630 -16.521
  707    H    ILE  42           H        ILE  42  -1.565  18.040  -7.825
  708    HA   ILE  42           HA       ILE  42  -1.719  20.974  -7.846
  709    HB   ILE  42           HB       ILE  42  -3.018  19.290  -5.737
  710   1HG1  ILE  42          1HG1      ILE  42  -4.061  19.865  -8.499
  711   2HG1  ILE  42          2HG1      ILE  42  -4.040  18.330  -7.617
  712   1HG2  ILE  42          1HG2      ILE  42  -3.835  21.984  -6.832
  713   2HG2  ILE  42          2HG2      ILE  42  -4.307  21.215  -5.297
  714   3HG2  ILE  42          3HG2      ILE  42  -2.640  21.795  -5.528
  715   1HD1  ILE  42          1HD1      ILE  42  -5.940  20.635  -7.430
  716   2HD1  ILE  42          2HD1      ILE  42  -6.248  18.890  -7.259
  717   3HD1  ILE  42          3HD1      ILE  42  -5.544  19.807  -5.905
  718    HA   PRO  43           HA       PRO  43   1.929  20.222  -5.508
  719   1HB   PRO  43          1HB       PRO  43   2.978  22.729  -5.776
  720   2HB   PRO  43          2HB       PRO  43   3.267  21.435  -6.937
  721   1HG   PRO  43          1HG       PRO  43   1.473  23.772  -7.111
  722   2HG   PRO  43          2HG       PRO  43   2.120  22.751  -8.445
  723   1HD   PRO  43          1HD       PRO  43  -0.515  22.759  -7.326
  724   2HD   PRO  43          2HD       PRO  43   0.116  21.626  -8.527
  725    H    GLY  44           H        GLY  44  -0.780  21.962  -4.868
  726   1HA   GLY  44          1HA       GLY  44   0.238  23.110  -2.382
  727   2HA   GLY  44          2HA       GLY  44  -1.352  23.323  -3.087
  728    H    VAL  45           H        VAL  45  -0.879  20.082  -3.477
  729    HA   VAL  45           HA       VAL  45  -1.884  19.466  -0.784
  730    HB   VAL  45           HB       VAL  45  -3.563  18.160  -1.633
  731   1HG1  VAL  45          1HG1      VAL  45  -3.379  20.746  -2.617
  732   2HG1  VAL  45          2HG1      VAL  45  -3.775  19.785  -4.062
  733   3HG1  VAL  45          3HG1      VAL  45  -4.832  19.718  -2.631
  734   1HG2  VAL  45          1HG2      VAL  45  -3.655  17.156  -3.830
  735   2HG2  VAL  45          2HG2      VAL  45  -2.222  18.072  -4.356
  736   3HG2  VAL  45          3HG2      VAL  45  -2.065  16.813  -3.106
  737    HA   PRO  46           HA       PRO  46   0.868  16.106  -0.771
  738   1HB   PRO  46          1HB       PRO  46  -0.552  13.829  -0.256
  739   2HB   PRO  46          2HB       PRO  46  -0.134  15.006   0.987
  740   1HG   PRO  46          1HG       PRO  46  -2.702  14.526  -0.384
  741   2HG   PRO  46          2HG       PRO  46  -2.404  15.365   1.180
  742   1HD   PRO  46          1HD       PRO  46  -3.030  16.514  -1.367
  743   2HD   PRO  46          2HD       PRO  46  -2.590  17.389   0.106
  744    H    TRP  47           H        TRP  47   2.155  15.518  -2.387
  745    HA   TRP  47           HA       TRP  47   0.812  14.477  -4.742
  746   1HB   TRP  47          1HB       TRP  47   3.720  14.675  -4.812
  747   2HB   TRP  47          2HB       TRP  47   2.504  15.324  -5.913
  748    HD1  TRP  47           HD1      TRP  47   1.356  17.768  -5.027
  749    HE1  TRP  47           HE1      TRP  47   2.417  19.829  -3.767
  750    HE3  TRP  47           HE3      TRP  47   5.397  15.258  -3.230
  751    HZ2  TRP  47           HZ2      TRP  47   4.775  20.171  -2.195
  752    HZ3  TRP  47           HZ3      TRP  47   7.030  16.529  -1.840
  753    HH2  TRP  47           HH2      TRP  47   6.769  18.903  -1.316
  754    H    CYS  48           H        CYS  48   0.962  12.974  -2.127
  755    HA   CYS  48           HA       CYS  48   1.736  10.495  -3.235
  756   1HB   CYS  48          1HB       CYS  48   3.961  11.488  -2.610
  757   2HB   CYS  48          2HB       CYS  48   3.447  11.417  -0.923
  758    H    PHE  49           H        PHE  49  -0.159   9.519  -2.558
  759    HA   PHE  49           HA       PHE  49  -0.631   9.470   0.311
  760   1HB   PHE  49          1HB       PHE  49  -3.183   9.704  -0.625
  761   2HB   PHE  49          2HB       PHE  49  -2.240  11.124  -0.163
  762    HD1  PHE  49           HD1      PHE  49  -0.741  12.091  -2.138
  763    HD2  PHE  49           HD2      PHE  49  -4.213   9.710  -2.674
  764    HE1  PHE  49           HE1      PHE  49  -1.011  13.006  -4.459
  765    HE2  PHE  49           HE2      PHE  49  -4.483  10.626  -4.996
  766    HZ   PHE  49           HZ       PHE  49  -2.878  12.264  -5.859
  767    H    LYS  50           H        LYS  50  -3.030   8.061   0.342
  768    HA   LYS  50           HA       LYS  50  -2.435   5.712  -1.314
  769   1HB   LYS  50          1HB       LYS  50  -3.445   4.536   0.856
  770   2HB   LYS  50          2HB       LYS  50  -1.711   4.828   0.645
  771   1HG   LYS  50          1HG       LYS  50  -3.293   7.060   1.837
  772   2HG   LYS  50          2HG       LYS  50  -3.125   5.612   2.847
  773   1HD   LYS  50          1HD       LYS  50  -0.926   7.347   1.660
  774   2HD   LYS  50          2HD       LYS  50  -1.272   7.073   3.376
  775   1HE   LYS  50          1HE       LYS  50   0.037   5.252   1.358
  776   2HE   LYS  50          2HE       LYS  50   0.558   5.640   3.005
  777   1HZ   LYS  50          1HZ       LYS  50  -1.293   3.656   2.089
  778   2HZ   LYS  50          2HZ       LYS  50  -0.348   3.665   3.421
  779   3HZ   LYS  50          3HZ       LYS  50  -1.774   4.460   3.426
  780    HA   PRO  51           HA       PRO  51  -6.714   7.085  -1.871
  781   1HB   PRO  51          1HB       PRO  51  -6.670   7.306  -4.593
  782   2HB   PRO  51          2HB       PRO  51  -6.402   8.671  -3.510
  783   1HG   PRO  51          1HG       PRO  51  -4.472   7.095  -5.088
  784   2HG   PRO  51          2HG       PRO  51  -4.271   8.742  -4.390
  785   1HD   PRO  51          1HD       PRO  51  -3.175   6.267  -3.458
  786   2HD   PRO  51          2HD       PRO  51  -3.080   7.834  -2.646
  787    H    LEU  52           H        LEU  52  -6.058   5.579  -4.907
  788    HA   LEU  52           HA       LEU  52  -7.679   3.330  -3.976
  789   1HB   LEU  52          1HB       LEU  52  -8.499   3.130  -6.056
  790   2HB   LEU  52          2HB       LEU  52  -8.158   4.870  -6.048
  791    HG   LEU  52           HG       LEU  52  -5.816   3.665  -7.006
  792   1HD1  LEU  52          1HD1      LEU  52  -7.209   2.541  -9.075
  793   2HD1  LEU  52          2HD1      LEU  52  -6.437   1.644  -7.747
  794   3HD1  LEU  52          3HD1      LEU  52  -8.171   2.033  -7.667
  795   1HD2  LEU  52          1HD2      LEU  52  -6.055   5.359  -8.414
  796   2HD2  LEU  52          2HD2      LEU  52  -7.461   4.577  -9.175
  797   3HD2  LEU  52          3HD2      LEU  52  -7.690   5.640  -7.767
  798    H    GLN  53           H        GLN  53  -5.007   3.478  -3.017
  799    HA   GLN  53           HA       GLN  53  -3.113   2.288  -4.544
  800   1HB   GLN  53          1HB       GLN  53  -3.662   1.944  -1.573
  801   2HB   GLN  53          2HB       GLN  53  -2.142   1.485  -2.361
  802   1HG   GLN  53          1HG       GLN  53  -3.354   4.283  -2.298
  803   2HG   GLN  53          2HG       GLN  53  -2.000   3.737  -1.300
  804   1HE2  GLN  53          1HE2      GLN  53  -0.790   2.091  -3.298
  805   2HE2  GLN  53          2HE2      GLN  53  -0.061   3.116  -4.489
  806    H    GLU  54           H        GLU  54  -6.114   0.951  -3.448
  807    HA   GLU  54           HA       GLU  54  -5.650  -1.621  -2.947
  808   1HB   GLU  54          1HB       GLU  54  -7.877  -1.956  -3.381
  809   2HB   GLU  54          2HB       GLU  54  -7.876  -0.183  -3.403
  810   1HG   GLU  54          1HG       GLU  54  -8.930  -0.553  -5.414
  811   2HG   GLU  54          2HG       GLU  54  -7.260  -0.624  -5.996
  812    H    ALA  55           H        ALA  55  -5.031   0.064  -5.966
  813    HA   ALA  55           HA       ALA  55  -5.207  -1.640  -7.957
  814   1HB   ALA  55          1HB       ALA  55  -3.235  -0.637  -8.901
  815   2HB   ALA  55          2HB       ALA  55  -4.014   0.597  -7.882
  816   3HB   ALA  55          3HB       ALA  55  -2.577  -0.268  -7.288
  817    H    GLU  56           H        GLU  56  -2.171  -1.709  -5.955
  818    HA   GLU  56           HA       GLU  56  -2.325  -4.608  -6.126
  819   1HB   GLU  56          1HB       GLU  56  -0.563  -3.098  -7.642
  820   2HB   GLU  56          2HB       GLU  56   0.429  -3.549  -6.245
  821   1HG   GLU  56          1HG       GLU  56   0.452  -5.757  -6.825
  822   2HG   GLU  56          2HG       GLU  56  -1.234  -5.750  -7.366
  823    H    CYS  57           H        CYS  57  -2.812  -2.334  -4.064
  824    HA   CYS  57           HA       CYS  57  -0.745  -2.970  -2.132
  825   1HB   CYS  57          1HB       CYS  57  -1.744  -0.628  -2.637
  826   2HB   CYS  57          2HB       CYS  57  -3.079  -1.155  -1.608
  827    H    THR  58           H        THR  58  -4.370  -2.616  -1.986
  828    HA   THR  58           HA       THR  58  -4.787  -4.190   0.213
  829    HB   THR  58           HB       THR  58  -6.392  -2.673  -1.153
  830    HG1  THR  58           HG1      THR  58  -8.085  -3.956  -0.228
  831   1HG2  THR  58          1HG2      THR  58  -6.322  -3.713  -3.361
  832   2HG2  THR  58          2HG2      THR  58  -6.622  -5.323  -2.664
  833   3HG2  THR  58          3HG2      THR  58  -7.910  -4.096  -2.654
  834    H    PHE  59           H        PHE  59  -4.292  -5.217  -3.183
  835    HA   PHE  59           HA       PHE  59  -5.121  -7.708  -3.282
  836   1HB   PHE  59          1HB       PHE  59  -2.991  -6.099  -4.351
  837   2HB   PHE  59          2HB       PHE  59  -2.252  -7.650  -3.933
  838    HD1  PHE  59           HD1      PHE  59  -4.383  -5.874  -6.238
  839    HD2  PHE  59           HD2      PHE  59  -3.162  -9.738  -4.976
  840    HE1  PHE  59           HE1      PHE  59  -5.259  -6.849  -8.378
  841    HE2  PHE  59           HE2      PHE  59  -4.039 -10.712  -7.117
  842    HZ   PHE  59           HZ       PHE  59  -5.077  -9.256  -8.792
  Start of MODEL   16
    1   1H    GLU   1           H1       GLU   1 -18.373 -12.553   0.918
    2    HA   GLU   1           HA       GLU   1 -16.255 -13.680   1.074
    3   1HB   GLU   1          1HB       GLU   1 -18.195 -14.352  -1.128
    4   2HB   GLU   1          2HB       GLU   1 -16.733 -15.337  -0.948
    5   1HG   GLU   1          1HG       GLU   1 -17.342 -16.022   1.248
    6   2HG   GLU   1          2HG       GLU   1 -18.546 -14.736   1.417
    7    H    GLU   2           H        GLU   2 -16.559 -11.282  -1.316
    8    HA   GLU   2           HA       GLU   2 -14.454 -12.200  -2.990
    9   1HB   GLU   2          1HB       GLU   2 -16.195  -9.768  -2.800
   10   2HB   GLU   2          2HB       GLU   2 -14.675  -9.614  -3.699
   11   1HG   GLU   2          1HG       GLU   2 -15.554 -11.942  -4.751
   12   2HG   GLU   2          2HG       GLU   2 -17.121 -11.245  -4.316
   13    H    TYR   3           H        TYR   3 -14.572 -10.932   0.141
   14    HA   TYR   3           HA       TYR   3 -12.127  -9.376  -0.121
   15   1HB   TYR   3          1HB       TYR   3 -12.715  -9.326   2.492
   16   2HB   TYR   3          2HB       TYR   3 -13.728  -8.404   1.377
   17    HD1  TYR   3           HD1      TYR   3 -16.020  -9.050   0.957
   18    HD2  TYR   3           HD2      TYR   3 -13.511 -11.449   3.459
   19    HE1  TYR   3           HE1      TYR   3 -18.056 -10.330   1.784
   20    HE2  TYR   3           HE2      TYR   3 -15.555 -12.721   4.276
   21    HH   TYR   3           HH       TYR   3 -17.684 -13.031   4.061
   22    H    VAL   4           H        VAL   4 -10.995 -11.473  -0.862
   23    HA   VAL   4           HA       VAL   4 -10.167 -12.957   1.538
   24    HB   VAL   4           HB       VAL   4  -9.514 -14.612  -0.484
   25   1HG1  VAL   4          1HG1      VAL   4 -12.148 -15.348   0.054
   26   2HG1  VAL   4          2HG1      VAL   4 -10.702 -15.818   0.980
   27   3HG1  VAL   4          3HG1      VAL   4 -11.661 -14.406   1.483
   28   1HG2  VAL   4          1HG2      VAL   4 -10.494 -13.163  -2.211
   29   2HG2  VAL   4          2HG2      VAL   4 -11.356 -14.717  -2.101
   30   3HG2  VAL   4          3HG2      VAL   4 -12.074 -13.251  -1.393
   31    H    GLY   5           H        GLY   5  -9.131 -11.898  -1.783
   32   1HA   GLY   5          1HA       GLY   5  -6.357 -12.160  -1.187
   33   2HA   GLY   5          2HA       GLY   5  -7.084 -11.385  -2.582
   34    H    LEU   6           H        LEU   6  -8.466 -10.177   0.323
   35    HA   LEU   6           HA       LEU   6  -6.434  -8.126   0.652
   36   1HB   LEU   6          1HB       LEU   6  -8.101  -6.339   0.458
   37   2HB   LEU   6          2HB       LEU   6  -7.765  -7.170  -1.072
   38    HG   LEU   6           HG       LEU   6 -10.202  -7.552   0.691
   39   1HD1  LEU   6          1HD1      LEU   6  -9.623  -5.823  -1.658
   40   2HD1  LEU   6          2HD1      LEU   6 -11.207  -6.632  -1.612
   41   3HD1  LEU   6          3HD1      LEU   6 -10.713  -5.565  -0.276
   42   1HD2  LEU   6          1HD2      LEU   6  -9.164  -9.048  -1.658
   43   2HD2  LEU   6          2HD2      LEU   6 -10.152  -9.596  -0.284
   44   3HD2  LEU   6          3HD2      LEU   6 -10.909  -8.701  -1.623
   45    H    SER   7           H        SER   7  -7.863 -10.541   2.045
   46    HA   SER   7           HA       SER   7  -9.105  -9.165   4.237
   47   1HB   SER   7          1HB       SER   7  -9.713 -11.343   5.038
   48   2HB   SER   7          2HB       SER   7  -9.945 -11.369   3.282
   49    HG   SER   7           HG       SER   7  -7.409 -12.136   3.747
   50    H    ALA   8           H        ALA   8  -8.402  -9.961   6.559
   51    HA   ALA   8           HA       ALA   8  -5.702  -9.212   6.892
   52   1HB   ALA   8          1HB       ALA   8  -7.694  -8.872   8.470
   53   2HB   ALA   8          2HB       ALA   8  -7.487 -10.578   8.931
   54   3HB   ALA   8          3HB       ALA   8  -6.173  -9.414   9.220
   55    H    ASN   9           H        ASN   9  -7.118 -12.108   5.835
   56    HA   ASN   9           HA       ASN   9  -5.207 -13.793   7.155
   57   1HB   ASN   9          1HB       ASN   9  -7.768 -14.146   5.987
   58   2HB   ASN   9          2HB       ASN   9  -6.665 -15.048   4.937
   59   1HD2  ASN   9          1HD2      ASN   9  -4.995 -16.368   6.162
   60   2HD2  ASN   9          2HD2      ASN   9  -5.558 -17.307   7.504
   61    H    GLN  10           H        GLN  10  -5.495 -11.823   4.326
   62    HA   GLN  10           HA       GLN  10  -4.161 -13.352   2.451
   63   1HB   GLN  10          1HB       GLN  10  -5.385 -10.932   2.451
   64   2HB   GLN  10          2HB       GLN  10  -3.694 -10.400   2.428
   65   1HG   GLN  10          1HG       GLN  10  -4.051 -12.598   0.576
   66   2HG   GLN  10          2HG       GLN  10  -5.274 -11.361   0.247
   67   1HE2  GLN  10          1HE2      GLN  10  -3.919  -9.086   1.030
   68   2HE2  GLN  10          2HE2      GLN  10  -2.592  -8.776  -0.038
   69    H    CYS  11           H        CYS  11  -2.983 -11.182   5.064
   70    HA   CYS  11           HA       CYS  11  -0.301 -11.206   4.223
   71   1HB   CYS  11          1HB       CYS  11  -1.024  -9.454   5.626
   72   2HB   CYS  11          2HB       CYS  11  -1.637 -10.567   6.851
   73    H    ALA  12           H        ALA  12  -2.343 -13.669   5.309
   74    HA   ALA  12           HA       ALA  12  -0.159 -15.098   6.649
   75   1HB   ALA  12          1HB       ALA  12  -2.031 -16.597   7.421
   76   2HB   ALA  12          2HB       ALA  12  -2.168 -14.916   7.990
   77   3HB   ALA  12          3HB       ALA  12  -3.178 -15.482   6.638
   78    H    VAL  13           H        VAL  13  -0.554 -14.553   3.663
   79    HA   VAL  13           HA       VAL  13  -1.547 -16.583   2.226
   80    HB   VAL  13           HB       VAL  13   0.801 -16.169   0.930
   81   1HG1  VAL  13          1HG1      VAL  13  -1.307 -15.732  -0.091
   82   2HG1  VAL  13          2HG1      VAL  13  -1.677 -14.429   1.064
   83   3HG1  VAL  13          3HG1      VAL  13  -0.392 -14.206  -0.147
   84   1HG2  VAL  13          1HG2      VAL  13   0.367 -13.547   2.360
   85   2HG2  VAL  13          2HG2      VAL  13   1.491 -14.771   2.999
   86   3HG2  VAL  13          3HG2      VAL  13   1.754 -14.080   1.381
   87    HA   PRO  14           HA       PRO  14   0.691 -20.194   3.025
   88   1HB   PRO  14          1HB       PRO  14   1.044 -21.354   0.577
   89   2HB   PRO  14          2HB       PRO  14  -0.476 -21.421   1.465
   90   1HG   PRO  14          1HG       PRO  14   0.295 -19.768  -0.852
   91   2HG   PRO  14          2HG       PRO  14  -1.357 -20.184  -0.270
   92   1HD   PRO  14          1HD       PRO  14   0.056 -17.709   0.003
   93   2HD   PRO  14          2HD       PRO  14  -1.502 -18.120   0.732
   94    H    ALA  15           H        ALA  15   2.191 -17.651   1.725
   95    HA   ALA  15           HA       ALA  15   4.359 -17.101   1.923
   96   1HB   ALA  15          1HB       ALA  15   5.431 -19.869   2.092
   97   2HB   ALA  15          2HB       ALA  15   5.817 -18.431   3.066
   98   3HB   ALA  15          3HB       ALA  15   4.352 -19.378   3.420
   99    H    LYS  16           H        LYS  16   3.037 -17.252  -0.472
  100    HA   LYS  16           HA       LYS  16   5.046 -17.335  -2.318
  101   1HB   LYS  16          1HB       LYS  16   4.076 -19.530  -3.514
  102   2HB   LYS  16          2HB       LYS  16   5.488 -19.548  -2.444
  103   1HG   LYS  16          1HG       LYS  16   4.364 -20.644  -0.775
  104   2HG   LYS  16          2HG       LYS  16   2.838 -19.801  -1.091
  105   1HD   LYS  16          1HD       LYS  16   2.346 -21.986  -1.760
  106   2HD   LYS  16          2HD       LYS  16   2.813 -21.245  -3.301
  107   1HE   LYS  16          1HE       LYS  16   4.496 -22.728  -3.527
  108   2HE   LYS  16          2HE       LYS  16   5.186 -22.242  -1.971
  109   1HZ   LYS  16          1HZ       LYS  16   3.020 -24.193  -2.344
  110   2HZ   LYS  16          2HZ       LYS  16   4.577 -24.561  -2.020
  111   3HZ   LYS  16          3HZ       LYS  16   3.678 -23.769  -0.911
  112    H    ASP  17           H        ASP  17   2.953 -15.640  -1.661
  113    HA   ASP  17           HA       ASP  17   1.578 -15.639  -4.176
  114   1HB   ASP  17          1HB       ASP  17   0.056 -16.910  -2.682
  115   2HB   ASP  17          2HB       ASP  17   0.079 -15.578  -1.514
  116    H    ARG  18           H        ARG  18   3.531 -14.164  -2.100
  117    HA   ARG  18           HA       ARG  18   2.103 -11.687  -1.829
  118   1HB   ARG  18          1HB       ARG  18   4.995 -12.280  -1.072
  119   2HB   ARG  18          2HB       ARG  18   3.976 -10.975  -0.442
  120   1HG   ARG  18          1HG       ARG  18   2.952 -12.346   1.060
  121   2HG   ARG  18          2HG       ARG  18   2.843 -13.697  -0.081
  122   1HD   ARG  18          1HD       ARG  18   5.253 -14.185   0.295
  123   2HD   ARG  18          2HD       ARG  18   5.353 -12.841   1.442
  124    HE   ARG  18           HE       ARG  18   3.306 -14.909   1.995
  125   1HH1  ARG  18          1HH1      ARG  18   6.516 -13.648   2.695
  126   2HH1  ARG  18          2HH1      ARG  18   6.653 -14.481   4.207
  127   1HH2  ARG  18          1HH2      ARG  18   3.487 -16.009   3.990
  128   2HH2  ARG  18          2HH2      ARG  18   4.919 -15.834   4.948
  129    H    VAL  19           H        VAL  19   3.773  -9.645  -2.246
  130    HA   VAL  19           HA       VAL  19   4.744 -10.047  -4.989
  131    HB   VAL  19           HB       VAL  19   3.946  -7.412  -3.782
  132   1HG1  VAL  19          1HG1      VAL  19   3.375  -7.005  -6.251
  133   2HG1  VAL  19          2HG1      VAL  19   5.098  -7.124  -5.817
  134   3HG1  VAL  19          3HG1      VAL  19   4.275  -8.505  -6.582
  135   1HG2  VAL  19          1HG2      VAL  19   1.719  -7.873  -5.063
  136   2HG2  VAL  19          2HG2      VAL  19   2.154  -9.586  -4.846
  137   3HG2  VAL  19          3HG2      VAL  19   1.941  -8.534  -3.425
  138    H    ASP  20           H        ASP  20   6.049 -10.442  -2.203
  139    HA   ASP  20           HA       ASP  20   7.839  -9.803  -1.092
  140   1HB   ASP  20          1HB       ASP  20   9.067 -11.112  -2.555
  141   2HB   ASP  20          2HB       ASP  20   8.618 -10.151  -3.971
  142    H    CYS  21           H        CYS  21   7.345  -7.674  -0.254
  143    HA   CYS  21           HA       CYS  21   7.273  -5.354  -1.699
  144   1HB   CYS  21          1HB       CYS  21   6.976  -6.069   0.931
  145   2HB   CYS  21          2HB       CYS  21   8.410  -5.040   0.986
  146    H    GLY  22           H        GLY  22  10.020  -7.226  -0.368
  147   1HA   GLY  22          1HA       GLY  22  12.240  -7.058  -0.656
  148   2HA   GLY  22          2HA       GLY  22  11.900  -6.207  -2.150
  149    H    TYR  23           H        TYR  23  11.501  -5.484   1.400
  150    HA   TYR  23           HA       TYR  23  12.395  -2.768   0.877
  151   1HB   TYR  23          1HB       TYR  23  10.512  -4.058   2.510
  152   2HB   TYR  23          2HB       TYR  23  11.841  -3.797   3.644
  153    HD1  TYR  23           HD1      TYR  23  10.784  -1.582   0.830
  154    HD2  TYR  23           HD2      TYR  23  10.948  -2.142   5.069
  155    HE1  TYR  23           HE1      TYR  23   9.999   0.810   1.185
  156    HE2  TYR  23           HE2      TYR  23  10.162   0.251   5.409
  157    HH   TYR  23           HH       TYR  23  10.414   2.520   3.479
  158    HA   PRO  24           HA       PRO  24  16.385  -3.546   2.381
  159   1HB   PRO  24          1HB       PRO  24  17.214  -0.980   2.823
  160   2HB   PRO  24          2HB       PRO  24  17.239  -1.741   1.234
  161   1HG   PRO  24          1HG       PRO  24  15.363   0.241   2.359
  162   2HG   PRO  24          2HG       PRO  24  15.675  -0.156   0.630
  163   1HD   PRO  24          1HD       PRO  24  13.436  -0.900   2.254
  164   2HD   PRO  24          2HD       PRO  24  13.773  -1.448   0.607
  165    H    HIS  25           H        HIS  25  13.927  -2.202   4.234
  166    HA   HIS  25           HA       HIS  25  15.552  -2.736   6.612
  167   1HB   HIS  25          1HB       HIS  25  14.048  -0.353   5.843
  168   2HB   HIS  25          2HB       HIS  25  13.588  -0.965   7.436
  169    HD1  HIS  25           HD1      HIS  25  15.634  -1.218   9.204
  170    HD2  HIS  25           HD2      HIS  25  16.414   1.039   5.756
  171    HE1  HIS  25           HE1      HIS  25  17.735   0.141   9.701
  172    HE2  HIS  25           HE2      HIS  25  18.196   1.468   7.526
  173    H    VAL  26           H        VAL  26  14.024  -4.682   5.142
  174    HA   VAL  26           HA       VAL  26  11.427  -5.007   6.004
  175    HB   VAL  26           HB       VAL  26  12.112  -6.377   4.284
  176   1HG1  VAL  26          1HG1      VAL  26  14.325  -6.613   4.011
  177   2HG1  VAL  26          2HG1      VAL  26  14.641  -6.474   5.758
  178   3HG1  VAL  26          3HG1      VAL  26  14.188  -8.047   5.057
  179   1HG2  VAL  26          1HG2      VAL  26  10.909  -7.557   6.291
  180   2HG2  VAL  26          2HG2      VAL  26  11.541  -8.527   4.939
  181   3HG2  VAL  26          3HG2      VAL  26  12.454  -8.423   6.463
  182    H    THR  27           H        THR  27  10.579  -5.164   8.010
  183    HA   THR  27           HA       THR  27  11.623  -6.960   9.922
  184    HB   THR  27           HB       THR  27  12.917  -4.417   9.821
  185    HG1  THR  27           HG1      THR  27  13.980  -5.488  11.592
  186   1HG2  THR  27          1HG2      THR  27  10.941  -4.732  12.130
  187   2HG2  THR  27          2HG2      THR  27  12.449  -3.801  12.297
  188   3HG2  THR  27          3HG2      THR  27  11.215  -3.292  11.121
  189    HA   PRO  28           HA       PRO  28   7.585  -6.481  11.285
  190   1HB   PRO  28          1HB       PRO  28   7.723  -7.551  13.795
  191   2HB   PRO  28          2HB       PRO  28   7.619  -8.531  12.334
  192   1HG   PRO  28          1HG       PRO  28   9.936  -7.945  14.062
  193   2HG   PRO  28          2HG       PRO  28   9.723  -9.295  12.889
  194   1HD   PRO  28          1HD       PRO  28  11.298  -6.921  12.603
  195   2HD   PRO  28          2HD       PRO  28  10.993  -8.140  11.360
  196    H    LYS  29           H        LYS  29   8.406  -4.056  11.145
  197    HA   LYS  29           HA       LYS  29   7.024  -2.750  13.143
  198   1HB   LYS  29          1HB       LYS  29   8.794  -3.538  14.643
  199   2HB   LYS  29          2HB       LYS  29  10.014  -2.720  13.652
  200   1HG   LYS  29          1HG       LYS  29   9.581  -0.743  14.647
  201   2HG   LYS  29          2HG       LYS  29   7.841  -0.891  14.341
  202   1HD   LYS  29          1HD       LYS  29   7.425  -1.613  16.455
  203   2HD   LYS  29          2HD       LYS  29   8.836  -2.685  16.478
  204   1HE   LYS  29          1HE       LYS  29   9.845  -0.026  16.469
  205   2HE   LYS  29          2HE       LYS  29   8.516  -0.035  17.638
  206   1HZ   LYS  29          1HZ       LYS  29   9.578  -1.606  18.889
  207   2HZ   LYS  29          2HZ       LYS  29  10.491  -2.176  17.662
  208   3HZ   LYS  29          3HZ       LYS  29  10.854  -0.742  18.352
  209    H    GLU  30           H        GLU  30   9.479  -2.897  10.613
  210    HA   GLU  30           HA       GLU  30   9.090  -0.073  10.094
  211   1HB   GLU  30          1HB       GLU  30  11.235  -2.002   9.664
  212   2HB   GLU  30          2HB       GLU  30  10.868  -1.120   8.171
  213   1HG   GLU  30          1HG       GLU  30  12.213   0.493   9.030
  214   2HG   GLU  30          2HG       GLU  30  10.836   0.906  10.063
  215    H    CYS  31           H        CYS  31   8.766  -3.332   8.565
  216    HA   CYS  31           HA       CYS  31   7.808  -2.390   6.118
  217   1HB   CYS  31          1HB       CYS  31   7.845  -4.996   7.549
  218   2HB   CYS  31          2HB       CYS  31   6.726  -4.825   6.192
  219    H    ASN  32           H        ASN  32   6.123  -3.739   9.053
  220    HA   ASN  32           HA       ASN  32   3.574  -3.282   8.073
  221   1HB   ASN  32          1HB       ASN  32   4.845  -3.938  10.682
  222   2HB   ASN  32          2HB       ASN  32   3.280  -3.124  10.832
  223   1HD2  ASN  32          1HD2      ASN  32   4.838  -5.608   8.801
  224   2HD2  ASN  32          2HD2      ASN  32   3.549  -6.764   8.840
  225    H    ASN  33           H        ASN  33   6.009  -1.080   8.849
  226    HA   ASN  33           HA       ASN  33   4.121   0.895   9.843
  227   1HB   ASN  33          1HB       ASN  33   6.069   0.723  11.264
  228   2HB   ASN  33          2HB       ASN  33   7.173   0.734   9.880
  229   1HD2  ASN  33          1HD2      ASN  33   8.237   2.539   9.706
  230   2HD2  ASN  33          2HD2      ASN  33   7.667   4.140  10.039
  231    H    ARG  34           H        ARG  34   6.226  -0.110   7.185
  232    HA   ARG  34           HA       ARG  34   6.179   2.476   5.964
  233   1HB   ARG  34          1HB       ARG  34   7.689   1.580   4.381
  234   2HB   ARG  34          2HB       ARG  34   8.088   0.677   5.852
  235   1HG   ARG  34          1HG       ARG  34   7.938  -1.021   4.253
  236   2HG   ARG  34          2HG       ARG  34   6.307  -1.049   4.945
  237   1HD   ARG  34          1HD       ARG  34   5.544  -0.796   2.830
  238   2HD   ARG  34          2HD       ARG  34   6.148   0.868   2.893
  239    HE   ARG  34           HE       ARG  34   8.119  -1.207   2.151
  240   1HH1  ARG  34          1HH1      ARG  34   5.862   1.255   1.044
  241   2HH1  ARG  34          2HH1      ARG  34   6.592   1.404  -0.519
  242   1HH2  ARG  34          1HH2      ARG  34   9.083  -1.011   0.089
  243   2HH2  ARG  34          2HH2      ARG  34   8.437   0.106  -1.067
  244    H    GLY  35           H        GLY  35   4.531  -0.681   5.762
  245   1HA   GLY  35          1HA       GLY  35   2.182  -0.320   4.909
  246   2HA   GLY  35          2HA       GLY  35   2.954   0.294   3.460
  247    H    CYS  36           H        CYS  36   4.581  -2.284   5.240
  248    HA   CYS  36           HA       CYS  36   3.653  -4.169   3.196
  249   1HB   CYS  36          1HB       CYS  36   6.401  -3.980   4.437
  250   2HB   CYS  36          2HB       CYS  36   5.866  -5.241   3.323
  251    H    CYS  37           H        CYS  37   4.312  -6.562   4.118
  252    HA   CYS  37           HA       CYS  37   3.492  -6.585   6.931
  253   1HB   CYS  37          1HB       CYS  37   1.763  -7.282   5.137
  254   2HB   CYS  37          2HB       CYS  37   2.718  -8.762   5.011
  255    H    PHE  38           H        PHE  38   5.016  -7.576   8.215
  256    HA   PHE  38           HA       PHE  38   7.173  -8.974   6.889
  257   1HB   PHE  38          1HB       PHE  38   7.436  -7.205   8.710
  258   2HB   PHE  38          2HB       PHE  38   6.589  -8.277   9.830
  259    HD1  PHE  38           HD1      PHE  38   7.753 -10.003  10.951
  260    HD2  PHE  38           HD2      PHE  38   9.656  -7.896   7.798
  261    HE1  PHE  38           HE1      PHE  38   9.944 -11.060  11.568
  262    HE2  PHE  38           HE2      PHE  38  11.848  -8.953   8.414
  263    HZ   PHE  38           HZ       PHE  38  11.966 -10.523  10.292
  264    H    ASP  39           H        ASP  39   7.276 -11.160   6.708
  265    HA   ASP  39           HA       ASP  39   5.294 -12.683   8.113
  266   1HB   ASP  39          1HB       ASP  39   5.669 -13.205   5.775
  267   2HB   ASP  39          2HB       ASP  39   7.412 -13.384   6.032
  268    H    SER  40           H        SER  40   8.677 -13.675   7.297
  269    HA   SER  40           HA       SER  40  10.421 -14.061   8.610
  270   1HB   SER  40          1HB       SER  40   9.106 -12.527  10.361
  271   2HB   SER  40          2HB       SER  40   8.877 -14.076  11.192
  272    HG   SER  40           HG       SER  40  11.081 -14.286  11.468
  273    H    ARG  41           H        ARG  41   7.331 -15.590   8.610
  274    HA   ARG  41           HA       ARG  41   7.876 -17.820  10.149
  275   1HB   ARG  41          1HB       ARG  41   6.034 -17.389   7.760
  276   2HB   ARG  41          2HB       ARG  41   6.020 -18.880   8.717
  277   1HG   ARG  41          1HG       ARG  41   5.896 -16.843  10.633
  278   2HG   ARG  41          2HG       ARG  41   4.867 -16.239   9.321
  279   1HD   ARG  41          1HD       ARG  41   3.395 -17.507  10.673
  280   2HD   ARG  41          2HD       ARG  41   3.792 -18.621   9.355
  281    HE   ARG  41           HE       ARG  41   5.692 -18.977  11.457
  282   1HH1  ARG  41          1HH1      ARG  41   2.276 -19.524  10.814
  283   2HH1  ARG  41          2HH1      ARG  41   2.153 -20.860  11.909
  284   1HH2  ARG  41          1HH2      ARG  41   5.530 -20.740  12.903
  285   2HH2  ARG  41          2HH2      ARG  41   4.016 -21.556  13.105
  286    H    ILE  42           H        ILE  42   8.287 -17.134   6.616
  287    HA   ILE  42           HA       ILE  42   9.970 -19.538   6.477
  288    HB   ILE  42           HB       ILE  42   8.500 -18.451   4.106
  289   1HG1  ILE  42          1HG1      ILE  42   7.359 -20.063   6.361
  290   2HG1  ILE  42          2HG1      ILE  42   6.640 -18.712   5.468
  291   1HG2  ILE  42          1HG2      ILE  42  10.400 -20.292   4.203
  292   2HG2  ILE  42          2HG2      ILE  42   9.028 -21.342   4.628
  293   3HG2  ILE  42          3HG2      ILE  42   9.013 -20.432   3.098
  294   1HD1  ILE  42          1HD1      ILE  42   6.896 -21.618   4.686
  295   2HD1  ILE  42          2HD1      ILE  42   5.482 -20.542   4.575
  296   3HD1  ILE  42          3HD1      ILE  42   6.819 -20.379   3.411
  297    HA   PRO  43           HA       PRO  43  12.898 -16.436   5.519
  298   1HB   PRO  43          1HB       PRO  43  15.110 -18.033   5.647
  299   2HB   PRO  43          2HB       PRO  43  14.409 -17.242   7.057
  300   1HG   PRO  43          1HG       PRO  43  14.250 -20.056   6.187
  301   2HG   PRO  43          2HG       PRO  43  13.960 -19.369   7.826
  302   1HD   PRO  43          1HD       PRO  43  12.035 -20.285   5.912
  303   2HD   PRO  43          2HD       PRO  43  11.694 -19.471   7.445
  304    H    GLY  44           H        GLY  44  11.908 -19.052   3.731
  305   1HA   GLY  44          1HA       GLY  44  13.761 -18.523   1.535
  306   2HA   GLY  44          2HA       GLY  44  12.572 -19.807   1.646
  307    H    VAL  45           H        VAL  45  10.909 -17.151   2.749
  308    HA   VAL  45           HA       VAL  45  10.066 -16.414   0.030
  309    HB   VAL  45           HB       VAL  45   7.867 -16.566   0.610
  310   1HG1  VAL  45          1HG1      VAL  45   7.533 -18.638   2.035
  311   2HG1  VAL  45          2HG1      VAL  45   8.649 -18.817   0.660
  312   3HG1  VAL  45          3HG1      VAL  45   9.291 -18.632   2.310
  313   1HG2  VAL  45          1HG2      VAL  45   6.927 -16.366   2.827
  314   2HG2  VAL  45          2HG2      VAL  45   8.545 -16.427   3.566
  315   3HG2  VAL  45          3HG2      VAL  45   8.075 -15.031   2.568
  316    HA   PRO  46           HA       PRO  46  10.383 -12.270   1.262
  317   1HB   PRO  46          1HB       PRO  46   8.042 -11.039   0.580
  318   2HB   PRO  46          2HB       PRO  46   9.298 -11.437  -0.590
  319   1HG   PRO  46          1HG       PRO  46   6.719 -12.765  -0.049
  320   2HG   PRO  46          2HG       PRO  46   7.748 -12.869  -1.523
  321   1HD   PRO  46          1HD       PRO  46   7.420 -14.808   0.558
  322   2HD   PRO  46          2HD       PRO  46   8.564 -14.889  -0.789
  323    H    TRP  47           H        TRP  47  10.760 -11.617   3.275
  324    HA   TRP  47           HA       TRP  47   8.622 -12.087   5.178
  325   1HB   TRP  47          1HB       TRP  47  11.016 -10.756   6.160
  326   2HB   TRP  47          2HB       TRP  47  10.223 -12.233   6.710
  327    HD1  TRP  47           HD1      TRP  47  10.912 -14.525   5.155
  328    HE1  TRP  47           HE1      TRP  47  13.211 -15.257   4.086
  329    HE3  TRP  47           HE3      TRP  47  13.015  -9.896   5.220
  330    HZ2  TRP  47           HZ2      TRP  47  15.597 -13.849   3.402
  331    HZ3  TRP  47           HZ3      TRP  47  15.332  -9.661   4.332
  332    HH2  TRP  47           HH2      TRP  47  16.616 -11.543   3.446
  333    H    CYS  48           H        CYS  48   8.344 -10.096   2.948
  334    HA   CYS  48           HA       CYS  48   7.289  -8.002   4.480
  335   1HB   CYS  48          1HB       CYS  48   9.644  -7.368   4.706
  336   2HB   CYS  48          2HB       CYS  48   9.802  -7.298   2.948
  337    H    PHE  49           H        PHE  49   5.420  -7.928   3.265
  338    HA   PHE  49           HA       PHE  49   5.734  -7.382   0.424
  339   1HB   PHE  49          1HB       PHE  49   3.574  -9.064   0.422
  340   2HB   PHE  49          2HB       PHE  49   5.218  -9.661   0.165
  341    HD1  PHE  49           HD1      PHE  49   6.501 -10.248   2.417
  342    HD2  PHE  49           HD2      PHE  49   2.280 -10.099   2.007
  343    HE1  PHE  49           HE1      PHE  49   6.254 -11.742   4.418
  344    HE2  PHE  49           HE2      PHE  49   2.032 -11.595   4.008
  345    HZ   PHE  49           HZ       PHE  49   4.022 -12.398   5.189
  346    H    LYS  50           H        LYS  50   3.036  -7.402  -0.308
  347    HA   LYS  50           HA       LYS  50   1.868  -5.491   1.593
  348   1HB   LYS  50          1HB       LYS  50   0.930  -4.328  -0.407
  349   2HB   LYS  50          2HB       LYS  50   2.689  -4.205  -0.239
  350   1HG   LYS  50          1HG       LYS  50   1.914  -6.569  -1.777
  351   2HG   LYS  50          2HG       LYS  50   1.254  -5.094  -2.502
  352   1HD   LYS  50          1HD       LYS  50   4.161  -5.708  -1.845
  353   2HD   LYS  50          2HD       LYS  50   3.457  -5.497  -3.457
  354   1HE   LYS  50          1HE       LYS  50   2.815  -3.151  -1.977
  355   2HE   LYS  50          2HE       LYS  50   4.519  -3.492  -1.635
  356   1HZ   LYS  50          1HZ       LYS  50   3.520  -2.326  -3.865
  357   2HZ   LYS  50          2HZ       LYS  50   5.037  -2.900  -3.681
  358   3HZ   LYS  50          3HZ       LYS  50   3.888  -3.836  -4.366
  359    HA   PRO  51           HA       PRO  51  -0.958  -8.959   0.871
  360   1HB   PRO  51          1HB       PRO  51  -1.317  -9.689   3.479
  361   2HB   PRO  51          2HB       PRO  51  -0.146 -10.464   2.413
  362   1HG   PRO  51          1HG       PRO  51   0.262  -8.489   4.568
  363   2HG   PRO  51          2HG       PRO  51   1.462  -9.614   3.833
  364   1HD   PRO  51          1HD       PRO  51   1.175  -6.795   3.417
  365   2HD   PRO  51          2HD       PRO  51   2.265  -7.884   2.550
  366    H    LEU  52           H        LEU  52  -1.957  -8.198   4.044
  367    HA   LEU  52           HA       LEU  52  -4.295  -6.915   2.885
  368   1HB   LEU  52          1HB       LEU  52  -5.436  -7.533   4.744
  369   2HB   LEU  52          2HB       LEU  52  -4.263  -8.853   4.603
  370    HG   LEU  52           HG       LEU  52  -3.158  -6.789   6.259
  371   1HD1  LEU  52          1HD1      LEU  52  -5.050  -7.383   8.107
  372   2HD1  LEU  52          2HD1      LEU  52  -5.028  -5.894   7.132
  373   3HD1  LEU  52          3HD1      LEU  52  -6.049  -7.266   6.638
  374   1HD2  LEU  52          1HD2      LEU  52  -2.281  -8.682   7.018
  375   2HD2  LEU  52          2HD2      LEU  52  -3.822  -8.990   7.855
  376   3HD2  LEU  52          3HD2      LEU  52  -3.542  -9.658   6.229
  377    H    GLN  53           H        GLN  53  -1.786  -5.486   2.734
  378    HA   GLN  53           HA       GLN  53  -1.408  -3.754   4.830
  379   1HB   GLN  53          1HB       GLN  53  -0.968  -3.348   1.848
  380   2HB   GLN  53          2HB       GLN  53  -0.310  -2.281   3.101
  381   1HG   GLN  53          1HG       GLN  53   0.276  -5.243   2.699
  382   2HG   GLN  53          2HG       GLN  53   1.402  -3.902   2.439
  383   1HE2  GLN  53          1HE2      GLN  53  -0.109  -6.030   4.681
  384   2HE2  GLN  53          2HE2      GLN  53   0.716  -5.535   6.123
  385    H    GLU  54           H        GLU  54  -4.000  -3.956   2.503
  386    HA   GLU  54           HA       GLU  54  -4.787  -1.424   2.135
  387   1HB   GLU  54          1HB       GLU  54  -7.068  -2.282   1.924
  388   2HB   GLU  54          2HB       GLU  54  -5.924  -3.442   1.225
  389   1HG   GLU  54          1HG       GLU  54  -6.343  -5.018   2.838
  390   2HG   GLU  54          2HG       GLU  54  -6.553  -3.817   4.122
  391    H    ALA  55           H        ALA  55  -4.615  -3.158   5.170
  392    HA   ALA  55           HA       ALA  55  -6.515  -2.155   6.755
  393   1HB   ALA  55          1HB       ALA  55  -4.273  -3.539   7.175
  394   2HB   ALA  55          2HB       ALA  55  -3.687  -1.957   7.742
  395   3HB   ALA  55          3HB       ALA  55  -5.111  -2.704   8.506
  396    H    GLU  56           H        GLU  56  -3.341  -0.435   6.272
  397    HA   GLU  56           HA       GLU  56  -4.869   2.034   6.550
  398   1HB   GLU  56          1HB       GLU  56  -2.640   1.033   8.145
  399   2HB   GLU  56          2HB       GLU  56  -2.255   2.608   7.432
  400   1HG   GLU  56          1HG       GLU  56  -3.621   3.651   8.892
  401   2HG   GLU  56          2HG       GLU  56  -4.982   2.614   8.444
  402    H    CYS  57           H        CYS  57  -3.756   0.289   4.230
  403    HA   CYS  57           HA       CYS  57  -1.875   2.201   3.099
  404   1HB   CYS  57          1HB       CYS  57  -1.157  -0.069   2.986
  405   2HB   CYS  57          2HB       CYS  57  -2.686  -0.589   2.270
  406    H    THR  58           H        THR  58  -4.237   0.126   1.350
  407    HA   THR  58           HA       THR  58  -4.976   1.848  -0.567
  408    HB   THR  58           HB       THR  58  -5.672  -0.601  -0.144
  409    HG1  THR  58           HG1      THR  58  -6.580   1.208  -1.683
  410   1HG2  THR  58          1HG2      THR  58  -7.888   0.860   1.388
  411   2HG2  THR  58          2HG2      THR  58  -7.961  -0.840   0.867
  412   3HG2  THR  58          3HG2      THR  58  -6.759  -0.331   2.078
  413    H    PHE  59           H        PHE  59  -6.055   1.944   2.832
  414    HA   PHE  59           HA       PHE  59  -8.214   3.456   2.836
  415   1HB   PHE  59          1HB       PHE  59  -6.638   2.753   4.747
  416   2HB   PHE  59          2HB       PHE  59  -5.621   4.142   4.343
  417    HD1  PHE  59           HD1      PHE  59  -9.163   3.336   5.207
  418    HD2  PHE  59           HD2      PHE  59  -5.964   6.108   5.502
  419    HE1  PHE  59           HE1      PHE  59 -10.550   4.774   6.727
  420    HE2  PHE  59           HE2      PHE  59  -7.350   7.546   7.022
  421    HZ   PHE  59           HZ       PHE  59  -9.627   6.863   7.616
  422   1H    GLU   1           H1       GLU   1 -21.970   3.984   2.159
  423    HA   GLU   1           HA       GLU   1 -20.073   4.490   1.222
  424   1HB   GLU   1          1HB       GLU   1 -19.657   4.499   4.010
  425   2HB   GLU   1          2HB       GLU   1 -18.202   3.744   3.335
  426   1HG   GLU   1          1HG       GLU   1 -18.145   5.706   1.675
  427   2HG   GLU   1          2HG       GLU   1 -19.374   6.480   2.686
  428    H    GLU   2           H        GLU   2 -20.268   2.709  -0.330
  429    HA   GLU   2           HA       GLU   2 -18.966   0.263   0.282
  430   1HB   GLU   2          1HB       GLU   2 -20.059   1.384  -2.326
  431   2HB   GLU   2          2HB       GLU   2 -19.480  -0.278  -2.120
  432   1HG   GLU   2          1HG       GLU   2 -21.540  -0.845  -1.406
  433   2HG   GLU   2          2HG       GLU   2 -21.306   0.189   0.011
  434    H    TYR   3           H        TYR   3 -18.186   0.908  -2.924
  435    HA   TYR   3           HA       TYR   3 -15.400   1.306  -2.204
  436   1HB   TYR   3          1HB       TYR   3 -15.381   0.976  -4.853
  437   2HB   TYR   3          2HB       TYR   3 -15.769  -0.417  -3.838
  438    HD1  TYR   3           HD1      TYR   3 -17.086   2.079  -6.194
  439    HD2  TYR   3           HD2      TYR   3 -18.052  -1.290  -3.741
  440    HE1  TYR   3           HE1      TYR   3 -19.298   1.811  -7.419
  441    HE2  TYR   3           HE2      TYR   3 -20.260  -1.547  -4.974
  442    HH   TYR   3           HH       TYR   3 -21.603   0.799  -6.769
  443    H    VAL   4           H        VAL   4 -15.776   3.591  -1.481
  444    HA   VAL   4           HA       VAL   4 -15.715   5.350  -3.828
  445    HB   VAL   4           HB       VAL   4 -17.124   5.858  -1.200
  446   1HG1  VAL   4          1HG1      VAL   4 -17.611   7.686  -3.456
  447   2HG1  VAL   4          2HG1      VAL   4 -17.319   8.036  -1.735
  448   3HG1  VAL   4          3HG1      VAL   4 -15.946   7.735  -2.829
  449   1HG2  VAL   4          1HG2      VAL   4 -18.628   4.500  -2.289
  450   2HG2  VAL   4          2HG2      VAL   4 -19.095   6.083  -2.953
  451   3HG2  VAL   4          3HG2      VAL   4 -18.068   4.986  -3.907
  452    H    GLY   5           H        GLY   5 -15.203   5.373  -0.224
  453   1HA   GLY   5          1HA       GLY   5 -13.114   7.277  -0.346
  454   2HA   GLY   5          2HA       GLY   5 -13.543   6.259   1.013
  455    H    LEU   6           H        LEU   6 -13.123   4.234  -1.674
  456    HA   LEU   6           HA       LEU   6 -10.250   4.087  -1.523
  457   1HB   LEU   6          1HB       LEU   6 -10.397   1.629  -0.911
  458   2HB   LEU   6          2HB       LEU   6 -10.556   2.824   0.388
  459    HG   LEU   6           HG       LEU   6 -12.896   2.440   0.569
  460   1HD1  LEU   6          1HD1      LEU   6 -12.604   1.039  -2.074
  461   2HD1  LEU   6          2HD1      LEU   6 -13.952   0.643  -0.981
  462   3HD1  LEU   6          3HD1      LEU   6 -13.751   2.307  -1.580
  463   1HD2  LEU   6          1HD2      LEU   6 -11.001   0.457   1.045
  464   2HD2  LEU   6          2HD2      LEU   6 -12.642   0.558   1.727
  465   3HD2  LEU   6          3HD2      LEU   6 -12.348  -0.397   0.255
  466    H    SER   7           H        SER   7 -12.403   4.692  -3.493
  467    HA   SER   7           HA       SER   7 -12.406   2.340  -5.145
  468   1HB   SER   7          1HB       SER   7 -14.296   4.182  -4.763
  469   2HB   SER   7          2HB       SER   7 -13.457   4.998  -6.094
  470    HG   SER   7           HG       SER   7 -14.871   2.509  -6.062
  471    H    ALA   8           H        ALA   8 -12.002   2.909  -7.665
  472    HA   ALA   8           HA       ALA   8  -9.265   3.607  -7.830
  473   1HB   ALA   8          1HB       ALA   8 -11.263   3.335 -10.104
  474   2HB   ALA   8          2HB       ALA   8  -9.506   3.048 -10.147
  475   3HB   ALA   8          3HB       ALA   8 -10.568   1.936  -9.249
  476    H    ASN   9           H        ASN   9 -11.978   5.518  -7.369
  477    HA   ASN   9           HA       ASN   9 -11.012   7.626  -9.099
  478   1HB   ASN   9          1HB       ASN   9 -13.580   6.800  -8.245
  479   2HB   ASN   9          2HB       ASN   9 -13.299   8.321  -7.382
  480   1HD2  ASN   9          1HD2      ASN   9 -12.526  10.154  -8.673
  481   2HD2  ASN   9          2HD2      ASN   9 -13.121  10.370 -10.285
  482    H    GLN  10           H        GLN  10 -10.680   6.391  -5.923
  483    HA   GLN  10           HA       GLN  10 -10.729   8.710  -4.406
  484   1HB   GLN  10          1HB       GLN  10 -10.308   5.989  -3.972
  485   2HB   GLN  10          2HB       GLN  10  -8.763   6.716  -3.499
  486   1HG   GLN  10          1HG       GLN  10 -10.851   8.378  -2.465
  487   2HG   GLN  10          2HG       GLN  10 -11.283   6.706  -2.074
  488   1HE2  GLN  10          1HE2      GLN  10  -8.716   5.616  -1.900
  489   2HE2  GLN  10          2HE2      GLN  10  -7.908   6.240  -0.501
  490    H    CYS  11           H        CYS  11  -8.231   7.220  -6.478
  491    HA   CYS  11           HA       CYS  11  -6.127   8.847  -5.502
  492   1HB   CYS  11          1HB       CYS  11  -5.703   6.689  -6.514
  493   2HB   CYS  11          2HB       CYS  11  -6.383   7.236  -8.050
  494    H    ALA  12           H        ALA  12  -8.954   9.618  -7.072
  495    HA   ALA  12           HA       ALA  12  -7.668  11.780  -8.597
  496   1HB   ALA  12          1HB       ALA  12  -8.928  11.164 -10.351
  497   2HB   ALA  12          2HB       ALA  12  -9.524   9.774  -9.412
  498   3HB   ALA  12          3HB       ALA  12 -10.406  11.320  -9.374
  499    H    VAL  13           H        VAL  13  -8.730  11.286  -5.643
  500    HA   VAL  13           HA       VAL  13 -10.957  12.658  -5.068
  501    HB   VAL  13           HB       VAL  13  -8.728  11.741  -3.717
  502   1HG1  VAL  13          1HG1      VAL  13  -7.719  14.016  -3.939
  503   2HG1  VAL  13          2HG1      VAL  13  -9.089  14.671  -3.009
  504   3HG1  VAL  13          3HG1      VAL  13  -7.974  13.508  -2.252
  505   1HG2  VAL  13          1HG2      VAL  13 -10.372  11.358  -2.262
  506   2HG2  VAL  13          2HG2      VAL  13 -10.447  13.092  -1.867
  507   3HG2  VAL  13          3HG2      VAL  13 -11.441  12.436  -3.190
  508    HA   PRO  14           HA       PRO  14 -10.442  16.801  -6.181
  509   1HB   PRO  14          1HB       PRO  14 -11.737  18.170  -4.205
  510   2HB   PRO  14          2HB       PRO  14 -12.577  17.359  -5.525
  511   1HG   PRO  14          1HG       PRO  14 -12.245  16.549  -2.706
  512   2HG   PRO  14          2HG       PRO  14 -13.473  15.991  -3.899
  513   1HD   PRO  14          1HD       PRO  14 -11.149  14.608  -2.955
  514   2HD   PRO  14          2HD       PRO  14 -12.239  14.082  -4.245
  515    H    ALA  15           H        ALA  15  -8.249  15.598  -4.674
  516    HA   ALA  15           HA       ALA  15  -6.431  16.206  -3.549
  517   1HB   ALA  15          1HB       ALA  15  -6.177  17.423  -5.708
  518   2HB   ALA  15          2HB       ALA  15  -6.933  18.854  -4.967
  519   3HB   ALA  15          3HB       ALA  15  -5.372  18.258  -4.359
  520    H    LYS  16           H        LYS  16  -7.741  16.001  -1.514
  521    HA   LYS  16           HA       LYS  16  -7.150  17.821   0.338
  522   1HB   LYS  16          1HB       LYS  16  -9.439  19.032   0.585
  523   2HB   LYS  16          2HB       LYS  16  -8.217  19.676  -0.523
  524   1HG   LYS  16          1HG       LYS  16  -9.632  19.441  -2.258
  525   2HG   LYS  16          2HG       LYS  16  -9.824  17.712  -1.919
  526   1HD   LYS  16          1HD       LYS  16 -12.005  18.399  -1.624
  527   2HD   LYS  16          2HD       LYS  16 -11.420  18.664   0.027
  528   1HE   LYS  16          1HE       LYS  16 -10.917  21.052  -0.614
  529   2HE   LYS  16          2HE       LYS  16 -11.669  20.752  -2.189
  530   1HZ   LYS  16          1HZ       LYS  16 -13.409  21.522  -0.994
  531   2HZ   LYS  16          2HZ       LYS  16 -13.584  19.933  -0.662
  532   3HZ   LYS  16          3HZ       LYS  16 -12.890  20.924   0.434
  533    H    ASP  17           H        ASP  17  -7.345  15.094   0.193
  534    HA   ASP  17           HA       ASP  17  -9.122  14.625   2.357
  535   1HB   ASP  17          1HB       ASP  17 -10.528  14.320   0.241
  536   2HB   ASP  17          2HB       ASP  17  -9.481  12.951  -0.168
  537    H    ARG  18           H        ARG  18  -6.760  13.617  -0.120
  538    HA   ARG  18           HA       ARG  18  -6.130  11.127   0.555
  539   1HB   ARG  18          1HB       ARG  18  -4.179  13.408  -0.004
  540   2HB   ARG  18          2HB       ARG  18  -3.764  11.690  -0.128
  541   1HG   ARG  18          1HG       ARG  18  -4.911  11.428  -2.095
  542   2HG   ARG  18          2HG       ARG  18  -6.195  12.558  -1.634
  543   1HD   ARG  18          1HD       ARG  18  -4.541  14.444  -1.993
  544   2HD   ARG  18          2HD       ARG  18  -3.392  13.258  -2.630
  545    HE   ARG  18           HE       ARG  18  -6.071  13.287  -3.884
  546   1HH1  ARG  18          1HH1      ARG  18  -2.723  14.359  -4.039
  547   2HH1  ARG  18          2HH1      ARG  18  -2.780  14.714  -5.734
  548   1HH2  ARG  18          1HH2      ARG  18  -6.148  13.756  -6.119
  549   2HH2  ARG  18          2HH2      ARG  18  -4.742  14.369  -6.925
  550    H    VAL  19           H        VAL  19  -3.949  10.423   1.770
  551    HA   VAL  19           HA       VAL  19  -4.079  11.669   4.423
  552    HB   VAL  19           HB       VAL  19  -2.921   8.963   3.869
  553   1HG1  VAL  19          1HG1      VAL  19  -3.536   8.504   6.133
  554   2HG1  VAL  19          2HG1      VAL  19  -2.765  10.107   6.115
  555   3HG1  VAL  19          3HG1      VAL  19  -4.535   9.974   6.228
  556   1HG2  VAL  19          1HG2      VAL  19  -5.217   8.003   4.301
  557   2HG2  VAL  19          2HG2      VAL  19  -5.875   9.633   4.023
  558   3HG2  VAL  19          3HG2      VAL  19  -5.010   8.788   2.716
  559    H    ASP  20           H        ASP  20  -2.517  12.521   1.929
  560    HA   ASP  20           HA       ASP  20  -0.425  12.863   1.280
  561   1HB   ASP  20          1HB       ASP  20  -0.541  14.825   2.492
  562   2HB   ASP  20          2HB       ASP  20  -0.831  13.993   4.027
  563    H    CYS  21           H        CYS  21   0.491  10.706   1.013
  564    HA   CYS  21           HA       CYS  21   1.296   9.012   2.968
  565   1HB   CYS  21          1HB       CYS  21   1.333   8.899   0.334
  566   2HB   CYS  21          2HB       CYS  21   3.038   9.303   0.558
  567    H    GLY  22           H        GLY  22   2.865  11.971   1.700
  568   1HA   GLY  22          1HA       GLY  22   4.609  13.182   2.434
  569   2HA   GLY  22          2HA       GLY  22   4.355  12.454   4.008
  570    H    TYR  23           H        TYR  23   5.448  11.205   0.764
  571    HA   TYR  23           HA       TYR  23   7.484   9.644   2.120
  572   1HB   TYR  23          1HB       TYR  23   5.777   9.378  -0.091
  573   2HB   TYR  23          2HB       TYR  23   7.299   9.823  -0.872
  574    HD1  TYR  23           HD1      TYR  23   6.861   7.760   2.207
  575    HD2  TYR  23           HD2      TYR  23   7.877   7.799  -1.950
  576    HE1  TYR  23           HE1      TYR  23   7.633   5.343   2.365
  577    HE2  TYR  23           HE2      TYR  23   8.645   5.383  -1.777
  578    HH   TYR  23           HH       TYR  23   8.800   3.758   1.337
  579    HA   PRO  24           HA       PRO  24  10.590  12.537   1.203
  580   1HB   PRO  24          1HB       PRO  24  12.767  11.032   1.878
  581   2HB   PRO  24          2HB       PRO  24  11.805  11.920   3.059
  582   1HG   PRO  24          1HG       PRO  24  11.855   9.036   2.436
  583   2HG   PRO  24          2HG       PRO  24  11.256   9.854   3.924
  584   1HD   PRO  24          1HD       PRO  24   9.733   8.711   1.786
  585   2HD   PRO  24          2HD       PRO  24   9.102   9.644   3.148
  586    H    HIS  25           H        HIS  25   9.848   9.901  -0.574
  587    HA   HIS  25           HA       HIS  25  11.831  10.720  -2.564
  588   1HB   HIS  25          1HB       HIS  25  11.737   8.249  -1.262
  589   2HB   HIS  25          2HB       HIS  25  11.021   7.946  -2.850
  590    HD1  HIS  25           HD1      HIS  25  14.017   7.220  -1.541
  591    HD2  HIS  25           HD2      HIS  25  13.039   9.864  -4.648
  592    HE1  HIS  25           HE1      HIS  25  16.134   7.494  -2.940
  593    HE2  HIS  25           HE2      HIS  25  15.456   9.085  -4.864
  594    H    VAL  26           H        VAL  26   8.970  11.515  -1.958
  595    HA   VAL  26           HA       VAL  26   7.119  10.324  -3.547
  596    HB   VAL  26           HB       VAL  26   6.432  12.034  -2.125
  597   1HG1  VAL  26          1HG1      VAL  26   7.269  14.465  -2.567
  598   2HG1  VAL  26          2HG1      VAL  26   8.309  13.334  -1.668
  599   3HG1  VAL  26          3HG1      VAL  26   8.629  13.663  -3.388
  600   1HG2  VAL  26          1HG2      VAL  26   6.274  13.593  -4.688
  601   2HG2  VAL  26          2HG2      VAL  26   5.489  11.999  -4.580
  602   3HG2  VAL  26          3HG2      VAL  26   5.025  13.297  -3.454
  603    H    THR  27           H        THR  27   6.907   9.914  -5.688
  604    HA   THR  27           HA       THR  27   7.674  11.751  -7.677
  605    HB   THR  27           HB       THR  27   9.805  10.136  -6.616
  606    HG1  THR  27           HG1      THR  27  10.654  11.860  -7.712
  607   1HG2  THR  27          1HG2      THR  27   9.405   8.278  -8.067
  608   2HG2  THR  27          2HG2      THR  27   8.775   9.321  -9.364
  609   3HG2  THR  27          3HG2      THR  27  10.518   9.302  -9.005
  610    HA   PRO  28           HA       PRO  28   5.001   9.201  -9.855
  611   1HB   PRO  28          1HB       PRO  28   5.592   9.830 -12.446
  612   2HB   PRO  28          2HB       PRO  28   4.581  10.841 -11.417
  613   1HG   PRO  28          1HG       PRO  28   7.391  11.190 -12.245
  614   2HG   PRO  28          2HG       PRO  28   6.243  12.428 -11.617
  615   1HD   PRO  28          1HD       PRO  28   8.421  11.166 -10.251
  616   2HD   PRO  28          2HD       PRO  28   7.223  12.257  -9.545
  617    H    LYS  29           H        LYS  29   6.972   7.689  -8.809
  618    HA   LYS  29           HA       LYS  29   6.907   5.489 -10.503
  619   1HB   LYS  29          1HB       LYS  29   8.448   6.880 -11.869
  620   2HB   LYS  29          2HB       LYS  29   9.610   6.861 -10.531
  621   1HG   LYS  29          1HG       LYS  29  10.319   4.796 -11.098
  622   2HG   LYS  29          2HG       LYS  29   8.665   4.160 -11.125
  623   1HD   LYS  29          1HD       LYS  29   8.777   5.720 -13.423
  624   2HD   LYS  29          2HD       LYS  29  10.406   5.024 -13.354
  625   1HE   LYS  29          1HE       LYS  29   9.519   2.777 -13.311
  626   2HE   LYS  29          2HE       LYS  29   7.864   3.360 -13.066
  627   1HZ   LYS  29          1HZ       LYS  29   8.880   4.553 -15.343
  628   2HZ   LYS  29          2HZ       LYS  29   9.219   2.959 -15.454
  629   3HZ   LYS  29          3HZ       LYS  29   7.677   3.453 -15.239
  630    H    GLU  30           H        GLU  30   7.916   7.318  -7.736
  631    HA   GLU  30           HA       GLU  30   9.005   4.927  -6.507
  632   1HB   GLU  30          1HB       GLU  30   9.419   7.811  -6.207
  633   2HB   GLU  30          2HB       GLU  30   9.168   7.016  -4.643
  634   1HG   GLU  30          1HG       GLU  30  11.441   6.695  -4.858
  635   2HG   GLU  30          2HG       GLU  30  10.893   5.242  -5.709
  636    H    CYS  31           H        CYS  31   6.452   7.453  -6.111
  637    HA   CYS  31           HA       CYS  31   5.407   6.461  -3.735
  638   1HB   CYS  31          1HB       CYS  31   4.175   8.069  -5.967
  639   2HB   CYS  31          2HB       CYS  31   3.313   7.677  -4.478
  640    H    ASN  32           H        ASN  32   4.300   6.038  -7.184
  641    HA   ASN  32           HA       ASN  32   2.361   4.170  -6.562
  642   1HB   ASN  32          1HB       ASN  32   3.811   5.089  -9.017
  643   2HB   ASN  32          2HB       ASN  32   3.016   3.513  -9.146
  644   1HD2  ASN  32          1HD2      ASN  32   2.290   6.598  -7.513
  645   2HD2  ASN  32          2HD2      ASN  32   0.702   6.823  -8.167
  646    H    ASN  33           H        ASN  33   5.728   3.978  -6.268
  647    HA   ASN  33           HA       ASN  33   5.828   1.176  -7.002
  648   1HB   ASN  33          1HB       ASN  33   7.697   2.400  -7.874
  649   2HB   ASN  33          2HB       ASN  33   7.947   3.273  -6.355
  650   1HD2  ASN  33          1HD2      ASN  33   9.843   2.696  -5.604
  651   2HD2  ASN  33          2HD2      ASN  33  10.440   1.082  -5.407
  652    H    ARG  34           H        ARG  34   5.891   3.494  -4.304
  653    HA   ARG  34           HA       ARG  34   6.781   1.503  -2.451
  654   1HB   ARG  34          1HB       ARG  34   6.941   3.254  -0.884
  655   2HB   ARG  34          2HB       ARG  34   7.252   4.098  -2.412
  656   1HG   ARG  34          1HG       ARG  34   5.669   5.502  -1.469
  657   2HG   ARG  34          2HG       ARG  34   4.601   4.422  -2.381
  658   1HD   ARG  34          1HD       ARG  34   3.539   4.004  -0.429
  659   2HD   ARG  34          2HD       ARG  34   4.982   3.124   0.097
  660    HE   ARG  34           HE       ARG  34   5.279   5.980   0.495
  661   1HH1  ARG  34          1HH1      ARG  34   3.769   3.109   1.859
  662   2HH1  ARG  34          2HH1      ARG  34   3.722   3.743   3.470
  663   1HH2  ARG  34          1HH2      ARG  34   5.217   6.818   2.620
  664   2HH2  ARG  34          2HH2      ARG  34   4.551   5.867   3.905
  665    H    GLY  35           H        GLY  35   3.783   3.000  -3.623
  666   1HA   GLY  35          1HA       GLY  35   1.843   1.477  -3.290
  667   2HA   GLY  35          2HA       GLY  35   2.252   1.496  -1.586
  668    H    CYS  36           H        CYS  36   2.789   4.432  -3.481
  669    HA   CYS  36           HA       CYS  36   0.373   5.559  -2.260
  670   1HB   CYS  36          1HB       CYS  36   3.061   6.878  -2.656
  671   2HB   CYS  36          2HB       CYS  36   1.599   7.709  -2.119
  672    H    CYS  37           H        CYS  37  -0.302   7.654  -3.539
  673    HA   CYS  37           HA       CYS  37   0.001   7.026  -6.379
  674   1HB   CYS  37          1HB       CYS  37  -2.283   7.378  -4.827
  675   2HB   CYS  37          2HB       CYS  37  -2.136   8.884  -5.739
  676    H    PHE  38           H        PHE  38   0.738   8.667  -7.789
  677    HA   PHE  38           HA       PHE  38   1.889  10.966  -6.438
  678   1HB   PHE  38          1HB       PHE  38   3.105   9.385  -8.075
  679   2HB   PHE  38          2HB       PHE  38   2.037   9.983  -9.349
  680    HD1  PHE  38           HD1      PHE  38   4.543  11.124  -6.843
  681    HD2  PHE  38           HD2      PHE  38   2.653  11.869 -10.569
  682    HE1  PHE  38           HE1      PHE  38   6.147  13.003  -7.281
  683    HE2  PHE  38           HE2      PHE  38   4.257  13.748 -11.006
  684    HZ   PHE  38           HZ       PHE  38   5.985  14.294  -9.357
  685    H    ASP  39           H        ASP  39   0.962  12.957  -6.495
  686    HA   ASP  39           HA       ASP  39  -1.470  13.328  -7.778
  687   1HB   ASP  39          1HB       ASP  39  -0.975  14.658  -5.859
  688   2HB   ASP  39          2HB       ASP  39   0.567  15.209  -6.530
  689    H    SER  40           H        SER  40   0.923  15.907  -8.249
  690    HA   SER  40           HA       SER  40   2.113  16.513 -10.034
  691   1HB   SER  40          1HB       SER  40   1.814  14.041 -10.862
  692   2HB   SER  40          2HB       SER  40   0.566  14.723 -11.922
  693    HG   SER  40           HG       SER  40   2.100  15.931 -12.996
  694    H    ARG  41           H        ARG  41  -1.238  16.410  -9.482
  695    HA   ARG  41           HA       ARG  41  -1.882  18.114 -11.704
  696   1HB   ARG  41          1HB       ARG  41  -3.673  17.282  -9.381
  697   2HB   ARG  41          2HB       ARG  41  -4.196  17.884 -10.964
  698   1HG   ARG  41          1HG       ARG  41  -2.596  15.703 -11.616
  699   2HG   ARG  41          2HG       ARG  41  -3.405  15.159 -10.136
  700   1HD   ARG  41          1HD       ARG  41  -5.103  14.589 -11.544
  701   2HD   ARG  41          2HD       ARG  41  -5.501  16.315 -11.520
  702    HE   ARG  41           HE       ARG  41  -4.728  16.482 -13.725
  703   1HH1  ARG  41          1HH1      ARG  41  -3.560  13.476 -12.315
  704   2HH1  ARG  41          2HH1      ARG  41  -2.917  12.877 -13.807
  705   1HH2  ARG  41          1HH2      ARG  41  -3.880  15.690 -15.695
  706   2HH2  ARG  41          2HH2      ARG  41  -3.101  14.145 -15.743
  707    H    ILE  42           H        ILE  42  -2.107  18.185  -8.067
  708    HA   ILE  42           HA       ILE  42  -1.927  21.112  -8.252
  709    HB   ILE  42           HB       ILE  42  -3.076  19.758  -5.861
  710   1HG1  ILE  42          1HG1      ILE  42  -4.516  20.081  -8.497
  711   2HG1  ILE  42          2HG1      ILE  42  -4.241  18.580  -7.599
  712   1HG2  ILE  42          1HG2      ILE  42  -4.465  22.078  -6.881
  713   2HG2  ILE  42          2HG2      ILE  42  -3.645  21.834  -5.320
  714   3HG2  ILE  42          3HG2      ILE  42  -2.721  22.399  -6.733
  715   1HD1  ILE  42          1HD1      ILE  42  -5.508  20.000  -5.674
  716   2HD1  ILE  42          2HD1      ILE  42  -6.208  20.787  -7.108
  717   3HD1  ILE  42          3HD1      ILE  42  -6.389  19.032  -6.879
  718    HA   PRO  43           HA       PRO  43   1.863  20.364  -6.230
  719   1HB   PRO  43          1HB       PRO  43   2.778  22.937  -6.272
  720   2HB   PRO  43          2HB       PRO  43   2.993  21.816  -7.615
  721   1HG   PRO  43          1HG       PRO  43   1.103  24.059  -7.302
  722   2HG   PRO  43          2HG       PRO  43   1.641  23.248  -8.816
  723   1HD   PRO  43          1HD       PRO  43  -0.858  22.979  -7.443
  724   2HD   PRO  43          2HD       PRO  43  -0.314  22.040  -8.840
  725    H    GLY  44           H        GLY  44  -0.793  22.038  -5.134
  726   1HA   GLY  44          1HA       GLY  44   0.457  22.772  -2.598
  727   2HA   GLY  44          2HA       GLY  44  -1.169  23.144  -3.135
  728    H    VAL  45           H        VAL  45  -0.971  20.010  -4.050
  729    HA   VAL  45           HA       VAL  45  -1.991  19.089  -1.459
  730    HB   VAL  45           HB       VAL  45  -3.111  19.077  -4.000
  731   1HG1  VAL  45          1HG1      VAL  45  -1.441  16.803  -3.851
  732   2HG1  VAL  45          2HG1      VAL  45  -3.106  16.214  -3.621
  733   3HG1  VAL  45          3HG1      VAL  45  -2.688  17.165  -5.067
  734   1HG2  VAL  45          1HG2      VAL  45  -4.478  17.123  -2.518
  735   2HG2  VAL  45          2HG2      VAL  45  -3.753  18.207  -1.306
  736   3HG2  VAL  45          3HG2      VAL  45  -4.815  18.871  -2.570
  737    HA   PRO  46           HA       PRO  46   1.062  16.026  -1.284
  738   1HB   PRO  46          1HB       PRO  46  -0.227  13.727  -0.570
  739   2HB   PRO  46          2HB       PRO  46   0.158  15.011   0.574
  740   1HG   PRO  46          1HG       PRO  46  -2.412  14.306  -0.692
  741   2HG   PRO  46          2HG       PRO  46  -2.122  15.273   0.799
  742   1HD   PRO  46          1HD       PRO  46  -2.863  16.200  -1.808
  743   2HD   PRO  46          2HD       PRO  46  -2.435  17.200  -0.413
  744    H    TRP  47           H        TRP  47   2.322  15.442  -2.926
  745    HA   TRP  47           HA       TRP  47   0.988  14.156  -5.153
  746   1HB   TRP  47          1HB       TRP  47   3.883  14.470  -5.303
  747   2HB   TRP  47          2HB       TRP  47   2.617  14.992  -6.417
  748    HD1  TRP  47           HD1      TRP  47   1.410  17.452  -5.710
  749    HE1  TRP  47           HE1      TRP  47   2.399  19.631  -4.600
  750    HE3  TRP  47           HE3      TRP  47   5.530  15.212  -3.745
  751    HZ2  TRP  47           HZ2      TRP  47   4.742  20.162  -3.058
  752    HZ3  TRP  47           HZ3      TRP  47   7.118  16.632  -2.451
  753    HH2  TRP  47           HH2      TRP  47   6.777  19.027  -2.094
  754    H    CYS  48           H        CYS  48   1.188  12.807  -2.492
  755    HA   CYS  48           HA       CYS  48   2.094  10.313  -3.443
  756   1HB   CYS  48          1HB       CYS  48   4.233  11.621  -2.742
  757   2HB   CYS  48          2HB       CYS  48   3.711  11.249  -1.096
  758    H    PHE  49           H        PHE  49  -0.003   9.636  -2.807
  759    HA   PHE  49           HA       PHE  49  -0.400   9.588   0.092
  760   1HB   PHE  49          1HB       PHE  49  -2.951   9.750  -0.867
  761   2HB   PHE  49          2HB       PHE  49  -2.024  11.200  -0.464
  762    HD1  PHE  49           HD1      PHE  49  -0.417  11.938  -2.536
  763    HD2  PHE  49           HD2      PHE  49  -4.073   9.806  -2.857
  764    HE1  PHE  49           HE1      PHE  49  -0.681  12.745  -4.898
  765    HE2  PHE  49           HE2      PHE  49  -4.336  10.613  -5.219
  766    HZ   PHE  49           HZ       PHE  49  -2.636  12.073  -6.211
  767    H    LYS  50           H        LYS  50  -2.755   8.145   0.218
  768    HA   LYS  50           HA       LYS  50  -2.188   5.750  -1.378
  769   1HB   LYS  50          1HB       LYS  50  -2.673   4.380   0.605
  770   2HB   LYS  50          2HB       LYS  50  -1.222   5.376   0.807
  771   1HG   LYS  50          1HG       LYS  50  -3.668   6.749   1.682
  772   2HG   LYS  50          2HG       LYS  50  -3.405   5.234   2.564
  773   1HD   LYS  50          1HD       LYS  50  -1.453   7.554   2.263
  774   2HD   LYS  50          2HD       LYS  50  -2.296   7.076   3.747
  775   1HE   LYS  50          1HE       LYS  50  -0.922   4.772   2.718
  776   2HE   LYS  50          2HE       LYS  50   0.224   6.122   2.716
  777   1HZ   LYS  50          1HZ       LYS  50  -0.734   6.484   5.057
  778   2HZ   LYS  50          2HZ       LYS  50  -1.195   4.921   4.952
  779   3HZ   LYS  50          3HZ       LYS  50   0.384   5.316   4.825
  780    HA   PRO  51           HA       PRO  51  -6.519   7.042  -1.703
  781   1HB   PRO  51          1HB       PRO  51  -6.639   7.251  -4.424
  782   2HB   PRO  51          2HB       PRO  51  -6.340   8.627  -3.364
  783   1HG   PRO  51          1HG       PRO  51  -4.467   7.087  -5.045
  784   2HG   PRO  51          2HG       PRO  51  -4.265   8.741  -4.365
  785   1HD   PRO  51          1HD       PRO  51  -3.060   6.297  -3.487
  786   2HD   PRO  51          2HD       PRO  51  -2.955   7.872  -2.689
  787    H    LEU  52           H        LEU  52  -5.970   5.520  -4.759
  788    HA   LEU  52           HA       LEU  52  -7.475   3.236  -3.721
  789   1HB   LEU  52          1HB       LEU  52  -8.433   2.998  -5.743
  790   2HB   LEU  52          2HB       LEU  52  -8.172   4.752  -5.739
  791    HG   LEU  52           HG       LEU  52  -5.854   3.675  -6.881
  792   1HD1  LEU  52          1HD1      LEU  52  -7.362   2.490  -8.846
  793   2HD1  LEU  52          2HD1      LEU  52  -6.405   1.635  -7.611
  794   3HD1  LEU  52          3HD1      LEU  52  -8.146   1.907  -7.358
  795   1HD2  LEU  52          1HD2      LEU  52  -7.752   5.619  -7.436
  796   2HD2  LEU  52          2HD2      LEU  52  -6.283   5.266  -8.378
  797   3HD2  LEU  52          3HD2      LEU  52  -7.836   4.528  -8.840
  798    H    GLN  53           H        GLN  53  -4.769   3.433  -2.938
  799    HA   GLN  53           HA       GLN  53  -2.940   2.327  -4.603
  800   1HB   GLN  53          1HB       GLN  53  -3.286   1.913  -1.610
  801   2HB   GLN  53          2HB       GLN  53  -1.804   1.527  -2.503
  802   1HG   GLN  53          1HG       GLN  53  -3.113   4.275  -2.296
  803   2HG   GLN  53          2HG       GLN  53  -1.671   3.760  -1.409
  804   1HE2  GLN  53          1HE2      GLN  53  -0.606   2.183  -3.577
  805   2HE2  GLN  53          2HE2      GLN  53   0.017   3.269  -4.775
  806    H    GLU  54           H        GLU  54  -5.844   0.897  -3.421
  807    HA   GLU  54           HA       GLU  54  -5.274  -1.674  -2.966
  808   1HB   GLU  54          1HB       GLU  54  -7.528  -2.140  -4.154
  809   2HB   GLU  54          2HB       GLU  54  -7.538  -1.016  -2.782
  810   1HG   GLU  54          1HG       GLU  54  -8.019   0.791  -4.108
  811   2HG   GLU  54          2HG       GLU  54  -7.036   0.209  -5.460
  812    H    ALA  55           H        ALA  55  -4.775   0.082  -5.942
  813    HA   ALA  55           HA       ALA  55  -5.047  -1.595  -7.969
  814   1HB   ALA  55          1HB       ALA  55  -2.877  -0.644  -8.853
  815   2HB   ALA  55          2HB       ALA  55  -4.013   0.573  -8.223
  816   3HB   ALA  55          3HB       ALA  55  -2.610   0.077  -7.248
  817    H    GLU  56           H        GLU  56  -1.968  -1.623  -6.028
  818    HA   GLU  56           HA       GLU  56  -2.023  -4.516  -6.296
  819   1HB   GLU  56          1HB       GLU  56  -0.029  -2.632  -7.401
  820   2HB   GLU  56          2HB       GLU  56   0.679  -3.974  -6.484
  821   1HG   GLU  56          1HG       GLU  56   0.289  -5.382  -8.195
  822   2HG   GLU  56          2HG       GLU  56  -1.438  -4.996  -8.174
  823    H    CYS  57           H        CYS  57  -2.508  -2.306  -4.163
  824    HA   CYS  57           HA       CYS  57  -0.363  -2.931  -2.314
  825   1HB   CYS  57          1HB       CYS  57  -1.361  -0.601  -2.702
  826   2HB   CYS  57          2HB       CYS  57  -2.735  -1.165  -1.746
  827    H    THR  58           H        THR  58  -3.976  -2.634  -1.976
  828    HA   THR  58           HA       THR  58  -4.249  -4.320   0.166
  829    HB   THR  58           HB       THR  58  -5.978  -2.769  -0.834
  830    HG1  THR  58           HG1      THR  58  -6.557  -5.640  -0.621
  831   1HG2  THR  58          1HG2      THR  58  -5.649  -3.610  -3.253
  832   2HG2  THR  58          2HG2      THR  58  -6.500  -5.092  -2.753
  833   3HG2  THR  58          3HG2      THR  58  -7.339  -3.523  -2.700
  834    H    PHE  59           H        PHE  59  -3.867  -5.153  -3.282
  835    HA   PHE  59           HA       PHE  59  -4.725  -7.591  -3.587
  836   1HB   PHE  59          1HB       PHE  59  -2.543  -5.995  -4.487
  837   2HB   PHE  59          2HB       PHE  59  -1.801  -7.540  -4.059
  838    HD1  PHE  59           HD1      PHE  59  -2.117  -9.456  -5.431
  839    HD2  PHE  59           HD2      PHE  59  -4.324  -5.917  -6.210
  840    HE1  PHE  59           HE1      PHE  59  -2.851 -10.400  -7.638
  841    HE2  PHE  59           HE2      PHE  59  -5.058  -6.859  -8.417
  842    HZ   PHE  59           HZ       PHE  59  -4.313  -9.090  -9.104
  Start of MODEL   17
    1   1H    GLU   1           H1       GLU   1 -17.132  -6.472  -2.122
    2    HA   GLU   1           HA       GLU   1 -17.265  -7.049  -0.021
    3   1HB   GLU   1          1HB       GLU   1 -19.030  -8.504   0.852
    4   2HB   GLU   1          2HB       GLU   1 -19.714  -7.361  -0.318
    5   1HG   GLU   1          1HG       GLU   1 -19.093  -9.431  -1.977
    6   2HG   GLU   1          2HG       GLU   1 -19.401 -10.333  -0.486
    7    H    GLU   2           H        GLU   2 -15.656  -8.432  -2.213
    8    HA   GLU   2           HA       GLU   2 -15.324 -11.060  -1.086
    9   1HB   GLU   2          1HB       GLU   2 -14.199  -9.629  -3.504
   10   2HB   GLU   2          2HB       GLU   2 -13.539 -11.186  -2.974
   11   1HG   GLU   2          1HG       GLU   2 -16.073 -11.929  -2.981
   12   2HG   GLU   2          2HG       GLU   2 -16.293 -10.535  -4.050
   13    H    TYR   3           H        TYR   3 -14.565 -10.291   1.048
   14    HA   TYR   3           HA       TYR   3 -11.998  -8.931   1.051
   15   1HB   TYR   3          1HB       TYR   3 -12.560  -9.363   3.632
   16   2HB   TYR   3          2HB       TYR   3 -13.514  -8.168   2.747
   17    HD1  TYR   3           HD1      TYR   3 -15.844  -8.614   2.170
   18    HD2  TYR   3           HD2      TYR   3 -13.506 -11.521   4.267
   19    HE1  TYR   3           HE1      TYR   3 -17.958  -9.891   2.774
   20    HE2  TYR   3           HE2      TYR   3 -15.629 -12.787   4.863
   21    HH   TYR   3           HH       TYR   3 -18.748 -11.797   3.549
   22    H    VAL   4           H        VAL   4 -10.956 -10.846  -0.088
   23    HA   VAL   4           HA       VAL   4 -10.157 -12.793   1.957
   24    HB   VAL   4           HB       VAL   4 -11.721 -13.866   0.461
   25   1HG1  VAL   4          1HG1      VAL   4 -11.284 -12.240  -1.457
   26   2HG1  VAL   4          2HG1      VAL   4  -9.878 -13.255  -1.862
   27   3HG1  VAL   4          3HG1      VAL   4 -11.517 -13.949  -1.898
   28   1HG2  VAL   4          1HG2      VAL   4  -9.781 -15.157   1.288
   29   2HG2  VAL   4          2HG2      VAL   4 -10.339 -15.725  -0.305
   30   3HG2  VAL   4          3HG2      VAL   4  -8.876 -14.717  -0.181
   31    H    GLY   5           H        GLY   5  -9.365 -11.451  -1.329
   32   1HA   GLY   5          1HA       GLY   5  -6.586 -12.007  -1.079
   33   2HA   GLY   5          2HA       GLY   5  -7.371 -11.008  -2.286
   34    H    LEU   6           H        LEU   6  -8.334 -10.038   0.861
   35    HA   LEU   6           HA       LEU   6  -6.066  -8.311   1.308
   36   1HB   LEU   6          1HB       LEU   6  -7.557  -6.290   1.342
   37   2HB   LEU   6          2HB       LEU   6  -7.095  -6.919  -0.250
   38    HG   LEU   6           HG       LEU   6  -9.290  -7.880  -0.555
   39   1HD1  LEU   6          1HD1      LEU   6 -10.089  -8.678   1.437
   40   2HD1  LEU   6          2HD1      LEU   6  -9.624  -7.217   2.343
   41   3HD1  LEU   6          3HD1      LEU   6 -11.051  -7.189   1.280
   42   1HD2  LEU   6          1HD2      LEU   6  -8.818  -5.056  -0.167
   43   2HD2  LEU   6          2HD2      LEU   6  -9.801  -5.890  -1.395
   44   3HD2  LEU   6          3HD2      LEU   6 -10.515  -5.464   0.178
   45    H    SER   7           H        SER   7  -7.671 -10.605   2.538
   46    HA   SER   7           HA       SER   7  -8.933  -9.320   4.760
   47   1HB   SER   7          1HB       SER   7  -9.029 -11.838   5.528
   48   2HB   SER   7          2HB       SER   7 -10.058 -11.287   4.194
   49    HG   SER   7           HG       SER   7  -7.441 -12.454   3.803
   50    H    ALA   8           H        ALA   8  -8.306 -10.216   7.068
   51    HA   ALA   8           HA       ALA   8  -5.623  -9.484   7.527
   52   1HB   ALA   8          1HB       ALA   8  -6.451 -10.679   9.846
   53   2HB   ALA   8          2HB       ALA   8  -6.840  -9.003   9.387
   54   3HB   ALA   8          3HB       ALA   8  -8.013 -10.305   9.079
   55    H    ASN   9           H        ASN   9  -6.930 -12.293   6.206
   56    HA   ASN   9           HA       ASN   9  -5.011 -14.017   7.504
   57   1HB   ASN   9          1HB       ASN   9  -7.602 -14.396   6.469
   58   2HB   ASN   9          2HB       ASN   9  -6.559 -15.197   5.284
   59   1HD2  ASN   9          1HD2      ASN   9  -4.837 -16.612   6.222
   60   2HD2  ASN   9          2HD2      ASN   9  -5.255 -17.630   7.560
   61    H    GLN  10           H        GLN  10  -5.271 -11.885   4.853
   62    HA   GLN  10           HA       GLN  10  -4.050 -13.356   2.835
   63   1HB   GLN  10          1HB       GLN  10  -5.161 -10.829   3.113
   64   2HB   GLN  10          2HB       GLN  10  -3.451 -10.467   2.815
   65   1HG   GLN  10          1HG       GLN  10  -4.542 -12.592   1.075
   66   2HG   GLN  10          2HG       GLN  10  -5.361 -11.037   0.869
   67   1HE2  GLN  10          1HE2      GLN  10  -3.815  -9.118   0.817
   68   2HE2  GLN  10          2HE2      GLN  10  -2.411  -9.267  -0.187
   69    H    CYS  11           H        CYS  11  -2.783 -11.403   5.561
   70    HA   CYS  11           HA       CYS  11  -0.109 -11.457   4.621
   71   1HB   CYS  11          1HB       CYS  11  -0.860  -9.687   6.060
   72   2HB   CYS  11          2HB       CYS  11  -1.285 -10.832   7.336
   73    H    ALA  12           H        ALA  12  -2.157 -13.897   5.563
   74    HA   ALA  12           HA       ALA  12  -0.079 -15.362   7.024
   75   1HB   ALA  12          1HB       ALA  12  -2.839 -16.453   6.734
   76   2HB   ALA  12          2HB       ALA  12  -1.760 -16.429   8.150
   77   3HB   ALA  12          3HB       ALA  12  -2.673 -14.968   7.702
   78    H    VAL  13           H        VAL  13  -0.786 -14.729   3.930
   79    HA   VAL  13           HA       VAL  13  -1.468 -16.894   2.542
   80    HB   VAL  13           HB       VAL  13   0.128 -14.562   2.142
   81   1HG1  VAL  13          1HG1      VAL  13   2.107 -15.818   1.851
   82   2HG1  VAL  13          2HG1      VAL  13   1.262 -17.103   0.954
   83   3HG1  VAL  13          3HG1      VAL  13   1.510 -15.508   0.204
   84   1HG2  VAL  13          1HG2      VAL  13  -2.062 -15.267   1.069
   85   2HG2  VAL  13          2HG2      VAL  13  -0.838 -14.592  -0.034
   86   3HG2  VAL  13          3HG2      VAL  13  -1.106 -16.351   0.029
   87    HA   PRO  14           HA       PRO  14   1.311 -20.099   3.361
   88   1HB   PRO  14          1HB       PRO  14   1.282 -21.509   1.022
   89   2HB   PRO  14          2HB       PRO  14   0.011 -21.631   2.236
   90   1HG   PRO  14          1HG       PRO  14   0.035 -20.206  -0.346
   91   2HG   PRO  14          2HG       PRO  14  -1.381 -20.725   0.637
   92   1HD   PRO  14          1HD       PRO  14  -0.288 -18.095   0.337
   93   2HD   PRO  14          2HD       PRO  14  -1.583 -18.579   1.440
   94    H    ALA  15           H        ALA  15   2.443 -17.559   2.429
   95    HA   ALA  15           HA       ALA  15   4.369 -16.758   1.678
   96   1HB   ALA  15          1HB       ALA  15   5.169 -19.447   2.820
   97   2HB   ALA  15          2HB       ALA  15   6.382 -18.329   2.151
   98   3HB   ALA  15          3HB       ALA  15   5.372 -17.826   3.527
   99    H    LYS  16           H        LYS  16   3.135 -17.017  -0.501
  100    HA   LYS  16           HA       LYS  16   4.867 -17.552  -2.491
  101   1HB   LYS  16          1HB       LYS  16   3.773 -19.807  -3.312
  102   2HB   LYS  16          2HB       LYS  16   5.179 -19.800  -2.234
  103   1HG   LYS  16          1HG       LYS  16   4.003 -20.775  -0.570
  104   2HG   LYS  16          2HG       LYS  16   2.661 -19.630  -0.736
  105   1HD   LYS  16          1HD       LYS  16   3.134 -22.023  -2.561
  106   2HD   LYS  16          2HD       LYS  16   2.029 -22.042  -1.175
  107   1HE   LYS  16          1HE       LYS  16   0.763 -20.148  -2.218
  108   2HE   LYS  16          2HE       LYS  16   1.837 -20.222  -3.624
  109   1HZ   LYS  16          1HZ       LYS  16  -0.027 -22.280  -2.678
  110   2HZ   LYS  16          2HZ       LYS  16  -0.053 -21.488  -4.106
  111   3HZ   LYS  16          3HZ       LYS  16   1.120 -22.583  -3.801
  112    H    ASP  17           H        ASP  17   2.836 -15.718  -1.765
  113    HA   ASP  17           HA       ASP  17   1.367 -15.780  -4.197
  114   1HB   ASP  17          1HB       ASP  17  -0.007 -17.145  -2.522
  115   2HB   ASP  17          2HB       ASP  17  -0.200 -15.655  -1.583
  116    H    ARG  18           H        ARG  18   3.296 -14.255  -2.159
  117    HA   ARG  18           HA       ARG  18   1.767 -11.855  -1.775
  118   1HB   ARG  18          1HB       ARG  18   4.697 -12.428  -1.133
  119   2HB   ARG  18          2HB       ARG  18   3.748 -11.061  -0.525
  120   1HG   ARG  18          1HG       ARG  18   2.674 -12.342   1.037
  121   2HG   ARG  18          2HG       ARG  18   2.584 -13.762  -0.019
  122   1HD   ARG  18          1HD       ARG  18   4.864 -14.366   0.472
  123   2HD   ARG  18          2HD       ARG  18   5.188 -12.812   1.254
  124    HE   ARG  18           HE       ARG  18   3.006 -14.273   2.520
  125   1HH1  ARG  18          1HH1      ARG  18   6.507 -13.972   2.362
  126   2HH1  ARG  18          2HH1      ARG  18   6.762 -14.619   3.949
  127   1HH2  ARG  18          1HH2      ARG  18   3.341 -15.126   4.613
  128   2HH2  ARG  18          2HH2      ARG  18   4.950 -15.280   5.237
  129    H    VAL  19           H        VAL  19   3.292  -9.722  -2.226
  130    HA   VAL  19           HA       VAL  19   4.102  -9.999  -5.033
  131    HB   VAL  19           HB       VAL  19   3.345  -7.464  -3.589
  132   1HG1  VAL  19          1HG1      VAL  19   3.652  -6.447  -5.559
  133   2HG1  VAL  19          2HG1      VAL  19   4.442  -7.944  -6.108
  134   3HG1  VAL  19          3HG1      VAL  19   2.711  -7.682  -6.428
  135   1HG2  VAL  19          1HG2      VAL  19   1.393  -8.747  -3.307
  136   2HG2  VAL  19          2HG2      VAL  19   1.092  -7.802  -4.785
  137   3HG2  VAL  19          3HG2      VAL  19   1.557  -9.516  -4.904
  138    H    ASP  20           H        ASP  20   5.645 -10.550  -2.416
  139    HA   ASP  20           HA       ASP  20   7.499  -9.901  -1.392
  140   1HB   ASP  20          1HB       ASP  20   8.580 -11.231  -2.953
  141   2HB   ASP  20          2HB       ASP  20   8.068 -10.236  -4.325
  142    H    CYS  21           H        CYS  21   6.984  -7.749  -0.560
  143    HA   CYS  21           HA       CYS  21   6.872  -5.435  -1.969
  144   1HB   CYS  21          1HB       CYS  21   6.735  -6.130   0.657
  145   2HB   CYS  21          2HB       CYS  21   8.234  -5.196   0.634
  146    H    GLY  22           H        GLY  22   9.705  -7.329  -0.869
  147   1HA   GLY  22          1HA       GLY  22  11.924  -7.058  -1.171
  148   2HA   GLY  22          2HA       GLY  22  11.467  -6.537  -2.781
  149    H    TYR  23           H        TYR  23  11.389  -5.179   0.600
  150    HA   TYR  23           HA       TYR  23  12.028  -2.564  -0.499
  151   1HB   TYR  23          1HB       TYR  23  10.755  -3.836   1.841
  152   2HB   TYR  23          2HB       TYR  23  11.944  -2.643   2.375
  153    HD1  TYR  23           HD1      TYR  23  11.652  -0.251   1.777
  154    HD2  TYR  23           HD2      TYR  23   8.695  -3.183   0.797
  155    HE1  TYR  23           HE1      TYR  23   9.947   1.592   1.375
  156    HE2  TYR  23           HE2      TYR  23   7.000  -1.330   0.399
  157    HH   TYR  23           HH       TYR  23   7.968   2.019   0.358
  158    HA   PRO  24           HA       PRO  24  16.211  -2.861   0.593
  159   1HB   PRO  24          1HB       PRO  24  16.896  -0.219   0.531
  160   2HB   PRO  24          2HB       PRO  24  16.787  -1.219  -0.916
  161   1HG   PRO  24          1HG       PRO  24  14.922   0.814   0.128
  162   2HG   PRO  24          2HG       PRO  24  15.051   0.163  -1.544
  163   1HD   PRO  24          1HD       PRO  24  13.083  -0.430   0.450
  164   2HD   PRO  24          2HD       PRO  24  13.259  -1.215  -1.125
  165    H    HIS  25           H        HIS  25  13.876  -1.565   2.556
  166    HA   HIS  25           HA       HIS  25  15.840  -1.454   4.727
  167   1HB   HIS  25          1HB       HIS  25  13.667   0.423   3.968
  168   2HB   HIS  25          2HB       HIS  25  13.887   0.116   5.695
  169    HD1  HIS  25           HD1      HIS  25  16.433   0.591   6.605
  170    HD2  HIS  25           HD2      HIS  25  15.393   2.253   2.896
  171    HE1  HIS  25           HE1      HIS  25  18.148   2.421   6.134
  172    HE2  HIS  25           HE2      HIS  25  17.491   3.368   3.819
  173    H    VAL  26           H        VAL  26  13.886  -3.545   3.416
  174    HA   VAL  26           HA       VAL  26  11.750  -4.154   4.894
  175    HB   VAL  26           HB       VAL  26  12.316  -5.544   3.112
  176   1HG1  VAL  26          1HG1      VAL  26  14.676  -6.937   4.040
  177   2HG1  VAL  26          2HG1      VAL  26  14.409  -6.046   2.523
  178   3HG1  VAL  26          3HG1      VAL  26  14.973  -5.183   3.974
  179   1HG2  VAL  26          1HG2      VAL  26  13.074  -7.510   5.222
  180   2HG2  VAL  26          2HG2      VAL  26  11.540  -6.634   5.434
  181   3HG2  VAL  26          3HG2      VAL  26  11.818  -7.602   3.966
  182    H    THR  27           H        THR  27  11.249  -4.545   6.996
  183    HA   THR  27           HA       THR  27  13.036  -5.877   8.748
  184    HB   THR  27           HB       THR  27  13.370  -3.012   8.435
  185    HG1  THR  27           HG1      THR  27  15.119  -3.639   9.872
  186   1HG2  THR  27          1HG2      THR  27  11.618  -3.617  10.608
  187   2HG2  THR  27          2HG2      THR  27  13.237  -3.427  11.323
  188   3HG2  THR  27          3HG2      THR  27  12.530  -2.109  10.358
  189    HA   PRO  28           HA       PRO  28   9.286  -6.496  10.733
  190   1HB   PRO  28          1HB       PRO  28  10.092  -7.266  13.225
  191   2HB   PRO  28          2HB       PRO  28  10.089  -8.351  11.836
  192   1HG   PRO  28          1HG       PRO  28  12.334  -6.965  13.154
  193   2HG   PRO  28          2HG       PRO  28  12.381  -8.409  12.079
  194   1HD   PRO  28          1HD       PRO  28  13.101  -5.707  11.462
  195   2HD   PRO  28          2HD       PRO  28  13.011  -7.060  10.326
  196    H    LYS  29           H        LYS  29   9.591  -3.868  10.409
  197    HA   LYS  29           HA       LYS  29   7.988  -2.839  12.394
  198   1HB   LYS  29          1HB       LYS  29  10.294  -3.267  13.618
  199   2HB   LYS  29          2HB       LYS  29  10.706  -1.701  12.895
  200   1HG   LYS  29          1HG       LYS  29   9.582  -0.708  14.574
  201   2HG   LYS  29          2HG       LYS  29   8.081  -1.405  13.939
  202   1HD   LYS  29          1HD       LYS  29   8.141  -3.206  15.435
  203   2HD   LYS  29          2HD       LYS  29   9.891  -3.087  15.685
  204   1HE   LYS  29          1HE       LYS  29   9.460  -1.920  17.567
  205   2HE   LYS  29          2HE       LYS  29   8.832  -0.605  16.559
  206   1HZ   LYS  29          1HZ       LYS  29   7.287  -1.506  18.252
  207   2HZ   LYS  29          2HZ       LYS  29   6.686  -1.505  16.733
  208   3HZ   LYS  29          3HZ       LYS  29   7.210  -2.900  17.403
  209    H    GLU  30           H        GLU  30  10.264  -2.608   9.755
  210    HA   GLU  30           HA       GLU  30   9.458   0.122   9.242
  211   1HB   GLU  30          1HB       GLU  30  11.764  -1.548   8.601
  212   2HB   GLU  30          2HB       GLU  30  11.142  -0.740   7.152
  213   1HG   GLU  30          1HG       GLU  30  12.418   1.002   7.879
  214   2HG   GLU  30          2HG       GLU  30  11.062   1.320   8.971
  215    H    CYS  31           H        CYS  31   9.342  -3.190   7.808
  216    HA   CYS  31           HA       CYS  31   8.160  -2.536   5.415
  217   1HB   CYS  31          1HB       CYS  31   8.088  -4.983   7.146
  218   2HB   CYS  31          2HB       CYS  31   7.140  -4.910   5.659
  219    H    ASN  32           H        ASN  32   6.649  -3.474   8.591
  220    HA   ASN  32           HA       ASN  32   4.045  -3.129   7.698
  221   1HB   ASN  32          1HB       ASN  32   5.455  -3.479  10.296
  222   2HB   ASN  32          2HB       ASN  32   3.900  -2.645  10.429
  223   1HD2  ASN  32          1HD2      ASN  32   5.277  -5.311   8.497
  224   2HD2  ASN  32          2HD2      ASN  32   4.018  -6.464   8.788
  225    H    ASN  33           H        ASN  33   6.528  -0.876   8.070
  226    HA   ASN  33           HA       ASN  33   4.778   1.216   9.041
  227   1HB   ASN  33          1HB       ASN  33   7.232   0.823   9.843
  228   2HB   ASN  33          2HB       ASN  33   7.720   1.520   8.291
  229   1HD2  ASN  33          1HD2      ASN  33   8.698   2.933  10.096
  230   2HD2  ASN  33          2HD2      ASN  33   7.807   4.357  10.524
  231    H    ARG  34           H        ARG  34   6.591   0.001   6.211
  232    HA   ARG  34           HA       ARG  34   6.195   2.384   4.719
  233   1HB   ARG  34          1HB       ARG  34   6.934  -0.338   3.585
  234   2HB   ARG  34          2HB       ARG  34   7.387   1.257   2.958
  235   1HG   ARG  34          1HG       ARG  34   8.326   1.112   5.650
  236   2HG   ARG  34          2HG       ARG  34   8.778  -0.417   4.874
  237   1HD   ARG  34          1HD       ARG  34  10.308   0.599   3.525
  238   2HD   ARG  34          2HD       ARG  34   9.249   1.974   3.181
  239    HE   ARG  34           HE       ARG  34  10.037   2.280   5.856
  240   1HH1  ARG  34          1HH1      ARG  34  11.660   2.075   2.741
  241   2HH1  ARG  34          2HH1      ARG  34  13.001   3.056   3.232
  242   1HH2  ARG  34          1HH2      ARG  34  11.805   3.574   6.504
  243   2HH2  ARG  34          2HH2      ARG  34  13.083   3.915   5.387
  244    H    GLY  35           H        GLY  35   4.441  -0.574   5.397
  245   1HA   GLY  35          1HA       GLY  35   2.064  -0.464   4.870
  246   2HA   GLY  35          2HA       GLY  35   2.498   0.097   3.268
  247    H    CYS  36           H        CYS  36   4.474  -2.368   4.898
  248    HA   CYS  36           HA       CYS  36   3.332  -4.344   3.060
  249   1HB   CYS  36          1HB       CYS  36   6.180  -4.266   4.047
  250   2HB   CYS  36          2HB       CYS  36   5.493  -5.356   2.840
  251    H    CYS  37           H        CYS  37   4.285  -6.682   4.045
  252    HA   CYS  37           HA       CYS  37   3.656  -6.600   6.904
  253   1HB   CYS  37          1HB       CYS  37   1.829  -7.466   5.273
  254   2HB   CYS  37          2HB       CYS  37   2.832  -8.916   5.181
  255    H    PHE  38           H        PHE  38   5.345  -7.430   8.087
  256    HA   PHE  38           HA       PHE  38   7.430  -8.830   6.653
  257   1HB   PHE  38          1HB       PHE  38   7.780  -6.938   8.331
  258   2HB   PHE  38          2HB       PHE  38   7.089  -7.970   9.588
  259    HD1  PHE  38           HD1      PHE  38   9.982  -7.415   7.397
  260    HD2  PHE  38           HD2      PHE  38   8.382  -9.757  10.553
  261    HE1  PHE  38           HE1      PHE  38  12.266  -8.345   7.865
  262    HE2  PHE  38           HE2      PHE  38  10.665 -10.686  11.023
  263    HZ   PHE  38           HZ       PHE  38  12.580  -9.969   9.673
  264    H    ASP  39           H        ASP  39   7.528 -11.018   6.540
  265    HA   ASP  39           HA       ASP  39   5.807 -12.510   8.284
  266   1HB   ASP  39          1HB       ASP  39   5.872 -13.126   5.932
  267   2HB   ASP  39          2HB       ASP  39   7.634 -13.286   5.965
  268    H    SER  40           H        SER  40   9.102 -13.374   7.037
  269    HA   SER  40           HA       SER  40  11.013 -13.691   8.097
  270   1HB   SER  40          1HB       SER  40   9.797 -12.151   9.993
  271   2HB   SER  40          2HB       SER  40   9.986 -13.665  10.897
  272    HG   SER  40           HG       SER  40  12.278 -12.995   9.477
  273    H    ARG  41           H        ARG  41   8.017 -15.302   8.568
  274    HA   ARG  41           HA       ARG  41   8.867 -17.433  10.136
  275   1HB   ARG  41          1HB       ARG  41   6.675 -17.344   8.012
  276   2HB   ARG  41          2HB       ARG  41   6.808 -18.566   9.288
  277   1HG   ARG  41          1HG       ARG  41   6.853 -16.363  10.832
  278   2HG   ARG  41          2HG       ARG  41   5.958 -15.686   9.458
  279   1HD   ARG  41          1HD       ARG  41   4.158 -16.557  10.576
  280   2HD   ARG  41          2HD       ARG  41   4.636 -18.060   9.772
  281    HE   ARG  41           HE       ARG  41   6.003 -17.604  12.322
  282   1HH1  ARG  41          1HH1      ARG  41   3.114 -18.918  10.803
  283   2HH1  ARG  41          2HH1      ARG  41   2.758 -19.993  12.115
  284   1HH2  ARG  41          1HH2      ARG  41   5.535 -19.020  14.052
  285   2HH2  ARG  41          2HH2      ARG  41   4.145 -20.051  13.974
  286    H    ILE  42           H        ILE  42   8.809 -16.812   6.587
  287    HA   ILE  42           HA       ILE  42  10.418 -19.247   6.253
  288    HB   ILE  42           HB       ILE  42   8.660 -18.200   4.073
  289   1HG1  ILE  42          1HG1      ILE  42   7.774 -19.887   6.415
  290   2HG1  ILE  42          2HG1      ILE  42   7.080 -18.357   5.853
  291   1HG2  ILE  42          1HG2      ILE  42  10.491 -20.021   3.868
  292   2HG2  ILE  42          2HG2      ILE  42   9.314 -21.068   4.695
  293   3HG2  ILE  42          3HG2      ILE  42   8.893 -20.312   3.140
  294   1HD1  ILE  42          1HD1      ILE  42   6.636 -21.119   4.887
  295   2HD1  ILE  42          2HD1      ILE  42   5.600 -19.680   4.731
  296   3HD1  ILE  42          3HD1      ILE  42   6.933 -19.946   3.582
  297    HA   PRO  43           HA       PRO  43  13.147 -16.090   4.888
  298   1HB   PRO  43          1HB       PRO  43  15.429 -17.590   5.014
  299   2HB   PRO  43          2HB       PRO  43  14.793 -16.684   6.385
  300   1HG   PRO  43          1HG       PRO  43  14.691 -19.575   5.810
  301   2HG   PRO  43          2HG       PRO  43  14.486 -18.738   7.389
  302   1HD   PRO  43          1HD       PRO  43  12.477 -19.908   5.719
  303   2HD   PRO  43          2HD       PRO  43  12.207 -18.955   7.184
  304    H    GLY  44           H        GLY  44  12.037 -18.802   3.407
  305   1HA   GLY  44          1HA       GLY  44  13.771 -18.535   1.070
  306   2HA   GLY  44          2HA       GLY  44  12.555 -19.763   1.365
  307    H    VAL  45           H        VAL  45  10.944 -17.073   2.331
  308    HA   VAL  45           HA       VAL  45  10.058 -16.434  -0.399
  309    HB   VAL  45           HB       VAL  45   7.855 -16.586   0.209
  310   1HG1  VAL  45          1HG1      VAL  45   7.723 -18.787   0.581
  311   2HG1  VAL  45          2HG1      VAL  45   9.482 -18.761   0.856
  312   3HG1  VAL  45          3HG1      VAL  45   8.363 -18.620   2.234
  313   1HG2  VAL  45          1HG2      VAL  45   8.604 -16.453   3.150
  314   2HG2  VAL  45          2HG2      VAL  45   8.039 -15.077   2.172
  315   3HG2  VAL  45          3HG2      VAL  45   6.961 -16.462   2.466
  316    HA   PRO  46           HA       PRO  46  10.214 -12.254   0.766
  317   1HB   PRO  46          1HB       PRO  46   7.777 -11.128   0.265
  318   2HB   PRO  46          2HB       PRO  46   8.951 -11.487  -0.999
  319   1HG   PRO  46          1HG       PRO  46   6.483 -12.916  -0.244
  320   2HG   PRO  46          2HG       PRO  46   7.394 -12.990  -1.794
  321   1HD   PRO  46          1HD       PRO  46   7.315 -14.921   0.319
  322   2HD   PRO  46          2HD       PRO  46   8.351 -14.967  -1.114
  323    H    TRP  47           H        TRP  47  10.721 -11.561   2.738
  324    HA   TRP  47           HA       TRP  47   8.748 -12.087   4.802
  325   1HB   TRP  47          1HB       TRP  47  11.156 -10.702   5.634
  326   2HB   TRP  47          2HB       TRP  47  10.468 -12.229   6.192
  327    HD1  TRP  47           HD1      TRP  47  11.243 -14.475   4.702
  328    HE1  TRP  47           HE1      TRP  47  13.460 -15.058   3.395
  329    HE3  TRP  47           HE3      TRP  47  12.917  -9.686   4.346
  330    HZ2  TRP  47           HZ2      TRP  47  15.617 -13.488   2.382
  331    HZ3  TRP  47           HZ3      TRP  47  15.087  -9.298   3.183
  332    HH2  TRP  47           HH2      TRP  47  16.424 -11.105   2.220
  333    H    CYS  48           H        CYS  48   8.293 -10.103   2.581
  334    HA   CYS  48           HA       CYS  48   7.311  -8.021   4.191
  335   1HB   CYS  48          1HB       CYS  48   9.689  -7.370   4.186
  336   2HB   CYS  48          2HB       CYS  48   9.646  -7.258   2.425
  337    H    PHE  49           H        PHE  49   5.349  -7.937   3.139
  338    HA   PHE  49           HA       PHE  49   5.396  -7.378   0.295
  339   1HB   PHE  49          1HB       PHE  49   3.360  -9.185   0.376
  340   2HB   PHE  49          2HB       PHE  49   5.020  -9.694   0.045
  341    HD1  PHE  49           HD1      PHE  49   6.425 -10.305   2.183
  342    HD2  PHE  49           HD2      PHE  49   2.184 -10.232   2.050
  343    HE1  PHE  49           HE1      PHE  49   6.336 -11.832   4.173
  344    HE2  PHE  49           HE2      PHE  49   2.095 -11.760   4.040
  345    HZ   PHE  49           HZ       PHE  49   4.172 -12.542   5.077
  346    H    LYS  50           H        LYS  50   2.690  -7.473  -0.263
  347    HA   LYS  50           HA       LYS  50   1.558  -5.704   1.791
  348   1HB   LYS  50          1HB       LYS  50   0.318  -4.952  -0.522
  349   2HB   LYS  50          2HB       LYS  50   1.696  -4.117   0.217
  350   1HG   LYS  50          1HG       LYS  50   2.260  -6.457  -1.578
  351   2HG   LYS  50          2HG       LYS  50   1.723  -4.954  -2.346
  352   1HD   LYS  50          1HD       LYS  50   4.133  -5.356  -0.529
  353   2HD   LYS  50          2HD       LYS  50   4.161  -4.959  -2.256
  354   1HE   LYS  50          1HE       LYS  50   3.475  -3.223   0.112
  355   2HE   LYS  50          2HE       LYS  50   4.522  -2.857  -1.268
  356   1HZ   LYS  50          1HZ       LYS  50   2.246  -3.125  -2.497
  357   2HZ   LYS  50          2HZ       LYS  50   1.645  -2.692  -1.041
  358   3HZ   LYS  50          3HZ       LYS  50   2.686  -1.705  -1.823
  359    HA   PRO  51           HA       PRO  51  -1.129  -9.301   1.227
  360   1HB   PRO  51          1HB       PRO  51  -1.289 -10.045   3.851
  361   2HB   PRO  51          2HB       PRO  51  -0.144 -10.756   2.716
  362   1HG   PRO  51          1HG       PRO  51   0.285  -8.757   4.843
  363   2HG   PRO  51          2HG       PRO  51   1.498  -9.815   4.036
  364   1HD   PRO  51          1HD       PRO  51   1.032  -7.019   3.643
  365   2HD   PRO  51          2HD       PRO  51   2.127  -8.047   2.708
  366    H    LEU  52           H        LEU  52  -1.923  -8.507   4.467
  367    HA   LEU  52           HA       LEU  52  -4.426  -7.415   3.463
  368   1HB   LEU  52          1HB       LEU  52  -5.385  -8.090   5.385
  369   2HB   LEU  52          2HB       LEU  52  -4.083  -9.285   5.260
  370    HG   LEU  52           HG       LEU  52  -3.047  -7.104   6.734
  371   1HD1  LEU  52          1HD1      LEU  52  -5.931  -7.520   7.213
  372   2HD1  LEU  52          2HD1      LEU  52  -4.906  -7.521   8.669
  373   3HD1  LEU  52          3HD1      LEU  52  -4.888  -6.121   7.570
  374   1HD2  LEU  52          1HD2      LEU  52  -2.214  -8.828   7.853
  375   2HD2  LEU  52          2HD2      LEU  52  -3.833  -9.282   8.436
  376   3HD2  LEU  52          3HD2      LEU  52  -3.236  -9.917   6.884
  377    H    GLN  53           H        GLN  53  -1.951  -5.880   3.140
  378    HA   GLN  53           HA       GLN  53  -1.534  -4.055   5.119
  379   1HB   GLN  53          1HB       GLN  53  -1.393  -3.712   2.102
  380   2HB   GLN  53          2HB       GLN  53  -0.703  -2.560   3.258
  381   1HG   GLN  53          1HG       GLN  53   0.042  -5.499   2.948
  382   2HG   GLN  53          2HG       GLN  53   1.032  -4.119   2.451
  383   1HE2  GLN  53          1HE2      GLN  53   0.713  -2.397   4.540
  384   2HE2  GLN  53          2HE2      GLN  53   1.403  -3.043   5.991
  385    H    GLU  54           H        GLU  54  -4.318  -4.477   3.064
  386    HA   GLU  54           HA       GLU  54  -5.324  -2.067   2.643
  387   1HB   GLU  54          1HB       GLU  54  -7.462  -3.051   2.598
  388   2HB   GLU  54          2HB       GLU  54  -6.373  -4.418   2.303
  389   1HG   GLU  54          1HG       GLU  54  -7.751  -5.314   3.943
  390   2HG   GLU  54          2HG       GLU  54  -6.468  -4.639   4.960
  391    H    ALA  55           H        ALA  55  -4.699  -3.517   5.789
  392    HA   ALA  55           HA       ALA  55  -6.409  -2.332   7.484
  393   1HB   ALA  55          1HB       ALA  55  -4.788  -3.717   8.440
  394   2HB   ALA  55          2HB       ALA  55  -3.447  -2.897   7.604
  395   3HB   ALA  55          3HB       ALA  55  -4.257  -2.105   8.977
  396    H    GLU  56           H        GLU  56  -3.178  -0.764   7.120
  397    HA   GLU  56           HA       GLU  56  -4.622   1.770   7.104
  398   1HB   GLU  56          1HB       GLU  56  -2.360   0.780   8.643
  399   2HB   GLU  56          2HB       GLU  56  -1.917   2.262   7.778
  400   1HG   GLU  56          1HG       GLU  56  -4.484   2.019   9.384
  401   2HG   GLU  56          2HG       GLU  56  -2.963   2.525  10.133
  402    H    CYS  57           H        CYS  57  -3.850  -0.080   4.795
  403    HA   CYS  57           HA       CYS  57  -2.012   1.735   3.422
  404   1HB   CYS  57          1HB       CYS  57  -1.610  -0.838   3.704
  405   2HB   CYS  57          2HB       CYS  57  -2.744  -0.966   2.357
  406    H    THR  58           H        THR  58  -5.012  -0.285   3.020
  407    HA   THR  58           HA       THR  58  -5.799   0.802   0.576
  408    HB   THR  58           HB       THR  58  -6.844  -0.936   2.714
  409    HG1  THR  58           HG1      THR  58  -7.392  -0.479  -0.136
  410   1HG2  THR  58          1HG2      THR  58  -8.680   0.709   2.887
  411   2HG2  THR  58          2HG2      THR  58  -8.775   0.823   1.113
  412   3HG2  THR  58          3HG2      THR  58  -9.241  -0.686   1.934
  413    H    PHE  59           H        PHE  59  -6.025   2.070   3.874
  414    HA   PHE  59           HA       PHE  59  -8.040   3.771   3.875
  415   1HB   PHE  59          1HB       PHE  59  -5.676   3.448   5.229
  416   2HB   PHE  59          2HB       PHE  59  -5.305   4.962   4.396
  417    HD1  PHE  59           HD1      PHE  59  -7.596   3.346   6.799
  418    HD2  PHE  59           HD2      PHE  59  -6.272   7.008   5.116
  419    HE1  PHE  59           HE1      PHE  59  -8.833   4.611   8.579
  420    HE2  PHE  59           HE2      PHE  59  -7.508   8.274   6.896
  421    HZ   PHE  59           HZ       PHE  59  -8.773   7.060   8.606
  422   1H    GLU   1           H1       GLU   1 -24.113   0.301  -0.547
  423    HA   GLU   1           HA       GLU   1 -21.313   0.015  -0.071
  424   1HB   GLU   1          1HB       GLU   1 -23.193  -0.845  -2.286
  425   2HB   GLU   1          2HB       GLU   1 -21.441  -1.084  -2.417
  426   1HG   GLU   1          1HG       GLU   1 -21.939  -3.078  -1.407
  427   2HG   GLU   1          2HG       GLU   1 -21.863  -2.109   0.074
  428    H    GLU   2           H        GLU   2 -20.915   2.418   0.021
  429    HA   GLU   2           HA       GLU   2 -21.141   3.744  -2.521
  430   1HB   GLU   2          1HB       GLU   2 -20.761   4.521   0.299
  431   2HB   GLU   2          2HB       GLU   2 -19.801   5.491  -0.833
  432   1HG   GLU   2          1HG       GLU   2 -21.776   6.132  -2.064
  433   2HG   GLU   2          2HG       GLU   2 -22.782   4.959  -1.200
  434    H    TYR   3           H        TYR   3 -19.608   2.140  -3.554
  435    HA   TYR   3           HA       TYR   3 -16.837   2.432  -2.736
  436   1HB   TYR   3          1HB       TYR   3 -16.790   0.825  -4.895
  437   2HB   TYR   3          2HB       TYR   3 -17.409   0.197  -3.364
  438    HD1  TYR   3           HD1      TYR   3 -19.002   2.443  -5.912
  439    HD2  TYR   3           HD2      TYR   3 -19.080  -1.337  -3.909
  440    HE1  TYR   3           HE1      TYR   3 -21.206   1.878  -7.047
  441    HE2  TYR   3           HE2      TYR   3 -21.283  -1.889  -5.051
  442    HH   TYR   3           HH       TYR   3 -22.689  -1.304  -6.623
  443    H    VAL   4           H        VAL   4 -17.254   4.898  -3.356
  444    HA   VAL   4           HA       VAL   4 -16.489   5.153  -6.184
  445    HB   VAL   4           HB       VAL   4 -17.610   7.313  -6.189
  446   1HG1  VAL   4          1HG1      VAL   4 -19.999   6.094  -5.395
  447   2HG1  VAL   4          2HG1      VAL   4 -19.272   6.069  -7.021
  448   3HG1  VAL   4          3HG1      VAL   4 -18.945   4.743  -5.880
  449   1HG2  VAL   4          1HG2      VAL   4 -19.183   7.853  -4.276
  450   2HG2  VAL   4          2HG2      VAL   4 -18.331   6.610  -3.330
  451   3HG2  VAL   4          3HG2      VAL   4 -17.447   8.036  -3.924
  452    H    GLY   5           H        GLY   5 -16.303   6.637  -2.877
  453   1HA   GLY   5          1HA       GLY   5 -14.059   8.269  -3.529
  454   2HA   GLY   5          2HA       GLY   5 -14.709   7.931  -1.937
  455    H    LEU   6           H        LEU   6 -14.256   4.948  -3.466
  456    HA   LEU   6           HA       LEU   6 -11.496   4.750  -2.491
  457   1HB   LEU   6          1HB       LEU   6 -12.117   2.442  -1.725
  458   2HB   LEU   6          2HB       LEU   6 -12.717   3.797  -0.750
  459    HG   LEU   6           HG       LEU   6 -14.338   1.935  -1.040
  460   1HD1  LEU   6          1HD1      LEU   6 -14.803   4.624  -1.004
  461   2HD1  LEU   6          2HD1      LEU   6 -15.723   4.120  -2.443
  462   3HD1  LEU   6          3HD1      LEU   6 -16.055   3.365  -0.865
  463   1HD2  LEU   6          1HD2      LEU   6 -15.224   1.268  -3.060
  464   2HD2  LEU   6          2HD2      LEU   6 -14.788   2.786  -3.881
  465   3HD2  LEU   6          3HD2      LEU   6 -13.529   1.585  -3.503
  466    H    SER   7           H        SER   7 -13.432   4.807  -5.131
  467    HA   SER   7           HA       SER   7 -12.687   2.411  -6.395
  468   1HB   SER   7          1HB       SER   7 -13.528   3.568  -8.461
  469   2HB   SER   7          2HB       SER   7 -14.684   3.586  -7.116
  470    HG   SER   7           HG       SER   7 -13.922   5.669  -8.498
  471    H    ALA   8           H        ALA   8 -11.652   2.935  -8.863
  472    HA   ALA   8           HA       ALA   8  -8.942   3.565  -8.252
  473   1HB   ALA   8          1HB       ALA   8  -9.827   1.807  -9.884
  474   2HB   ALA   8          2HB       ALA   8 -10.201   3.154 -10.985
  475   3HB   ALA   8          3HB       ALA   8  -8.518   2.848 -10.492
  476    H    ASN   9           H        ASN   9 -11.654   5.489  -8.742
  477    HA   ASN   9           HA       ASN   9 -10.180   7.489 -10.223
  478   1HB   ASN   9          1HB       ASN   9 -12.831   6.704 -10.306
  479   2HB   ASN   9          2HB       ASN   9 -12.932   8.125  -9.256
  480   1HD2  ASN   9          1HD2      ASN   9 -11.540  10.013 -10.061
  481   2HD2  ASN   9          2HD2      ASN   9 -11.681  10.422 -11.738
  482    H    GLN  10           H        GLN  10 -10.674   6.443  -7.043
  483    HA   GLN  10           HA       GLN  10 -11.226   8.833  -5.728
  484   1HB   GLN  10          1HB       GLN  10 -11.218   7.509  -3.906
  485   2HB   GLN  10          2HB       GLN  10 -10.934   6.160  -5.019
  486   1HG   GLN  10          1HG       GLN  10  -8.503   6.414  -4.727
  487   2HG   GLN  10          2HG       GLN  10  -8.745   7.822  -3.685
  488   1HE2  GLN  10          1HE2      GLN  10  -9.357   7.571  -1.596
  489   2HE2  GLN  10          2HE2      GLN  10  -9.465   6.050  -0.776
  490    H    CYS  11           H        CYS  11  -8.175   7.240  -6.768
  491    HA   CYS  11           HA       CYS  11  -6.450   8.935  -5.382
  492   1HB   CYS  11          1HB       CYS  11  -5.608   6.898  -6.193
  493   2HB   CYS  11          2HB       CYS  11  -6.121   7.235  -7.848
  494    H    ALA  12           H        ALA  12  -8.715   9.582  -7.826
  495    HA   ALA  12           HA       ALA  12  -7.110  11.734  -8.990
  496   1HB   ALA  12          1HB       ALA  12  -8.117  11.016 -10.867
  497   2HB   ALA  12          2HB       ALA  12  -9.159   9.910  -9.939
  498   3HB   ALA  12          3HB       ALA  12  -9.662  11.597 -10.201
  499    H    VAL  13           H        VAL  13  -8.477  11.483  -6.178
  500    HA   VAL  13           HA       VAL  13 -10.672  12.987  -5.878
  501    HB   VAL  13           HB       VAL  13  -8.600  12.059  -4.289
  502   1HG1  VAL  13          1HG1      VAL  13  -8.023  13.931  -2.803
  503   2HG1  VAL  13          2HG1      VAL  13  -7.436  14.210  -4.459
  504   3HG1  VAL  13          3HG1      VAL  13  -8.890  15.055  -3.877
  505   1HG2  VAL  13          1HG2      VAL  13 -10.348  11.826  -2.924
  506   2HG2  VAL  13          2HG2      VAL  13 -10.467  13.589  -2.713
  507   3HG2  VAL  13          3HG2      VAL  13 -11.322  12.794  -4.057
  508    HA   PRO  14           HA       PRO  14  -9.852  17.027  -7.170
  509   1HB   PRO  14          1HB       PRO  14 -11.264  18.564  -5.409
  510   2HB   PRO  14          2HB       PRO  14 -12.012  17.712  -6.759
  511   1HG   PRO  14          1HG       PRO  14 -11.991  17.058  -3.883
  512   2HG   PRO  14          2HG       PRO  14 -13.124  16.482  -5.156
  513   1HD   PRO  14          1HD       PRO  14 -10.970  15.062  -3.915
  514   2HD   PRO  14          2HD       PRO  14 -11.954  14.506  -5.274
  515    H    ALA  15           H        ALA  15  -7.901  15.813  -5.340
  516    HA   ALA  15           HA       ALA  15  -6.176  16.413  -4.074
  517   1HB   ALA  15          1HB       ALA  15  -4.870  18.235  -4.950
  518   2HB   ALA  15          2HB       ALA  15  -5.723  17.493  -6.326
  519   3HB   ALA  15          3HB       ALA  15  -6.314  19.022  -5.630
  520    H    LYS  16           H        LYS  16  -7.765  16.438  -2.211
  521    HA   LYS  16           HA       LYS  16  -7.247  18.350  -0.422
  522   1HB   LYS  16          1HB       LYS  16  -9.451  19.723  -0.528
  523   2HB   LYS  16          2HB       LYS  16  -8.071  20.197  -1.533
  524   1HG   LYS  16          1HG       LYS  16  -9.326  19.948  -3.383
  525   2HG   LYS  16          2HG       LYS  16  -9.627  18.247  -2.983
  526   1HD   LYS  16          1HD       LYS  16 -11.798  19.003  -2.936
  527   2HD   LYS  16          2HD       LYS  16 -11.370  19.394  -1.261
  528   1HE   LYS  16          1HE       LYS  16 -11.031  21.694  -1.778
  529   2HE   LYS  16          2HE       LYS  16 -10.954  21.389  -3.521
  530   1HZ   LYS  16          1HZ       LYS  16 -13.327  20.566  -3.166
  531   2HZ   LYS  16          2HZ       LYS  16 -13.281  21.403  -1.764
  532   3HZ   LYS  16          3HZ       LYS  16 -13.064  22.177  -3.185
  533    H    ASP  17           H        ASP  17  -7.607  15.646  -0.382
  534    HA   ASP  17           HA       ASP  17  -9.622  15.443   1.593
  535   1HB   ASP  17          1HB       ASP  17 -10.859  15.130  -0.624
  536   2HB   ASP  17          2HB       ASP  17  -9.904  13.660  -0.866
  537    H    ARG  18           H        ARG  18  -7.044  14.221  -0.499
  538    HA   ARG  18           HA       ARG  18  -6.719  11.686   0.305
  539   1HB   ARG  18          1HB       ARG  18  -4.504  13.756  -0.067
  540   2HB   ARG  18          2HB       ARG  18  -4.290  12.000  -0.186
  541   1HG   ARG  18          1HG       ARG  18  -5.212  11.909  -2.271
  542   2HG   ARG  18          2HG       ARG  18  -6.452  13.120  -1.900
  543   1HD   ARG  18          1HD       ARG  18  -4.841  14.927  -2.199
  544   2HD   ARG  18          2HD       ARG  18  -3.506  13.777  -2.376
  545    HE   ARG  18           HE       ARG  18  -5.721  13.476  -4.306
  546   1HH1  ARG  18          1HH1      ARG  18  -2.553  14.863  -3.655
  547   2HH1  ARG  18          2HH1      ARG  18  -2.165  15.086  -5.328
  548   1HH2  ARG  18          1HH2      ARG  18  -5.209  13.770  -6.513
  549   2HH2  ARG  18          2HH2      ARG  18  -3.687  14.459  -6.965
  550    H    VAL  19           H        VAL  19  -4.501  11.064   1.708
  551    HA   VAL  19           HA       VAL  19  -4.921  12.359   4.312
  552    HB   VAL  19           HB       VAL  19  -4.028   9.528   3.740
  553   1HG1  VAL  19          1HG1      VAL  19  -4.386  11.158   6.202
  554   2HG1  VAL  19          2HG1      VAL  19  -4.975   9.480   6.263
  555   3HG1  VAL  19          3HG1      VAL  19  -3.272   9.813   5.865
  556   1HG2  VAL  19          1HG2      VAL  19  -6.692  10.716   3.745
  557   2HG2  VAL  19          2HG2      VAL  19  -6.167   9.086   3.256
  558   3HG2  VAL  19          3HG2      VAL  19  -6.531   9.430   4.966
  559    H    ASP  20           H        ASP  20  -3.061  12.951   1.905
  560    HA   ASP  20           HA       ASP  20  -0.910  13.201   1.475
  561   1HB   ASP  20          1HB       ASP  20  -1.021  15.223   2.568
  562   2HB   ASP  20          2HB       ASP  20  -1.546  14.498   4.094
  563    H    CYS  21           H        CYS  21   0.018  11.059   1.372
  564    HA   CYS  21           HA       CYS  21   0.538   9.450   3.542
  565   1HB   CYS  21          1HB       CYS  21   0.755   9.196   0.868
  566   2HB   CYS  21          2HB       CYS  21   2.465   9.323   1.297
  567    H    GLY  22           H        GLY  22   2.290  12.226   2.138
  568   1HA   GLY  22          1HA       GLY  22   4.115  13.360   2.795
  569   2HA   GLY  22          2HA       GLY  22   3.710  12.855   4.424
  570    H    TYR  23           H        TYR  23   4.958  11.206   1.423
  571    HA   TYR  23           HA       TYR  23   6.735   9.634   3.092
  572   1HB   TYR  23          1HB       TYR  23   5.220   9.291   0.757
  573   2HB   TYR  23          2HB       TYR  23   6.832   9.567   0.089
  574    HD1  TYR  23           HD1      TYR  23   7.388   7.437  -0.756
  575    HD2  TYR  23           HD2      TYR  23   5.948   7.798   3.257
  576    HE1  TYR  23           HE1      TYR  23   7.963   4.999  -0.323
  577    HE2  TYR  23           HE2      TYR  23   6.529   5.358   3.676
  578    HH   TYR  23           HH       TYR  23   7.198   3.494   2.799
  579    HA   PRO  24           HA       PRO  24  10.138  12.194   2.250
  580   1HB   PRO  24          1HB       PRO  24  12.123  10.580   3.210
  581   2HB   PRO  24          2HB       PRO  24  11.144  11.621   4.241
  582   1HG   PRO  24          1HG       PRO  24  11.008   8.704   3.816
  583   2HG   PRO  24          2HG       PRO  24  10.359   9.670   5.190
  584   1HD   PRO  24          1HD       PRO  24   8.927   8.495   3.006
  585   2HD   PRO  24          2HD       PRO  24   8.266   9.570   4.245
  586    H    HIS  25           H        HIS  25   9.426   9.370   0.679
  587    HA   HIS  25           HA       HIS  25  11.599   9.928  -1.207
  588   1HB   HIS  25          1HB       HIS  25  11.008   7.523   0.209
  589   2HB   HIS  25          2HB       HIS  25  10.686   7.242  -1.506
  590    HD1  HIS  25           HD1      HIS  25  13.055   5.851  -0.033
  591    HD2  HIS  25           HD2      HIS  25  13.374   9.424  -2.208
  592    HE1  HIS  25           HE1      HIS  25  15.505   6.057  -0.716
  593    HE2  HIS  25           HE2      HIS  25  15.629   8.243  -2.096
  594    H    VAL  26           H        VAL  26   8.728  10.940  -0.892
  595    HA   VAL  26           HA       VAL  26   6.919   9.832  -2.534
  596    HB   VAL  26           HB       VAL  26   6.316  11.760  -1.394
  597   1HG1  VAL  26          1HG1      VAL  26   7.838  13.291  -0.840
  598   2HG1  VAL  26          2HG1      VAL  26   8.966  12.652  -2.059
  599   3HG1  VAL  26          3HG1      VAL  26   7.794  13.914  -2.506
  600   1HG2  VAL  26          1HG2      VAL  26   6.564  13.149  -4.018
  601   2HG2  VAL  26          2HG2      VAL  26   5.729  11.577  -4.010
  602   3HG2  VAL  26          3HG2      VAL  26   5.142  12.903  -2.976
  603    H    THR  27           H        THR  27   6.849   9.158  -4.613
  604    HA   THR  27           HA       THR  27   7.985  10.659  -6.722
  605    HB   THR  27           HB       THR  27   9.720   8.759  -5.327
  606    HG1  THR  27           HG1      THR  27  10.034  10.264  -7.817
  607   1HG2  THR  27          1HG2      THR  27  10.561   8.040  -7.801
  608   2HG2  THR  27          2HG2      THR  27   9.453   7.012  -6.860
  609   3HG2  THR  27          3HG2      THR  27   8.812   8.088  -8.123
  610    HA   PRO  28           HA       PRO  28   5.087   8.263  -8.786
  611   1HB   PRO  28          1HB       PRO  28   5.811   8.684 -11.387
  612   2HB   PRO  28          2HB       PRO  28   4.866   9.840 -10.450
  613   1HG   PRO  28          1HG       PRO  28   7.719   9.885 -11.198
  614   2HG   PRO  28          2HG       PRO  28   6.672  11.255 -10.679
  615   1HD   PRO  28          1HD       PRO  28   8.683   9.882  -9.173
  616   2HD   PRO  28          2HD       PRO  28   7.572  11.117  -8.568
  617    H    LYS  29           H        LYS  29   6.846   6.628  -7.588
  618    HA   LYS  29           HA       LYS  29   6.646   4.360  -9.183
  619   1HB   LYS  29          1HB       LYS  29   8.337   5.385 -10.585
  620   2HB   LYS  29          2HB       LYS  29   9.414   5.599  -9.193
  621   1HG   LYS  29          1HG       LYS  29  10.094   3.439  -9.269
  622   2HG   LYS  29          2HG       LYS  29   8.444   2.826  -9.480
  623   1HD   LYS  29          1HD       LYS  29   9.223   4.199 -11.885
  624   2HD   LYS  29          2HD       LYS  29  10.529   3.084 -11.447
  625   1HE   LYS  29          1HE       LYS  29   9.246   1.233 -11.857
  626   2HE   LYS  29          2HE       LYS  29   7.774   1.969 -11.205
  627   1HZ   LYS  29          1HZ       LYS  29   7.326   2.938 -13.202
  628   2HZ   LYS  29          2HZ       LYS  29   8.877   2.946 -13.713
  629   3HZ   LYS  29          3HZ       LYS  29   8.023   1.553 -13.714
  630    H    GLU  30           H        GLU  30   7.851   6.229  -6.479
  631    HA   GLU  30           HA       GLU  30   8.567   3.800  -5.078
  632   1HB   GLU  30          1HB       GLU  30   9.322   6.612  -4.931
  633   2HB   GLU  30          2HB       GLU  30   8.874   5.994  -3.331
  634   1HG   GLU  30          1HG       GLU  30  10.771   4.774  -3.193
  635   2HG   GLU  30          2HG       GLU  30  10.527   4.069  -4.798
  636    H    CYS  31           H        CYS  31   6.281   6.591  -4.944
  637    HA   CYS  31           HA       CYS  31   5.055   5.881  -2.556
  638   1HB   CYS  31          1HB       CYS  31   4.215   7.502  -4.933
  639   2HB   CYS  31          2HB       CYS  31   3.075   7.182  -3.623
  640    H    ASN  32           H        ASN  32   4.076   5.282  -6.016
  641    HA   ASN  32           HA       ASN  32   1.921   3.680  -5.364
  642   1HB   ASN  32          1HB       ASN  32   3.604   4.198  -7.794
  643   2HB   ASN  32          2HB       ASN  32   2.610   2.733  -7.833
  644   1HD2  ASN  32          1HD2      ASN  32   2.250   6.042  -6.554
  645   2HD2  ASN  32          2HD2      ASN  32   0.734   6.406  -7.311
  646    H    ASN  33           H        ASN  33   5.230   3.176  -4.852
  647    HA   ASN  33           HA       ASN  33   5.062   0.322  -5.328
  648   1HB   ASN  33          1HB       ASN  33   7.088   1.272  -6.206
  649   2HB   ASN  33          2HB       ASN  33   7.368   2.236  -4.748
  650   1HD2  ASN  33          1HD2      ASN  33   9.136   1.525  -3.830
  651   2HD2  ASN  33          2HD2      ASN  33   9.548  -0.123  -3.487
  652    H    ARG  34           H        ARG  34   5.252   2.868  -2.852
  653    HA   ARG  34           HA       ARG  34   5.862   0.999  -0.779
  654   1HB   ARG  34          1HB       ARG  34   6.082   2.875   0.630
  655   2HB   ARG  34          2HB       ARG  34   6.548   3.537  -0.947
  656   1HG   ARG  34          1HG       ARG  34   5.045   5.146  -0.172
  657   2HG   ARG  34          2HG       ARG  34   3.976   4.121  -1.146
  658   1HD   ARG  34          1HD       ARG  34   2.690   3.929   0.706
  659   2HD   ARG  34          2HD       ARG  34   3.964   2.909   1.392
  660    HE   ARG  34           HE       ARG  34   4.520   5.745   1.731
  661   1HH1  ARG  34          1HH1      ARG  34   2.695   3.044   3.058
  662   2HH1  ARG  34          2HH1      ARG  34   2.602   3.722   4.649
  663   1HH2  ARG  34          1HH2      ARG  34   4.399   6.639   3.831
  664   2HH2  ARG  34          2HH2      ARG  34   3.578   5.781   5.092
  665    H    GLY  35           H        GLY  35   3.058   2.621  -2.237
  666   1HA   GLY  35          1HA       GLY  35   0.986   1.283  -1.877
  667   2HA   GLY  35          2HA       GLY  35   1.312   1.439  -0.162
  668    H    CYS  36           H        CYS  36   2.185   4.126  -2.285
  669    HA   CYS  36           HA       CYS  36  -0.176   5.556  -1.298
  670   1HB   CYS  36          1HB       CYS  36   2.624   6.604  -1.725
  671   2HB   CYS  36          2HB       CYS  36   1.220   7.606  -1.344
  672    H    CYS  37           H        CYS  37  -0.427   7.680  -2.822
  673    HA   CYS  37           HA       CYS  37  -0.051   6.747  -5.575
  674   1HB   CYS  37          1HB       CYS  37  -2.427   6.706  -4.585
  675   2HB   CYS  37          2HB       CYS  37  -2.367   8.466  -4.722
  676    H    PHE  38           H        PHE  38   1.123   8.175  -6.828
  677    HA   PHE  38           HA       PHE  38   1.789  10.728  -5.616
  678   1HB   PHE  38          1HB       PHE  38   3.380   8.929  -6.693
  679   2HB   PHE  38          2HB       PHE  38   2.747   9.479  -8.249
  680    HD1  PHE  38           HD1      PHE  38   3.083  11.919  -8.864
  681    HD2  PHE  38           HD2      PHE  38   5.108  10.077  -5.622
  682    HE1  PHE  38           HE1      PHE  38   4.799  13.751  -8.895
  683    HE2  PHE  38           HE2      PHE  38   6.824  11.908  -5.652
  684    HZ   PHE  38           HZ       PHE  38   6.648  13.724  -7.289
  685    H    ASP  39           H        ASP  39   0.884  12.631  -6.246
  686    HA   ASP  39           HA       ASP  39  -0.923  12.522  -8.473
  687   1HB   ASP  39          1HB       ASP  39  -1.699  13.637  -6.468
  688   2HB   ASP  39          2HB       ASP  39  -0.251  14.652  -6.397
  689    H    SER  40           H        SER  40   1.227  15.229  -7.361
  690    HA   SER  40           HA       SER  40   2.952  16.193  -8.357
  691   1HB   SER  40          1HB       SER  40   3.066  13.898  -9.739
  692   2HB   SER  40          2HB       SER  40   2.524  14.951 -11.059
  693    HG   SER  40           HG       SER  40   4.469  16.309  -9.883
  694    H    ARG  41           H        ARG  41  -0.297  15.923  -9.481
  695    HA   ARG  41           HA       ARG  41  -0.297  17.753 -11.539
  696   1HB   ARG  41          1HB       ARG  41  -2.438  17.033  -9.490
  697   2HB   ARG  41          2HB       ARG  41  -2.766  18.024 -10.921
  698   1HG   ARG  41          1HG       ARG  41  -1.456  15.852 -12.012
  699   2HG   ARG  41          2HG       ARG  41  -2.346  15.093 -10.682
  700   1HD   ARG  41          1HD       ARG  41  -4.084  15.051 -12.149
  701   2HD   ARG  41          2HD       ARG  41  -4.265  16.770 -11.772
  702    HE   ARG  41           HE       ARG  41  -2.306  16.563 -13.806
  703   1HH1  ARG  41          1HH1      ARG  41  -5.734  15.879 -13.403
  704   2HH1  ARG  41          2HH1      ARG  41  -6.112  16.138 -15.073
  705   1HH2  ARG  41          1HH2      ARG  41  -2.804  16.904 -16.009
  706   2HH2  ARG  41          2HH2      ARG  41  -4.435  16.724 -16.566
  707    H    ILE  42           H        ILE  42  -1.205  18.213  -8.035
  708    HA   ILE  42           HA       ILE  42  -0.649  21.072  -8.405
  709    HB   ILE  42           HB       ILE  42  -2.155  20.208  -6.033
  710   1HG1  ILE  42          1HG1      ILE  42  -3.350  19.924  -8.796
  711   2HG1  ILE  42          2HG1      ILE  42  -3.080  18.619  -7.629
  712   1HG2  ILE  42          1HG2      ILE  42  -1.721  22.554  -7.566
  713   2HG2  ILE  42          2HG2      ILE  42  -3.457  22.173  -7.655
  714   3HG2  ILE  42          3HG2      ILE  42  -2.667  22.363  -6.071
  715   1HD1  ILE  42          1HD1      ILE  42  -5.389  19.212  -7.413
  716   2HD1  ILE  42          2HD1      ILE  42  -4.583  19.977  -6.023
  717   3HD1  ILE  42          3HD1      ILE  42  -5.023  20.954  -7.444
  718    HA   PRO  43           HA       PRO  43   2.747  20.298  -5.802
  719   1HB   PRO  43          1HB       PRO  43   3.729  22.844  -5.723
  720   2HB   PRO  43          2HB       PRO  43   4.098  21.710  -7.018
  721   1HG   PRO  43          1HG       PRO  43   2.244  24.004  -6.979
  722   2HG   PRO  43          2HG       PRO  43   2.969  23.170  -8.402
  723   1HD   PRO  43          1HD       PRO  43   0.295  22.975  -7.394
  724   2HD   PRO  43          2HD       PRO  43   1.004  22.014  -8.697
  725    H    GLY  44           H        GLY  44   0.068  22.216  -5.122
  726   1HA   GLY  44          1HA       GLY  44   0.957  22.840  -2.419
  727   2HA   GLY  44          2HA       GLY  44  -0.541  23.316  -3.191
  728    H    VAL  45           H        VAL  45  -0.462  20.189  -4.095
  729    HA   VAL  45           HA       VAL  45  -1.884  19.340  -1.674
  730    HB   VAL  45           HB       VAL  45  -2.679  19.441  -4.319
  731   1HG1  VAL  45          1HG1      VAL  45  -3.040  17.019  -4.902
  732   2HG1  VAL  45          2HG1      VAL  45  -1.349  17.568  -5.004
  733   3HG1  VAL  45          3HG1      VAL  45  -1.888  16.600  -3.610
  734   1HG2  VAL  45          1HG2      VAL  45  -3.698  18.560  -1.760
  735   2HG2  VAL  45          2HG2      VAL  45  -4.567  19.269  -3.142
  736   3HG2  VAL  45          3HG2      VAL  45  -4.304  17.511  -3.063
  737    HA   PRO  46           HA       PRO  46   0.905  16.082  -1.121
  738   1HB   PRO  46          1HB       PRO  46  -0.637  13.919  -0.485
  739   2HB   PRO  46          2HB       PRO  46  -0.258  15.202   0.661
  740   1HG   PRO  46          1HG       PRO  46  -2.744  14.671  -0.836
  741   2HG   PRO  46          2HG       PRO  46  -2.519  15.657   0.654
  742   1HD   PRO  46          1HD       PRO  46  -2.923  16.560  -2.033
  743   2HD   PRO  46          2HD       PRO  46  -2.548  17.565  -0.627
  744    H    TRP  47           H        TRP  47   2.249  15.411  -2.663
  745    HA   TRP  47           HA       TRP  47   1.029  14.129  -4.954
  746   1HB   TRP  47          1HB       TRP  47   3.924  14.219  -4.924
  747   2HB   TRP  47          2HB       TRP  47   2.775  14.886  -6.086
  748    HD1  TRP  47           HD1      TRP  47   1.722  17.420  -5.295
  749    HE1  TRP  47           HE1      TRP  47   2.883  19.478  -4.119
  750    HE3  TRP  47           HE3      TRP  47   5.636  14.792  -3.391
  751    HZ2  TRP  47           HZ2      TRP  47   5.256  19.768  -2.559
  752    HZ3  TRP  47           HZ3      TRP  47   7.331  16.038  -2.053
  753    HH2  TRP  47           HH2      TRP  47   7.187  18.440  -1.626
  754    H    CYS  48           H        CYS  48   0.928  12.860  -2.243
  755    HA   CYS  48           HA       CYS  48   1.673  10.277  -3.034
  756   1HB   CYS  48          1HB       CYS  48   3.925  11.219  -2.472
  757   2HB   CYS  48          2HB       CYS  48   3.381  11.384  -0.800
  758    H    PHE  49           H        PHE  49  -0.397   9.644  -2.375
  759    HA   PHE  49           HA       PHE  49  -0.913   9.909   0.493
  760   1HB   PHE  49          1HB       PHE  49  -3.419   9.977  -0.644
  761   2HB   PHE  49          2HB       PHE  49  -2.517  11.446  -0.256
  762    HD1  PHE  49           HD1      PHE  49  -0.733  12.029  -2.247
  763    HD2  PHE  49           HD2      PHE  49  -4.405   9.951  -2.703
  764    HE1  PHE  49           HE1      PHE  49  -0.811  12.697  -4.665
  765    HE2  PHE  49           HE2      PHE  49  -4.483  10.619  -5.121
  766    HZ   PHE  49           HZ       PHE  49  -2.685  11.985  -6.073
  767    H    LYS  50           H        LYS  50  -3.380   8.549   0.547
  768    HA   LYS  50           HA       LYS  50  -2.681   5.952  -0.631
  769   1HB   LYS  50          1HB       LYS  50  -3.615   4.926   1.453
  770   2HB   LYS  50          2HB       LYS  50  -2.075   5.778   1.664
  771   1HG   LYS  50          1HG       LYS  50  -4.236   7.647   2.040
  772   2HG   LYS  50          2HG       LYS  50  -4.562   6.215   3.032
  773   1HD   LYS  50          1HD       LYS  50  -2.094   7.992   3.051
  774   2HD   LYS  50          2HD       LYS  50  -3.247   7.742   4.374
  775   1HE   LYS  50          1HE       LYS  50  -2.296   5.164   3.651
  776   2HE   LYS  50          2HE       LYS  50  -0.866   6.208   3.682
  777   1HZ   LYS  50          1HZ       LYS  50  -2.788   6.373   5.855
  778   2HZ   LYS  50          2HZ       LYS  50  -1.752   5.111   5.824
  779   3HZ   LYS  50          3HZ       LYS  50  -1.177   6.639   5.877
  780    HA   PRO  51           HA       PRO  51  -6.878   7.277  -1.766
  781   1HB   PRO  51          1HB       PRO  51  -6.568   7.258  -4.479
  782   2HB   PRO  51          2HB       PRO  51  -6.417   8.716  -3.502
  783   1HG   PRO  51          1HG       PRO  51  -4.331   7.036  -4.738
  784   2HG   PRO  51          2HG       PRO  51  -4.210   8.742  -4.173
  785   1HD   PRO  51          1HD       PRO  51  -3.194   6.375  -2.920
  786   2HD   PRO  51          2HD       PRO  51  -3.190   8.011  -2.246
  787    H    LEU  52           H        LEU  52  -6.140   5.611  -4.649
  788    HA   LEU  52           HA       LEU  52  -7.699   3.371  -3.613
  789   1HB   LEU  52          1HB       LEU  52  -8.427   2.997  -5.714
  790   2HB   LEU  52          2HB       LEU  52  -8.185   4.752  -5.773
  791    HG   LEU  52           HG       LEU  52  -5.751   3.589  -6.599
  792   1HD1  LEU  52          1HD1      LEU  52  -6.327   1.546  -7.322
  793   2HD1  LEU  52          2HD1      LEU  52  -8.066   1.927  -7.340
  794   3HD1  LEU  52          3HD1      LEU  52  -7.033   2.418  -8.704
  795   1HD2  LEU  52          1HD2      LEU  52  -5.972   5.303  -7.984
  796   2HD2  LEU  52          2HD2      LEU  52  -7.261   4.444  -8.859
  797   3HD2  LEU  52          3HD2      LEU  52  -7.669   5.500  -7.485
  798    H    GLN  53           H        GLN  53  -5.094   3.601  -2.559
  799    HA   GLN  53           HA       GLN  53  -3.048   2.494  -3.850
  800   1HB   GLN  53          1HB       GLN  53  -3.565   1.376  -1.128
  801   2HB   GLN  53          2HB       GLN  53  -2.109   2.160  -1.766
  802   1HG   GLN  53          1HG       GLN  53  -2.864   3.817  -0.341
  803   2HG   GLN  53          2HG       GLN  53  -3.719   4.302  -1.814
  804   1HE2  GLN  53          1HE2      GLN  53  -5.508   2.002  -1.735
  805   2HE2  GLN  53          2HE2      GLN  53  -6.682   2.299  -0.497
  806    H    GLU  54           H        GLU  54  -6.097   0.954  -3.107
  807    HA   GLU  54           HA       GLU  54  -5.626  -1.610  -2.782
  808   1HB   GLU  54          1HB       GLU  54  -7.561  -0.321  -4.736
  809   2HB   GLU  54          2HB       GLU  54  -7.629  -2.041  -4.315
  810   1HG   GLU  54          1HG       GLU  54  -8.368  -1.617  -2.163
  811   2HG   GLU  54          2HG       GLU  54  -7.531  -0.060  -2.055
  812    H    ALA  55           H        ALA  55  -4.777   0.272  -5.658
  813    HA   ALA  55           HA       ALA  55  -4.566  -1.333  -7.707
  814   1HB   ALA  55          1HB       ALA  55  -3.445   0.597  -8.151
  815   2HB   ALA  55          2HB       ALA  55  -2.764   0.698  -6.509
  816   3HB   ALA  55          3HB       ALA  55  -2.009  -0.363  -7.723
  817    H    GLU  56           H        GLU  56  -2.037  -1.415  -5.087
  818    HA   GLU  56           HA       GLU  56  -1.974  -4.272  -5.369
  819   1HB   GLU  56          1HB       GLU  56   0.436  -4.391  -5.769
  820   2HB   GLU  56          2HB       GLU  56  -0.341  -3.484  -7.077
  821   1HG   GLU  56          1HG       GLU  56   0.300  -1.564  -5.104
  822   2HG   GLU  56          2HG       GLU  56   1.713  -2.626  -5.182
  823    H    CYS  57           H        CYS  57  -2.675  -2.068  -3.373
  824    HA   CYS  57           HA       CYS  57  -0.653  -2.581  -1.344
  825   1HB   CYS  57          1HB       CYS  57  -1.984  -0.292  -2.042
  826   2HB   CYS  57          2HB       CYS  57  -2.908  -0.838  -0.640
  827    H    THR  58           H        THR  58  -4.259  -2.610  -1.854
  828    HA   THR  58           HA       THR  58  -4.737  -4.099   0.526
  829    HB   THR  58           HB       THR  58  -6.215  -2.463  -1.090
  830    HG1  THR  58           HG1      THR  58  -7.572  -3.019   0.579
  831   1HG2  THR  58          1HG2      THR  58  -6.380  -4.249  -2.890
  832   2HG2  THR  58          2HG2      THR  58  -7.142  -5.320  -1.689
  833   3HG2  THR  58          3HG2      THR  58  -7.956  -3.816  -2.186
  834    H    PHE  59           H        PHE  59  -4.261  -4.915  -2.929
  835    HA   PHE  59           HA       PHE  59  -5.165  -7.351  -3.225
  836   1HB   PHE  59          1HB       PHE  59  -2.915  -5.775  -4.092
  837   2HB   PHE  59          2HB       PHE  59  -2.284  -7.397  -3.789
  838    HD1  PHE  59           HD1      PHE  59  -5.394  -5.986  -5.323
  839    HD2  PHE  59           HD2      PHE  59  -2.112  -8.650  -5.703
  840    HE1  PHE  59           HE1      PHE  59  -6.252  -6.724  -7.563
  841    HE2  PHE  59           HE2      PHE  59  -2.971  -9.387  -7.943
  842    HZ   PHE  59           HZ       PHE  59  -5.030  -8.416  -8.847
  Start of MODEL   18
    1   1H    GLU   1           H1       GLU   1 -14.271 -12.124  -5.363
    2    HA   GLU   1           HA       GLU   1 -14.642  -9.917  -5.522
    3   1HB   GLU   1          1HB       GLU   1 -17.361 -10.846  -5.932
    4   2HB   GLU   1          2HB       GLU   1 -17.357  -9.437  -4.857
    5   1HG   GLU   1          1HG       GLU   1 -16.756  -8.036  -6.540
    6   2HG   GLU   1          2HG       GLU   1 -15.527  -9.149  -7.159
    7    H    GLU   2           H        GLU   2 -15.310 -12.208  -3.135
    8    HA   GLU   2           HA       GLU   2 -15.791 -10.261  -1.069
    9   1HB   GLU   2          1HB       GLU   2 -15.956 -13.219  -1.339
   10   2HB   GLU   2          2HB       GLU   2 -15.505 -12.625   0.269
   11   1HG   GLU   2          1HG       GLU   2 -17.557 -10.942  -0.252
   12   2HG   GLU   2          2HG       GLU   2 -18.074 -12.308  -1.253
   13    H    TYR   3           H        TYR   3 -13.744  -9.093  -1.262
   14    HA   TYR   3           HA       TYR   3 -11.252  -9.838  -1.384
   15   1HB   TYR   3          1HB       TYR   3 -12.517  -8.211   0.904
   16   2HB   TYR   3          2HB       TYR   3 -10.831  -8.059   0.399
   17    HD1  TYR   3           HD1      TYR   3 -14.338  -7.330  -0.486
   18    HD2  TYR   3           HD2      TYR   3 -10.240  -6.832  -1.613
   19    HE1  TYR   3           HE1      TYR   3 -15.007  -5.533  -2.154
   20    HE2  TYR   3           HE2      TYR   3 -10.924  -5.036  -3.278
   21    HH   TYR   3           HH       TYR   3 -12.784  -3.445  -3.543
   22    H    VAL   4           H        VAL   4 -10.861 -12.045  -0.819
   23    HA   VAL   4           HA       VAL   4 -10.855 -12.536   2.077
   24    HB   VAL   4           HB       VAL   4 -10.620 -14.978   1.128
   25   1HG1  VAL   4          1HG1      VAL   4 -13.320 -14.754   0.812
   26   2HG1  VAL   4          2HG1      VAL   4 -12.491 -14.830   2.385
   27   3HG1  VAL   4          3HG1      VAL   4 -12.955 -13.254   1.700
   28   1HG2  VAL   4          1HG2      VAL   4 -11.370 -15.413  -0.997
   29   2HG2  VAL   4          2HG2      VAL   4 -12.363 -13.937  -1.072
   30   3HG2  VAL   4          3HG2      VAL   4 -10.597 -13.833  -1.270
   31    H    GLY   5           H        GLY   5  -9.035 -13.112  -1.009
   32   1HA   GLY   5          1HA       GLY   5  -6.654 -13.917   0.360
   33   2HA   GLY   5          2HA       GLY   5  -6.847 -13.579  -1.349
   34    H    LEU   6           H        LEU   6  -8.111 -11.017   0.576
   35    HA   LEU   6           HA       LEU   6  -5.544  -9.622   0.604
   36   1HB   LEU   6          1HB       LEU   6  -7.391  -7.706  -0.172
   37   2HB   LEU   6          2HB       LEU   6  -6.074  -8.392  -1.140
   38    HG   LEU   6           HG       LEU   6  -8.908  -9.461  -1.034
   39   1HD1  LEU   6          1HD1      LEU   6  -7.829  -8.155  -3.482
   40   2HD1  LEU   6          2HD1      LEU   6  -9.491  -8.224  -2.847
   41   3HD1  LEU   6          3HD1      LEU   6  -8.309  -7.103  -2.129
   42   1HD2  LEU   6          1HD2      LEU   6  -7.703 -10.350  -3.363
   43   2HD2  LEU   6          2HD2      LEU   6  -6.416 -10.498  -2.142
   44   3HD2  LEU   6          3HD2      LEU   6  -7.984 -11.301  -1.885
   45    H    SER   7           H        SER   7  -7.869 -10.908   2.398
   46    HA   SER   7           HA       SER   7  -8.759  -8.664   3.863
   47   1HB   SER   7          1HB       SER   7  -9.552 -11.284   3.619
   48   2HB   SER   7          2HB       SER   7  -8.787 -11.309   5.217
   49    HG   SER   7           HG       SER   7 -10.190  -9.218   5.484
   50    H    ALA   8           H        ALA   8  -8.424  -9.389   6.565
   51    HA   ALA   8           HA       ALA   8  -5.797  -8.462   7.034
   52   1HB   ALA   8          1HB       ALA   8  -6.451  -8.807   9.424
   53   2HB   ALA   8          2HB       ALA   8  -7.662  -7.889   8.496
   54   3HB   ALA   8          3HB       ALA   8  -7.941  -9.607   8.869
   55    H    ASN   9           H        ASN   9  -7.274 -11.630   6.635
   56    HA   ASN   9           HA       ASN   9  -5.106 -12.938   7.973
   57   1HB   ASN   9          1HB       ASN   9  -7.778 -13.600   7.218
   58   2HB   ASN   9          2HB       ASN   9  -6.733 -14.709   6.316
   59   1HD2  ASN   9          1HD2      ASN   9  -4.989 -15.762   7.587
   60   2HD2  ASN   9          2HD2      ASN   9  -5.346 -16.304   9.192
   61    H    GLN  10           H        GLN  10  -5.611 -11.439   4.987
   62    HA   GLN  10           HA       GLN  10  -4.620 -13.319   3.198
   63   1HB   GLN  10          1HB       GLN  10  -4.918 -11.675   1.666
   64   2HB   GLN  10          2HB       GLN  10  -5.712 -10.813   2.997
   65   1HG   GLN  10          1HG       GLN  10  -4.197  -9.191   2.405
   66   2HG   GLN  10          2HG       GLN  10  -3.147 -10.101   3.501
   67   1HE2  GLN  10          1HE2      GLN  10  -3.764  -9.052   0.310
   68   2HE2  GLN  10          2HE2      GLN  10  -2.426  -9.798  -0.496
   69    H    CYS  11           H        CYS  11  -3.045 -10.904   5.333
   70    HA   CYS  11           HA       CYS  11  -0.495 -11.140   4.193
   71   1HB   CYS  11          1HB       CYS  11  -0.938  -9.231   5.474
   72   2HB   CYS  11          2HB       CYS  11  -1.497 -10.169   6.861
   73    H    ALA  12           H        ALA  12  -2.453 -13.402   5.753
   74    HA   ALA  12           HA       ALA  12  -0.191 -14.762   7.021
   75   1HB   ALA  12          1HB       ALA  12  -2.707 -16.097   7.405
   76   2HB   ALA  12          2HB       ALA  12  -1.696 -15.263   8.609
   77   3HB   ALA  12          3HB       ALA  12  -2.937 -14.358   7.708
   78    H    VAL  13           H        VAL  13  -0.820 -14.461   4.022
   79    HA   VAL  13           HA       VAL  13  -1.896 -16.626   2.857
   80    HB   VAL  13           HB       VAL  13   0.301 -16.293   1.315
   81   1HG1  VAL  13          1HG1      VAL  13  -1.752 -15.896   0.319
   82   2HG1  VAL  13          2HG1      VAL  13  -2.262 -14.742   1.576
   83   3HG1  VAL  13          3HG1      VAL  13  -1.054 -14.259   0.361
   84   1HG2  VAL  13          1HG2      VAL  13   1.185 -14.742   3.191
   85   2HG2  VAL  13          2HG2      VAL  13   1.281 -14.177   1.505
   86   3HG2  VAL  13          3HG2      VAL  13  -0.004 -13.570   2.576
   87    HA   PRO  14           HA       PRO  14   0.484 -20.113   3.782
   88   1HB   PRO  14          1HB       PRO  14   0.609 -21.503   1.434
   89   2HB   PRO  14          2HB       PRO  14  -0.811 -21.500   2.478
   90   1HG   PRO  14          1HG       PRO  14  -0.318 -20.074  -0.057
   91   2HG   PRO  14          2HG       PRO  14  -1.892 -20.449   0.733
   92   1HD   PRO  14          1HD       PRO  14  -0.511 -17.944   0.616
   93   2HD   PRO  14          2HD       PRO  14  -1.977 -18.299   1.541
   94    H    ALA  15           H        ALA  15   1.790 -17.690   2.108
   95    HA   ALA  15           HA       ALA  15   3.959 -17.103   2.038
   96   1HB   ALA  15          1HB       ALA  15   4.227 -19.064   3.786
   97   2HB   ALA  15          2HB       ALA  15   4.915 -19.939   2.397
   98   3HB   ALA  15          3HB       ALA  15   5.655 -18.416   2.945
   99    H    LYS  16           H        LYS  16   2.475 -17.339  -0.193
  100    HA   LYS  16           HA       LYS  16   4.293 -17.653  -2.206
  101   1HB   LYS  16          1HB       LYS  16   3.107 -19.847  -3.172
  102   2HB   LYS  16          2HB       LYS  16   4.594 -19.898  -2.208
  103   1HG   LYS  16          1HG       LYS  16   3.514 -20.745  -0.352
  104   2HG   LYS  16          2HG       LYS  16   1.986 -19.924  -0.718
  105   1HD   LYS  16          1HD       LYS  16   1.643 -22.287  -1.039
  106   2HD   LYS  16          2HD       LYS  16   1.691 -21.553  -2.652
  107   1HE   LYS  16          1HE       LYS  16   4.033 -22.252  -2.923
  108   2HE   LYS  16          2HE       LYS  16   4.064 -22.901  -1.276
  109   1HZ   LYS  16          1HZ       LYS  16   2.033 -23.851  -3.120
  110   2HZ   LYS  16          2HZ       LYS  16   3.559 -24.404  -3.301
  111   3HZ   LYS  16          3HZ       LYS  16   2.767 -24.639  -1.892
  112    H    ASP  17           H        ASP  17   2.403 -15.777  -1.502
  113    HA   ASP  17           HA       ASP  17   0.797 -15.833  -3.867
  114   1HB   ASP  17          1HB       ASP  17  -0.590 -16.944  -2.057
  115   2HB   ASP  17          2HB       ASP  17  -0.517 -15.432  -1.141
  116    H    ARG  18           H        ARG  18   2.992 -14.373  -2.027
  117    HA   ARG  18           HA       ARG  18   1.722 -11.804  -1.797
  118   1HB   ARG  18          1HB       ARG  18   4.610 -12.561  -1.178
  119   2HB   ARG  18          2HB       ARG  18   3.743 -11.130  -0.592
  120   1HG   ARG  18          1HG       ARG  18   2.703 -12.298   1.063
  121   2HG   ARG  18          2HG       ARG  18   2.425 -13.718   0.039
  122   1HD   ARG  18          1HD       ARG  18   4.799 -14.381   0.332
  123   2HD   ARG  18          2HD       ARG  18   5.087 -12.953   1.338
  124    HE   ARG  18           HE       ARG  18   2.931 -14.808   2.190
  125   1HH1  ARG  18          1HH1      ARG  18   6.226 -13.657   2.632
  126   2HH1  ARG  18          2HH1      ARG  18   6.387 -14.335   4.218
  127   1HH2  ARG  18          1HH2      ARG  18   3.142 -15.702   4.283
  128   2HH2  ARG  18          2HH2      ARG  18   4.620 -15.506   5.163
  129    H    VAL  19           H        VAL  19   3.664  -9.954  -2.363
  130    HA   VAL  19           HA       VAL  19   4.391 -10.546  -5.149
  131    HB   VAL  19           HB       VAL  19   3.692  -7.834  -4.031
  132   1HG1  VAL  19          1HG1      VAL  19   4.041  -8.964  -6.818
  133   2HG1  VAL  19          2HG1      VAL  19   3.232  -7.411  -6.502
  134   3HG1  VAL  19          3HG1      VAL  19   4.937  -7.638  -6.041
  135   1HG2  VAL  19          1HG2      VAL  19   1.478  -8.178  -5.242
  136   2HG2  VAL  19          2HG2      VAL  19   1.872  -9.914  -5.272
  137   3HG2  VAL  19          3HG2      VAL  19   1.690  -9.070  -3.715
  138    H    ASP  20           H        ASP  20   5.844 -10.908  -2.481
  139    HA   ASP  20           HA       ASP  20   7.698 -10.263  -1.464
  140   1HB   ASP  20          1HB       ASP  20   8.826 -11.693  -2.876
  141   2HB   ASP  20          2HB       ASP  20   8.293 -10.851  -4.339
  142    H    CYS  21           H        CYS  21   7.329  -8.068  -0.735
  143    HA   CYS  21           HA       CYS  21   7.296  -5.832  -2.306
  144   1HB   CYS  21          1HB       CYS  21   6.995  -6.334   0.326
  145   2HB   CYS  21          2HB       CYS  21   8.569  -5.534   0.350
  146    H    GLY  22           H        GLY  22  10.015  -7.767  -1.017
  147   1HA   GLY  22          1HA       GLY  22  12.225  -7.721  -1.418
  148   2HA   GLY  22          2HA       GLY  22  11.847  -6.931  -2.936
  149    H    TYR  23           H        TYR  23  11.591  -5.968   0.568
  150    HA   TYR  23           HA       TYR  23  12.626  -3.351  -0.142
  151   1HB   TYR  23          1HB       TYR  23  10.734  -4.440   1.626
  152   2HB   TYR  23          2HB       TYR  23  12.113  -4.176   2.698
  153    HD1  TYR  23           HD1      TYR  23  11.043  -2.099  -0.217
  154    HD2  TYR  23           HD2      TYR  23  11.377  -2.385   4.039
  155    HE1  TYR  23           HE1      TYR  23  10.387   0.346   0.005
  156    HE2  TYR  23           HE2      TYR  23  10.719   0.062   4.247
  157    HH   TYR  23           HH       TYR  23  10.851   2.088   2.807
  158    HA   PRO  24           HA       PRO  24  16.621  -4.316   1.251
  159   1HB   PRO  24          1HB       PRO  24  17.665  -1.793   1.330
  160   2HB   PRO  24          2HB       PRO  24  17.558  -2.747  -0.148
  161   1HG   PRO  24          1HG       PRO  24  15.899  -0.490   0.779
  162   2HG   PRO  24          2HG       PRO  24  16.096  -1.126  -0.894
  163   1HD   PRO  24          1HD       PRO  24  13.884  -1.471   0.893
  164   2HD   PRO  24          2HD       PRO  24  14.100  -2.248  -0.681
  165    H    HIS  25           H        HIS  25  14.293  -2.814   3.039
  166    HA   HIS  25           HA       HIS  25  16.020  -3.054   5.388
  167   1HB   HIS  25          1HB       HIS  25  14.038  -0.856   4.776
  168   2HB   HIS  25          2HB       HIS  25  14.752  -1.124   6.370
  169    HD1  HIS  25           HD1      HIS  25  17.701  -1.680   5.449
  170    HD2  HIS  25           HD2      HIS  25  15.307   1.477   4.072
  171    HE1  HIS  25           HE1      HIS  25  19.304   0.120   4.611
  172    HE2  HIS  25           HE2      HIS  25  17.774   2.011   3.728
  173    H    VAL  26           H        VAL  26  14.325  -5.072   4.183
  174    HA   VAL  26           HA       VAL  26  11.772  -5.176   5.230
  175    HB   VAL  26           HB       VAL  26  12.301  -6.712   3.583
  176   1HG1  VAL  26          1HG1      VAL  26  14.460  -7.182   3.234
  177   2HG1  VAL  26          2HG1      VAL  26  14.883  -6.828   4.926
  178   3HG1  VAL  26          3HG1      VAL  26  14.300  -8.449   4.474
  179   1HG2  VAL  26          1HG2      VAL  26  11.660  -8.783   4.449
  180   2HG2  VAL  26          2HG2      VAL  26  12.576  -8.550   5.957
  181   3HG2  VAL  26          3HG2      VAL  26  11.075  -7.636   5.678
  182    H    THR  27           H        THR  27  10.999  -5.258   7.273
  183    HA   THR  27           HA       THR  27  12.220  -6.857   9.268
  184    HB   THR  27           HB       THR  27  13.165  -4.104   8.940
  185    HG1  THR  27           HG1      THR  27  13.538  -6.422  10.694
  186   1HG2  THR  27          1HG2      THR  27  11.207  -4.035  10.820
  187   2HG2  THR  27          2HG2      THR  27  12.498  -4.761  11.806
  188   3HG2  THR  27          3HG2      THR  27  12.748  -3.172  11.042
  189    HA   PRO  28           HA       PRO  28   8.210  -6.510  10.753
  190   1HB   PRO  28          1HB       PRO  28   8.507  -7.422  13.310
  191   2HB   PRO  28          2HB       PRO  28   8.394  -8.490  11.914
  192   1HG   PRO  28          1HG       PRO  28  10.746  -7.689  13.502
  193   2HG   PRO  28          2HG       PRO  28  10.557  -9.114  12.419
  194   1HD   PRO  28          1HD       PRO  28  11.992  -6.684  11.931
  195   2HD   PRO  28          2HD       PRO  28  11.701  -7.989  10.772
  196    H    LYS  29           H        LYS  29   9.074  -4.048  10.475
  197    HA   LYS  29           HA       LYS  29   7.621  -2.664  12.370
  198   1HB   LYS  29          1HB       LYS  29   9.295  -3.319  13.990
  199   2HB   LYS  29          2HB       LYS  29  10.593  -2.665  12.975
  200   1HG   LYS  29          1HG       LYS  29  10.177  -0.533  13.636
  201   2HG   LYS  29          2HG       LYS  29   8.420  -0.728  13.511
  202   1HD   LYS  29          1HD       LYS  29   8.697  -0.429  15.806
  203   2HD   LYS  29          2HD       LYS  29   8.726  -2.198  15.696
  204   1HE   LYS  29          1HE       LYS  29  11.308  -1.911  15.443
  205   2HE   LYS  29          2HE       LYS  29  11.049  -0.274  16.064
  206   1HZ   LYS  29          1HZ       LYS  29  10.036  -1.235  17.997
  207   2HZ   LYS  29          2HZ       LYS  29  10.201  -2.749  17.405
  208   3HZ   LYS  29          3HZ       LYS  29  11.525  -1.877  17.797
  209    H    GLU  30           H        GLU  30  10.104  -2.927   9.890
  210    HA   GLU  30           HA       GLU  30   9.807  -0.120   9.267
  211   1HB   GLU  30          1HB       GLU  30  11.842  -2.163   8.856
  212   2HB   GLU  30          2HB       GLU  30  11.473  -1.333   7.334
  213   1HG   GLU  30          1HG       GLU  30  11.988   0.813   8.285
  214   2HG   GLU  30          2HG       GLU  30  12.028   0.162   9.931
  215    H    CYS  31           H        CYS  31   9.273  -3.402   7.851
  216    HA   CYS  31           HA       CYS  31   8.304  -2.493   5.400
  217   1HB   CYS  31          1HB       CYS  31   8.224  -5.043   6.924
  218   2HB   CYS  31          2HB       CYS  31   7.082  -4.855   5.590
  219    H    ASN  32           H        ASN  32   6.579  -3.715   8.371
  220    HA   ASN  32           HA       ASN  32   4.053  -3.140   7.461
  221   1HB   ASN  32          1HB       ASN  32   5.363  -3.681  10.083
  222   2HB   ASN  32          2HB       ASN  32   3.822  -2.817  10.203
  223   1HD2  ASN  32          1HD2      ASN  32   5.290  -5.475   8.331
  224   2HD2  ASN  32          2HD2      ASN  32   3.968  -6.586   8.455
  225    H    ASN  33           H        ASN  33   6.626  -1.026   8.126
  226    HA   ASN  33           HA       ASN  33   4.850   1.095   9.012
  227   1HB   ASN  33          1HB       ASN  33   6.808   0.911  10.412
  228   2HB   ASN  33          2HB       ASN  33   7.888   0.778   9.016
  229   1HD2  ASN  33          1HD2      ASN  33   8.995   2.515   8.590
  230   2HD2  ASN  33          2HD2      ASN  33   8.535   4.160   8.877
  231    H    ARG  34           H        ARG  34   6.875  -0.149   6.387
  232    HA   ARG  34           HA       ARG  34   6.893   2.368   5.023
  233   1HB   ARG  34          1HB       ARG  34   8.479   1.419   3.621
  234   2HB   ARG  34          2HB       ARG  34   8.694   0.367   5.031
  235   1HG   ARG  34          1HG       ARG  34   8.432  -1.265   3.438
  236   2HG   ARG  34          2HG       ARG  34   6.714  -0.996   3.778
  237   1HD   ARG  34          1HD       ARG  34   7.446   0.962   1.859
  238   2HD   ARG  34          2HD       ARG  34   8.207  -0.540   1.311
  239    HE   ARG  34           HE       ARG  34   5.373  -0.738   2.134
  240   1HH1  ARG  34          1HH1      ARG  34   7.663  -0.383  -0.515
  241   2HH1  ARG  34          2HH1      ARG  34   6.539  -0.902  -1.726
  242   1HH2  ARG  34          1HH2      ARG  34   3.890  -1.424   0.537
  243   2HH2  ARG  34          2HH2      ARG  34   4.379  -1.498  -1.123
  244    H    GLY  35           H        GLY  35   5.033  -0.623   5.168
  245   1HA   GLY  35          1HA       GLY  35   2.748  -0.311   4.257
  246   2HA   GLY  35          2HA       GLY  35   3.513   0.203   2.767
  247    H    CYS  36           H        CYS  36   5.162  -2.295   4.611
  248    HA   CYS  36           HA       CYS  36   4.110  -4.279   2.726
  249   1HB   CYS  36          1HB       CYS  36   6.919  -4.023   3.804
  250   2HB   CYS  36          2HB       CYS  36   6.326  -5.381   2.843
  251    H    CYS  37           H        CYS  37   4.468  -6.609   3.680
  252    HA   CYS  37           HA       CYS  37   3.890  -6.466   6.549
  253   1HB   CYS  37          1HB       CYS  37   2.079  -7.218   4.871
  254   2HB   CYS  37          2HB       CYS  37   3.001  -8.720   4.770
  255    H    PHE  38           H        PHE  38   5.368  -7.504   7.862
  256    HA   PHE  38           HA       PHE  38   7.473  -8.994   6.533
  257   1HB   PHE  38          1HB       PHE  38   7.817  -7.129   8.256
  258   2HB   PHE  38          2HB       PHE  38   7.018  -8.148   9.457
  259    HD1  PHE  38           HD1      PHE  38  10.032  -7.720   7.397
  260    HD2  PHE  38           HD2      PHE  38   8.182  -9.988  10.470
  261    HE1  PHE  38           HE1      PHE  38  12.244  -8.766   7.957
  262    HE2  PHE  38           HE2      PHE  38  10.394 -11.034  11.030
  263    HZ   PHE  38           HZ       PHE  38  12.398 -10.411   9.767
  264    H    ASP  39           H        ASP  39   7.451 -11.186   6.421
  265    HA   ASP  39           HA       ASP  39   5.510 -12.570   8.007
  266   1HB   ASP  39          1HB       ASP  39   5.713 -13.241   5.702
  267   2HB   ASP  39          2HB       ASP  39   7.469 -13.409   5.831
  268    H    SER  40           H        SER  40   8.847 -13.635   7.071
  269    HA   SER  40           HA       SER  40  10.638 -14.006   8.327
  270   1HB   SER  40          1HB       SER  40   9.351 -12.454  10.110
  271   2HB   SER  40          2HB       SER  40   9.225 -13.997  10.974
  272    HG   SER  40           HG       SER  40  11.148 -12.908  11.598
  273    H    ARG  41           H        ARG  41   7.522 -15.507   8.535
  274    HA   ARG  41           HA       ARG  41   8.013 -17.684  10.089
  275   1HB   ARG  41          1HB       ARG  41   6.313 -17.297   7.599
  276   2HB   ARG  41          2HB       ARG  41   6.292 -18.827   8.495
  277   1HG   ARG  41          1HG       ARG  41   6.007 -16.849  10.468
  278   2HG   ARG  41          2HG       ARG  41   5.007 -16.263   9.127
  279   1HD   ARG  41          1HD       ARG  41   3.592 -17.644  10.486
  280   2HD   ARG  41          2HD       ARG  41   3.968 -18.610   9.051
  281    HE   ARG  41           HE       ARG  41   5.834 -19.017  11.272
  282   1HH1  ARG  41          1HH1      ARG  41   2.779 -20.034   9.853
  283   2HH1  ARG  41          2HH1      ARG  41   2.793 -21.588  10.619
  284   1HH2  ARG  41          1HH2      ARG  41   5.854 -21.066  12.283
  285   2HH2  ARG  41          2HH2      ARG  41   4.554 -22.179  12.010
  286    H    ILE  42           H        ILE  42   8.274 -17.476   6.456
  287    HA   ILE  42           HA       ILE  42  10.164 -19.719   6.601
  288    HB   ILE  42           HB       ILE  42   8.928 -19.063   4.013
  289   1HG1  ILE  42          1HG1      ILE  42   7.268 -20.071   6.328
  290   2HG1  ILE  42          2HG1      ILE  42   6.981 -18.624   5.346
  291   1HG2  ILE  42          1HG2      ILE  42   8.798 -21.483   3.837
  292   2HG2  ILE  42          2HG2      ILE  42  10.423 -20.982   4.365
  293   3HG2  ILE  42          3HG2      ILE  42   9.272 -21.655   5.545
  294   1HD1  ILE  42          1HD1      ILE  42   5.485 -20.378   4.576
  295   2HD1  ILE  42          2HD1      ILE  42   6.736 -20.149   3.331
  296   3HD1  ILE  42          3HD1      ILE  42   6.832 -21.535   4.444
  297    HA   PRO  43           HA       PRO  43  13.084 -16.792   5.278
  298   1HB   PRO  43          1HB       PRO  43  15.219 -18.475   5.027
  299   2HB   PRO  43          2HB       PRO  43  14.735 -17.757   6.560
  300   1HG   PRO  43          1HG       PRO  43  14.342 -20.497   5.541
  301   2HG   PRO  43          2HG       PRO  43  14.287 -19.914   7.243
  302   1HD   PRO  43          1HD       PRO  43  12.102 -20.625   5.533
  303   2HD   PRO  43          2HD       PRO  43  11.990 -19.904   7.145
  304    H    GLY  44           H        GLY  44  11.926 -19.395   3.482
  305   1HA   GLY  44          1HA       GLY  44  13.443 -18.665   1.102
  306   2HA   GLY  44          2HA       GLY  44  12.316 -19.993   1.288
  307    H    VAL  45           H        VAL  45  10.646 -17.572   2.744
  308    HA   VAL  45           HA       VAL  45   9.366 -16.814   0.215
  309    HB   VAL  45           HB       VAL  45   8.352 -18.014   2.496
  310   1HG1  VAL  45          1HG1      VAL  45   6.701 -16.292   3.330
  311   2HG1  VAL  45          2HG1      VAL  45   8.391 -16.027   3.824
  312   3HG1  VAL  45          3HG1      VAL  45   7.686 -15.057   2.508
  313   1HG2  VAL  45          1HG2      VAL  45   6.840 -18.418   0.907
  314   2HG2  VAL  45          2HG2      VAL  45   6.180 -16.787   1.175
  315   3HG2  VAL  45          3HG2      VAL  45   7.430 -17.049  -0.065
  316    HA   PRO  46           HA       PRO  46  10.168 -12.643   1.021
  317   1HB   PRO  46          1HB       PRO  46   7.870 -11.336   0.337
  318   2HB   PRO  46          2HB       PRO  46   9.034 -11.923  -0.850
  319   1HG   PRO  46          1HG       PRO  46   6.415 -13.028  -0.054
  320   2HG   PRO  46          2HG       PRO  46   7.354 -13.335  -1.561
  321   1HD   PRO  46          1HD       PRO  46   7.028 -15.043   0.715
  322   2HD   PRO  46          2HD       PRO  46   8.090 -15.323  -0.671
  323    H    TRP  47           H        TRP  47  10.711 -11.934   2.981
  324    HA   TRP  47           HA       TRP  47   8.650 -12.049   5.005
  325   1HB   TRP  47          1HB       TRP  47  11.151 -10.788   5.765
  326   2HB   TRP  47          2HB       TRP  47  10.326 -12.190   6.451
  327    HD1  TRP  47           HD1      TRP  47  10.834 -14.603   4.998
  328    HE1  TRP  47           HE1      TRP  47  13.052 -15.502   3.885
  329    HE3  TRP  47           HE3      TRP  47  13.148 -10.084   4.715
  330    HZ2  TRP  47           HZ2      TRP  47  15.470 -14.251   3.031
  331    HZ3  TRP  47           HZ3      TRP  47  15.436 -10.010   3.728
  332    HH2  TRP  47           HH2      TRP  47  16.595 -11.998   2.902
  333    H    CYS  48           H        CYS  48   8.381 -10.249   2.613
  334    HA   CYS  48           HA       CYS  48   7.539  -7.960   4.001
  335   1HB   CYS  48          1HB       CYS  48   9.973  -7.513   4.001
  336   2HB   CYS  48          2HB       CYS  48   9.955  -7.521   2.234
  337    H    PHE  49           H        PHE  49   5.588  -8.035   2.894
  338    HA   PHE  49           HA       PHE  49   5.757  -7.692   0.004
  339   1HB   PHE  49          1HB       PHE  49   3.549  -9.286   0.253
  340   2HB   PHE  49          2HB       PHE  49   5.156  -9.967  -0.025
  341    HD1  PHE  49           HD1      PHE  49   6.528 -10.308   2.269
  342    HD2  PHE  49           HD2      PHE  49   2.300 -10.228   1.920
  343    HE1  PHE  49           HE1      PHE  49   6.327 -11.614   4.402
  344    HE2  PHE  49           HE2      PHE  49   2.099 -11.533   4.054
  345    HZ   PHE  49           HZ       PHE  49   4.115 -12.212   5.270
  346    H    LYS  50           H        LYS  50   3.039  -7.646  -0.591
  347    HA   LYS  50           HA       LYS  50   2.032  -5.563   1.219
  348   1HB   LYS  50          1HB       LYS  50   1.017  -4.547  -0.855
  349   2HB   LYS  50          2HB       LYS  50   2.776  -4.398  -0.698
  350   1HG   LYS  50          1HG       LYS  50   2.106  -6.875  -2.049
  351   2HG   LYS  50          2HG       LYS  50   1.299  -5.524  -2.863
  352   1HD   LYS  50          1HD       LYS  50   4.268  -5.833  -2.271
  353   2HD   LYS  50          2HD       LYS  50   3.498  -5.823  -3.867
  354   1HE   LYS  50          1HE       LYS  50   2.752  -3.423  -2.444
  355   2HE   LYS  50          2HE       LYS  50   4.512  -3.597  -2.366
  356   1HZ   LYS  50          1HZ       LYS  50   3.150  -2.614  -4.439
  357   2HZ   LYS  50          2HZ       LYS  50   4.665  -3.215  -4.532
  358   3HZ   LYS  50          3HZ       LYS  50   3.389  -4.154  -4.928
  359    HA   PRO  51           HA       PRO  51  -0.947  -8.961   0.857
  360   1HB   PRO  51          1HB       PRO  51  -1.195  -9.523   3.519
  361   2HB   PRO  51          2HB       PRO  51  -0.111 -10.405   2.444
  362   1HG   PRO  51          1HG       PRO  51   0.484  -8.327   4.451
  363   2HG   PRO  51          2HG       PRO  51   1.599  -9.540   3.726
  364   1HD   PRO  51          1HD       PRO  51   1.396  -6.741   3.157
  365   2HD   PRO  51          2HD       PRO  51   2.398  -7.921   2.302
  366    H    LEU  52           H        LEU  52  -1.774  -8.014   4.021
  367    HA   LEU  52           HA       LEU  52  -4.089  -6.655   2.893
  368   1HB   LEU  52          1HB       LEU  52  -5.219  -7.228   4.752
  369   2HB   LEU  52          2HB       LEU  52  -4.052  -8.559   4.688
  370    HG   LEU  52           HG       LEU  52  -2.834  -6.556   6.238
  371   1HD1  LEU  52          1HD1      LEU  52  -5.766  -6.474   6.503
  372   2HD1  LEU  52          2HD1      LEU  52  -4.882  -6.663   8.035
  373   3HD1  LEU  52          3HD1      LEU  52  -4.530  -5.282   6.969
  374   1HD2  LEU  52          1HD2      LEU  52  -3.608  -9.309   6.429
  375   2HD2  LEU  52          2HD2      LEU  52  -2.328  -8.432   7.302
  376   3HD2  LEU  52          3HD2      LEU  52  -3.979  -8.486   7.964
  377    H    GLN  53           H        GLN  53  -1.504  -5.367   2.659
  378    HA   GLN  53           HA       GLN  53  -0.927  -3.632   4.677
  379   1HB   GLN  53          1HB       GLN  53  -0.727  -3.217   1.669
  380   2HB   GLN  53          2HB       GLN  53   0.089  -2.202   2.872
  381   1HG   GLN  53          1HG       GLN  53   0.484  -5.189   2.413
  382   2HG   GLN  53          2HG       GLN  53   1.642  -3.908   2.024
  383   1HE2  GLN  53          1HE2      GLN  53   0.201  -5.889   4.464
  384   2HE2  GLN  53          2HE2      GLN  53   1.219  -5.452   5.795
  385    H    GLU  54           H        GLU  54  -3.746  -3.761   2.656
  386    HA   GLU  54           HA       GLU  54  -4.488  -1.232   2.267
  387   1HB   GLU  54          1HB       GLU  54  -6.576  -2.080   1.904
  388   2HB   GLU  54          2HB       GLU  54  -5.731  -3.630   2.057
  389   1HG   GLU  54          1HG       GLU  54  -7.513  -3.921   3.534
  390   2HG   GLU  54          2HG       GLU  54  -6.260  -3.331   4.636
  391    H    ALA  55           H        ALA  55  -4.069  -2.849   5.366
  392    HA   ALA  55           HA       ALA  55  -5.686  -1.557   7.076
  393   1HB   ALA  55          1HB       ALA  55  -3.066  -1.517   8.225
  394   2HB   ALA  55          2HB       ALA  55  -4.358  -2.717   8.463
  395   3HB   ALA  55          3HB       ALA  55  -3.169  -2.937   7.156
  396    H    GLU  56           H        GLU  56  -2.317  -0.319   6.534
  397    HA   GLU  56           HA       GLU  56  -3.492   2.351   6.655
  398   1HB   GLU  56          1HB       GLU  56  -1.753   1.230   8.499
  399   2HB   GLU  56          2HB       GLU  56  -0.655   2.154   7.460
  400   1HG   GLU  56          1HG       GLU  56  -2.586   4.006   7.753
  401   2HG   GLU  56          2HG       GLU  56  -2.877   3.109   9.250
  402    H    CYS  57           H        CYS  57  -2.918   0.557   4.311
  403    HA   CYS  57           HA       CYS  57  -0.716   2.032   3.087
  404   1HB   CYS  57          1HB       CYS  57  -0.663  -0.462   3.108
  405   2HB   CYS  57          2HB       CYS  57  -2.093  -0.461   2.073
  406    H    THR  58           H        THR  58  -3.896   0.571   2.059
  407    HA   THR  58           HA       THR  58  -4.255   2.679   0.125
  408    HB   THR  58           HB       THR  58  -4.887   0.042   0.151
  409    HG1  THR  58           HG1      THR  58  -6.362   2.360  -0.875
  410   1HG2  THR  58          1HG2      THR  58  -6.603   0.346   2.000
  411   2HG2  THR  58          2HG2      THR  58  -7.468   1.488   0.945
  412   3HG2  THR  58          3HG2      THR  58  -7.316  -0.220   0.471
  413    H    PHE  59           H        PHE  59  -5.194   2.007   3.445
  414    HA   PHE  59           HA       PHE  59  -7.511   3.194   3.849
  415   1HB   PHE  59          1HB       PHE  59  -5.367   2.488   5.363
  416   2HB   PHE  59          2HB       PHE  59  -5.124   4.237   5.416
  417    HD1  PHE  59           HD1      PHE  59  -5.852   5.139   7.398
  418    HD2  PHE  59           HD2      PHE  59  -8.094   1.975   5.674
  419    HE1  PHE  59           HE1      PHE  59  -7.515   5.296   9.272
  420    HE2  PHE  59           HE2      PHE  59  -9.757   2.133   7.547
  421    HZ   PHE  59           HZ       PHE  59  -9.448   3.792   9.324
  422   1H    GLU   1           H1       GLU   1 -18.995  -1.780   2.429
  423    HA   GLU   1           HA       GLU   1 -19.820  -3.194   0.099
  424   1HB   GLU   1          1HB       GLU   1 -21.181  -1.318   2.048
  425   2HB   GLU   1          2HB       GLU   1 -22.017  -1.895   0.596
  426   1HG   GLU   1          1HG       GLU   1 -22.625  -3.655   1.898
  427   2HG   GLU   1          2HG       GLU   1 -20.979  -4.245   1.625
  428    H    GLU   2           H        GLU   2 -19.586   0.301   1.081
  429    HA   GLU   2           HA       GLU   2 -19.926   1.028  -1.686
  430   1HB   GLU   2          1HB       GLU   2 -19.679   2.661   0.865
  431   2HB   GLU   2          2HB       GLU   2 -19.869   3.385  -0.741
  432   1HG   GLU   2          1HG       GLU   2 -22.051   2.511  -0.999
  433   2HG   GLU   2          2HG       GLU   2 -21.820   1.286   0.259
  434    H    TYR   3           H        TYR   3 -17.843  -0.072  -2.306
  435    HA   TYR   3           HA       TYR   3 -15.434   1.225  -1.348
  436   1HB   TYR   3          1HB       TYR   3 -16.104  -0.944  -3.427
  437   2HB   TYR   3          2HB       TYR   3 -14.457  -0.548  -2.927
  438    HD1  TYR   3           HD1      TYR   3 -15.005  -0.222   0.053
  439    HD2  TYR   3           HD2      TYR   3 -16.217  -3.212  -2.757
  440    HE1  TYR   3           HE1      TYR   3 -15.186  -1.925   1.932
  441    HE2  TYR   3           HE2      TYR   3 -16.392  -4.905  -0.869
  442    HH   TYR   3           HH       TYR   3 -14.996  -4.794   1.783
  443    H    VAL   4           H        VAL   4 -16.407   3.358  -2.309
  444    HA   VAL   4           HA       VAL   4 -15.593   3.497  -5.131
  445    HB   VAL   4           HB       VAL   4 -17.641   5.161  -3.651
  446   1HG1  VAL   4          1HG1      VAL   4 -16.463   5.295  -6.406
  447   2HG1  VAL   4          2HG1      VAL   4 -18.174   5.726  -6.178
  448   3HG1  VAL   4          3HG1      VAL   4 -16.909   6.607  -5.289
  449   1HG2  VAL   4          1HG2      VAL   4 -18.337   3.336  -5.924
  450   2HG2  VAL   4          2HG2      VAL   4 -18.096   2.635  -4.306
  451   3HG2  VAL   4          3HG2      VAL   4 -19.332   3.890  -4.557
  452    H    GLY   5           H        GLY   5 -15.895   5.411  -2.055
  453   1HA   GLY   5          1HA       GLY   5 -13.977   7.353  -2.898
  454   2HA   GLY   5          2HA       GLY   5 -14.681   7.162  -1.303
  455    H    LEU   6           H        LEU   6 -13.327   4.240  -2.643
  456    HA   LEU   6           HA       LEU   6 -10.704   4.731  -1.528
  457   1HB   LEU   6          1HB       LEU   6 -10.809   2.772  -0.066
  458   2HB   LEU   6          2HB       LEU   6 -11.871   4.093   0.452
  459    HG   LEU   6           HG       LEU   6 -12.830   1.812   0.728
  460   1HD1  LEU   6          1HD1      LEU   6 -14.094   4.089   0.112
  461   2HD1  LEU   6          2HD1      LEU   6 -14.603   3.102  -1.279
  462   3HD1  LEU   6          3HD1      LEU   6 -14.944   2.548   0.378
  463   1HD2  LEU   6          1HD2      LEU   6 -13.091   1.719  -2.280
  464   2HD2  LEU   6          2HD2      LEU   6 -11.758   0.928  -1.402
  465   3HD2  LEU   6          3HD2      LEU   6 -13.442   0.442  -1.090
  466    H    SER   7           H        SER   7 -12.460   3.923  -4.065
  467    HA   SER   7           HA       SER   7 -10.789   1.624  -4.720
  468   1HB   SER   7          1HB       SER   7 -12.514   1.031  -6.392
  469   2HB   SER   7          2HB       SER   7 -13.192   1.090  -4.755
  470    HG   SER   7           HG       SER   7 -13.391   3.136  -6.798
  471    H    ALA   8           H        ALA   8 -11.155   1.680  -7.545
  472    HA   ALA   8           HA       ALA   8  -9.205   3.466  -8.329
  473   1HB   ALA   8          1HB       ALA   8  -9.700   1.514  -9.635
  474   2HB   ALA   8          2HB       ALA   8 -11.395   2.012  -9.855
  475   3HB   ALA   8          3HB       ALA   8 -10.090   2.923 -10.651
  476    H    ASN   9           H        ASN   9  -9.233   5.494  -9.405
  477    HA   ASN   9           HA       ASN   9 -10.223   7.290 -10.321
  478   1HB   ASN   9          1HB       ASN   9 -12.488   5.934 -10.230
  479   2HB   ASN   9          2HB       ASN   9 -12.793   6.857  -8.752
  480   1HD2  ASN   9          1HD2      ASN   9 -12.725   9.182  -8.876
  481   2HD2  ASN   9          2HD2      ASN   9 -13.192  10.000 -10.330
  482    H    GLN  10           H        GLN  10 -10.447   6.138  -6.990
  483    HA   GLN  10           HA       GLN  10 -11.021   8.512  -5.706
  484   1HB   GLN  10          1HB       GLN  10 -10.901   6.089  -4.805
  485   2HB   GLN  10          2HB       GLN  10  -9.172   6.391  -4.566
  486   1HG   GLN  10          1HG       GLN  10 -10.921   8.548  -3.552
  487   2HG   GLN  10          2HG       GLN  10 -11.187   6.994  -2.748
  488   1HE2  GLN  10          1HE2      GLN  10  -9.835   6.364  -1.225
  489   2HE2  GLN  10          2HE2      GLN  10  -8.318   7.096  -0.823
  490    H    CYS  11           H        CYS  11  -7.924   7.111  -6.878
  491    HA   CYS  11           HA       CYS  11  -6.229   8.908  -5.617
  492   1HB   CYS  11          1HB       CYS  11  -5.413   6.880  -6.599
  493   2HB   CYS  11          2HB       CYS  11  -5.923   7.387  -8.212
  494    H    ALA  12           H        ALA  12  -8.704   9.448  -7.879
  495    HA   ALA  12           HA       ALA  12  -7.338  11.725  -9.102
  496   1HB   ALA  12          1HB       ALA  12  -8.813   9.807 -10.272
  497   2HB   ALA  12          2HB       ALA  12 -10.128  10.923  -9.832
  498   3HB   ALA  12          3HB       ALA  12  -8.794  11.484 -10.867
  499    H    VAL  13           H        VAL  13  -8.272  11.477  -6.202
  500    HA   VAL  13           HA       VAL  13 -10.577  12.726  -5.618
  501    HB   VAL  13           HB       VAL  13  -8.833  13.927  -3.877
  502   1HG1  VAL  13          1HG1      VAL  13 -10.751  12.565  -3.252
  503   2HG1  VAL  13          2HG1      VAL  13  -9.920  11.091  -3.807
  504   3HG1  VAL  13          3HG1      VAL  13  -9.296  11.989  -2.403
  505   1HG2  VAL  13          1HG2      VAL  13  -6.926  12.630  -3.504
  506   2HG2  VAL  13          2HG2      VAL  13  -7.544  11.265  -4.466
  507   3HG2  VAL  13          3HG2      VAL  13  -6.993  12.750  -5.279
  508    HA   PRO  14           HA       PRO  14 -10.401  16.823  -6.988
  509   1HB   PRO  14          1HB       PRO  14 -11.462  18.297  -4.947
  510   2HB   PRO  14          2HB       PRO  14 -12.444  17.360  -6.071
  511   1HG   PRO  14          1HG       PRO  14 -11.682  16.778  -3.281
  512   2HG   PRO  14          2HG       PRO  14 -13.041  16.091  -4.240
  513   1HD   PRO  14          1HD       PRO  14 -10.550  14.861  -3.547
  514   2HD   PRO  14          2HD       PRO  14 -11.788  14.203  -4.626
  515    H    ALA  15           H        ALA  15  -8.254  15.786  -4.847
  516    HA   ALA  15           HA       ALA  15  -6.196  16.552  -4.435
  517   1HB   ALA  15          1HB       ALA  15  -5.358  18.145  -5.799
  518   2HB   ALA  15          2HB       ALA  15  -6.986  18.231  -6.511
  519   3HB   ALA  15          3HB       ALA  15  -6.519  19.364  -5.220
  520    H    LYS  16           H        LYS  16  -8.204  16.390  -2.511
  521    HA   LYS  16           HA       LYS  16  -7.173  17.866  -0.447
  522   1HB   LYS  16          1HB       LYS  16  -9.412  19.346  -0.240
  523   2HB   LYS  16          2HB       LYS  16  -7.897  19.946  -0.936
  524   1HG   LYS  16          1HG       LYS  16  -8.766  20.028  -3.038
  525   2HG   LYS  16          2HG       LYS  16  -9.630  18.491  -2.858
  526   1HD   LYS  16          1HD       LYS  16 -11.344  20.104  -3.062
  527   2HD   LYS  16          2HD       LYS  16 -11.255  19.816  -1.316
  528   1HE   LYS  16          1HE       LYS  16  -9.882  21.837  -1.033
  529   2HE   LYS  16          2HE       LYS  16  -9.853  22.102  -2.783
  530   1HZ   LYS  16          1HZ       LYS  16 -11.542  23.435  -1.998
  531   2HZ   LYS  16          2HZ       LYS  16 -12.359  22.131  -2.545
  532   3HZ   LYS  16          3HZ       LYS  16 -12.111  22.326  -0.942
  533    H    ASP  17           H        ASP  17  -7.985  15.213  -1.037
  534    HA   ASP  17           HA       ASP  17  -9.920  14.925   1.083
  535   1HB   ASP  17          1HB       ASP  17 -11.252  14.836  -0.991
  536   2HB   ASP  17          2HB       ASP  17 -10.175  13.599  -1.658
  537    H    ARG  18           H        ARG  18  -6.916  14.423   0.091
  538    HA   ARG  18           HA       ARG  18  -6.810  11.568   0.380
  539   1HB   ARG  18          1HB       ARG  18  -4.492  13.529   0.104
  540   2HB   ARG  18          2HB       ARG  18  -4.454  11.789  -0.226
  541   1HG   ARG  18          1HG       ARG  18  -5.323  12.060  -2.306
  542   2HG   ARG  18          2HG       ARG  18  -6.533  13.233  -1.758
  543   1HD   ARG  18          1HD       ARG  18  -4.773  14.996  -1.719
  544   2HD   ARG  18          2HD       ARG  18  -3.580  13.820  -2.293
  545    HE   ARG  18           HE       ARG  18  -6.018  14.201  -3.942
  546   1HH1  ARG  18          1HH1      ARG  18  -2.594  14.867  -3.477
  547   2HH1  ARG  18          2HH1      ARG  18  -2.335  15.356  -5.119
  548   1HH2  ARG  18          1HH2      ARG  18  -5.677  14.846  -6.108
  549   2HH2  ARG  18          2HH2      ARG  18  -4.101  15.343  -6.625
  550    H    VAL  19           H        VAL  19  -4.462  11.077   1.754
  551    HA   VAL  19           HA       VAL  19  -4.965  12.318   4.371
  552    HB   VAL  19           HB       VAL  19  -3.834   9.564   3.924
  553   1HG1  VAL  19          1HG1      VAL  19  -5.357   9.710   6.285
  554   2HG1  VAL  19          2HG1      VAL  19  -3.584   9.669   6.139
  555   3HG1  VAL  19          3HG1      VAL  19  -4.434  11.231   6.215
  556   1HG2  VAL  19          1HG2      VAL  19  -6.195   8.756   4.462
  557   2HG2  VAL  19          2HG2      VAL  19  -6.741  10.399   4.051
  558   3HG2  VAL  19          3HG2      VAL  19  -5.927   9.400   2.824
  559    H    ASP  20           H        ASP  20  -3.136  13.007   1.972
  560    HA   ASP  20           HA       ASP  20  -1.005  13.373   1.543
  561   1HB   ASP  20          1HB       ASP  20  -1.212  15.357   2.699
  562   2HB   ASP  20          2HB       ASP  20  -1.657  14.559   4.216
  563    H    CYS  21           H        CYS  21  -0.059  11.223   1.393
  564    HA   CYS  21           HA       CYS  21   0.549   9.568   3.466
  565   1HB   CYS  21          1HB       CYS  21   0.857   9.481   0.791
  566   2HB   CYS  21          2HB       CYS  21   2.542   9.675   1.279
  567    H    GLY  22           H        GLY  22   2.206  12.496   2.264
  568   1HA   GLY  22          1HA       GLY  22   3.925  13.700   3.067
  569   2HA   GLY  22          2HA       GLY  22   3.528  13.042   4.642
  570    H    TYR  23           H        TYR  23   4.861  11.627   1.561
  571    HA   TYR  23           HA       TYR  23   6.751  10.103   3.146
  572   1HB   TYR  23          1HB       TYR  23   5.237   9.764   0.812
  573   2HB   TYR  23          2HB       TYR  23   6.819  10.177   0.142
  574    HD1  TYR  23           HD1      TYR  23   6.096   8.213   3.235
  575    HD2  TYR  23           HD2      TYR  23   7.501   8.127  -0.806
  576    HE1  TYR  23           HE1      TYR  23   6.841   5.800   3.537
  577    HE2  TYR  23           HE2      TYR  23   8.241   5.716  -0.490
  578    HH   TYR  23           HH       TYR  23   8.846   4.234   1.250
  579    HA   PRO  24           HA       PRO  24  10.021  12.846   2.383
  580   1HB   PRO  24          1HB       PRO  24  12.119  11.244   3.088
  581   2HB   PRO  24          2HB       PRO  24  11.145  12.129   4.260
  582   1HG   PRO  24          1HG       PRO  24  11.119   9.265   3.548
  583   2HG   PRO  24          2HG       PRO  24  10.495  10.058   5.040
  584   1HD   PRO  24          1HD       PRO  24   9.014   9.035   2.812
  585   2HD   PRO  24          2HD       PRO  24   8.365   9.948   4.180
  586    H    HIS  25           H        HIS  25   9.403  10.114   0.592
  587    HA   HIS  25           HA       HIS  25  11.343  11.060  -1.384
  588   1HB   HIS  25          1HB       HIS  25  11.407   8.595  -0.045
  589   2HB   HIS  25          2HB       HIS  25  10.785   8.233  -1.660
  590    HD1  HIS  25           HD1      HIS  25  12.364   9.259  -3.697
  591    HD2  HIS  25           HD2      HIS  25  14.121   8.814   0.086
  592    HE1  HIS  25           HE1      HIS  25  14.887   9.301  -4.072
  593    HE2  HIS  25           HE2      HIS  25  15.913   9.078  -1.707
  594    H    VAL  26           H        VAL  26   8.629  11.943  -1.078
  595    HA   VAL  26           HA       VAL  26   6.784  10.503  -2.548
  596    HB   VAL  26           HB       VAL  26   5.950  12.250  -1.299
  597   1HG1  VAL  26          1HG1      VAL  26   8.411  13.619  -2.106
  598   2HG1  VAL  26          2HG1      VAL  26   6.989  14.689  -2.102
  599   3HG1  VAL  26          3HG1      VAL  26   7.434  13.794  -0.630
  600   1HG2  VAL  26          1HG2      VAL  26   5.988  13.786  -3.872
  601   2HG2  VAL  26          2HG2      VAL  26   5.241  12.171  -3.846
  602   3HG2  VAL  26          3HG2      VAL  26   4.638  13.447  -2.762
  603    H    THR  27           H        THR  27   6.811   9.827  -4.623
  604    HA   THR  27           HA       THR  27   7.482  11.593  -6.737
  605    HB   THR  27           HB       THR  27   9.665  10.192  -5.493
  606    HG1  THR  27           HG1      THR  27   9.430  12.294  -6.747
  607   1HG2  THR  27          1HG2      THR  27  10.483   9.249  -7.831
  608   2HG2  THR  27          2HG2      THR  27   9.476   8.212  -6.792
  609   3HG2  THR  27          3HG2      THR  27   8.742   9.077  -8.165
  610    HA   PRO  28           HA       PRO  28   5.014   8.736  -8.771
  611   1HB   PRO  28          1HB       PRO  28   5.600   9.258 -11.388
  612   2HB   PRO  28          2HB       PRO  28   4.500  10.248 -10.430
  613   1HG   PRO  28          1HG       PRO  28   7.289  10.758 -11.245
  614   2HG   PRO  28          2HG       PRO  28   6.044  11.939 -10.703
  615   1HD   PRO  28          1HD       PRO  28   8.288  10.920  -9.243
  616   2HD   PRO  28          2HD       PRO  28   7.001  11.960  -8.614
  617    H    LYS  29           H        LYS  29   7.014   7.398  -7.609
  618    HA   LYS  29           HA       LYS  29   7.182   5.149  -9.257
  619   1HB   LYS  29          1HB       LYS  29   8.737   6.454 -10.577
  620   2HB   LYS  29          2HB       LYS  29   9.721   6.806  -9.145
  621   1HG   LYS  29          1HG       LYS  29  10.750   4.793  -9.253
  622   2HG   LYS  29          2HG       LYS  29   9.223   3.923  -9.490
  623   1HD   LYS  29          1HD       LYS  29   9.396   5.028 -11.918
  624   2HD   LYS  29          2HD       LYS  29  11.123   5.077 -11.528
  625   1HE   LYS  29          1HE       LYS  29  11.258   2.908 -12.128
  626   2HE   LYS  29          2HE       LYS  29  10.218   2.490 -10.758
  627   1HZ   LYS  29          1HZ       LYS  29   9.478   1.862 -13.079
  628   2HZ   LYS  29          2HZ       LYS  29   8.367   2.560 -12.107
  629   3HZ   LYS  29          3HZ       LYS  29   9.088   3.435 -13.281
  630    H    GLU  30           H        GLU  30   8.058   7.116  -6.482
  631    HA   GLU  30           HA       GLU  30   9.023   4.756  -5.107
  632   1HB   GLU  30          1HB       GLU  30   9.490   7.629  -4.913
  633   2HB   GLU  30          2HB       GLU  30   9.086   6.946  -3.328
  634   1HG   GLU  30          1HG       GLU  30  11.351   6.537  -3.324
  635   2HG   GLU  30          2HG       GLU  30  10.832   5.057  -4.145
  636    H    CYS  31           H        CYS  31   6.472   7.307  -4.959
  637    HA   CYS  31           HA       CYS  31   5.291   6.368  -2.606
  638   1HB   CYS  31          1HB       CYS  31   4.477   8.171  -4.835
  639   2HB   CYS  31          2HB       CYS  31   3.229   7.591  -3.728
  640    H    ASN  32           H        ASN  32   4.494   5.909  -6.129
  641    HA   ASN  32           HA       ASN  32   2.396   4.163  -5.656
  642   1HB   ASN  32          1HB       ASN  32   4.258   4.337  -8.075
  643   2HB   ASN  32          2HB       ASN  32   2.663   3.570  -8.076
  644   1HD2  ASN  32          1HD2      ASN  32   1.141   5.270  -6.643
  645   2HD2  ASN  32          2HD2      ASN  32   1.003   6.815  -7.414
  646    H    ASN  33           H        ASN  33   5.691   3.817  -5.002
  647    HA   ASN  33           HA       ASN  33   5.693   0.982  -5.629
  648   1HB   ASN  33          1HB       ASN  33   7.667   2.111  -6.447
  649   2HB   ASN  33          2HB       ASN  33   7.907   2.964  -4.914
  650   1HD2  ASN  33          1HD2      ASN  33   9.654   2.244  -3.974
  651   2HD2  ASN  33          2HD2      ASN  33  10.146   0.594  -3.789
  652    H    ARG  34           H        ARG  34   5.714   3.439  -3.062
  653    HA   ARG  34           HA       ARG  34   6.395   1.522  -1.050
  654   1HB   ARG  34          1HB       ARG  34   6.517   3.353   0.430
  655   2HB   ARG  34          2HB       ARG  34   6.982   4.087  -1.115
  656   1HG   ARG  34          1HG       ARG  34   5.408   5.612  -0.319
  657   2HG   ARG  34          2HG       ARG  34   4.387   4.573  -1.329
  658   1HD   ARG  34          1HD       ARG  34   3.094   4.272   0.504
  659   2HD   ARG  34          2HD       ARG  34   4.406   3.292   1.178
  660    HE   ARG  34           HE       ARG  34   4.813   6.151   1.587
  661   1HH1  ARG  34          1HH1      ARG  34   3.172   3.304   2.848
  662   2HH1  ARG  34          2HH1      ARG  34   3.053   3.929   4.459
  663   1HH2  ARG  34          1HH2      ARG  34   4.656   6.976   3.713
  664   2HH2  ARG  34          2HH2      ARG  34   3.904   6.031   4.954
  665    H    GLY  35           H        GLY  35   3.540   3.130  -2.447
  666   1HA   GLY  35          1HA       GLY  35   1.519   1.679  -2.169
  667   2HA   GLY  35          2HA       GLY  35   1.823   1.787  -0.447
  668    H    CYS  36           H        CYS  36   2.575   4.561  -2.525
  669    HA   CYS  36           HA       CYS  36   0.161   5.867  -1.496
  670   1HB   CYS  36          1HB       CYS  36   2.916   7.051  -1.855
  671   2HB   CYS  36          2HB       CYS  36   1.466   7.972  -1.444
  672    H    CYS  37           H        CYS  37  -0.394   7.868  -2.950
  673    HA   CYS  37           HA       CYS  37   0.130   7.096  -5.728
  674   1HB   CYS  37          1HB       CYS  37  -2.253   6.979  -4.675
  675   2HB   CYS  37          2HB       CYS  37  -2.247   8.728  -4.910
  676    H    PHE  38           H        PHE  38   1.171   8.628  -6.988
  677    HA   PHE  38           HA       PHE  38   1.759  11.166  -5.694
  678   1HB   PHE  38          1HB       PHE  38   3.474   9.552  -6.761
  679   2HB   PHE  38          2HB       PHE  38   2.741   9.917  -8.327
  680    HD1  PHE  38           HD1      PHE  38   3.172  12.011  -9.424
  681    HD2  PHE  38           HD2      PHE  38   4.753  11.254  -5.560
  682    HE1  PHE  38           HE1      PHE  38   4.695  13.994  -9.658
  683    HE2  PHE  38           HE2      PHE  38   6.275  13.236  -5.793
  684    HZ   PHE  38           HZ       PHE  38   6.228  14.582  -7.840
  685    H    ASP  39           H        ASP  39   0.518  12.917  -6.144
  686    HA   ASP  39           HA       ASP  39  -1.290  12.836  -8.301
  687   1HB   ASP  39          1HB       ASP  39  -2.179  14.162  -6.660
  688   2HB   ASP  39          2HB       ASP  39  -0.593  14.668  -6.062
  689    H    SER  40           H        SER  40   0.889  15.618  -7.502
  690    HA   SER  40           HA       SER  40   2.524  16.550  -8.669
  691   1HB   SER  40          1HB       SER  40   2.713  14.216  -9.869
  692   2HB   SER  40          2HB       SER  40   1.880  15.032 -11.206
  693    HG   SER  40           HG       SER  40   4.122  16.339 -10.028
  694    H    ARG  41           H        ARG  41  -0.754  16.006  -9.801
  695    HA   ARG  41           HA       ARG  41  -0.811  17.922 -11.804
  696   1HB   ARG  41          1HB       ARG  41  -3.165  17.216 -10.012
  697   2HB   ARG  41          2HB       ARG  41  -3.207  17.664 -11.725
  698   1HG   ARG  41          1HG       ARG  41  -1.552  15.455 -11.750
  699   2HG   ARG  41          2HG       ARG  41  -2.680  15.034 -10.448
  700   1HD   ARG  41          1HD       ARG  41  -3.694  14.194 -12.424
  701   2HD   ARG  41          2HD       ARG  41  -4.558  15.708 -12.116
  702    HE   ARG  41           HE       ARG  41  -2.396  16.398 -13.763
  703   1HH1  ARG  41          1HH1      ARG  41  -5.161  14.232 -13.989
  704   2HH1  ARG  41          2HH1      ARG  41  -5.276  14.353 -15.713
  705   1HH2  ARG  41          1HH2      ARG  41  -2.549  16.557 -16.038
  706   2HH2  ARG  41          2HH2      ARG  41  -3.781  15.685 -16.886
  707    H    ILE  42           H        ILE  42  -1.612  18.030  -8.271
  708    HA   ILE  42           HA       ILE  42  -1.618  20.960  -8.488
  709    HB   ILE  42           HB       ILE  42  -2.976  19.483  -6.270
  710   1HG1  ILE  42          1HG1      ILE  42  -3.856  19.636  -9.112
  711   2HG1  ILE  42          2HG1      ILE  42  -4.113  18.360  -7.909
  712   1HG2  ILE  42          1HG2      ILE  42  -4.133  21.452  -5.922
  713   2HG2  ILE  42          2HG2      ILE  42  -2.539  22.046  -6.447
  714   3HG2  ILE  42          3HG2      ILE  42  -3.900  22.014  -7.595
  715   1HD1  ILE  42          1HD1      ILE  42  -5.558  20.274  -6.718
  716   2HD1  ILE  42          2HD1      ILE  42  -5.651  20.906  -8.379
  717   3HD1  ILE  42          3HD1      ILE  42  -6.251  19.270  -8.015
  718    HA   PRO  43           HA       PRO  43   1.973  20.352  -6.042
  719   1HB   PRO  43          1HB       PRO  43   2.974  22.876  -6.335
  720   2HB   PRO  43          2HB       PRO  43   3.304  21.571  -7.472
  721   1HG   PRO  43          1HG       PRO  43   1.468  23.868  -7.705
  722   2HG   PRO  43          2HG       PRO  43   2.152  22.840  -9.015
  723   1HD   PRO  43          1HD       PRO  43  -0.499  22.812  -7.929
  724   2HD   PRO  43          2HD       PRO  43   0.172  21.673  -9.105
  725    H    GLY  44           H        GLY  44  -0.761  22.126  -5.492
  726   1HA   GLY  44          1HA       GLY  44   0.212  23.239  -2.967
  727   2HA   GLY  44          2HA       GLY  44  -1.337  23.530  -3.735
  728    H    VAL  45           H        VAL  45  -0.881  20.245  -4.080
  729    HA   VAL  45           HA       VAL  45  -2.157  19.697  -1.489
  730    HB   VAL  45           HB       VAL  45  -3.737  18.388  -2.480
  731   1HG1  VAL  45          1HG1      VAL  45  -4.534  19.510  -4.601
  732   2HG1  VAL  45          2HG1      VAL  45  -4.233  20.601  -3.227
  733   3HG1  VAL  45          3HG1      VAL  45  -3.051  20.491  -4.552
  734   1HG2  VAL  45          1HG2      VAL  45  -3.552  17.223  -4.587
  735   2HG2  VAL  45          2HG2      VAL  45  -2.053  18.095  -4.989
  736   3HG2  VAL  45          3HG2      VAL  45  -2.071  16.931  -3.642
  737    HA   PRO  46           HA       PRO  46   0.640  16.418  -1.016
  738   1HB   PRO  46          1HB       PRO  46  -0.806  14.179  -0.422
  739   2HB   PRO  46          2HB       PRO  46  -0.481  15.454   0.749
  740   1HG   PRO  46          1HG       PRO  46  -2.944  14.846  -0.757
  741   2HG   PRO  46          2HG       PRO  46  -2.759  15.810   0.752
  742   1HD   PRO  46          1HD       PRO  46  -3.205  16.747  -1.916
  743   2HD   PRO  46          2HD       PRO  46  -2.873  17.740  -0.491
  744    H    TRP  47           H        TRP  47   2.037  15.732  -2.498
  745    HA   TRP  47           HA       TRP  47   0.871  14.498  -4.850
  746   1HB   TRP  47          1HB       TRP  47   3.781  14.707  -4.693
  747   2HB   TRP  47          2HB       TRP  47   2.664  15.229  -5.955
  748    HD1  TRP  47           HD1      TRP  47   1.452  17.736  -5.447
  749    HE1  TRP  47           HE1      TRP  47   2.375  19.922  -4.292
  750    HE3  TRP  47           HE3      TRP  47   5.272  15.454  -2.987
  751    HZ2  TRP  47           HZ2      TRP  47   4.551  20.439  -2.519
  752    HZ3  TRP  47           HZ3      TRP  47   6.749  16.871  -1.565
  753    HH2  TRP  47           HH2      TRP  47   6.437  19.282  -1.310
  754    H    CYS  48           H        CYS  48   0.784  13.183  -2.150
  755    HA   CYS  48           HA       CYS  48   1.614  10.633  -2.992
  756   1HB   CYS  48          1HB       CYS  48   3.820  11.573  -2.362
  757   2HB   CYS  48          2HB       CYS  48   3.229  11.789  -0.712
  758    H    PHE  49           H        PHE  49  -0.319   9.715  -2.344
  759    HA   PHE  49           HA       PHE  49  -0.961   9.917   0.485
  760   1HB   PHE  49          1HB       PHE  49  -3.451  10.055  -0.630
  761   2HB   PHE  49          2HB       PHE  49  -2.539  11.514  -0.227
  762    HD1  PHE  49           HD1      PHE  49  -0.908  12.313  -2.175
  763    HD2  PHE  49           HD2      PHE  49  -4.348   9.891  -2.733
  764    HE1  PHE  49           HE1      PHE  49  -1.024  13.029  -4.577
  765    HE2  PHE  49           HE2      PHE  49  -4.464  10.608  -5.135
  766    HZ   PHE  49           HZ       PHE  49  -2.800  12.170  -6.029
  767    H    LYS  50           H        LYS  50  -3.345   8.504   0.519
  768    HA   LYS  50           HA       LYS  50  -2.641   6.010  -0.864
  769   1HB   LYS  50          1HB       LYS  50  -3.771   4.980   1.263
  770   2HB   LYS  50          2HB       LYS  50  -2.056   5.432   1.278
  771   1HG   LYS  50          1HG       LYS  50  -4.012   7.561   2.034
  772   2HG   LYS  50          2HG       LYS  50  -3.838   6.224   3.183
  773   1HD   LYS  50          1HD       LYS  50  -1.458   7.723   2.033
  774   2HD   LYS  50          2HD       LYS  50  -2.281   8.261   3.507
  775   1HE   LYS  50          1HE       LYS  50  -1.475   5.378   3.354
  776   2HE   LYS  50          2HE       LYS  50  -0.169   6.560   3.541
  777   1HZ   LYS  50          1HZ       LYS  50  -1.996   7.375   5.314
  778   2HZ   LYS  50          2HZ       LYS  50  -2.175   5.753   5.397
  779   3HZ   LYS  50          3HZ       LYS  50  -0.714   6.429   5.672
  780    HA   PRO  51           HA       PRO  51  -6.845   7.307  -1.933
  781   1HB   PRO  51          1HB       PRO  51  -6.559   7.259  -4.648
  782   2HB   PRO  51          2HB       PRO  51  -6.381   8.726  -3.686
  783   1HG   PRO  51          1HG       PRO  51  -4.326   7.008  -4.924
  784   2HG   PRO  51          2HG       PRO  51  -4.181   8.717  -4.376
  785   1HD   PRO  51          1HD       PRO  51  -3.183   6.349  -3.110
  786   2HD   PRO  51          2HD       PRO  51  -3.153   7.990  -2.452
  787    H    LEU  52           H        LEU  52  -6.070   5.572  -4.784
  788    HA   LEU  52           HA       LEU  52  -7.593   3.328  -3.669
  789   1HB   LEU  52          1HB       LEU  52  -8.508   2.961  -5.705
  790   2HB   LEU  52          2HB       LEU  52  -8.347   4.726  -5.725
  791    HG   LEU  52           HG       LEU  52  -5.964   3.765  -6.839
  792   1HD1  LEU  52          1HD1      LEU  52  -7.427   2.476  -8.790
  793   2HD1  LEU  52          2HD1      LEU  52  -6.382   1.702  -7.575
  794   3HD1  LEU  52          3HD1      LEU  52  -8.130   1.851  -7.279
  795   1HD2  LEU  52          1HD2      LEU  52  -7.570   4.472  -8.988
  796   2HD2  LEU  52          2HD2      LEU  52  -8.284   5.349  -7.613
  797   3HD2  LEU  52          3HD2      LEU  52  -6.561   5.563  -8.008
  798    H    GLN  53           H        GLN  53  -4.963   3.496  -2.811
  799    HA   GLN  53           HA       GLN  53  -3.084   2.382  -4.452
  800   1HB   GLN  53          1HB       GLN  53  -3.423   2.057  -1.446
  801   2HB   GLN  53          2HB       GLN  53  -1.927   1.722  -2.335
  802   1HG   GLN  53          1HG       GLN  53  -3.359   4.410  -2.226
  803   2HG   GLN  53          2HG       GLN  53  -1.934   3.989  -1.267
  804   1HE2  GLN  53          1HE2      GLN  53  -3.211   4.861  -4.359
  805   2HE2  GLN  53          2HE2      GLN  53  -1.719   5.074  -5.212
  806    H    GLU  54           H        GLU  54  -5.987   0.984  -3.261
  807    HA   GLU  54           HA       GLU  54  -5.367  -1.571  -2.690
  808   1HB   GLU  54          1HB       GLU  54  -7.706  -0.285  -4.086
  809   2HB   GLU  54          2HB       GLU  54  -7.664  -2.049  -3.923
  810   1HG   GLU  54          1HG       GLU  54  -7.686  -1.937  -1.555
  811   2HG   GLU  54          2HG       GLU  54  -7.191  -0.237  -1.531
  812    H    ALA  55           H        ALA  55  -4.906   0.092  -5.714
  813    HA   ALA  55           HA       ALA  55  -5.219  -1.609  -7.705
  814   1HB   ALA  55          1HB       ALA  55  -4.134   0.489  -8.067
  815   2HB   ALA  55          2HB       ALA  55  -2.781   0.055  -6.996
  816   3HB   ALA  55          3HB       ALA  55  -2.967  -0.759  -8.567
  817    H    GLU  56           H        GLU  56  -2.137  -1.699  -5.773
  818    HA   GLU  56           HA       GLU  56  -2.300  -4.588  -5.920
  819   1HB   GLU  56          1HB       GLU  56  -0.405  -2.911  -7.373
  820   2HB   GLU  56          2HB       GLU  56   0.439  -4.030  -6.287
  821   1HG   GLU  56          1HG       GLU  56   0.178  -5.530  -7.973
  822   2HG   GLU  56          2HG       GLU  56  -1.491  -5.670  -7.401
  823    H    CYS  57           H        CYS  57  -2.491  -2.171  -3.925
  824    HA   CYS  57           HA       CYS  57  -0.287  -2.833  -2.166
  825   1HB   CYS  57          1HB       CYS  57  -1.367  -0.472  -2.705
  826   2HB   CYS  57          2HB       CYS  57  -2.440  -0.926  -1.378
  827    H    THR  58           H        THR  58  -3.922  -2.561  -2.019
  828    HA   THR  58           HA       THR  58  -4.165  -3.975   0.392
  829    HB   THR  58           HB       THR  58  -5.818  -2.382  -0.826
  830    HG1  THR  58           HG1      THR  58  -7.250  -3.402   0.551
  831   1HG2  THR  58          1HG2      THR  58  -7.569  -3.829  -2.099
  832   2HG2  THR  58          2HG2      THR  58  -6.105  -3.374  -3.003
  833   3HG2  THR  58          3HG2      THR  58  -6.255  -5.010  -2.316
  834    H    PHE  59           H        PHE  59  -3.886  -5.037  -2.992
  835    HA   PHE  59           HA       PHE  59  -4.897  -7.450  -3.108
  836   1HB   PHE  59          1HB       PHE  59  -2.526  -6.046  -4.064
  837   2HB   PHE  59          2HB       PHE  59  -2.088  -7.735  -3.790
  838    HD1  PHE  59           HD1      PHE  59  -5.367  -6.420  -4.929
  839    HD2  PHE  59           HD2      PHE  59  -1.825  -8.501  -5.991
  840    HE1  PHE  59           HE1      PHE  59  -6.386  -7.025  -7.142
  841    HE2  PHE  59           HE2      PHE  59  -2.844  -9.107  -8.204
  842    HZ   PHE  59           HZ       PHE  59  -5.113  -8.361  -8.752
  Start of MODEL   19
    1   1H    GLU   1           H1       GLU   1 -10.177 -16.126  -2.858
    2    HA   GLU   1           HA       GLU   1 -10.604 -16.995  -5.560
    3   1HB   GLU   1          1HB       GLU   1 -12.226 -17.940  -3.298
    4   2HB   GLU   1          2HB       GLU   1 -13.203 -17.165  -4.557
    5   1HG   GLU   1          1HG       GLU   1 -13.117 -19.388  -5.288
    6   2HG   GLU   1          2HG       GLU   1 -11.787 -18.663  -6.204
    7    H    GLU   2           H        GLU   2 -12.945 -15.545  -3.227
    8    HA   GLU   2           HA       GLU   2 -13.039 -13.235  -4.942
    9   1HB   GLU   2          1HB       GLU   2 -14.727 -14.165  -2.595
   10   2HB   GLU   2          2HB       GLU   2 -14.993 -12.613  -3.409
   11   1HG   GLU   2          1HG       GLU   2 -16.492 -14.097  -4.478
   12   2HG   GLU   2          2HG       GLU   2 -15.124 -14.012  -5.600
   13    H    TYR   3           H        TYR   3 -13.983 -12.495  -1.723
   14    HA   TYR   3           HA       TYR   3 -11.659 -10.776  -1.444
   15   1HB   TYR   3          1HB       TYR   3 -13.187 -10.055   0.566
   16   2HB   TYR   3          2HB       TYR   3 -13.836  -9.763  -1.052
   17    HD1  TYR   3           HD1      TYR   3 -15.719 -11.070  -1.893
   18    HD2  TYR   3           HD2      TYR   3 -14.112 -11.791   2.006
   19    HE1  TYR   3           HE1      TYR   3 -17.781 -12.427  -1.285
   20    HE2  TYR   3           HE2      TYR   3 -16.180 -13.145   2.601
   21    HH   TYR   3           HH       TYR   3 -18.270 -13.594   1.994
   22    H    VAL   4           H        VAL   4 -10.531 -13.132  -1.172
   23    HA   VAL   4           HA       VAL   4 -10.469 -13.608   1.729
   24    HB   VAL   4           HB       VAL   4 -10.061 -15.543  -0.560
   25   1HG1  VAL   4          1HG1      VAL   4  -8.848 -15.620   1.949
   26   2HG1  VAL   4          2HG1      VAL   4 -10.252 -16.702   2.111
   27   3HG1  VAL   4          3HG1      VAL   4  -9.054 -16.985   0.824
   28   1HG2  VAL   4          1HG2      VAL   4 -12.376 -14.792   1.061
   29   2HG2  VAL   4          2HG2      VAL   4 -12.289 -15.745  -0.440
   30   3HG2  VAL   4          3HG2      VAL   4 -12.026 -16.536   1.133
   31    H    GLY   5           H        GLY   5  -8.610 -13.585  -1.376
   32   1HA   GLY   5          1HA       GLY   5  -6.067 -13.757  -0.105
   33   2HA   GLY   5          2HA       GLY   5  -6.402 -13.332  -1.772
   34    H    LEU   6           H        LEU   6  -8.362 -11.338   0.109
   35    HA   LEU   6           HA       LEU   6  -6.261  -9.299   0.327
   36   1HB   LEU   6          1HB       LEU   6  -8.998  -8.433  -0.363
   37   2HB   LEU   6          2HB       LEU   6  -7.427  -7.759  -0.833
   38    HG   LEU   6           HG       LEU   6  -8.551  -8.559  -2.789
   39   1HD1  LEU   6          1HD1      LEU   6  -6.785 -10.846  -2.754
   40   2HD1  LEU   6          2HD1      LEU   6  -6.648  -9.312  -3.647
   41   3HD1  LEU   6          3HD1      LEU   6  -6.009  -9.438  -1.990
   42   1HD2  LEU   6          1HD2      LEU   6  -9.662 -10.482  -1.103
   43   2HD2  LEU   6          2HD2      LEU   6  -9.911 -10.315  -2.857
   44   3HD2  LEU   6          3HD2      LEU   6  -8.650 -11.407  -2.237
   45    H    SER   7           H        SER   7  -8.279 -11.323   1.964
   46    HA   SER   7           HA       SER   7  -9.514  -9.492   3.713
   47   1HB   SER   7          1HB       SER   7  -9.949 -11.540   5.097
   48   2HB   SER   7          2HB       SER   7 -10.466 -11.707   3.410
   49    HG   SER   7           HG       SER   7  -8.942 -13.383   4.733
   50    H    ALA   8           H        ALA   8  -9.034 -10.080   6.288
   51    HA   ALA   8           HA       ALA   8  -6.437  -9.007   6.722
   52   1HB   ALA   8          1HB       ALA   8  -8.328 -10.188   8.783
   53   2HB   ALA   8          2HB       ALA   8  -7.120  -8.900   9.006
   54   3HB   ALA   8          3HB       ALA   8  -8.588  -8.588   8.050
   55    H    ASN   9           H        ASN   9  -7.499 -12.107   5.938
   56    HA   ASN   9           HA       ASN   9  -5.507 -13.368   7.623
   57   1HB   ASN   9          1HB       ASN   9  -8.069 -14.148   6.835
   58   2HB   ASN   9          2HB       ASN   9  -7.037 -15.091   5.749
   59   1HD2  ASN   9          1HD2      ASN   9  -5.245 -16.283   6.750
   60   2HD2  ASN   9          2HD2      ASN   9  -5.477 -17.018   8.302
   61    H    GLN  10           H        GLN  10  -5.728 -11.812   4.671
   62    HA   GLN  10           HA       GLN  10  -4.559 -13.649   2.930
   63   1HB   GLN  10          1HB       GLN  10  -4.652 -11.953   1.396
   64   2HB   GLN  10          2HB       GLN  10  -5.736 -11.242   2.604
   65   1HG   GLN  10          1HG       GLN  10  -3.823  -9.992   3.569
   66   2HG   GLN  10          2HG       GLN  10  -2.738 -10.704   2.363
   67   1HE2  GLN  10          1HE2      GLN  10  -2.717  -9.959   0.308
   68   2HE2  GLN  10          2HE2      GLN  10  -3.593  -8.572  -0.251
   69    H    CYS  11           H        CYS  11  -3.244 -11.217   5.223
   70    HA   CYS  11           HA       CYS  11  -0.607 -11.321   4.330
   71   1HB   CYS  11          1HB       CYS  11  -1.268  -9.528   5.702
   72   2HB   CYS  11          2HB       CYS  11  -1.848 -10.599   6.980
   73    H    ALA  12           H        ALA  12  -2.611 -13.727   5.663
   74    HA   ALA  12           HA       ALA  12  -0.340 -15.127   6.883
   75   1HB   ALA  12          1HB       ALA  12  -2.507 -16.619   7.534
   76   2HB   ALA  12          2HB       ALA  12  -1.947 -15.236   8.506
   77   3HB   ALA  12          3HB       ALA  12  -3.284 -15.027   7.349
   78    H    VAL  13           H        VAL  13  -1.151 -14.694   3.903
   79    HA   VAL  13           HA       VAL  13  -2.212 -16.877   2.736
   80    HB   VAL  13           HB       VAL  13  -0.759 -14.657   1.968
   81   1HG1  VAL  13          1HG1      VAL  13   1.350 -15.879   2.057
   82   2HG1  VAL  13          2HG1      VAL  13   0.686 -17.147   0.999
   83   3HG1  VAL  13          3HG1      VAL  13   0.929 -15.500   0.370
   84   1HG2  VAL  13          1HG2      VAL  13  -2.208 -14.916   0.296
   85   2HG2  VAL  13          2HG2      VAL  13  -1.237 -16.265  -0.342
   86   3HG2  VAL  13          3HG2      VAL  13  -2.539 -16.581   0.830
   87    HA   PRO  14           HA       PRO  14   0.439 -20.242   3.323
   88   1HB   PRO  14          1HB       PRO  14   0.491 -21.517   0.907
   89   2HB   PRO  14          2HB       PRO  14  -0.853 -21.652   2.040
   90   1HG   PRO  14          1HG       PRO  14  -0.620 -20.087  -0.450
   91   2HG   PRO  14          2HG       PRO  14  -2.112 -20.597   0.420
   92   1HD   PRO  14          1HD       PRO  14  -0.898 -18.004   0.335
   93   2HD   PRO  14          2HD       PRO  14  -2.274 -18.493   1.334
   94    H    ALA  15           H        ALA  15   1.699 -17.685   2.525
   95    HA   ALA  15           HA       ALA  15   3.685 -16.928   1.881
   96   1HB   ALA  15          1HB       ALA  15   5.609 -18.214   2.708
   97   2HB   ALA  15          2HB       ALA  15   4.281 -18.251   3.894
   98   3HB   ALA  15          3HB       ALA  15   4.590 -19.666   2.860
   99    H    LYS  16           H        LYS  16   2.758 -17.063  -0.390
  100    HA   LYS  16           HA       LYS  16   4.589 -17.731  -2.214
  101   1HB   LYS  16          1HB       LYS  16   3.574 -19.929  -3.148
  102   2HB   LYS  16          2HB       LYS  16   4.745 -20.004  -1.820
  103   1HG   LYS  16          1HG       LYS  16   3.225 -21.000  -0.491
  104   2HG   LYS  16          2HG       LYS  16   2.071 -19.678  -0.739
  105   1HD   LYS  16          1HD       LYS  16   0.794 -21.108  -1.921
  106   2HD   LYS  16          2HD       LYS  16   2.066 -21.177  -3.154
  107   1HE   LYS  16          1HE       LYS  16   3.017 -23.135  -2.219
  108   2HE   LYS  16          2HE       LYS  16   2.213 -22.903  -0.659
  109   1HZ   LYS  16          1HZ       LYS  16   0.893 -23.577  -3.195
  110   2HZ   LYS  16          2HZ       LYS  16   1.155 -24.604  -1.952
  111   3HZ   LYS  16          3HZ       LYS  16   0.128 -23.347  -1.771
  112    H    ASP  17           H        ASP  17   2.640 -15.775  -1.724
  113    HA   ASP  17           HA       ASP  17   1.390 -15.781  -4.261
  114   1HB   ASP  17          1HB       ASP  17  -0.177 -17.092  -2.657
  115   2HB   ASP  17          2HB       ASP  17  -0.467 -15.537  -1.862
  116    H    ARG  18           H        ARG  18   3.200 -14.331  -2.112
  117    HA   ARG  18           HA       ARG  18   1.723 -11.888  -1.794
  118   1HB   ARG  18          1HB       ARG  18   4.593 -12.522  -0.975
  119   2HB   ARG  18          2HB       ARG  18   3.605 -11.176  -0.382
  120   1HG   ARG  18          1HG       ARG  18   2.466 -12.503   1.085
  121   2HG   ARG  18          2HG       ARG  18   2.388 -13.872  -0.040
  122   1HD   ARG  18          1HD       ARG  18   4.636 -14.550   0.514
  123   2HD   ARG  18          2HD       ARG  18   4.951 -13.047   1.397
  124    HE   ARG  18           HE       ARG  18   2.689 -14.592   2.444
  125   1HH1  ARG  18          1HH1      ARG  18   6.174 -14.125   2.578
  126   2HH1  ARG  18          2HH1      ARG  18   6.333 -14.811   4.162
  127   1HH2  ARG  18          1HH2      ARG  18   2.898 -15.496   4.532
  128   2HH2  ARG  18          2HH2      ARG  18   4.457 -15.596   5.280
  129    H    VAL  19           H        VAL  19   3.213  -9.777  -2.182
  130    HA   VAL  19           HA       VAL  19   4.183 -10.042  -4.927
  131    HB   VAL  19           HB       VAL  19   3.526  -7.532  -3.383
  132   1HG1  VAL  19          1HG1      VAL  19   3.155  -7.627  -6.306
  133   2HG1  VAL  19          2HG1      VAL  19   3.925  -6.390  -5.284
  134   3HG1  VAL  19          3HG1      VAL  19   4.841  -7.835  -5.773
  135   1HG2  VAL  19          1HG2      VAL  19   1.354  -7.641  -4.755
  136   2HG2  VAL  19          2HG2      VAL  19   1.722  -9.369  -4.966
  137   3HG2  VAL  19          3HG2      VAL  19   1.485  -8.704  -3.333
  138    H    ASP  20           H        ASP  20   5.576 -10.724  -2.215
  139    HA   ASP  20           HA       ASP  20   7.447 -10.250  -1.142
  140   1HB   ASP  20          1HB       ASP  20   8.488 -11.637  -2.678
  141   2HB   ASP  20          2HB       ASP  20   8.078 -10.607  -4.057
  142    H    CYS  21           H        CYS  21   7.003  -8.058  -0.328
  143    HA   CYS  21           HA       CYS  21   7.138  -5.735  -1.695
  144   1HB   CYS  21          1HB       CYS  21   6.625  -6.251   0.788
  145   2HB   CYS  21          2HB       CYS  21   8.342  -5.932   1.051
  146    H    GLY  22           H        GLY  22   9.808  -7.784  -0.424
  147   1HA   GLY  22          1HA       GLY  22  12.056  -7.606  -0.597
  148   2HA   GLY  22          2HA       GLY  22  11.695  -7.246  -2.273
  149    H    TYR  23           H        TYR  23  11.437  -5.484   0.907
  150    HA   TYR  23           HA       TYR  23  12.313  -3.060  -0.436
  151   1HB   TYR  23          1HB       TYR  23  10.912  -3.997   2.042
  152   2HB   TYR  23          2HB       TYR  23  11.977  -2.616   2.324
  153    HD1  TYR  23           HD1      TYR  23  10.501  -0.828   2.686
  154    HD2  TYR  23           HD2      TYR  23   9.882  -3.401  -0.675
  155    HE1  TYR  23           HE1      TYR  23   8.680   0.724   1.824
  156    HE2  TYR  23           HE2      TYR  23   8.063  -1.841  -1.526
  157    HH   TYR  23           HH       TYR  23   6.711   0.570   0.405
  158    HA   PRO  24           HA       PRO  24  16.360  -3.344   1.073
  159   1HB   PRO  24          1HB       PRO  24  17.133  -0.730   0.909
  160   2HB   PRO  24          2HB       PRO  24  17.118  -1.820  -0.477
  161   1HG   PRO  24          1HG       PRO  24  15.235   0.326   0.271
  162   2HG   PRO  24          2HG       PRO  24  15.487  -0.435  -1.341
  163   1HD   PRO  24          1HD       PRO  24  13.337  -0.846   0.505
  164   2HD   PRO  24          2HD       PRO  24  13.623  -1.736  -0.997
  165    H    HIS  25           H        HIS  25  13.892  -2.034   2.777
  166    HA   HIS  25           HA       HIS  25  15.674  -1.755   5.082
  167   1HB   HIS  25          1HB       HIS  25  13.926   0.205   3.909
  168   2HB   HIS  25          2HB       HIS  25  13.375  -0.179   5.544
  169    HD1  HIS  25           HD1      HIS  25  14.787   2.550   4.532
  170    HD2  HIS  25           HD2      HIS  25  16.568  -0.552   6.722
  171    HE1  HIS  25           HE1      HIS  25  16.783   3.583   5.743
  172    HE2  HIS  25           HE2      HIS  25  17.804   1.641   7.115
  173    H    VAL  26           H        VAL  26  13.814  -3.906   3.727
  174    HA   VAL  26           HA       VAL  26  11.569  -4.384   5.154
  175    HB   VAL  26           HB       VAL  26  12.108  -5.777   3.354
  176   1HG1  VAL  26          1HG1      VAL  26  14.746  -5.542   4.220
  177   2HG1  VAL  26          2HG1      VAL  26  14.381  -7.274   4.406
  178   3HG1  VAL  26          3HG1      VAL  26  14.165  -6.483   2.826
  179   1HG2  VAL  26          1HG2      VAL  26  11.396  -7.761   4.187
  180   2HG2  VAL  26          2HG2      VAL  26  12.696  -7.844   5.400
  181   3HG2  VAL  26          3HG2      VAL  26  11.259  -6.837   5.702
  182    H    THR  27           H        THR  27  11.026  -4.823   7.240
  183    HA   THR  27           HA       THR  27  12.773  -6.206   8.995
  184    HB   THR  27           HB       THR  27  13.043  -3.293   8.769
  185    HG1  THR  27           HG1      THR  27  14.134  -5.537  10.308
  186   1HG2  THR  27          1HG2      THR  27  11.389  -3.899  10.902
  187   2HG2  THR  27          2HG2      THR  27  12.994  -4.136  11.634
  188   3HG2  THR  27          3HG2      THR  27  12.569  -2.566  10.911
  189    HA   PRO  28           HA       PRO  28   8.980  -6.818  10.903
  190   1HB   PRO  28          1HB       PRO  28   9.746  -7.689  13.376
  191   2HB   PRO  28          2HB       PRO  28   9.732  -8.726  11.950
  192   1HG   PRO  28          1HG       PRO  28  11.995  -7.434  13.335
  193   2HG   PRO  28          2HG       PRO  28  12.021  -8.842  12.213
  194   1HD   PRO  28          1HD       PRO  28  12.804  -6.136  11.695
  195   2HD   PRO  28          2HD       PRO  28  12.698  -7.448  10.514
  196    H    LYS  29           H        LYS  29   9.319  -4.193  10.666
  197    HA   LYS  29           HA       LYS  29   7.720  -3.191  12.654
  198   1HB   LYS  29          1HB       LYS  29  10.013  -3.725  13.897
  199   2HB   LYS  29          2HB       LYS  29  10.434  -2.120  13.274
  200   1HG   LYS  29          1HG       LYS  29   9.192  -1.158  14.886
  201   2HG   LYS  29          2HG       LYS  29   7.749  -2.024  14.333
  202   1HD   LYS  29          1HD       LYS  29   9.708  -3.638  15.889
  203   2HD   LYS  29          2HD       LYS  29   8.897  -2.353  16.804
  204   1HE   LYS  29          1HE       LYS  29   6.902  -3.449  16.774
  205   2HE   LYS  29          2HE       LYS  29   7.069  -3.919  15.075
  206   1HZ   LYS  29          1HZ       LYS  29   8.254  -5.775  15.670
  207   2HZ   LYS  29          2HZ       LYS  29   8.690  -5.200  17.135
  208   3HZ   LYS  29          3HZ       LYS  29   7.156  -5.696  16.876
  209    H    GLU  30           H        GLU  30  10.062  -2.927  10.079
  210    HA   GLU  30           HA       GLU  30   9.348  -0.156   9.655
  211   1HB   GLU  30          1HB       GLU  30  11.627  -1.852   9.029
  212   2HB   GLU  30          2HB       GLU  30  11.059  -1.016   7.573
  213   1HG   GLU  30          1HG       GLU  30  11.457   1.107   8.491
  214   2HG   GLU  30          2HG       GLU  30  11.381   0.523  10.160
  215    H    CYS  31           H        CYS  31   9.176  -3.405   8.089
  216    HA   CYS  31           HA       CYS  31   8.076  -2.633   5.696
  217   1HB   CYS  31          1HB       CYS  31   7.902  -5.132   7.340
  218   2HB   CYS  31          2HB       CYS  31   6.958  -4.982   5.855
  219    H    ASN  32           H        ASN  32   6.440  -3.647   8.786
  220    HA   ASN  32           HA       ASN  32   3.878  -3.171   7.838
  221   1HB   ASN  32          1HB       ASN  32   5.202  -3.679  10.453
  222   2HB   ASN  32          2HB       ASN  32   3.680  -2.783  10.585
  223   1HD2  ASN  32          1HD2      ASN  32   5.030  -5.464   8.657
  224   2HD2  ASN  32          2HD2      ASN  32   3.700  -6.559   8.843
  225    H    ASN  33           H        ASN  33   6.415  -1.019   8.327
  226    HA   ASN  33           HA       ASN  33   4.686   1.099   9.302
  227   1HB   ASN  33          1HB       ASN  33   7.083   0.558  10.239
  228   2HB   ASN  33          2HB       ASN  33   7.675   1.359   8.776
  229   1HD2  ASN  33          1HD2      ASN  33   8.600   2.693  10.592
  230   2HD2  ASN  33          2HD2      ASN  33   7.694   4.071  11.123
  231    H    ARG  34           H        ARG  34   6.546  -0.146   6.542
  232    HA   ARG  34           HA       ARG  34   6.394   2.322   5.122
  233   1HB   ARG  34          1HB       ARG  34   7.093  -0.373   3.912
  234   2HB   ARG  34          2HB       ARG  34   7.688   1.226   3.431
  235   1HG   ARG  34          1HG       ARG  34   8.463   1.027   6.099
  236   2HG   ARG  34          2HG       ARG  34   8.689  -0.627   5.503
  237   1HD   ARG  34          1HD       ARG  34  10.623   0.039   4.551
  238   2HD   ARG  34          2HD       ARG  34   9.705   1.102   3.473
  239    HE   ARG  34           HE       ARG  34  10.211   2.189   6.163
  240   1HH1  ARG  34          1HH1      ARG  34  11.357   1.956   2.844
  241   2HH1  ARG  34          2HH1      ARG  34  12.339   3.379   2.948
  242   1HH2  ARG  34          1HH2      ARG  34  11.506   4.066   6.301
  243   2HH2  ARG  34          2HH2      ARG  34  12.424   4.588   4.928
  244    H    GLY  35           H        GLY  35   4.553  -0.666   5.495
  245   1HA   GLY  35          1HA       GLY  35   2.193  -0.391   4.828
  246   2HA   GLY  35          2HA       GLY  35   2.782   0.159   3.271
  247    H    CYS  36           H        CYS  36   4.511  -2.400   5.028
  248    HA   CYS  36           HA       CYS  36   3.414  -4.319   3.102
  249   1HB   CYS  36          1HB       CYS  36   6.222  -4.185   4.205
  250   2HB   CYS  36          2HB       CYS  36   5.594  -5.462   3.159
  251    H    CYS  37           H        CYS  37   4.141  -6.702   4.101
  252    HA   CYS  37           HA       CYS  37   3.410  -6.606   6.936
  253   1HB   CYS  37          1HB       CYS  37   1.572  -7.317   5.298
  254   2HB   CYS  37          2HB       CYS  37   2.505  -8.801   5.083
  255    H    PHE  38           H        PHE  38   4.984  -7.561   8.184
  256    HA   PHE  38           HA       PHE  38   7.053  -9.052   6.824
  257   1HB   PHE  38          1HB       PHE  38   7.350  -7.204   8.601
  258   2HB   PHE  38          2HB       PHE  38   6.640  -8.311   9.781
  259    HD1  PHE  38           HD1      PHE  38   7.915 -10.155  10.654
  260    HD2  PHE  38           HD2      PHE  38   9.566  -7.630   7.669
  261    HE1  PHE  38           HE1      PHE  38  10.189 -11.119  11.097
  262    HE2  PHE  38           HE2      PHE  38  11.840  -8.594   8.113
  263    HZ   PHE  38           HZ       PHE  38  12.125 -10.327   9.822
  264    H    ASP  39           H        ASP  39   7.136 -11.246   6.736
  265    HA   ASP  39           HA       ASP  39   5.195 -12.679   8.295
  266   1HB   ASP  39          1HB       ASP  39   5.406 -13.280   5.956
  267   2HB   ASP  39          2HB       ASP  39   7.157 -13.492   6.106
  268    H    SER  40           H        SER  40   8.536 -13.680   7.301
  269    HA   SER  40           HA       SER  40  10.342 -14.079   8.513
  270   1HB   SER  40          1HB       SER  40   9.055 -12.530  10.331
  271   2HB   SER  40          2HB       SER  40   9.045 -14.071  11.207
  272    HG   SER  40           HG       SER  40  11.512 -13.521  10.048
  273    H    ARG  41           H        ARG  41   7.261 -15.588   8.684
  274    HA   ARG  41           HA       ARG  41   7.884 -17.787  10.258
  275   1HB   ARG  41          1HB       ARG  41   5.893 -17.434   7.973
  276   2HB   ARG  41          2HB       ARG  41   5.915 -18.854   9.034
  277   1HG   ARG  41          1HG       ARG  41   5.929 -16.753  10.839
  278   2HG   ARG  41          2HG       ARG  41   4.911 -16.110   9.537
  279   1HD   ARG  41          1HD       ARG  41   3.296 -17.232  10.749
  280   2HD   ARG  41          2HD       ARG  41   3.817 -18.572   9.717
  281    HE   ARG  41           HE       ARG  41   5.525 -18.695  11.904
  282   1HH1  ARG  41          1HH1      ARG  41   2.028 -18.681  11.512
  283   2HH1  ARG  41          2HH1      ARG  41   1.736 -19.623  12.937
  284   1HH2  ARG  41          1HH2      ARG  41   5.141 -19.937  13.784
  285   2HH2  ARG  41          2HH2      ARG  41   3.520 -20.342  14.237
  286    H    ILE  42           H        ILE  42   8.144 -17.119   6.719
  287    HA   ILE  42           HA       ILE  42   9.733 -19.580   6.494
  288    HB   ILE  42           HB       ILE  42   8.194 -18.445   4.192
  289   1HG1  ILE  42          1HG1      ILE  42   7.094 -20.119   6.442
  290   2HG1  ILE  42          2HG1      ILE  42   6.434 -18.626   5.750
  291   1HG2  ILE  42          1HG2      ILE  42   8.323 -20.684   3.339
  292   2HG2  ILE  42          2HG2      ILE  42   9.947 -20.186   3.868
  293   3HG2  ILE  42          3HG2      ILE  42   8.983 -21.287   4.879
  294   1HD1  ILE  42          1HD1      ILE  42   6.330 -21.447   4.710
  295   2HD1  ILE  42          2HD1      ILE  42   5.069 -20.190   4.710
  296   3HD1  ILE  42          3HD1      ILE  42   6.392 -20.124   3.522
  297    HA   PRO  43           HA       PRO  43  12.678 -16.516   5.428
  298   1HB   PRO  43          1HB       PRO  43  14.878 -18.124   5.617
  299   2HB   PRO  43          2HB       PRO  43  14.194 -17.259   6.992
  300   1HG   PRO  43          1HG       PRO  43  14.005 -20.111   6.260
  301   2HG   PRO  43          2HG       PRO  43  13.734 -19.344   7.866
  302   1HD   PRO  43          1HD       PRO  43  11.788 -20.335   6.013
  303   2HD   PRO  43          2HD       PRO  43  11.465 -19.445   7.506
  304    H    GLY  44           H        GLY  44  11.586 -19.137   3.752
  305   1HA   GLY  44          1HA       GLY  44  13.450 -18.758   1.527
  306   2HA   GLY  44          2HA       GLY  44  12.245 -20.018   1.705
  307    H    VAL  45           H        VAL  45  10.590 -17.340   2.707
  308    HA   VAL  45           HA       VAL  45   9.770 -16.665  -0.034
  309    HB   VAL  45           HB       VAL  45   7.567 -16.827   0.520
  310   1HG1  VAL  45          1HG1      VAL  45   8.895 -18.819   2.388
  311   2HG1  VAL  45          2HG1      VAL  45   7.191 -18.879   1.875
  312   3HG1  VAL  45          3HG1      VAL  45   8.489 -19.066   0.672
  313   1HG2  VAL  45          1HG2      VAL  45   8.202 -16.601   3.480
  314   2HG2  VAL  45          2HG2      VAL  45   7.735 -15.236   2.438
  315   3HG2  VAL  45          3HG2      VAL  45   6.593 -16.573   2.717
  316    HA   PRO  46           HA       PRO  46  10.000 -12.491   1.133
  317   1HB   PRO  46          1HB       PRO  46   7.609 -11.314   0.530
  318   2HB   PRO  46          2HB       PRO  46   8.828 -11.701  -0.685
  319   1HG   PRO  46          1HG       PRO  46   6.300 -13.071  -0.029
  320   2HG   PRO  46          2HG       PRO  46   7.271 -13.172  -1.541
  321   1HD   PRO  46          1HD       PRO  46   7.061 -15.093   0.572
  322   2HD   PRO  46          2HD       PRO  46   8.154 -15.168  -0.817
  323    H    TRP  47           H        TRP  47  10.449 -11.832   3.131
  324    HA   TRP  47           HA       TRP  47   8.369 -12.288   5.105
  325   1HB   TRP  47          1HB       TRP  47  10.786 -10.992   6.042
  326   2HB   TRP  47          2HB       TRP  47  10.020 -12.491   6.570
  327    HD1  TRP  47           HD1      TRP  47  10.810 -14.772   5.179
  328    HE1  TRP  47           HE1      TRP  47  13.046 -15.436   3.945
  329    HE3  TRP  47           HE3      TRP  47  12.592 -10.030   4.742
  330    HZ2  TRP  47           HZ2      TRP  47  15.260 -13.937   2.947
  331    HZ3  TRP  47           HZ3      TRP  47  14.799  -9.717   3.625
  332    HH2  TRP  47           HH2      TRP  47  16.120 -11.575   2.744
  333    H    CYS  48           H        CYS  48   8.055 -10.296   2.881
  334    HA   CYS  48           HA       CYS  48   7.077  -8.184   4.441
  335   1HB   CYS  48          1HB       CYS  48   9.435  -7.574   4.606
  336   2HB   CYS  48          2HB       CYS  48   9.564  -7.533   2.844
  337    H    PHE  49           H        PHE  49   5.171  -8.114   3.280
  338    HA   PHE  49           HA       PHE  49   5.412  -7.583   0.425
  339   1HB   PHE  49          1HB       PHE  49   3.202  -9.203   0.525
  340   2HB   PHE  49          2HB       PHE  49   4.816  -9.845   0.204
  341    HD1  PHE  49           HD1      PHE  49   6.179 -10.422   2.422
  342    HD2  PHE  49           HD2      PHE  49   1.949 -10.214   2.155
  343    HE1  PHE  49           HE1      PHE  49   5.979 -11.895   4.446
  344    HE2  PHE  49           HE2      PHE  49   1.749 -11.687   4.178
  345    HZ   PHE  49           HZ       PHE  49   3.766 -12.510   5.298
  346    H    LYS  50           H        LYS  50   2.684  -7.547  -0.211
  347    HA   LYS  50           HA       LYS  50   1.640  -5.568   1.692
  348   1HB   LYS  50          1HB       LYS  50   0.590  -4.944  -0.815
  349   2HB   LYS  50          2HB       LYS  50   1.816  -4.038   0.089
  350   1HG   LYS  50          1HG       LYS  50   2.616  -6.424  -1.583
  351   2HG   LYS  50          2HG       LYS  50   2.324  -4.866  -2.374
  352   1HD   LYS  50          1HD       LYS  50   4.354  -5.519  -0.206
  353   2HD   LYS  50          2HD       LYS  50   4.689  -4.995  -1.865
  354   1HE   LYS  50          1HE       LYS  50   3.606  -3.394   0.468
  355   2HE   LYS  50          2HE       LYS  50   5.005  -3.033  -0.555
  356   1HZ   LYS  50          1HZ       LYS  50   3.027  -3.063  -2.314
  357   2HZ   LYS  50          2HZ       LYS  50   2.225  -2.510  -1.004
  358   3HZ   LYS  50          3HZ       LYS  50   3.538  -1.711  -1.554
  359    HA   PRO  51           HA       PRO  51  -1.301  -8.974   1.135
  360   1HB   PRO  51          1HB       PRO  51  -1.567  -9.669   3.763
  361   2HB   PRO  51          2HB       PRO  51  -0.463 -10.485   2.658
  362   1HG   PRO  51          1HG       PRO  51   0.092  -8.502   4.771
  363   2HG   PRO  51          2HG       PRO  51   1.227  -9.666   3.997
  364   1HD   PRO  51          1HD       PRO  51   0.997  -6.843   3.562
  365   2HD   PRO  51          2HD       PRO  51   2.021  -7.971   2.661
  366    H    LEU  52           H        LEU  52  -2.180  -8.210   4.330
  367    HA   LEU  52           HA       LEU  52  -4.537  -6.901   3.277
  368   1HB   LEU  52          1HB       LEU  52  -5.577  -7.555   5.136
  369   2HB   LEU  52          2HB       LEU  52  -4.262  -8.742   5.174
  370    HG   LEU  52           HG       LEU  52  -4.721  -6.320   6.888
  371   1HD1  LEU  52          1HD1      LEU  52  -4.528  -9.246   7.229
  372   2HD1  LEU  52          2HD1      LEU  52  -3.715  -8.276   8.482
  373   3HD1  LEU  52          3HD1      LEU  52  -5.447  -8.032   8.151
  374   1HD2  LEU  52          1HD2      LEU  52  -2.167  -7.042   5.787
  375   2HD2  LEU  52          2HD2      LEU  52  -2.587  -5.724   6.907
  376   3HD2  LEU  52          3HD2      LEU  52  -2.169  -7.333   7.543
  377    H    GLN  53           H        GLN  53  -1.991  -5.530   2.929
  378    HA   GLN  53           HA       GLN  53  -1.507  -3.688   4.908
  379   1HB   GLN  53          1HB       GLN  53  -1.174  -3.448   1.894
  380   2HB   GLN  53          2HB       GLN  53  -0.440  -2.341   3.067
  381   1HG   GLN  53          1HG       GLN  53   0.065  -5.329   2.764
  382   2HG   GLN  53          2HG       GLN  53   1.213  -4.022   2.439
  383   1HE2  GLN  53          1HE2      GLN  53  -0.253  -6.075   4.765
  384   2HE2  GLN  53          2HE2      GLN  53   0.603  -5.549   6.175
  385    H    GLU  54           H        GLU  54  -4.220  -4.006   2.765
  386    HA   GLU  54           HA       GLU  54  -4.992  -1.510   2.208
  387   1HB   GLU  54          1HB       GLU  54  -7.398  -2.456   2.715
  388   2HB   GLU  54          2HB       GLU  54  -6.427  -3.172   1.416
  389   1HG   GLU  54          1HG       GLU  54  -6.117  -5.135   2.563
  390   2HG   GLU  54          2HG       GLU  54  -6.027  -4.337   4.139
  391    H    ALA  55           H        ALA  55  -4.672  -2.958   5.389
  392    HA   ALA  55           HA       ALA  55  -6.426  -1.706   6.973
  393   1HB   ALA  55          1HB       ALA  55  -4.241  -1.449   8.512
  394   2HB   ALA  55          2HB       ALA  55  -4.952  -3.038   8.137
  395   3HB   ALA  55          3HB       ALA  55  -3.538  -2.458   7.225
  396    H    GLU  56           H        GLU  56  -3.199  -0.233   6.148
  397    HA   GLU  56           HA       GLU  56  -4.574   2.327   6.109
  398   1HB   GLU  56          1HB       GLU  56  -2.505   1.436   7.997
  399   2HB   GLU  56          2HB       GLU  56  -2.067   2.944   7.173
  400   1HG   GLU  56          1HG       GLU  56  -4.846   3.076   7.920
  401   2HG   GLU  56          2HG       GLU  56  -3.922   2.556   9.338
  402    H    CYS  57           H        CYS  57  -3.558   0.382   4.036
  403    HA   CYS  57           HA       CYS  57  -1.391   1.986   2.909
  404   1HB   CYS  57          1HB       CYS  57  -1.178  -0.534   3.255
  405   2HB   CYS  57          2HB       CYS  57  -2.306  -0.703   1.907
  406    H    THR  58           H        THR  58  -4.412   0.183   1.952
  407    HA   THR  58           HA       THR  58  -4.691   1.631  -0.476
  408    HB   THR  58           HB       THR  58  -5.541  -0.754   0.263
  409    HG1  THR  58           HG1      THR  58  -6.146   0.057  -1.775
  410   1HG2  THR  58          1HG2      THR  58  -7.894  -0.759   1.001
  411   2HG2  THR  58          2HG2      THR  58  -6.917   0.093   2.220
  412   3HG2  THR  58          3HG2      THR  58  -7.906   1.019   1.066
  413    H    PHE  59           H        PHE  59  -5.875   2.068   2.860
  414    HA   PHE  59           HA       PHE  59  -7.959   3.656   2.687
  415   1HB   PHE  59          1HB       PHE  59  -6.205   3.082   4.607
  416   2HB   PHE  59          2HB       PHE  59  -5.448   4.613   4.153
  417    HD1  PHE  59           HD1      PHE  59  -7.656   6.403   3.710
  418    HD2  PHE  59           HD2      PHE  59  -7.259   3.348   6.628
  419    HE1  PHE  59           HE1      PHE  59  -9.262   7.623   5.204
  420    HE2  PHE  59           HE2      PHE  59  -8.865   4.567   8.122
  421    HZ   PHE  59           HZ       PHE  59  -9.848   6.690   7.392
  422   1H    GLU   1           H1       GLU   1 -17.185  -4.187  -1.569
  423    HA   GLU   1           HA       GLU   1 -19.384  -3.861  -1.970
  424   1HB   GLU   1          1HB       GLU   1 -19.629  -4.683   0.684
  425   2HB   GLU   1          2HB       GLU   1 -20.315  -3.049   0.699
  426   1HG   GLU   1          1HG       GLU   1 -21.663  -3.772  -1.371
  427   2HG   GLU   1          2HG       GLU   1 -21.154  -5.428  -1.008
  428    H    GLU   2           H        GLU   2 -18.072  -1.915   0.813
  429    HA   GLU   2           HA       GLU   2 -18.983   0.468  -0.517
  430   1HB   GLU   2          1HB       GLU   2 -18.068  -0.276   2.215
  431   2HB   GLU   2          2HB       GLU   2 -17.694   1.379   1.708
  432   1HG   GLU   2          1HG       GLU   2 -20.393   0.779   0.920
  433   2HG   GLU   2          2HG       GLU   2 -20.206   0.298   2.615
  434    H    TYR   3           H        TYR   3 -17.387  -0.165  -2.358
  435    HA   TYR   3           HA       TYR   3 -14.622   0.458  -1.711
  436   1HB   TYR   3          1HB       TYR   3 -14.533  -0.086  -4.280
  437   2HB   TYR   3          2HB       TYR   3 -15.003  -1.415  -3.217
  438    HD1  TYR   3           HD1      TYR   3 -17.357  -2.168  -3.136
  439    HD2  TYR   3           HD2      TYR   3 -16.089   0.903  -5.832
  440    HE1  TYR   3           HE1      TYR   3 -19.500  -2.450  -4.476
  441    HE2  TYR   3           HE2      TYR   3 -18.236   0.611  -7.162
  442    HH   TYR   3           HH       TYR   3 -20.565  -0.205  -6.660
  443    H    VAL   4           H        VAL   4 -14.965   2.739  -1.150
  444    HA   VAL   4           HA       VAL   4 -15.187   4.357  -3.586
  445    HB   VAL   4           HB       VAL   4 -16.373   5.040  -0.890
  446   1HG1  VAL   4          1HG1      VAL   4 -17.199   7.019  -1.856
  447   2HG1  VAL   4          2HG1      VAL   4 -15.523   6.906  -2.445
  448   3HG1  VAL   4          3HG1      VAL   4 -16.874   6.455  -3.513
  449   1HG2  VAL   4          1HG2      VAL   4 -17.900   4.367  -3.418
  450   2HG2  VAL   4          2HG2      VAL   4 -17.525   3.163  -2.162
  451   3HG2  VAL   4          3HG2      VAL   4 -18.532   4.577  -1.768
  452    H    GLY   5           H        GLY   5 -14.422   4.647  -0.039
  453   1HA   GLY   5          1HA       GLY   5 -12.429   6.614  -0.443
  454   2HA   GLY   5          2HA       GLY   5 -12.719   5.679   1.011
  455    H    LEU   6           H        LEU   6 -12.382   3.534  -1.618
  456    HA   LEU   6           HA       LEU   6  -9.516   3.496  -1.668
  457   1HB   LEU   6          1HB       LEU   6  -9.464   1.108  -0.838
  458   2HB   LEU   6          2HB       LEU   6  -9.608   2.397   0.368
  459    HG   LEU   6           HG       LEU   6 -10.997   0.395   0.836
  460   1HD1  LEU   6          1HD1      LEU   6 -12.758   1.587   1.727
  461   2HD1  LEU   6          2HD1      LEU   6 -11.551   2.869   1.464
  462   3HD1  LEU   6          3HD1      LEU   6 -12.894   2.661   0.314
  463   1HD2  LEU   6          1HD2      LEU   6 -12.549   1.222  -1.632
  464   2HD2  LEU   6          2HD2      LEU   6 -11.523  -0.224  -1.478
  465   3HD2  LEU   6          3HD2      LEU   6 -12.991  -0.066  -0.485
  466    H    SER   7           H        SER   7 -11.874   3.821  -3.474
  467    HA   SER   7           HA       SER   7 -11.584   1.373  -5.019
  468   1HB   SER   7          1HB       SER   7 -13.822   1.555  -5.146
  469   2HB   SER   7          2HB       SER   7 -13.807   3.203  -4.491
  470    HG   SER   7           HG       SER   7 -13.445   2.371  -7.240
  471    H    ALA   8           H        ALA   8 -11.454   1.683  -7.468
  472    HA   ALA   8           HA       ALA   8  -9.322   3.371  -8.096
  473   1HB   ALA   8          1HB       ALA   8  -9.424   2.342 -10.158
  474   2HB   ALA   8          2HB       ALA   8 -10.385   1.183  -9.209
  475   3HB   ALA   8          3HB       ALA   8 -11.202   2.399 -10.221
  476    H    ASN   9           H        ASN   9  -9.740   5.535  -7.509
  477    HA   ASN   9           HA       ASN   9 -10.686   7.183  -9.376
  478   1HB   ASN   9          1HB       ASN   9 -12.916   5.877  -8.152
  479   2HB   ASN   9          2HB       ASN   9 -12.925   7.537  -7.541
  480   1HD2  ASN   9          1HD2      ASN   9 -12.702   9.267  -9.148
  481   2HD2  ASN   9          2HD2      ASN   9 -13.461   9.092 -10.696
  482    H    GLN  10           H        GLN  10 -10.387   6.294  -5.954
  483    HA   GLN  10           HA       GLN  10 -10.555   8.826  -4.843
  484   1HB   GLN  10          1HB       GLN  10 -10.554   6.509  -3.712
  485   2HB   GLN  10          2HB       GLN  10  -8.785   6.599  -3.773
  486   1HG   GLN  10          1HG       GLN  10  -8.867   8.736  -2.510
  487   2HG   GLN  10          2HG       GLN  10 -10.634   8.641  -2.448
  488   1HE2  GLN  10          1HE2      GLN  10  -8.060   6.213  -2.077
  489   2HE2  GLN  10          2HE2      GLN  10  -8.494   5.668  -0.492
  490    H    CYS  11           H        CYS  11  -7.983   7.155  -6.613
  491    HA   CYS  11           HA       CYS  11  -5.890   8.825  -5.695
  492   1HB   CYS  11          1HB       CYS  11  -5.392   6.635  -6.510
  493   2HB   CYS  11          2HB       CYS  11  -6.130   6.982  -8.078
  494    H    ALA  12           H        ALA  12  -8.658   9.492  -7.431
  495    HA   ALA  12           HA       ALA  12  -7.298  11.553  -9.030
  496   1HB   ALA  12          1HB       ALA  12  -8.608   9.592 -10.172
  497   2HB   ALA  12          2HB       ALA  12 -10.056  10.481  -9.637
  498   3HB   ALA  12          3HB       ALA  12  -8.885  11.261 -10.727
  499    H    VAL  13           H        VAL  13  -8.587  11.195  -6.118
  500    HA   VAL  13           HA       VAL  13 -10.830  12.677  -5.841
  501    HB   VAL  13           HB       VAL  13  -8.851  11.639  -4.216
  502   1HG1  VAL  13          1HG1      VAL  13  -8.301  13.448  -2.622
  503   2HG1  VAL  13          2HG1      VAL  13  -7.599  13.731  -4.233
  504   3HG1  VAL  13          3HG1      VAL  13  -9.048  14.630  -3.723
  505   1HG2  VAL  13          1HG2      VAL  13 -10.713  11.365  -3.023
  506   2HG2  VAL  13          2HG2      VAL  13 -10.667  13.085  -2.570
  507   3HG2  VAL  13          3HG2      VAL  13 -11.557  12.570  -4.023
  508    HA   PRO  14           HA       PRO  14  -9.917  16.783  -6.836
  509   1HB   PRO  14          1HB       PRO  14 -11.205  18.257  -4.930
  510   2HB   PRO  14          2HB       PRO  14 -12.033  17.519  -6.299
  511   1HG   PRO  14          1HG       PRO  14 -11.931  16.686  -3.471
  512   2HG   PRO  14          2HG       PRO  14 -13.131  16.231  -4.732
  513   1HD   PRO  14          1HD       PRO  14 -10.988  14.661  -3.664
  514   2HD   PRO  14          2HD       PRO  14 -12.043  14.226  -5.017
  515    H    ALA  15           H        ALA  15  -7.959  15.383  -5.137
  516    HA   ALA  15           HA       ALA  15  -6.174  15.843  -3.893
  517   1HB   ALA  15          1HB       ALA  15  -6.381  17.817  -6.042
  518   2HB   ALA  15          2HB       ALA  15  -5.434  18.430  -4.665
  519   3HB   ALA  15          3HB       ALA  15  -4.962  16.912  -5.463
  520    H    LYS  16           H        LYS  16  -7.981  15.924  -2.104
  521    HA   LYS  16           HA       LYS  16  -7.230  17.815  -0.249
  522   1HB   LYS  16          1HB       LYS  16  -9.374  19.164  -0.156
  523   2HB   LYS  16          2HB       LYS  16  -8.232  19.578  -1.446
  524   1HG   LYS  16          1HG       LYS  16  -9.810  19.166  -2.996
  525   2HG   LYS  16          2HG       LYS  16 -10.013  17.510  -2.401
  526   1HD   LYS  16          1HD       LYS  16 -12.154  18.599  -2.249
  527   2HD   LYS  16          2HD       LYS  16 -11.540  18.459  -0.592
  528   1HE   LYS  16          1HE       LYS  16 -10.624  20.840  -0.890
  529   2HE   LYS  16          2HE       LYS  16 -11.577  20.931  -2.379
  530   1HZ   LYS  16          1HZ       LYS  16 -12.732  20.230   0.225
  531   2HZ   LYS  16          2HZ       LYS  16 -12.668  21.765  -0.332
  532   3HZ   LYS  16          3HZ       LYS  16 -13.531  20.639  -1.141
  533    H    ASP  17           H        ASP  17  -7.692  14.985  -0.552
  534    HA   ASP  17           HA       ASP  17  -9.343  14.661   1.736
  535   1HB   ASP  17          1HB       ASP  17 -10.893  14.594  -0.331
  536   2HB   ASP  17          2HB       ASP  17 -10.090  13.074  -0.752
  537    H    ARG  18           H        ARG  18  -6.544  14.218   0.372
  538    HA   ARG  18           HA       ARG  18  -6.371  11.355   0.468
  539   1HB   ARG  18          1HB       ARG  18  -4.166  13.415   0.016
  540   2HB   ARG  18          2HB       ARG  18  -4.065  11.682  -0.342
  541   1HG   ARG  18          1HG       ARG  18  -5.242  11.896  -2.286
  542   2HG   ARG  18          2HG       ARG  18  -6.354  13.101  -1.614
  543   1HD   ARG  18          1HD       ARG  18  -4.757  14.874  -1.952
  544   2HD   ARG  18          2HD       ARG  18  -3.451  13.734  -2.307
  545    HE   ARG  18           HE       ARG  18  -5.731  13.487  -4.123
  546   1HH1  ARG  18          1HH1      ARG  18  -2.733  15.225  -3.505
  547   2HH1  ARG  18          2HH1      ARG  18  -2.504  15.677  -5.162
  548   1HH2  ARG  18          1HH2      ARG  18  -5.430  14.084  -6.308
  549   2HH2  ARG  18          2HH2      ARG  18  -4.049  15.024  -6.767
  550    H    VAL  19           H        VAL  19  -4.238  10.498   1.669
  551    HA   VAL  19           HA       VAL  19  -4.392  11.593   4.370
  552    HB   VAL  19           HB       VAL  19  -3.088   9.027   3.477
  553   1HG1  VAL  19          1HG1      VAL  19  -3.870  10.265   6.079
  554   2HG1  VAL  19          2HG1      VAL  19  -4.042   8.501   5.918
  555   3HG1  VAL  19          3HG1      VAL  19  -2.457   9.267   5.660
  556   1HG2  VAL  19          1HG2      VAL  19  -5.958   9.709   3.611
  557   2HG2  VAL  19          2HG2      VAL  19  -5.128   8.383   2.761
  558   3HG2  VAL  19          3HG2      VAL  19  -5.499   8.235   4.495
  559    H    ASP  20           H        ASP  20  -2.849  12.688   1.901
  560    HA   ASP  20           HA       ASP  20  -0.768  13.218   1.335
  561   1HB   ASP  20          1HB       ASP  20  -1.180  15.151   2.548
  562   2HB   ASP  20          2HB       ASP  20  -1.373  14.285   4.080
  563    H    CYS  21           H        CYS  21   0.222  11.031   1.188
  564    HA   CYS  21           HA       CYS  21   1.157   9.514   3.211
  565   1HB   CYS  21          1HB       CYS  21   1.279   9.389   0.530
  566   2HB   CYS  21          2HB       CYS  21   2.970   9.757   0.878
  567    H    GLY  22           H        GLY  22   2.570  12.482   1.761
  568   1HA   GLY  22          1HA       GLY  22   4.270  13.809   2.392
  569   2HA   GLY  22          2HA       GLY  22   3.926  13.294   4.031
  570    H    TYR  23           H        TYR  23   5.349  11.775   1.039
  571    HA   TYR  23           HA       TYR  23   7.274  10.401   2.724
  572   1HB   TYR  23          1HB       TYR  23   5.942  10.198   0.099
  573   2HB   TYR  23          2HB       TYR  23   7.689  10.012  -0.096
  574    HD1  TYR  23           HD1      TYR  23   4.604   8.446   0.947
  575    HD2  TYR  23           HD2      TYR  23   8.866   8.183   1.216
  576    HE1  TYR  23           HE1      TYR  23   4.416   6.013   1.664
  577    HE2  TYR  23           HE2      TYR  23   8.664   5.752   1.932
  578    HH   TYR  23           HH       TYR  23   7.330   4.137   2.451
  579    HA   PRO  24           HA       PRO  24  10.421  13.248   1.822
  580   1HB   PRO  24          1HB       PRO  24  12.577  11.801   2.670
  581   2HB   PRO  24          2HB       PRO  24  11.543  12.718   3.762
  582   1HG   PRO  24          1HG       PRO  24  11.663   9.815   3.256
  583   2HG   PRO  24          2HG       PRO  24  10.974  10.679   4.677
  584   1HD   PRO  24          1HD       PRO  24   9.582   9.433   2.508
  585   2HD   PRO  24          2HD       PRO  24   8.868  10.410   3.798
  586    H    HIS  25           H        HIS  25   9.839  10.495   0.138
  587    HA   HIS  25           HA       HIS  25  11.931  11.255  -1.767
  588   1HB   HIS  25          1HB       HIS  25  12.013   8.958  -0.415
  589   2HB   HIS  25          2HB       HIS  25  10.933   8.445  -1.717
  590    HD1  HIS  25           HD1      HIS  25  13.672   7.132  -1.546
  591    HD2  HIS  25           HD2      HIS  25  12.946  10.630  -3.746
  592    HE1  HIS  25           HE1      HIS  25  15.517   7.269  -3.304
  593    HE2  HIS  25           HE2      HIS  25  14.987   9.408  -4.658
  594    H    VAL  26           H        VAL  26   8.819  11.708  -1.166
  595    HA   VAL  26           HA       VAL  26   7.172  10.626  -2.929
  596    HB   VAL  26           HB       VAL  26   6.394  12.329  -1.526
  597   1HG1  VAL  26          1HG1      VAL  26   8.677  13.533  -1.543
  598   2HG1  VAL  26          2HG1      VAL  26   8.027  14.452  -2.922
  599   3HG1  VAL  26          3HG1      VAL  26   7.210  14.522  -1.343
  600   1HG2  VAL  26          1HG2      VAL  26   5.011  13.580  -2.928
  601   2HG2  VAL  26          2HG2      VAL  26   6.271  13.768  -4.173
  602   3HG2  VAL  26          3HG2      VAL  26   5.466  12.196  -3.951
  603    H    THR  27           H        THR  27   7.054  10.246  -5.086
  604    HA   THR  27           HA       THR  27   7.957  12.105  -7.009
  605    HB   THR  27           HB       THR  27   9.961  10.341  -5.878
  606    HG1  THR  27           HG1      THR  27  10.846  12.197  -6.693
  607   1HG2  THR  27          1HG2      THR  27  10.796   9.704  -8.306
  608   2HG2  THR  27          2HG2      THR  27   9.637   8.623  -7.494
  609   3HG2  THR  27          3HG2      THR  27   9.069   9.772  -8.730
  610    HA   PRO  28           HA       PRO  28   5.315   9.671  -9.352
  611   1HB   PRO  28          1HB       PRO  28   6.038  10.339 -11.900
  612   2HB   PRO  28          2HB       PRO  28   5.006  11.353 -10.894
  613   1HG   PRO  28          1HG       PRO  28   7.858  11.649 -11.588
  614   2HG   PRO  28          2HG       PRO  28   6.713  12.902 -10.986
  615   1HD   PRO  28          1HD       PRO  28   8.797  11.558  -9.552
  616   2HD   PRO  28          2HD       PRO  28   7.594  12.663  -8.875
  617    H    LYS  29           H        LYS  29   7.248   8.113  -8.258
  618    HA   LYS  29           HA       LYS  29   7.169   5.917  -9.939
  619   1HB   LYS  29          1HB       LYS  29   8.851   7.563 -11.126
  620   2HB   LYS  29          2HB       LYS  29   9.994   6.909  -9.943
  621   1HG   LYS  29          1HG       LYS  29  10.125   4.938 -11.043
  622   2HG   LYS  29          2HG       LYS  29   8.364   4.798 -11.172
  623   1HD   LYS  29          1HD       LYS  29   8.430   6.399 -13.098
  624   2HD   LYS  29          2HD       LYS  29  10.199   6.422 -12.996
  625   1HE   LYS  29          1HE       LYS  29   9.944   3.795 -13.169
  626   2HE   LYS  29          2HE       LYS  29   8.354   4.177 -13.848
  627   1HZ   LYS  29          1HZ       LYS  29  10.940   4.502 -14.985
  628   2HZ   LYS  29          2HZ       LYS  29   9.486   4.410 -15.722
  629   3HZ   LYS  29          3HZ       LYS  29  10.017   5.839 -15.138
  630    H    GLU  30           H        GLU  30   8.099   7.728  -7.169
  631    HA   GLU  30           HA       GLU  30   9.255   5.359  -5.948
  632   1HB   GLU  30          1HB       GLU  30   9.584   8.261  -5.611
  633   2HB   GLU  30          2HB       GLU  30   9.404   7.412  -4.066
  634   1HG   GLU  30          1HG       GLU  30  11.666   7.131  -4.320
  635   2HG   GLU  30          2HG       GLU  30  11.160   5.737  -5.288
  636    H    CYS  31           H        CYS  31   6.647   7.828  -5.576
  637    HA   CYS  31           HA       CYS  31   5.611   6.889  -3.194
  638   1HB   CYS  31          1HB       CYS  31   4.361   8.329  -5.522
  639   2HB   CYS  31          2HB       CYS  31   3.446   7.926  -4.067
  640    H    ASN  32           H        ASN  32   4.673   6.156  -6.635
  641    HA   ASN  32           HA       ASN  32   2.764   4.277  -5.969
  642   1HB   ASN  32          1HB       ASN  32   4.528   4.423  -8.463
  643   2HB   ASN  32          2HB       ASN  32   3.000   3.536  -8.351
  644   1HD2  ASN  32          1HD2      ASN  32   1.425   5.240  -6.941
  645   2HD2  ASN  32          2HD2      ASN  32   1.129   6.701  -7.823
  646    H    ASN  33           H        ASN  33   6.156   4.241  -5.566
  647    HA   ASN  33           HA       ASN  33   6.371   1.389  -5.985
  648   1HB   ASN  33          1HB       ASN  33   8.151   3.073  -6.761
  649   2HB   ASN  33          2HB       ASN  33   8.546   3.328  -5.054
  650   1HD2  ASN  33          1HD2      ASN  33  10.633   2.580  -6.141
  651   2HD2  ASN  33          2HD2      ASN  33  10.996   0.888  -6.060
  652    H    ARG  34           H        ARG  34   6.153   3.927  -3.513
  653    HA   ARG  34           HA       ARG  34   7.031   2.169  -1.436
  654   1HB   ARG  34          1HB       ARG  34   5.724   4.904  -1.133
  655   2HB   ARG  34          2HB       ARG  34   6.784   4.091   0.032
  656   1HG   ARG  34          1HG       ARG  34   8.232   4.235  -2.410
  657   2HG   ARG  34          2HG       ARG  34   7.484   5.826  -2.196
  658   1HD   ARG  34          1HD       ARG  34   8.807   6.327  -0.403
  659   2HD   ARG  34          2HD       ARG  34   8.684   4.699   0.278
  660    HE   ARG  34           HE       ARG  34  10.273   4.494  -2.051
  661   1HH1  ARG  34          1HH1      ARG  34  10.441   6.105   1.073
  662   2HH1  ARG  34          2HH1      ARG  34  12.172   6.089   1.131
  663   1HH2  ARG  34          1HH2      ARG  34  12.556   4.472  -1.974
  664   2HH2  ARG  34          2HH2      ARG  34  13.383   5.153  -0.613
  665    H    GLY  35           H        GLY  35   4.056   3.213  -3.001
  666   1HA   GLY  35          1HA       GLY  35   2.177   1.688  -2.648
  667   2HA   GLY  35          2HA       GLY  35   2.485   1.802  -0.927
  668    H    CYS  36           H        CYS  36   2.948   4.679  -2.936
  669    HA   CYS  36           HA       CYS  36   0.411   5.710  -1.889
  670   1HB   CYS  36          1HB       CYS  36   2.995   7.227  -2.258
  671   2HB   CYS  36          2HB       CYS  36   1.461   7.915  -1.721
  672    H    CYS  37           H        CYS  37  -0.249   7.762  -3.297
  673    HA   CYS  37           HA       CYS  37   0.264   7.040  -6.090
  674   1HB   CYS  37          1HB       CYS  37  -2.096   6.815  -5.013
  675   2HB   CYS  37          2HB       CYS  37  -2.160   8.569  -5.206
  676    H    PHE  38           H        PHE  38   1.039   8.680  -7.448
  677    HA   PHE  38           HA       PHE  38   1.694  11.177  -6.102
  678   1HB   PHE  38          1HB       PHE  38   3.331   9.636  -7.404
  679   2HB   PHE  38          2HB       PHE  38   2.461  10.090  -8.874
  680    HD1  PHE  38           HD1      PHE  38   2.845  12.200  -9.913
  681    HD2  PHE  38           HD2      PHE  38   4.619  11.336  -6.156
  682    HE1  PHE  38           HE1      PHE  38   4.319  14.217 -10.146
  683    HE2  PHE  38           HE2      PHE  38   6.094  13.354  -6.389
  684    HZ   PHE  38           HZ       PHE  38   5.926  14.770  -8.381
  685    H    ASP  39           H        ASP  39   0.395  12.923  -6.378
  686    HA   ASP  39           HA       ASP  39  -1.603  12.861  -8.373
  687   1HB   ASP  39          1HB       ASP  39  -2.406  14.079  -6.613
  688   2HB   ASP  39          2HB       ASP  39  -0.793  14.598  -6.100
  689    H    SER  40           H        SER  40   0.562  15.667  -7.608
  690    HA   SER  40           HA       SER  40   2.048  16.727  -8.852
  691   1HB   SER  40          1HB       SER  40   2.148  14.424 -10.198
  692   2HB   SER  40          2HB       SER  40   1.312  15.374 -11.439
  693    HG   SER  40           HG       SER  40   3.219  16.982 -10.783
  694    H    ARG  41           H        ARG  41  -1.280  16.090  -9.766
  695    HA   ARG  41           HA       ARG  41  -1.574  18.067 -11.679
  696   1HB   ARG  41          1HB       ARG  41  -3.750  17.254  -9.721
  697   2HB   ARG  41          2HB       ARG  41  -3.938  17.709 -11.424
  698   1HG   ARG  41          1HG       ARG  41  -2.177  15.527 -11.481
  699   2HG   ARG  41          2HG       ARG  41  -3.350  15.085 -10.229
  700   1HD   ARG  41          1HD       ARG  41  -4.425  14.292 -12.135
  701   2HD   ARG  41          2HD       ARG  41  -5.114  15.921 -12.050
  702    HE   ARG  41           HE       ARG  41  -3.884  16.514 -13.968
  703   1HH1  ARG  41          1HH1      ARG  41  -2.757  13.417 -12.736
  704   2HH1  ARG  41          2HH1      ARG  41  -1.781  13.074 -14.126
  705   1HH2  ARG  41          1HH2      ARG  41  -2.597  16.063 -15.802
  706   2HH2  ARG  41          2HH2      ARG  41  -1.690  14.590 -15.881
  707    H    ILE  42           H        ILE  42  -1.939  18.052  -8.085
  708    HA   ILE  42           HA       ILE  42  -2.085  20.984  -8.209
  709    HB   ILE  42           HB       ILE  42  -3.239  19.397  -5.947
  710   1HG1  ILE  42          1HG1      ILE  42  -4.407  19.756  -8.682
  711   2HG1  ILE  42          2HG1      ILE  42  -4.428  18.332  -7.629
  712   1HG2  ILE  42          1HG2      ILE  42  -4.006  22.074  -7.140
  713   2HG2  ILE  42          2HG2      ILE  42  -4.608  21.352  -5.629
  714   3HG2  ILE  42          3HG2      ILE  42  -2.905  21.852  -5.760
  715   1HD1  ILE  42          1HD1      ILE  42  -5.880  19.803  -6.035
  716   2HD1  ILE  42          2HD1      ILE  42  -6.091  20.865  -7.448
  717   3HD1  ILE  42          3HD1      ILE  42  -6.643  19.174  -7.515
  718    HA   PRO  43           HA       PRO  43   1.710  20.303  -6.090
  719   1HB   PRO  43          1HB       PRO  43   2.751  22.789  -6.543
  720   2HB   PRO  43          2HB       PRO  43   2.958  21.439  -7.657
  721   1HG   PRO  43          1HG       PRO  43   1.170  23.780  -7.822
  722   2HG   PRO  43          2HG       PRO  43   1.721  22.693  -9.147
  723   1HD   PRO  43          1HD       PRO  43  -0.834  22.776  -7.857
  724   2HD   PRO  43          2HD       PRO  43  -0.290  21.584  -9.045
  725    H    GLY  44           H        GLY  44  -0.943  22.085  -5.349
  726   1HA   GLY  44          1HA       GLY  44   0.249  23.321  -2.982
  727   2HA   GLY  44          2HA       GLY  44  -1.374  23.550  -3.603
  728    H    VAL  45           H        VAL  45  -0.964  20.275  -3.879
  729    HA   VAL  45           HA       VAL  45  -1.856  19.799  -1.119
  730    HB   VAL  45           HB       VAL  45  -3.599  18.503  -1.828
  731   1HG1  VAL  45          1HG1      VAL  45  -3.784  20.934  -2.608
  732   2HG1  VAL  45          2HG1      VAL  45  -3.457  20.316  -4.245
  733   3HG1  VAL  45          3HG1      VAL  45  -4.893  19.758  -3.354
  734   1HG2  VAL  45          1HG2      VAL  45  -2.167  17.039  -3.273
  735   2HG2  VAL  45          2HG2      VAL  45  -3.794  17.344  -3.929
  736   3HG2  VAL  45          3HG2      VAL  45  -2.388  18.210  -4.595
  737    HA   PRO  46           HA       PRO  46   0.849  16.400  -1.075
  738   1HB   PRO  46          1HB       PRO  46  -0.574  14.170  -0.395
  739   2HB   PRO  46          2HB       PRO  46  -0.086  15.396   0.773
  740   1HG   PRO  46          1HG       PRO  46  -2.719  14.893  -0.460
  741   2HG   PRO  46          2HG       PRO  46  -2.341  15.797   1.052
  742   1HD   PRO  46          1HD       PRO  46  -3.067  16.841  -1.514
  743   2HD   PRO  46          2HD       PRO  46  -2.548  17.774  -0.104
  744    H    TRP  47           H        TRP  47   2.067  15.666  -2.686
  745    HA   TRP  47           HA       TRP  47   0.587  14.511  -4.918
  746   1HB   TRP  47          1HB       TRP  47   3.468  14.775  -5.222
  747   2HB   TRP  47          2HB       TRP  47   2.153  15.359  -6.244
  748    HD1  TRP  47           HD1      TRP  47   1.050  17.825  -5.392
  749    HE1  TRP  47           HE1      TRP  47   2.166  19.951  -4.296
  750    HE3  TRP  47           HE3      TRP  47   5.237  15.440  -3.768
  751    HZ2  TRP  47           HZ2      TRP  47   4.620  20.385  -2.905
  752    HZ3  TRP  47           HZ3      TRP  47   6.944  16.787  -2.551
  753    HH2  TRP  47           HH2      TRP  47   6.687  19.178  -2.111
  754    H    CYS  48           H        CYS  48   0.891  13.137  -2.279
  755    HA   CYS  48           HA       CYS  48   1.766  10.648  -3.302
  756   1HB   CYS  48          1HB       CYS  48   3.935  11.788  -2.706
  757   2HB   CYS  48          2HB       CYS  48   3.421  11.727  -1.018
  758    H    PHE  49           H        PHE  49  -0.066   9.590  -2.581
  759    HA   PHE  49           HA       PHE  49  -0.535   9.611   0.282
  760   1HB   PHE  49          1HB       PHE  49  -3.103   9.737  -0.655
  761   2HB   PHE  49          2HB       PHE  49  -2.209  11.192  -0.199
  762    HD1  PHE  49           HD1      PHE  49  -0.772  12.235  -2.159
  763    HD2  PHE  49           HD2      PHE  49  -4.097   9.659  -2.723
  764    HE1  PHE  49           HE1      PHE  49  -1.068  13.127  -4.486
  765    HE2  PHE  49           HE2      PHE  49  -4.392  10.551  -5.050
  766    HZ   PHE  49           HZ       PHE  49  -2.874  12.274  -5.904
  767    H    LYS  50           H        LYS  50  -2.889   8.129   0.361
  768    HA   LYS  50           HA       LYS  50  -2.188   5.747  -1.210
  769   1HB   LYS  50          1HB       LYS  50  -3.459   4.955   1.189
  770   2HB   LYS  50          2HB       LYS  50  -1.793   4.635   0.671
  771   1HG   LYS  50          1HG       LYS  50  -2.520   7.307   1.881
  772   2HG   LYS  50          2HG       LYS  50  -2.260   5.913   2.944
  773   1HD   LYS  50          1HD       LYS  50  -0.308   7.220   1.020
  774   2HD   LYS  50          2HD       LYS  50  -0.136   7.020   2.772
  775   1HE   LYS  50          1HE       LYS  50   0.105   4.945   0.576
  776   2HE   LYS  50          2HE       LYS  50   1.277   5.342   1.843
  777   1HZ   LYS  50          1HZ       LYS  50  -0.897   3.537   1.906
  778   2HZ   LYS  50          2HZ       LYS  50   0.376   3.659   2.922
  779   3HZ   LYS  50          3HZ       LYS  50  -0.954   4.574   3.166
  780    HA   PRO  51           HA       PRO  51  -6.468   6.990  -2.018
  781   1HB   PRO  51          1HB       PRO  51  -6.297   7.141  -4.740
  782   2HB   PRO  51          2HB       PRO  51  -6.121   8.540  -3.684
  783   1HG   PRO  51          1HG       PRO  51  -4.071   6.979  -5.123
  784   2HG   PRO  51          2HG       PRO  51  -3.952   8.649  -4.461
  785   1HD   PRO  51          1HD       PRO  51  -2.832   6.234  -3.406
  786   2HD   PRO  51          2HD       PRO  51  -2.823   7.824  -2.636
  787    H    LEU  52           H        LEU  52  -5.748   5.475  -5.010
  788    HA   LEU  52           HA       LEU  52  -7.277   3.174  -4.063
  789   1HB   LEU  52          1HB       LEU  52  -8.133   2.995  -6.105
  790   2HB   LEU  52          2HB       LEU  52  -7.684   4.707  -6.213
  791    HG   LEU  52           HG       LEU  52  -6.405   2.300  -7.481
  792   1HD1  LEU  52          1HD1      LEU  52  -6.395   4.372  -9.284
  793   2HD1  LEU  52          2HD1      LEU  52  -7.646   3.113  -9.154
  794   3HD1  LEU  52          3HD1      LEU  52  -7.877   4.685  -8.349
  795   1HD2  LEU  52          1HD2      LEU  52  -4.340   3.062  -7.233
  796   2HD2  LEU  52          2HD2      LEU  52  -4.805   4.576  -8.047
  797   3HD2  LEU  52          3HD2      LEU  52  -4.940   4.439  -6.278
  798    H    GLN  53           H        GLN  53  -4.560   3.519  -3.144
  799    HA   GLN  53           HA       GLN  53  -2.632   2.350  -4.603
  800   1HB   GLN  53          1HB       GLN  53  -3.215   2.055  -1.634
  801   2HB   GLN  53          2HB       GLN  53  -1.679   1.578  -2.381
  802   1HG   GLN  53          1HG       GLN  53  -2.908   4.369  -2.402
  803   2HG   GLN  53          2HG       GLN  53  -1.543   3.855  -1.399
  804   1HE2  GLN  53          1HE2      GLN  53  -0.091   2.328  -3.116
  805   2HE2  GLN  53          2HE2      GLN  53   0.540   3.276  -4.421
  806    H    GLU  54           H        GLU  54  -5.565   0.883  -3.414
  807    HA   GLU  54           HA       GLU  54  -5.070  -1.632  -2.888
  808   1HB   GLU  54          1HB       GLU  54  -7.204  -2.208  -3.802
  809   2HB   GLU  54          2HB       GLU  54  -7.330  -0.522  -3.269
  810   1HG   GLU  54          1HG       GLU  54  -8.181  -0.190  -5.357
  811   2HG   GLU  54          2HG       GLU  54  -6.482  -0.181  -5.859
  812    H    ALA  55           H        ALA  55  -4.413  -0.054  -5.984
  813    HA   ALA  55           HA       ALA  55  -4.351  -1.880  -7.864
  814   1HB   ALA  55          1HB       ALA  55  -1.773  -0.869  -8.083
  815   2HB   ALA  55          2HB       ALA  55  -3.255  -0.077  -8.673
  816   3HB   ALA  55          3HB       ALA  55  -2.596   0.345  -7.074
  817    H    GLU  56           H        GLU  56  -1.640  -1.646  -5.444
  818    HA   GLU  56           HA       GLU  56  -1.485  -4.532  -5.560
  819   1HB   GLU  56          1HB       GLU  56   0.380  -2.796  -6.861
  820   2HB   GLU  56          2HB       GLU  56   1.214  -3.523  -5.477
  821   1HG   GLU  56          1HG       GLU  56   0.301  -5.774  -6.287
  822   2HG   GLU  56          2HG       GLU  56  -0.204  -4.948  -7.770
  823    H    CYS  57           H        CYS  57  -2.226  -2.103  -3.701
  824    HA   CYS  57           HA       CYS  57  -0.301  -2.485  -1.583
  825   1HB   CYS  57          1HB       CYS  57  -2.008  -0.403  -2.381
  826   2HB   CYS  57          2HB       CYS  57  -2.622  -0.952  -0.819
  827    H    THR  58           H        THR  58  -3.905  -2.766  -2.066
  828    HA   THR  58           HA       THR  58  -4.236  -4.301   0.311
  829    HB   THR  58           HB       THR  58  -5.938  -2.745  -0.791
  830    HG1  THR  58           HG1      THR  58  -6.173  -4.945   0.578
  831   1HG2  THR  58          1HG2      THR  58  -6.209  -5.144  -2.680
  832   2HG2  THR  58          2HG2      THR  58  -7.339  -3.772  -2.585
  833   3HG2  THR  58          3HG2      THR  58  -5.675  -3.516  -3.161
  834    H    PHE  59           H        PHE  59  -4.017  -5.077  -3.201
  835    HA   PHE  59           HA       PHE  59  -4.714  -7.661  -3.228
  836   1HB   PHE  59          1HB       PHE  59  -2.730  -5.871  -4.551
  837   2HB   PHE  59          2HB       PHE  59  -2.307  -7.581  -4.696
  838    HD1  PHE  59           HD1      PHE  59  -5.512  -5.656  -4.868
  839    HD2  PHE  59           HD2      PHE  59  -2.889  -8.404  -6.760
  840    HE1  PHE  59           HE1      PHE  59  -7.122  -5.876  -6.780
  841    HE2  PHE  59           HE2      PHE  59  -4.500  -8.625  -8.671
  842    HZ   PHE  59           HZ       PHE  59  -6.598  -7.359  -8.660
  Start of MODEL   20
    1   1H    GLU   1           H1       GLU   1 -12.914  -9.289  -5.514
    2    HA   GLU   1           HA       GLU   1 -14.681  -7.908  -5.222
    3   1HB   GLU   1          1HB       GLU   1 -16.049  -9.097  -6.940
    4   2HB   GLU   1          2HB       GLU   1 -16.522 -10.291  -5.718
    5   1HG   GLU   1          1HG       GLU   1 -18.310  -8.765  -5.695
    6   2HG   GLU   1          2HG       GLU   1 -17.318  -8.208  -4.337
    7    H    GLU   2           H        GLU   2 -14.052 -11.075  -3.895
    8    HA   GLU   2           HA       GLU   2 -15.496 -10.466  -1.474
    9   1HB   GLU   2          1HB       GLU   2 -14.853 -12.829  -2.836
   10   2HB   GLU   2          2HB       GLU   2 -13.824 -12.873  -1.393
   11   1HG   GLU   2          1HG       GLU   2 -15.609 -13.108   0.018
   12   2HG   GLU   2          2HG       GLU   2 -16.641 -12.018  -0.920
   13    H    TYR   3           H        TYR   3 -14.378  -8.779  -0.445
   14    HA   TYR   3           HA       TYR   3 -11.569  -8.656  -0.319
   15   1HB   TYR   3          1HB       TYR   3 -13.596  -7.566   1.701
   16   2HB   TYR   3          2HB       TYR   3 -12.108  -6.782   1.157
   17    HD1  TYR   3           HD1      TYR   3 -15.525  -6.516   1.019
   18    HD2  TYR   3           HD2      TYR   3 -12.151  -6.524  -1.611
   19    HE1  TYR   3           HE1      TYR   3 -16.856  -5.203  -0.703
   20    HE2  TYR   3           HE2      TYR   3 -13.494  -5.212  -3.326
   21    HH   TYR   3           HH       TYR   3 -16.885  -4.780  -3.012
   22    H    VAL   4           H        VAL   4 -11.346 -11.080   0.287
   23    HA   VAL   4           HA       VAL   4 -11.264 -11.218   3.218
   24    HB   VAL   4           HB       VAL   4 -13.130 -12.541   2.433
   25   1HG1  VAL   4          1HG1      VAL   4 -13.066 -14.140   0.751
   26   2HG1  VAL   4          2HG1      VAL   4 -11.986 -12.882   0.104
   27   3HG1  VAL   4          3HG1      VAL   4 -11.301 -14.341   0.861
   28   1HG2  VAL   4          1HG2      VAL   4 -12.604 -13.929   4.096
   29   2HG2  VAL   4          2HG2      VAL   4 -11.632 -14.894   2.960
   30   3HG2  VAL   4          3HG2      VAL   4 -10.873 -13.574   3.881
   31    H    GLY   5           H        GLY   5 -10.055 -12.634   0.100
   32   1HA   GLY   5          1HA       GLY   5  -7.691 -13.696   1.271
   33   2HA   GLY   5          2HA       GLY   5  -8.046 -13.510  -0.435
   34    H    LEU   6           H        LEU   6  -8.634 -10.495   0.920
   35    HA   LEU   6           HA       LEU   6  -5.833  -9.670   0.679
   36   1HB   LEU   6          1HB       LEU   6  -6.987  -7.562  -0.412
   37   2HB   LEU   6          2HB       LEU   6  -6.415  -8.944  -1.364
   38    HG   LEU   6           HG       LEU   6  -9.173  -9.284  -0.498
   39   1HD1  LEU   6          1HD1      LEU   6  -8.997  -7.106  -2.515
   40   2HD1  LEU   6          2HD1      LEU   6 -10.251  -7.459  -1.303
   41   3HD1  LEU   6          3HD1      LEU   6  -8.737  -6.664  -0.810
   42   1HD2  LEU   6          1HD2      LEU   6  -7.497  -9.642  -2.891
   43   2HD2  LEU   6          2HD2      LEU   6  -8.810 -10.651  -2.237
   44   3HD2  LEU   6          3HD2      LEU   6  -9.193  -9.221  -3.226
   45    H    SER   7           H        SER   7  -8.110 -10.188   2.815
   46    HA   SER   7           HA       SER   7  -7.992  -7.524   3.981
   47   1HB   SER   7          1HB       SER   7 -10.252  -8.444   3.685
   48   2HB   SER   7          2HB       SER   7  -9.816  -9.884   4.623
   49    HG   SER   7           HG       SER   7 -10.293  -7.201   5.483
   50    H    ALA   8           H        ALA   8  -8.641  -8.570   6.695
   51    HA   ALA   8           HA       ALA   8  -5.997  -9.009   7.581
   52   1HB   ALA   8          1HB       ALA   8  -6.899  -8.605   9.640
   53   2HB   ALA   8          2HB       ALA   8  -8.288  -8.039   8.681
   54   3HB   ALA   8          3HB       ALA   8  -8.286  -9.684   9.360
   55    H    ASN   9           H        ASN   9  -5.330 -10.885   6.308
   56    HA   ASN   9           HA       ASN   9  -5.358 -13.193   7.702
   57   1HB   ASN   9          1HB       ASN   9  -7.892 -12.913   6.594
   58   2HB   ASN   9          2HB       ASN   9  -7.077 -13.906   5.377
   59   1HD2  ASN   9          1HD2      ASN   9  -5.405 -15.454   6.749
   60   2HD2  ASN   9          2HD2      ASN   9  -6.226 -16.490   7.866
   61    H    GLN  10           H        GLN  10  -5.420 -11.490   4.572
   62    HA   GLN  10           HA       GLN  10  -4.178 -13.398   3.016
   63   1HB   GLN  10          1HB       GLN  10  -5.303 -11.313   2.208
   64   2HB   GLN  10          2HB       GLN  10  -3.919 -10.368   2.788
   65   1HG   GLN  10          1HG       GLN  10  -2.427 -11.669   1.282
   66   2HG   GLN  10          2HG       GLN  10  -3.817 -12.596   0.698
   67   1HE2  GLN  10          1HE2      GLN  10  -3.158  -9.164   1.404
   68   2HE2  GLN  10          2HE2      GLN  10  -3.658  -8.525  -0.126
   69    H    CYS  11           H        CYS  11  -2.908 -11.073   5.397
   70    HA   CYS  11           HA       CYS  11  -0.231 -11.201   4.597
   71   1HB   CYS  11          1HB       CYS  11  -1.017  -9.423   5.986
   72   2HB   CYS  11          2HB       CYS  11  -1.500 -10.547   7.260
   73    H    ALA  12           H        ALA  12  -2.337 -13.592   5.743
   74    HA   ALA  12           HA       ALA  12  -0.152 -15.069   7.038
   75   1HB   ALA  12          1HB       ALA  12  -1.905 -16.356   8.135
   76   2HB   ALA  12          2HB       ALA  12  -2.214 -14.621   8.388
   77   3HB   ALA  12          3HB       ALA  12  -3.159 -15.528   7.181
   78    H    VAL  13           H        VAL  13  -1.035 -14.564   4.040
   79    HA   VAL  13           HA       VAL  13  -2.093 -16.721   2.855
   80    HB   VAL  13           HB       VAL  13  -0.594 -14.512   2.113
   81   1HG1  VAL  13          1HG1      VAL  13   1.476 -15.809   2.143
   82   2HG1  VAL  13          2HG1      VAL  13   0.752 -17.024   1.063
   83   3HG1  VAL  13          3HG1      VAL  13   1.042 -15.371   0.474
   84   1HG2  VAL  13          1HG2      VAL  13  -2.052 -14.690   0.438
   85   2HG2  VAL  13          2HG2      VAL  13  -1.171 -16.094  -0.207
   86   3HG2  VAL  13          3HG2      VAL  13  -2.472 -16.331   0.985
   87    HA   PRO  14           HA       PRO  14   0.502 -20.126   3.439
   88   1HB   PRO  14          1HB       PRO  14   0.407 -21.452   1.053
   89   2HB   PRO  14          2HB       PRO  14  -0.881 -21.533   2.253
   90   1HG   PRO  14          1HG       PRO  14  -0.742 -20.027  -0.279
   91   2HG   PRO  14          2HG       PRO  14  -2.198 -20.485   0.676
   92   1HD   PRO  14          1HD       PRO  14  -0.936 -17.922   0.474
   93   2HD   PRO  14          2HD       PRO  14  -2.269 -18.361   1.550
   94    H    ALA  15           H        ALA  15   1.792 -17.626   2.571
   95    HA   ALA  15           HA       ALA  15   3.760 -16.924   1.821
   96   1HB   ALA  15          1HB       ALA  15   5.058 -19.551   2.411
   97   2HB   ALA  15          2HB       ALA  15   5.513 -17.909   2.926
   98   3HB   ALA  15          3HB       ALA  15   4.185 -18.762   3.747
   99    H    LYS  16           H        LYS  16   2.691 -17.040  -0.396
  100    HA   LYS  16           HA       LYS  16   4.394 -17.727  -2.326
  101   1HB   LYS  16          1HB       LYS  16   3.264 -19.929  -3.175
  102   2HB   LYS  16          2HB       LYS  16   4.581 -19.992  -1.992
  103   1HG   LYS  16          1HG       LYS  16   3.230 -20.962  -0.472
  104   2HG   LYS  16          2HG       LYS  16   2.029 -19.669  -0.629
  105   1HD   LYS  16          1HD       LYS  16   2.305 -22.029  -2.536
  106   2HD   LYS  16          2HD       LYS  16   1.143 -21.964  -1.201
  107   1HE   LYS  16          1HE       LYS  16   0.447 -19.669  -2.341
  108   2HE   LYS  16          2HE       LYS  16   1.201 -20.382  -3.777
  109   1HZ   LYS  16          1HZ       LYS  16  -0.284 -22.381  -2.960
  110   2HZ   LYS  16          2HZ       LYS  16  -1.195 -21.156  -2.378
  111   3HZ   LYS  16          3HZ       LYS  16  -0.848 -21.231  -3.973
  112    H    ASP  17           H        ASP  17   2.711 -15.671  -1.971
  113    HA   ASP  17           HA       ASP  17   1.161 -15.815  -4.319
  114   1HB   ASP  17          1HB       ASP  17  -0.325 -16.865  -2.502
  115   2HB   ASP  17          2HB       ASP  17  -0.372 -15.267  -1.743
  116    H    ARG  18           H        ARG  18   2.386 -14.287  -1.376
  117    HA   ARG  18           HA       ARG  18   1.413 -11.800  -1.475
  118   1HB   ARG  18          1HB       ARG  18   4.338 -12.536  -1.008
  119   2HB   ARG  18          2HB       ARG  18   3.540 -11.071  -0.410
  120   1HG   ARG  18          1HG       ARG  18   2.560 -12.179   1.317
  121   2HG   ARG  18          2HG       ARG  18   2.147 -13.585   0.319
  122   1HD   ARG  18          1HD       ARG  18   4.416 -14.456   0.532
  123   2HD   ARG  18          2HD       ARG  18   4.959 -12.987   1.355
  124    HE   ARG  18           HE       ARG  18   2.731 -14.456   2.633
  125   1HH1  ARG  18          1HH1      ARG  18   6.195 -13.844   2.527
  126   2HH1  ARG  18          2HH1      ARG  18   6.479 -14.441   4.128
  127   1HH2  ARG  18          1HH2      ARG  18   3.105 -15.243   4.745
  128   2HH2  ARG  18          2HH2      ARG  18   4.709 -15.242   5.398
  129    H    VAL  19           H        VAL  19   2.968  -9.744  -2.088
  130    HA   VAL  19           HA       VAL  19   3.594 -10.124  -4.930
  131    HB   VAL  19           HB       VAL  19   3.020  -7.520  -3.526
  132   1HG1  VAL  19          1HG1      VAL  19   2.109  -7.612  -6.224
  133   2HG1  VAL  19          2HG1      VAL  19   3.436  -6.647  -5.533
  134   3HG1  VAL  19          3HG1      VAL  19   3.763  -8.269  -6.189
  135   1HG2  VAL  19          1HG2      VAL  19   0.951  -8.323  -3.120
  136   2HG2  VAL  19          2HG2      VAL  19   0.702  -8.076  -4.865
  137   3HG2  VAL  19          3HG2      VAL  19   1.147  -9.685  -4.250
  138    H    ASP  20           H        ASP  20   5.259 -10.617  -2.352
  139    HA   ASP  20           HA       ASP  20   7.196 -10.017  -1.476
  140   1HB   ASP  20          1HB       ASP  20   8.160 -11.418  -3.047
  141   2HB   ASP  20          2HB       ASP  20   7.571 -10.469  -4.421
  142    H    CYS  21           H        CYS  21   6.803  -7.828  -0.678
  143    HA   CYS  21           HA       CYS  21   6.689  -5.553  -2.159
  144   1HB   CYS  21          1HB       CYS  21   6.553  -6.114   0.455
  145   2HB   CYS  21          2HB       CYS  21   8.159  -5.381   0.415
  146    H    GLY  22           H        GLY  22   9.513  -7.487  -1.087
  147   1HA   GLY  22          1HA       GLY  22  11.708  -7.353  -1.558
  148   2HA   GLY  22          2HA       GLY  22  11.204  -6.747  -3.123
  149    H    TYR  23           H        TYR  23  11.353  -5.521   0.306
  150    HA   TYR  23           HA       TYR  23  12.083  -2.903  -0.727
  151   1HB   TYR  23          1HB       TYR  23  10.803  -4.178   1.594
  152   2HB   TYR  23          2HB       TYR  23  12.102  -3.119   2.153
  153    HD1  TYR  23           HD1      TYR  23  12.024  -0.674   1.592
  154    HD2  TYR  23           HD2      TYR  23   8.752  -3.300   0.757
  155    HE1  TYR  23           HE1      TYR  23  10.473   1.325   1.347
  156    HE2  TYR  23           HE2      TYR  23   7.212  -1.292   0.515
  157    HH   TYR  23           HH       TYR  23   8.251   1.726   0.020
  158    HA   PRO  24           HA       PRO  24  16.283  -3.489   0.175
  159   1HB   PRO  24          1HB       PRO  24  17.129  -0.893   0.092
  160   2HB   PRO  24          2HB       PRO  24  16.901  -1.879  -1.352
  161   1HG   PRO  24          1HG       PRO  24  15.209   0.262  -0.231
  162   2HG   PRO  24          2HG       PRO  24  15.232  -0.389  -1.908
  163   1HD   PRO  24          1HD       PRO  24  13.309  -0.868   0.161
  164   2HD   PRO  24          2HD       PRO  24  13.376  -1.655  -1.422
  165    H    HIS  25           H        HIS  25  14.121  -2.004   2.222
  166    HA   HIS  25           HA       HIS  25  16.169  -2.049   4.319
  167   1HB   HIS  25          1HB       HIS  25  14.668   0.141   3.436
  168   2HB   HIS  25          2HB       HIS  25  13.896  -0.357   4.946
  169    HD1  HIS  25           HD1      HIS  25  15.668  -0.611   7.057
  170    HD2  HIS  25           HD2      HIS  25  16.894   1.684   3.767
  171    HE1  HIS  25           HE1      HIS  25  17.605   0.834   7.875
  172    HE2  HIS  25           HE2      HIS  25  18.351   2.182   5.796
  173    H    VAL  26           H        VAL  26  14.072  -4.030   3.103
  174    HA   VAL  26           HA       VAL  26  11.938  -4.495   4.639
  175    HB   VAL  26           HB       VAL  26  12.424  -5.918   2.837
  176   1HG1  VAL  26          1HG1      VAL  26  14.842  -5.744   2.781
  177   2HG1  VAL  26          2HG1      VAL  26  14.980  -6.691   4.282
  178   3HG1  VAL  26          3HG1      VAL  26  14.375  -7.462   2.796
  179   1HG2  VAL  26          1HG2      VAL  26  11.700  -7.892   3.704
  180   2HG2  VAL  26          2HG2      VAL  26  12.972  -7.942   4.948
  181   3HG2  VAL  26          3HG2      VAL  26  11.540  -6.912   5.181
  182    H    THR  27           H        THR  27  11.465  -4.857   6.754
  183    HA   THR  27           HA       THR  27  13.209  -6.267   8.479
  184    HB   THR  27           HB       THR  27  13.686  -3.412   8.135
  185    HG1  THR  27           HG1      THR  27  15.317  -5.037   8.452
  186   1HG2  THR  27          1HG2      THR  27  13.878  -3.150  10.760
  187   2HG2  THR  27          2HG2      THR  27  12.314  -2.805   9.983
  188   3HG2  THR  27          3HG2      THR  27  12.576  -4.363  10.802
  189    HA   PRO  28           HA       PRO  28   9.463  -6.618  10.540
  190   1HB   PRO  28          1HB       PRO  28  10.278  -7.503  12.992
  191   2HB   PRO  28          2HB       PRO  28  10.138  -8.555  11.585
  192   1HG   PRO  28          1HG       PRO  28  12.535  -7.392  12.853
  193   2HG   PRO  28          2HG       PRO  28  12.425  -8.813  11.753
  194   1HD   PRO  28          1HD       PRO  28  13.353  -6.169  11.161
  195   2HD   PRO  28          2HD       PRO  28  13.114  -7.487  10.006
  196    H    LYS  29           H        LYS  29   9.874  -4.038  10.239
  197    HA   LYS  29           HA       LYS  29   8.473  -2.926  12.316
  198   1HB   LYS  29          1HB       LYS  29  10.850  -3.521  13.377
  199   2HB   LYS  29          2HB       LYS  29  11.254  -1.932  12.703
  200   1HG   LYS  29          1HG       LYS  29  10.194  -0.943  14.422
  201   2HG   LYS  29          2HG       LYS  29   8.675  -1.730  13.961
  202   1HD   LYS  29          1HD       LYS  29  10.103  -3.779  15.188
  203   2HD   LYS  29          2HD       LYS  29  10.555  -2.363  16.153
  204   1HE   LYS  29          1HE       LYS  29   7.738  -2.212  15.653
  205   2HE   LYS  29          2HE       LYS  29   8.084  -3.865  16.182
  206   1HZ   LYS  29          1HZ       LYS  29   8.168  -1.446  17.655
  207   2HZ   LYS  29          2HZ       LYS  29   8.094  -2.986  18.194
  208   3HZ   LYS  29          3HZ       LYS  29   9.539  -2.315  17.836
  209    H    GLU  30           H        GLU  30  10.557  -2.845   9.535
  210    HA   GLU  30           HA       GLU  30   9.905  -0.053   9.095
  211   1HB   GLU  30          1HB       GLU  30  12.097  -1.839   8.326
  212   2HB   GLU  30          2HB       GLU  30  11.476  -0.923   6.943
  213   1HG   GLU  30          1HG       GLU  30  12.962   0.638   7.737
  214   2HG   GLU  30          2HG       GLU  30  11.589   1.081   8.762
  215    H    CYS  31           H        CYS  31   9.602  -3.342   7.634
  216    HA   CYS  31           HA       CYS  31   8.361  -2.608   5.293
  217   1HB   CYS  31          1HB       CYS  31   8.224  -5.081   6.991
  218   2HB   CYS  31          2HB       CYS  31   7.280  -4.940   5.505
  219    H    ASN  32           H        ASN  32   6.954  -3.495   8.527
  220    HA   ASN  32           HA       ASN  32   4.325  -3.041   7.723
  221   1HB   ASN  32          1HB       ASN  32   5.805  -3.575  10.238
  222   2HB   ASN  32          2HB       ASN  32   4.335  -2.619  10.484
  223   1HD2  ASN  32          1HD2      ASN  32   5.420  -5.348   8.458
  224   2HD2  ASN  32          2HD2      ASN  32   4.069  -6.390   8.755
  225    H    ASN  33           H        ASN  33   6.889  -0.903   7.979
  226    HA   ASN  33           HA       ASN  33   5.251   1.237   9.063
  227   1HB   ASN  33          1HB       ASN  33   7.696   0.687   9.852
  228   2HB   ASN  33          2HB       ASN  33   8.202   1.462   8.343
  229   1HD2  ASN  33          1HD2      ASN  33   9.258   2.831  10.040
  230   2HD2  ASN  33          2HD2      ASN  33   8.399   4.218  10.620
  231    H    ARG  34           H        ARG  34   6.914  -0.055   6.202
  232    HA   ARG  34           HA       ARG  34   6.699   2.398   4.768
  233   1HB   ARG  34          1HB       ARG  34   7.282  -0.327   3.557
  234   2HB   ARG  34          2HB       ARG  34   7.848   1.257   2.996
  235   1HG   ARG  34          1HG       ARG  34   8.795   1.072   5.630
  236   2HG   ARG  34          2HG       ARG  34   9.019  -0.565   4.984
  237   1HD   ARG  34          1HD       ARG  34  10.623   0.113   3.491
  238   2HD   ARG  34          2HD       ARG  34   9.828   1.661   3.163
  239    HE   ARG  34           HE       ARG  34  11.962   1.210   5.026
  240   1HH1  ARG  34          1HH1      ARG  34   8.936   2.983   4.747
  241   2HH1  ARG  34          2HH1      ARG  34   9.417   4.233   5.846
  242   1HH2  ARG  34          1HH2      ARG  34  12.598   2.857   6.476
  243   2HH2  ARG  34          2HH2      ARG  34  11.515   4.160   6.836
  244    H    GLY  35           H        GLY  35   4.804  -0.501   5.353
  245   1HA   GLY  35          1HA       GLY  35   2.425  -0.219   4.827
  246   2HA   GLY  35          2HA       GLY  35   2.909   0.316   3.230
  247    H    CYS  36           H        CYS  36   4.731  -2.260   4.858
  248    HA   CYS  36           HA       CYS  36   3.463  -4.170   3.031
  249   1HB   CYS  36          1HB       CYS  36   6.344  -4.117   3.937
  250   2HB   CYS  36          2HB       CYS  36   5.608  -5.336   2.892
  251    H    CYS  37           H        CYS  37   4.270  -6.559   3.993
  252    HA   CYS  37           HA       CYS  37   3.708  -6.441   6.866
  253   1HB   CYS  37          1HB       CYS  37   1.781  -7.177   5.349
  254   2HB   CYS  37          2HB       CYS  37   2.711  -8.655   5.082
  255    H    PHE  38           H        PHE  38   5.260  -7.498   8.076
  256    HA   PHE  38           HA       PHE  38   7.328  -8.896   6.614
  257   1HB   PHE  38          1HB       PHE  38   7.627  -7.119   8.468
  258   2HB   PHE  38          2HB       PHE  38   6.967  -8.296   9.609
  259    HD1  PHE  38           HD1      PHE  38   8.310 -10.105  10.411
  260    HD2  PHE  38           HD2      PHE  38   9.816  -7.503   7.417
  261    HE1  PHE  38           HE1      PHE  38  10.613 -11.042  10.756
  262    HE2  PHE  38           HE2      PHE  38  12.119  -8.439   7.761
  263    HZ   PHE  38           HZ       PHE  38  12.490 -10.197   9.426
  264    H    ASP  39           H        ASP  39   7.376 -11.079   6.389
  265    HA   ASP  39           HA       ASP  39   5.464 -12.609   7.848
  266   1HB   ASP  39          1HB       ASP  39   5.613 -13.567   5.781
  267   2HB   ASP  39          2HB       ASP  39   7.256 -12.966   5.509
  268    H    SER  40           H        SER  40   8.879 -13.523   7.051
  269    HA   SER  40           HA       SER  40  10.612 -13.932   8.354
  270   1HB   SER  40          1HB       SER  40   9.279 -12.361  10.086
  271   2HB   SER  40          2HB       SER  40   9.128 -13.893  10.962
  272    HG   SER  40           HG       SER  40  11.647 -12.886   9.964
  273    H    ARG  41           H        ARG  41   7.446 -15.393   8.662
  274    HA   ARG  41           HA       ARG  41   8.127 -17.622  10.143
  275   1HB   ARG  41          1HB       ARG  41   6.092 -17.644   7.885
  276   2HB   ARG  41          2HB       ARG  41   6.018 -18.523   9.421
  277   1HG   ARG  41          1HG       ARG  41   6.224 -15.819  10.160
  278   2HG   ARG  41          2HG       ARG  41   5.123 -15.804   8.770
  279   1HD   ARG  41          1HD       ARG  41   3.868 -16.084  10.872
  280   2HD   ARG  41          2HD       ARG  41   3.724 -17.548   9.887
  281    HE   ARG  41           HE       ARG  41   5.976 -17.756  11.677
  282   1HH1  ARG  41          1HH1      ARG  41   2.459 -17.877  11.649
  283   2HH1  ARG  41          2HH1      ARG  41   2.356 -18.899  13.044
  284   1HH2  ARG  41          1HH2      ARG  41   5.840 -19.104  13.517
  285   2HH2  ARG  41          2HH2      ARG  41   4.292 -19.601  14.114
  286    H    ILE  42           H        ILE  42   8.147 -16.963   6.584
  287    HA   ILE  42           HA       ILE  42   9.697 -19.439   6.261
  288    HB   ILE  42           HB       ILE  42   8.093 -18.240   4.040
  289   1HG1  ILE  42          1HG1      ILE  42   7.033 -19.662   6.434
  290   2HG1  ILE  42          2HG1      ILE  42   6.298 -18.379   5.457
  291   1HG2  ILE  42          1HG2      ILE  42   8.260 -20.331   3.052
  292   2HG2  ILE  42          2HG2      ILE  42   9.837 -20.150   3.860
  293   3HG2  ILE  42          3HG2      ILE  42   8.567 -21.155   4.600
  294   1HD1  ILE  42          1HD1      ILE  42   6.362 -20.303   3.580
  295   2HD1  ILE  42          2HD1      ILE  42   6.346 -21.353   5.018
  296   3HD1  ILE  42          3HD1      ILE  42   5.027 -20.188   4.752
  297    HA   PRO  43           HA       PRO  43  12.656 -16.416   5.101
  298   1HB   PRO  43          1HB       PRO  43  14.834 -18.060   5.218
  299   2HB   PRO  43          2HB       PRO  43  14.214 -17.180   6.615
  300   1HG   PRO  43          1HG       PRO  43  13.952 -20.031   5.899
  301   2HG   PRO  43          2HG       PRO  43  13.749 -19.254   7.511
  302   1HD   PRO  43          1HD       PRO  43  11.723 -20.218   5.731
  303   2HD   PRO  43          2HD       PRO  43  11.467 -19.317   7.232
  304    H    GLY  44           H        GLY  44  11.482 -19.045   3.481
  305   1HA   GLY  44          1HA       GLY  44  13.263 -18.682   1.185
  306   2HA   GLY  44          2HA       GLY  44  12.065 -19.941   1.415
  307    H    VAL  45           H        VAL  45  10.525 -17.171   2.456
  308    HA   VAL  45           HA       VAL  45   9.545 -16.577  -0.252
  309    HB   VAL  45           HB       VAL  45   7.379 -16.657   0.444
  310   1HG1  VAL  45          1HG1      VAL  45   8.828 -18.630   2.235
  311   2HG1  VAL  45          2HG1      VAL  45   7.067 -18.631   1.980
  312   3HG1  VAL  45          3HG1      VAL  45   8.164 -18.915   0.608
  313   1HG2  VAL  45          1HG2      VAL  45   7.708 -15.002   2.284
  314   2HG2  VAL  45          2HG2      VAL  45   6.553 -16.295   2.685
  315   3HG2  VAL  45          3HG2      VAL  45   8.204 -16.340   3.347
  316    HA   PRO  46           HA       PRO  46   9.959 -12.373   0.741
  317   1HB   PRO  46          1HB       PRO  46   7.570 -11.149   0.240
  318   2HB   PRO  46          2HB       PRO  46   8.699 -11.614  -1.031
  319   1HG   PRO  46          1HG       PRO  46   6.179 -12.887  -0.173
  320   2HG   PRO  46          2HG       PRO  46   7.055 -13.070  -1.735
  321   1HD   PRO  46          1HD       PRO  46   6.924 -14.909   0.457
  322   2HD   PRO  46          2HD       PRO  46   7.927 -15.062  -0.992
  323    H    TRP  47           H        TRP  47  10.525 -11.568   2.652
  324    HA   TRP  47           HA       TRP  47   8.580 -11.936   4.783
  325   1HB   TRP  47          1HB       TRP  47  11.104 -10.626   5.442
  326   2HB   TRP  47          2HB       TRP  47  10.315 -12.024   6.176
  327    HD1  TRP  47           HD1      TRP  47  10.805 -14.460   4.831
  328    HE1  TRP  47           HE1      TRP  47  12.934 -15.362   3.559
  329    HE3  TRP  47           HE3      TRP  47  12.953  -9.908   4.111
  330    HZ2  TRP  47           HZ2      TRP  47  15.226 -14.100   2.420
  331    HZ3  TRP  47           HZ3      TRP  47  15.137  -9.830   2.911
  332    HH2  TRP  47           HH2      TRP  47  16.270 -11.830   2.077
  333    H    CYS  48           H        CYS  48   8.152 -10.037   2.488
  334    HA   CYS  48           HA       CYS  48   7.324  -7.835   4.034
  335   1HB   CYS  48          1HB       CYS  48   9.766  -7.346   3.830
  336   2HB   CYS  48          2HB       CYS  48   9.548  -7.223   2.081
  337    H    PHE  49           H        PHE  49   5.303  -7.828   3.080
  338    HA   PHE  49           HA       PHE  49   5.233  -7.407   0.203
  339   1HB   PHE  49          1HB       PHE  49   3.100  -9.087   0.556
  340   2HB   PHE  49          2HB       PHE  49   4.697  -9.695   0.108
  341    HD1  PHE  49           HD1      PHE  49   6.273 -10.147   2.219
  342    HD2  PHE  49           HD2      PHE  49   2.031 -10.097   2.311
  343    HE1  PHE  49           HE1      PHE  49   6.301 -11.559   4.294
  344    HE2  PHE  49           HE2      PHE  49   2.059 -11.509   4.386
  345    HZ   PHE  49           HZ       PHE  49   4.194 -12.224   5.353
  346    H    LYS  50           H        LYS  50   2.491  -7.406  -0.199
  347    HA   LYS  50           HA       LYS  50   1.549  -5.463   1.793
  348   1HB   LYS  50          1HB       LYS  50   0.312  -4.856  -0.641
  349   2HB   LYS  50          2HB       LYS  50   1.555  -3.913   0.200
  350   1HG   LYS  50          1HG       LYS  50   2.420  -6.256  -1.472
  351   2HG   LYS  50          2HG       LYS  50   1.901  -4.786  -2.316
  352   1HD   LYS  50          1HD       LYS  50   4.148  -5.096  -0.290
  353   2HD   LYS  50          2HD       LYS  50   4.297  -4.633  -1.994
  354   1HE   LYS  50          1HE       LYS  50   3.260  -3.026   0.351
  355   2HE   LYS  50          2HE       LYS  50   4.484  -2.570  -0.844
  356   1HZ   LYS  50          1HZ       LYS  50   2.300  -1.510  -1.137
  357   2HZ   LYS  50          2HZ       LYS  50   2.789  -2.341  -2.456
  358   3HZ   LYS  50          3HZ       LYS  50   1.643  -2.967  -1.475
  359    HA   PRO  51           HA       PRO  51  -1.354  -8.924   1.425
  360   1HB   PRO  51          1HB       PRO  51  -1.425  -9.626   4.064
  361   2HB   PRO  51          2HB       PRO  51  -0.383 -10.417   2.884
  362   1HG   PRO  51          1HG       PRO  51   0.272  -8.426   4.959
  363   2HG   PRO  51          2HG       PRO  51   1.376  -9.564   4.107
  364   1HD   PRO  51          1HD       PRO  51   1.058  -6.748   3.697
  365   2HD   PRO  51          2HD       PRO  51   2.041  -7.851   2.724
  366    H    LEU  52           H        LEU  52  -1.923  -8.028   4.690
  367    HA   LEU  52           HA       LEU  52  -4.419  -6.830   3.806
  368   1HB   LEU  52          1HB       LEU  52  -5.296  -7.468   5.753
  369   2HB   LEU  52          2HB       LEU  52  -3.969  -8.642   5.694
  370    HG   LEU  52           HG       LEU  52  -4.331  -6.223   7.428
  371   1HD1  LEU  52          1HD1      LEU  52  -4.866  -7.938   8.773
  372   2HD1  LEU  52          2HD1      LEU  52  -4.036  -9.136   7.752
  373   3HD1  LEU  52          3HD1      LEU  52  -3.104  -8.158   8.911
  374   1HD2  LEU  52          1HD2      LEU  52  -2.229  -5.548   7.204
  375   2HD2  LEU  52          2HD2      LEU  52  -1.707  -7.109   7.883
  376   3HD2  LEU  52          3HD2      LEU  52  -1.848  -6.908   6.121
  377    H    GLN  53           H        GLN  53  -1.912  -5.429   3.259
  378    HA   GLN  53           HA       GLN  53  -1.348  -3.540   5.180
  379   1HB   GLN  53          1HB       GLN  53  -1.152  -3.383   2.149
  380   2HB   GLN  53          2HB       GLN  53  -0.392  -2.224   3.253
  381   1HG   GLN  53          1HG       GLN  53   0.156  -5.213   3.044
  382   2HG   GLN  53          2HG       GLN  53   1.260  -3.904   2.594
  383   1HE2  GLN  53          1HE2      GLN  53   0.032  -5.916   5.063
  384   2HE2  GLN  53          2HE2      GLN  53   0.930  -5.293   6.408
  385    H    GLU  54           H        GLU  54  -4.045  -3.840   2.927
  386    HA   GLU  54           HA       GLU  54  -4.859  -1.345   2.504
  387   1HB   GLU  54          1HB       GLU  54  -7.136  -2.196   2.418
  388   2HB   GLU  54          2HB       GLU  54  -6.037  -3.431   1.780
  389   1HG   GLU  54          1HG       GLU  54  -6.670  -3.493   4.713
  390   2HG   GLU  54          2HG       GLU  54  -7.949  -3.998   3.598
  391    H    ALA  55           H        ALA  55  -4.613  -2.958   5.617
  392    HA   ALA  55           HA       ALA  55  -6.416  -1.816   7.218
  393   1HB   ALA  55          1HB       ALA  55  -4.754  -3.309   8.086
  394   2HB   ALA  55          2HB       ALA  55  -3.432  -2.207   7.634
  395   3HB   ALA  55          3HB       ALA  55  -4.547  -1.766   8.949
  396    H    GLU  56           H        GLU  56  -3.217  -0.235   6.492
  397    HA   GLU  56           HA       GLU  56  -4.639   2.291   6.529
  398   1HB   GLU  56          1HB       GLU  56  -2.262   1.535   8.244
  399   2HB   GLU  56          2HB       GLU  56  -2.585   3.228   7.829
  400   1HG   GLU  56          1HG       GLU  56  -4.979   2.790   8.708
  401   2HG   GLU  56          2HG       GLU  56  -4.329   1.300   9.411
  402    H    CYS  57           H        CYS  57  -3.456   0.451   4.445
  403    HA   CYS  57           HA       CYS  57  -1.259   2.129   3.510
  404   1HB   CYS  57          1HB       CYS  57  -0.415   0.363   2.380
  405   2HB   CYS  57          2HB       CYS  57  -1.191  -0.485   3.721
  406    H    THR  58           H        THR  58  -4.281   0.436   2.382
  407    HA   THR  58           HA       THR  58  -4.441   2.264   0.122
  408    HB   THR  58           HB       THR  58  -4.872  -0.394   0.291
  409    HG1  THR  58           HG1      THR  58  -6.440   1.684  -1.064
  410   1HG2  THR  58          1HG2      THR  58  -7.652   0.836   0.661
  411   2HG2  THR  58          2HG2      THR  58  -7.269  -0.885   0.415
  412   3HG2  THR  58          3HG2      THR  58  -6.806  -0.079   1.934
  413    H    PHE  59           H        PHE  59  -6.049   1.567   3.236
  414    HA   PHE  59           HA       PHE  59  -8.386   2.781   3.088
  415   1HB   PHE  59          1HB       PHE  59  -6.848   1.939   5.082
  416   2HB   PHE  59          2HB       PHE  59  -6.336   3.626   5.198
  417    HD1  PHE  59           HD1      PHE  59  -7.479   4.974   6.675
  418    HD2  PHE  59           HD2      PHE  59  -9.483   1.615   5.029
  419    HE1  PHE  59           HE1      PHE  59  -9.480   5.465   8.109
  420    HE2  PHE  59           HE2      PHE  59 -11.483   2.106   6.462
  421    HZ   PHE  59           HZ       PHE  59 -11.458   4.026   7.986
  422   1H    GLU   1           H1       GLU   1 -22.508  -1.140  -3.557
  423    HA   GLU   1           HA       GLU   1 -20.488  -0.452  -4.217
  424   1HB   GLU   1          1HB       GLU   1 -22.179   0.999  -5.284
  425   2HB   GLU   1          2HB       GLU   1 -22.019   2.176  -3.969
  426   1HG   GLU   1          1HG       GLU   1 -19.400   1.879  -4.731
  427   2HG   GLU   1          2HG       GLU   1 -20.218   1.624  -6.280
  428    H    GLU   2           H        GLU   2 -19.565  -1.055  -1.954
  429    HA   GLU   2           HA       GLU   2 -18.908   1.249  -0.373
  430   1HB   GLU   2          1HB       GLU   2 -19.559  -0.939   0.651
  431   2HB   GLU   2          2HB       GLU   2 -18.081  -1.663  -0.004
  432   1HG   GLU   2          1HG       GLU   2 -17.272   0.711   1.321
  433   2HG   GLU   2          2HG       GLU   2 -18.448  -0.055   2.400
  434    H    TYR   3           H        TYR   3 -17.625  -0.492  -3.058
  435    HA   TYR   3           HA       TYR   3 -14.868   0.183  -2.422
  436   1HB   TYR   3          1HB       TYR   3 -14.762  -0.930  -4.850
  437   2HB   TYR   3          2HB       TYR   3 -15.133  -1.963  -3.467
  438    HD1  TYR   3           HD1      TYR   3 -16.449  -0.373  -6.504
  439    HD2  TYR   3           HD2      TYR   3 -17.404  -2.831  -3.134
  440    HE1  TYR   3           HE1      TYR   3 -18.617  -1.082  -7.626
  441    HE2  TYR   3           HE2      TYR   3 -19.569  -3.532  -4.268
  442    HH   TYR   3           HH       TYR   3 -20.212  -3.600  -7.034
  443    H    VAL   4           H        VAL   4 -15.354   2.567  -2.432
  444    HA   VAL   4           HA       VAL   4 -15.149   3.538  -5.185
  445    HB   VAL   4           HB       VAL   4 -17.313   4.134  -4.912
  446   1HG1  VAL   4          1HG1      VAL   4 -17.552   3.030  -2.710
  447   2HG1  VAL   4          2HG1      VAL   4 -16.901   4.488  -1.923
  448   3HG1  VAL   4          3HG1      VAL   4 -18.448   4.565  -2.799
  449   1HG2  VAL   4          1HG2      VAL   4 -15.695   6.205  -4.852
  450   2HG2  VAL   4          2HG2      VAL   4 -17.445   6.424  -4.616
  451   3HG2  VAL   4          3HG2      VAL   4 -16.352   6.417  -3.211
  452    H    GLY   5           H        GLY   5 -14.976   4.441  -1.668
  453   1HA   GLY   5          1HA       GLY   5 -13.140   6.554  -2.064
  454   2HA   GLY   5          2HA       GLY   5 -13.525   5.752  -0.554
  455    H    LEU   6           H        LEU   6 -12.704   3.279  -2.665
  456    HA   LEU   6           HA       LEU   6  -9.836   3.577  -2.368
  457   1HB   LEU   6          1HB       LEU   6  -9.787   1.216  -1.389
  458   2HB   LEU   6          2HB       LEU   6 -10.121   2.587  -0.316
  459    HG   LEU   6           HG       LEU   6 -11.495   0.535   0.095
  460   1HD1  LEU   6          1HD1      LEU   6 -13.356   2.749  -0.704
  461   2HD1  LEU   6          2HD1      LEU   6 -13.357   1.727   0.753
  462   3HD1  LEU   6          3HD1      LEU   6 -12.145   3.017   0.572
  463   1HD2  LEU   6          1HD2      LEU   6 -13.147  -0.217  -1.384
  464   2HD2  LEU   6          2HD2      LEU   6 -13.035   1.239  -2.400
  465   3HD2  LEU   6          3HD2      LEU   6 -11.717   0.044  -2.412
  466    H    SER   7           H        SER   7 -11.877   3.575  -4.554
  467    HA   SER   7           HA       SER   7 -11.090   1.091  -5.855
  468   1HB   SER   7          1HB       SER   7 -13.004   1.382  -7.315
  469   2HB   SER   7          2HB       SER   7 -13.550   1.545  -5.637
  470    HG   SER   7           HG       SER   7 -12.910   4.007  -6.362
  471    H    ALA   8           H        ALA   8 -10.957   1.448  -8.421
  472    HA   ALA   8           HA       ALA   8  -8.806   3.206  -8.846
  473   1HB   ALA   8          1HB       ALA   8  -8.847   1.301 -10.206
  474   2HB   ALA   8          2HB       ALA   8 -10.582   1.468 -10.563
  475   3HB   ALA   8          3HB       ALA   8  -9.409   2.573 -11.318
  476    H    ASN   9           H        ASN   9  -9.471   5.318  -8.183
  477    HA   ASN   9           HA       ASN   9 -10.251   6.984 -10.114
  478   1HB   ASN   9          1HB       ASN   9 -12.541   5.504  -9.249
  479   2HB   ASN   9          2HB       ASN   9 -12.736   7.138  -8.596
  480   1HD2  ASN   9          1HD2      ASN   9 -12.084   8.899 -10.218
  481   2HD2  ASN   9          2HD2      ASN   9 -12.725   8.752 -11.820
  482    H    GLN  10           H        GLN  10 -10.308   5.973  -6.723
  483    HA   GLN  10           HA       GLN  10 -10.827   8.412  -5.532
  484   1HB   GLN  10          1HB       GLN  10 -10.518   5.908  -4.625
  485   2HB   GLN  10          2HB       GLN  10  -8.902   6.517  -4.220
  486   1HG   GLN  10          1HG       GLN  10 -10.958   8.449  -3.488
  487   2HG   GLN  10          2HG       GLN  10 -11.301   6.878  -2.748
  488   1HE2  GLN  10          1HE2      GLN  10  -9.196   5.767  -1.940
  489   2HE2  GLN  10          2HE2      GLN  10  -8.167   6.739  -0.941
  490    H    CYS  11           H        CYS  11  -7.887   7.042  -6.995
  491    HA   CYS  11           HA       CYS  11  -6.084   8.838  -5.804
  492   1HB   CYS  11          1HB       CYS  11  -5.354   6.745  -6.750
  493   2HB   CYS  11          2HB       CYS  11  -5.899   7.230  -8.359
  494    H    ALA  12           H        ALA  12  -8.688   9.316  -7.908
  495    HA   ALA  12           HA       ALA  12  -7.376  11.554  -9.276
  496   1HB   ALA  12          1HB       ALA  12  -8.644  11.011 -11.060
  497   2HB   ALA  12          2HB       ALA  12  -9.047   9.508 -10.196
  498   3HB   ALA  12          3HB       ALA  12 -10.122  10.922 -10.072
  499    H    VAL  13           H        VAL  13  -8.328  11.321  -6.354
  500    HA   VAL  13           HA       VAL  13 -10.651  12.576  -5.828
  501    HB   VAL  13           HB       VAL  13  -9.067  13.745  -3.996
  502   1HG1  VAL  13          1HG1      VAL  13  -9.940  10.846  -4.166
  503   2HG1  VAL  13          2HG1      VAL  13  -9.285  11.592  -2.688
  504   3HG1  VAL  13          3HG1      VAL  13 -10.795  12.208  -3.402
  505   1HG2  VAL  13          1HG2      VAL  13  -7.044  12.635  -3.607
  506   2HG2  VAL  13          2HG2      VAL  13  -7.466  11.281  -4.682
  507   3HG2  VAL  13          3HG2      VAL  13  -7.057  12.870  -5.371
  508    HA   PRO  14           HA       PRO  14 -10.412  16.665  -7.213
  509   1HB   PRO  14          1HB       PRO  14 -11.540  18.146  -5.214
  510   2HB   PRO  14          2HB       PRO  14 -12.484  17.211  -6.370
  511   1HG   PRO  14          1HG       PRO  14 -11.825  16.633  -3.553
  512   2HG   PRO  14          2HG       PRO  14 -13.151  15.948  -4.559
  513   1HD   PRO  14          1HD       PRO  14 -10.691  14.711  -3.775
  514   2HD   PRO  14          2HD       PRO  14 -11.891  14.054  -4.896
  515    H    ALA  15           H        ALA  15  -8.346  15.627  -4.992
  516    HA   ALA  15           HA       ALA  15  -6.290  16.394  -4.547
  517   1HB   ALA  15          1HB       ALA  15  -7.033  18.108  -6.596
  518   2HB   ALA  15          2HB       ALA  15  -6.656  19.227  -5.263
  519   3HB   ALA  15          3HB       ALA  15  -5.433  18.058  -5.817
  520    H    LYS  16           H        LYS  16  -8.287  16.127  -2.651
  521    HA   LYS  16           HA       LYS  16  -7.323  17.576  -0.537
  522   1HB   LYS  16          1HB       LYS  16  -9.613  18.978  -0.313
  523   2HB   LYS  16          2HB       LYS  16  -8.109  19.645  -0.970
  524   1HG   LYS  16          1HG       LYS  16  -8.914  19.682  -3.116
  525   2HG   LYS  16          2HG       LYS  16  -9.852  18.192  -2.914
  526   1HD   LYS  16          1HD       LYS  16 -11.409  20.018  -3.193
  527   2HD   LYS  16          2HD       LYS  16 -11.487  19.522  -1.493
  528   1HE   LYS  16          1HE       LYS  16  -9.562  21.402  -1.289
  529   2HE   LYS  16          2HE       LYS  16 -10.389  22.038  -2.720
  530   1HZ   LYS  16          1HZ       LYS  16 -12.330  21.332  -0.917
  531   2HZ   LYS  16          2HZ       LYS  16 -11.193  22.116  -0.044
  532   3HZ   LYS  16          3HZ       LYS  16 -11.877  22.844  -1.336
  533    H    ASP  17           H        ASP  17  -7.996  14.920  -1.143
  534    HA   ASP  17           HA       ASP  17  -9.957  14.512   0.924
  535   1HB   ASP  17          1HB       ASP  17 -11.260  14.434  -1.175
  536   2HB   ASP  17          2HB       ASP  17 -10.143  13.233  -1.845
  537    H    ARG  18           H        ARG  18  -6.929  14.142  -0.037
  538    HA   ARG  18           HA       ARG  18  -6.733  11.284   0.194
  539   1HB   ARG  18          1HB       ARG  18  -4.459  13.298  -0.039
  540   2HB   ARG  18          2HB       ARG  18  -4.403  11.573  -0.439
  541   1HG   ARG  18          1HG       ARG  18  -5.338  11.903  -2.491
  542   2HG   ARG  18          2HG       ARG  18  -6.494  13.105  -1.891
  543   1HD   ARG  18          1HD       ARG  18  -4.761  14.833  -1.911
  544   2HD   ARG  18          2HD       ARG  18  -3.522  13.647  -2.349
  545    HE   ARG  18           HE       ARG  18  -5.826  13.892  -4.192
  546   1HH1  ARG  18          1HH1      ARG  18  -2.494  14.769  -3.478
  547   2HH1  ARG  18          2HH1      ARG  18  -2.131  15.229  -5.108
  548   1HH2  ARG  18          1HH2      ARG  18  -5.347  14.498  -6.343
  549   2HH2  ARG  18          2HH2      ARG  18  -3.765  15.074  -6.748
  550    H    VAL  19           H        VAL  19  -4.512  10.703   1.603
  551    HA   VAL  19           HA       VAL  19  -5.006  11.938   4.222
  552    HB   VAL  19           HB       VAL  19  -3.762   9.240   3.760
  553   1HG1  VAL  19          1HG1      VAL  19  -3.582   9.385   5.986
  554   2HG1  VAL  19          2HG1      VAL  19  -4.613  10.836   6.049
  555   3HG1  VAL  19          3HG1      VAL  19  -5.353   9.217   6.049
  556   1HG2  VAL  19          1HG2      VAL  19  -6.165   8.383   4.254
  557   2HG2  VAL  19          2HG2      VAL  19  -6.684   9.979   3.661
  558   3HG2  VAL  19          3HG2      VAL  19  -5.756   8.892   2.598
  559    H    ASP  20           H        ASP  20  -3.202  12.790   1.886
  560    HA   ASP  20           HA       ASP  20  -1.067  13.194   1.465
  561   1HB   ASP  20          1HB       ASP  20  -1.355  15.165   2.625
  562   2HB   ASP  20          2HB       ASP  20  -1.803  14.347   4.130
  563    H    CYS  21           H        CYS  21  -0.120  11.022   1.344
  564    HA   CYS  21           HA       CYS  21   0.537   9.399   3.406
  565   1HB   CYS  21          1HB       CYS  21   0.905   9.351   0.733
  566   2HB   CYS  21          2HB       CYS  21   2.573   9.579   1.265
  567    H    GLY  22           H        GLY  22   2.217  12.324   2.169
  568   1HA   GLY  22          1HA       GLY  22   3.931  13.536   2.971
  569   2HA   GLY  22          2HA       GLY  22   3.402  13.023   4.561
  570    H    TYR  23           H        TYR  23   5.000  11.433   1.697
  571    HA   TYR  23           HA       TYR  23   6.691   9.956   3.542
  572   1HB   TYR  23          1HB       TYR  23   5.580   9.817   0.810
  573   2HB   TYR  23          2HB       TYR  23   7.322   9.527   0.769
  574    HD1  TYR  23           HD1      TYR  23   8.269   7.636   2.172
  575    HD2  TYR  23           HD2      TYR  23   4.069   8.156   1.547
  576    HE1  TYR  23           HE1      TYR  23   7.860   5.225   2.868
  577    HE2  TYR  23           HE2      TYR  23   3.674   5.743   2.245
  578    HH   TYR  23           HH       TYR  23   4.584   3.986   3.232
  579    HA   PRO  24           HA       PRO  24  10.063  12.610   2.911
  580   1HB   PRO  24          1HB       PRO  24  12.052  11.042   3.934
  581   2HB   PRO  24          2HB       PRO  24  10.986  12.022   4.936
  582   1HG   PRO  24          1HG       PRO  24  10.978   9.114   4.437
  583   2HG   PRO  24          2HG       PRO  24  10.226  10.023   5.798
  584   1HD   PRO  24          1HD       PRO  24   8.948   8.853   3.517
  585   2HD   PRO  24          2HD       PRO  24   8.188   9.873   4.744
  586    H    HIS  25           H        HIS  25   9.481   9.869   1.192
  587    HA   HIS  25           HA       HIS  25  11.751  10.519  -0.542
  588   1HB   HIS  25          1HB       HIS  25  11.326   8.125   0.817
  589   2HB   HIS  25          2HB       HIS  25  10.779   7.789  -0.830
  590    HD1  HIS  25           HD1      HIS  25  13.576   7.031   0.919
  591    HD2  HIS  25           HD2      HIS  25  13.089   9.375  -2.525
  592    HE1  HIS  25           HE1      HIS  25  15.845   7.066  -0.249
  593    HE2  HIS  25           HE2      HIS  25  15.469   8.475  -2.386
  594    H    VAL  26           H        VAL  26   8.703  11.251  -0.246
  595    HA   VAL  26           HA       VAL  26   7.126  10.181  -2.122
  596    HB   VAL  26           HB       VAL  26   6.288  11.912  -0.811
  597   1HG1  VAL  26          1HG1      VAL  26   7.659  14.268  -1.755
  598   2HG1  VAL  26          2HG1      VAL  26   7.514  13.633  -0.098
  599   3HG1  VAL  26          3HG1      VAL  26   8.841  13.082  -1.149
  600   1HG2  VAL  26          1HG2      VAL  26   6.520  13.460  -3.375
  601   2HG2  VAL  26          2HG2      VAL  26   5.695  11.883  -3.374
  602   3HG2  VAL  26          3HG2      VAL  26   5.106  13.196  -2.327
  603    H    THR  27           H        THR  27   7.143   9.833  -4.291
  604    HA   THR  27           HA       THR  27   8.339  11.638  -6.109
  605    HB   THR  27           HB       THR  27  10.071   9.642  -4.867
  606    HG1  THR  27           HG1      THR  27  10.124  11.712  -6.935
  607   1HG2  THR  27          1HG2      THR  27  11.062   9.218  -7.346
  608   2HG2  THR  27          2HG2      THR  27   9.926   8.069  -6.598
  609   3HG2  THR  27          3HG2      THR  27   9.334   9.271  -7.770
  610    HA   PRO  28           HA       PRO  28   5.703   9.450  -8.689
  611   1HB   PRO  28          1HB       PRO  28   6.671  10.095 -11.160
  612   2HB   PRO  28          2HB       PRO  28   5.644  11.171 -10.217
  613   1HG   PRO  28          1HG       PRO  28   8.554  11.256 -10.685
  614   2HG   PRO  28          2HG       PRO  28   7.465  12.585 -10.146
  615   1HD   PRO  28          1HD       PRO  28   9.323  11.063  -8.587
  616   2HD   PRO  28          2HD       PRO  28   8.159  12.248  -7.981
  617    H    LYS  29           H        LYS  29   7.415   7.729  -7.481
  618    HA   LYS  29           HA       LYS  29   7.298   5.568  -9.196
  619   1HB   LYS  29          1HB       LYS  29   9.183   7.105 -10.233
  620   2HB   LYS  29          2HB       LYS  29  10.185   6.320  -8.999
  621   1HG   LYS  29          1HG       LYS  29  10.272   4.427 -10.215
  622   2HG   LYS  29          2HG       LYS  29   8.505   4.346 -10.319
  623   1HD   LYS  29          1HD       LYS  29   8.885   6.283 -12.119
  624   2HD   LYS  29          2HD       LYS  29  10.496   5.555 -12.235
  625   1HE   LYS  29          1HE       LYS  29   9.466   4.202 -13.767
  626   2HE   LYS  29          2HE       LYS  29   8.935   3.308 -12.335
  627   1HZ   LYS  29          1HZ       LYS  29   6.862   4.037 -12.610
  628   2HZ   LYS  29          2HZ       LYS  29   7.297   5.541 -13.071
  629   3HZ   LYS  29          3HZ       LYS  29   7.307   4.321 -14.156
  630    H    GLU  30           H        GLU  30   8.279   7.291  -6.360
  631    HA   GLU  30           HA       GLU  30   9.142   4.829  -5.098
  632   1HB   GLU  30          1HB       GLU  30   9.644   7.697  -4.697
  633   2HB   GLU  30          2HB       GLU  30   9.305   6.849  -3.179
  634   1HG   GLU  30          1HG       GLU  30  11.439   6.121  -3.205
  635   2HG   GLU  30          2HG       GLU  30  11.045   5.141  -4.624
  636    H    CYS  31           H        CYS  31   6.698   7.477  -4.826
  637    HA   CYS  31           HA       CYS  31   5.449   6.638  -2.537
  638   1HB   CYS  31          1HB       CYS  31   4.454   8.067  -4.985
  639   2HB   CYS  31          2HB       CYS  31   3.377   7.704  -3.634
  640    H    ASN  32           H        ASN  32   4.670   5.831  -6.004
  641    HA   ASN  32           HA       ASN  32   2.653   4.057  -5.412
  642   1HB   ASN  32          1HB       ASN  32   4.416   4.672  -7.738
  643   2HB   ASN  32          2HB       ASN  32   3.705   3.051  -7.767
  644   1HD2  ASN  32          1HD2      ASN  32   2.583   6.223  -6.596
  645   2HD2  ASN  32          2HD2      ASN  32   1.121   6.296  -7.524
  646    H    ASN  33           H        ASN  33   6.052   3.878  -4.863
  647    HA   ASN  33           HA       ASN  33   6.209   1.034  -5.177
  648   1HB   ASN  33          1HB       ASN  33   8.070   2.984  -5.443
  649   2HB   ASN  33          2HB       ASN  33   8.348   2.599  -3.737
  650   1HD2  ASN  33          1HD2      ASN  33  10.457   1.967  -4.564
  651   2HD2  ASN  33          2HD2      ASN  33  10.698   0.367  -5.182
  652    H    ARG  34           H        ARG  34   5.906   3.568  -2.660
  653    HA   ARG  34           HA       ARG  34   6.342   1.717  -0.544
  654   1HB   ARG  34          1HB       ARG  34   5.075   4.455  -0.226
  655   2HB   ARG  34          2HB       ARG  34   6.139   3.601   0.906
  656   1HG   ARG  34          1HG       ARG  34   7.571   3.913  -1.549
  657   2HG   ARG  34          2HG       ARG  34   6.835   5.483  -1.181
  658   1HD   ARG  34          1HD       ARG  34   8.250   5.835   0.558
  659   2HD   ARG  34          2HD       ARG  34   8.014   4.202   1.200
  660    HE   ARG  34           HE       ARG  34   9.657   4.295  -1.225
  661   1HH1  ARG  34          1HH1      ARG  34   9.685   4.522   2.287
  662   2HH1  ARG  34          2HH1      ARG  34  11.356   4.086   2.429
  663   1HH2  ARG  34          1HH2      ARG  34  11.861   3.720  -1.037
  664   2HH2  ARG  34          2HH2      ARG  34  12.601   3.626   0.526
  665    H    GLY  35           H        GLY  35   3.645   2.991  -2.435
  666   1HA   GLY  35          1HA       GLY  35   1.662   1.551  -2.386
  667   2HA   GLY  35          2HA       GLY  35   1.751   1.597  -0.637
  668    H    CYS  36           H        CYS  36   2.595   4.488  -2.511
  669    HA   CYS  36           HA       CYS  36   0.045   5.655  -1.659
  670   1HB   CYS  36          1HB       CYS  36   2.726   7.021  -1.914
  671   2HB   CYS  36          2HB       CYS  36   1.206   7.802  -1.469
  672    H    CYS  37           H        CYS  37  -0.389   7.749  -3.122
  673    HA   CYS  37           HA       CYS  37   0.212   6.949  -5.878
  674   1HB   CYS  37          1HB       CYS  37  -2.213   6.878  -4.907
  675   2HB   CYS  37          2HB       CYS  37  -2.166   8.626  -5.164
  676    H    PHE  38           H        PHE  38   1.236   8.493  -7.156
  677    HA   PHE  38           HA       PHE  38   1.905  10.987  -5.821
  678   1HB   PHE  38          1HB       PHE  38   3.568   9.375  -6.952
  679   2HB   PHE  38          2HB       PHE  38   2.799   9.755  -8.495
  680    HD1  PHE  38           HD1      PHE  38   4.814  11.133  -5.729
  681    HD2  PHE  38           HD2      PHE  38   3.315  11.772  -9.648
  682    HE1  PHE  38           HE1      PHE  38   6.355  13.096  -5.999
  683    HE2  PHE  38           HE2      PHE  38   4.856  13.734  -9.917
  684    HZ   PHE  38           HZ       PHE  38   6.357  14.374  -8.089
  685    H    ASP  39           H        ASP  39   0.724  12.793  -6.214
  686    HA   ASP  39           HA       ASP  39  -1.108  12.799  -8.372
  687   1HB   ASP  39          1HB       ASP  39  -2.011  14.022  -6.660
  688   2HB   ASP  39          2HB       ASP  39  -0.430  14.520  -6.037
  689    H    SER  40           H        SER  40   1.038  15.549  -7.403
  690    HA   SER  40           HA       SER  40   2.667  16.571  -8.490
  691   1HB   SER  40          1HB       SER  40   2.831  14.244  -9.817
  692   2HB   SER  40          2HB       SER  40   2.205  15.241 -11.143
  693    HG   SER  40           HG       SER  40   4.442  15.385 -11.256
  694    H    ARG  41           H        ARG  41  -0.566  16.003  -9.713
  695    HA   ARG  41           HA       ARG  41  -0.616  17.960 -11.675
  696   1HB   ARG  41          1HB       ARG  41  -2.992  17.187  -9.938
  697   2HB   ARG  41          2HB       ARG  41  -3.010  17.666 -11.645
  698   1HG   ARG  41          1HG       ARG  41  -1.333  15.487 -11.704
  699   2HG   ARG  41          2HG       ARG  41  -2.441  15.022 -10.401
  700   1HD   ARG  41          1HD       ARG  41  -3.568  14.205 -12.274
  701   2HD   ARG  41          2HD       ARG  41  -4.307  15.808 -12.126
  702    HE   ARG  41           HE       ARG  41  -1.908  15.788 -13.797
  703   1HH1  ARG  41          1HH1      ARG  41  -5.384  15.248 -13.770
  704   2HH1  ARG  41          2HH1      ARG  41  -5.573  15.547 -15.465
  705   1HH2  ARG  41          1HH2      ARG  41  -2.156  16.182 -16.035
  706   2HH2  ARG  41          2HH2      ARG  41  -3.724  16.082 -16.762
  707    H    ILE  42           H        ILE  42  -1.459  17.986  -8.151
  708    HA   ILE  42           HA       ILE  42  -1.504  20.920  -8.311
  709    HB   ILE  42           HB       ILE  42  -2.905  19.348  -6.179
  710   1HG1  ILE  42          1HG1      ILE  42  -3.747  19.716  -9.021
  711   2HG1  ILE  42          2HG1      ILE  42  -3.987  18.334  -7.937
  712   1HG2  ILE  42          1HG2      ILE  42  -4.095  21.305  -5.777
  713   2HG2  ILE  42          2HG2      ILE  42  -2.452  21.890  -6.136
  714   3HG2  ILE  42          3HG2      ILE  42  -3.723  21.983  -7.379
  715   1HD1  ILE  42          1HD1      ILE  42  -5.464  20.122  -6.589
  716   2HD1  ILE  42          2HD1      ILE  42  -5.566  20.884  -8.194
  717   3HD1  ILE  42          3HD1      ILE  42  -6.138  19.214  -7.963
  718    HA   PRO  43           HA       PRO  43   2.041  20.293  -5.802
  719   1HB   PRO  43          1HB       PRO  43   3.025  22.831  -6.026
  720   2HB   PRO  43          2HB       PRO  43   3.391  21.551  -7.179
  721   1HG   PRO  43          1HG       PRO  43   1.541  23.837  -7.409
  722   2HG   PRO  43          2HG       PRO  43   2.261  22.838  -8.723
  723   1HD   PRO  43          1HD       PRO  43  -0.411  22.768  -7.695
  724   2HD   PRO  43          2HD       PRO  43   0.294  21.659  -8.878
  725    H    GLY  44           H        GLY  44  -0.718  22.036  -5.277
  726   1HA   GLY  44          1HA       GLY  44   0.189  23.116  -2.716
  727   2HA   GLY  44          2HA       GLY  44  -1.350  23.394  -3.507
  728    H    VAL  45           H        VAL  45  -0.838  20.123  -3.896
  729    HA   VAL  45           HA       VAL  45  -2.137  19.510  -1.330
  730    HB   VAL  45           HB       VAL  45  -3.701  18.219  -2.359
  731   1HG1  VAL  45          1HG1      VAL  45  -4.503  19.361  -4.450
  732   2HG1  VAL  45          2HG1      VAL  45  -4.163  20.459  -3.091
  733   3HG1  VAL  45          3HG1      VAL  45  -3.003  20.320  -4.433
  734   1HG2  VAL  45          1HG2      VAL  45  -2.087  16.740  -3.499
  735   2HG2  VAL  45          2HG2      VAL  45  -3.482  17.129  -4.535
  736   3HG2  VAL  45          3HG2      VAL  45  -1.920  17.939  -4.804
  737    HA   PRO  46           HA       PRO  46   0.690  16.250  -0.905
  738   1HB   PRO  46          1HB       PRO  46  -0.737  13.982  -0.376
  739   2HB   PRO  46          2HB       PRO  46  -0.437  15.234   0.827
  740   1HG   PRO  46          1HG       PRO  46  -2.878  14.634  -0.718
  741   2HG   PRO  46          2HG       PRO  46  -2.720  15.565   0.815
  742   1HD   PRO  46          1HD       PRO  46  -3.152  16.559  -1.834
  743   2HD   PRO  46          2HD       PRO  46  -2.842  17.523  -0.384
  744    H    TRP  47           H        TRP  47   2.103  15.640  -2.407
  745    HA   TRP  47           HA       TRP  47   0.975  14.444  -4.793
  746   1HB   TRP  47          1HB       TRP  47   3.882  14.664  -4.599
  747   2HB   TRP  47          2HB       TRP  47   2.774  15.216  -5.857
  748    HD1  TRP  47           HD1      TRP  47   1.547  17.704  -5.293
  749    HE1  TRP  47           HE1      TRP  47   2.448  19.859  -4.067
  750    HE3  TRP  47           HE3      TRP  47   5.349  15.368  -2.854
  751    HZ2  TRP  47           HZ2      TRP  47   4.600  20.335  -2.254
  752    HZ3  TRP  47           HZ3      TRP  47   6.803  16.751  -1.376
  753    HH2  TRP  47           HH2      TRP  47   6.477  19.153  -1.057
  754    H    CYS  48           H        CYS  48   0.870  13.062  -2.124
  755    HA   CYS  48           HA       CYS  48   1.737  10.539  -3.026
  756   1HB   CYS  48          1HB       CYS  48   3.903  11.595  -2.255
  757   2HB   CYS  48          2HB       CYS  48   3.250  11.542  -0.615
  758    H    PHE  49           H        PHE  49  -0.194   9.577  -2.446
  759    HA   PHE  49           HA       PHE  49  -0.902   9.686   0.371
  760   1HB   PHE  49          1HB       PHE  49  -3.371   9.855  -0.780
  761   2HB   PHE  49          2HB       PHE  49  -2.468  11.304  -0.321
  762    HD1  PHE  49           HD1      PHE  49  -0.805  12.157  -2.221
  763    HD2  PHE  49           HD2      PHE  49  -4.241   9.760  -2.897
  764    HE1  PHE  49           HE1      PHE  49  -0.885  12.944  -4.602
  765    HE2  PHE  49           HE2      PHE  49  -4.321  10.548  -5.279
  766    HZ   PHE  49           HZ       PHE  49  -2.642  12.131  -6.103
  767    H    LYS  50           H        LYS  50  -3.274   8.259   0.316
  768    HA   LYS  50           HA       LYS  50  -2.560   5.833  -1.176
  769   1HB   LYS  50          1HB       LYS  50  -3.767   4.823   1.019
  770   2HB   LYS  50          2HB       LYS  50  -2.011   4.988   0.838
  771   1HG   LYS  50          1HG       LYS  50  -3.496   7.379   1.848
  772   2HG   LYS  50          2HG       LYS  50  -3.398   5.996   2.951
  773   1HD   LYS  50          1HD       LYS  50  -1.108   7.529   1.663
  774   2HD   LYS  50          2HD       LYS  50  -1.494   7.434   3.390
  775   1HE   LYS  50          1HE       LYS  50  -0.244   5.372   1.576
  776   2HE   LYS  50          2HE       LYS  50   0.269   5.888   3.189
  777   1HZ   LYS  50          1HZ       LYS  50  -2.080   4.868   3.734
  778   2HZ   LYS  50          2HZ       LYS  50  -1.728   3.958   2.425
  779   3HZ   LYS  50          3HZ       LYS  50  -0.721   3.963   3.710
  780    HA   PRO  51           HA       PRO  51  -6.792   7.144  -2.103
  781   1HB   PRO  51          1HB       PRO  51  -6.558   7.220  -4.824
  782   2HB   PRO  51          2HB       PRO  51  -6.370   8.642  -3.800
  783   1HG   PRO  51          1HG       PRO  51  -4.330   6.994  -5.152
  784   2HG   PRO  51          2HG       PRO  51  -4.183   8.679  -4.531
  785   1HD   PRO  51          1HD       PRO  51  -3.147   6.265  -3.391
  786   2HD   PRO  51          2HD       PRO  51  -3.115   7.874  -2.661
  787    H    LEU  52           H        LEU  52  -5.902   5.473  -4.993
  788    HA   LEU  52           HA       LEU  52  -7.552   3.251  -4.036
  789   1HB   LEU  52          1HB       LEU  52  -8.280   2.929  -6.144
  790   2HB   LEU  52          2HB       LEU  52  -8.023   4.681  -6.170
  791    HG   LEU  52           HG       LEU  52  -5.593   3.595  -7.020
  792   1HD1  LEU  52          1HD1      LEU  52  -7.713   1.700  -7.551
  793   2HD1  LEU  52          2HD1      LEU  52  -7.021   2.322  -9.068
  794   3HD1  LEU  52          3HD1      LEU  52  -5.962   1.570  -7.850
  795   1HD2  LEU  52          1HD2      LEU  52  -5.904   5.224  -8.490
  796   2HD2  LEU  52          2HD2      LEU  52  -7.212   4.308  -9.277
  797   3HD2  LEU  52          3HD2      LEU  52  -7.580   5.400  -7.920
  798    H    GLN  53           H        GLN  53  -4.917   3.491  -3.001
  799    HA   GLN  53           HA       GLN  53  -2.958   2.271  -4.425
  800   1HB   GLN  53          1HB       GLN  53  -3.561   2.018  -1.453
  801   2HB   GLN  53          2HB       GLN  53  -2.003   1.628  -2.202
  802   1HG   GLN  53          1HG       GLN  53  -3.373   4.351  -2.275
  803   2HG   GLN  53          2HG       GLN  53  -2.046   3.919  -1.187
  804   1HE2  GLN  53          1HE2      GLN  53  -0.645   2.273  -3.058
  805   2HE2  GLN  53          2HE2      GLN  53   0.090   3.295  -4.248
  806    H    GLU  54           H        GLU  54  -5.950   0.923  -3.278
  807    HA   GLU  54           HA       GLU  54  -5.457  -1.606  -2.657
  808   1HB   GLU  54          1HB       GLU  54  -7.606  -0.353  -4.362
  809   2HB   GLU  54          2HB       GLU  54  -7.618  -2.104  -4.093
  810   1HG   GLU  54          1HG       GLU  54  -7.272  -1.327  -1.548
  811   2HG   GLU  54          2HG       GLU  54  -8.051   0.148  -2.142
  812    H    ALA  55           H        ALA  55  -4.815  -0.072  -5.758
  813    HA   ALA  55           HA       ALA  55  -4.896  -1.980  -7.608
  814   1HB   ALA  55          1HB       ALA  55  -3.563   0.445  -7.241
  815   2HB   ALA  55          2HB       ALA  55  -2.254  -0.710  -7.589
  816   3HB   ALA  55          3HB       ALA  55  -3.601  -0.518  -8.736
  817    H    GLU  56           H        GLU  56  -1.819  -1.530  -5.728
  818    HA   GLU  56           HA       GLU  56  -1.653  -4.439  -5.662
  819   1HB   GLU  56          1HB       GLU  56   0.094  -2.578  -6.998
  820   2HB   GLU  56          2HB       GLU  56   1.000  -3.370  -5.696
  821   1HG   GLU  56          1HG       GLU  56   1.302  -4.969  -7.313
  822   2HG   GLU  56          2HG       GLU  56  -0.272  -5.536  -6.733
  823    H    CYS  57           H        CYS  57  -2.576  -2.279  -3.712
  824    HA   CYS  57           HA       CYS  57  -0.495  -2.515  -1.690
  825   1HB   CYS  57          1HB       CYS  57  -1.730  -0.328  -2.352
  826   2HB   CYS  57          2HB       CYS  57  -3.037  -0.957  -1.344
  827    H    THR  58           H        THR  58  -4.137  -2.541  -1.656
  828    HA   THR  58           HA       THR  58  -4.365  -4.162   0.582
  829    HB   THR  58           HB       THR  58  -6.127  -2.685  -0.524
  830    HG1  THR  58           HG1      THR  58  -6.508  -5.545  -0.013
  831   1HG2  THR  58          1HG2      THR  58  -7.303  -3.395  -2.431
  832   2HG2  THR  58          2HG2      THR  58  -5.663  -3.939  -2.857
  833   3HG2  THR  58          3HG2      THR  58  -6.842  -5.099  -2.199
  834    H    PHE  59           H        PHE  59  -4.035  -5.030  -2.883
  835    HA   PHE  59           HA       PHE  59  -4.690  -7.694  -2.684
  836   1HB   PHE  59          1HB       PHE  59  -3.006  -5.861  -4.363
  837   2HB   PHE  59          2HB       PHE  59  -2.592  -7.573  -4.520
  838    HD1  PHE  59           HD1      PHE  59  -3.762  -8.866  -6.044
  839    HD2  PHE  59           HD2      PHE  59  -5.530  -5.276  -4.631
  840    HE1  PHE  59           HE1      PHE  59  -5.654  -9.158  -7.668
  841    HE2  PHE  59           HE2      PHE  59  -7.422  -5.569  -6.254
  842    HZ   PHE  59           HZ       PHE  59  -7.461  -7.506  -7.753
  Start of MODEL   21
    1   1H    GLU   1           H1       GLU   1 -11.116 -15.191  -0.239
    2    HA   GLU   1           HA       GLU   1 -10.935 -14.981  -2.534
    3   1HB   GLU   1          1HB       GLU   1 -13.083 -16.632  -2.622
    4   2HB   GLU   1          2HB       GLU   1 -13.877 -15.107  -3.054
    5   1HG   GLU   1          1HG       GLU   1 -13.097 -16.292  -5.067
    6   2HG   GLU   1          2HG       GLU   1 -12.210 -14.772  -4.874
    7    H    GLU   2           H        GLU   2 -14.008 -13.866  -0.940
    8    HA   GLU   2           HA       GLU   2 -13.896 -11.349  -2.163
    9   1HB   GLU   2          1HB       GLU   2 -15.426 -12.498   0.182
   10   2HB   GLU   2          2HB       GLU   2 -15.596 -10.792  -0.269
   11   1HG   GLU   2          1HG       GLU   2 -15.804 -12.727  -2.517
   12   2HG   GLU   2          2HG       GLU   2 -17.100 -12.849  -1.318
   13    H    TYR   3           H        TYR   3 -14.261 -11.305   1.350
   14    HA   TYR   3           HA       TYR   3 -12.274  -9.277   1.571
   15   1HB   TYR   3          1HB       TYR   3 -12.936  -9.662   4.055
   16   2HB   TYR   3          2HB       TYR   3 -14.283  -9.272   2.981
   17    HD1  TYR   3           HD1      TYR   3 -15.912 -11.011   2.346
   18    HD2  TYR   3           HD2      TYR   3 -12.717 -11.845   5.066
   19    HE1  TYR   3           HE1      TYR   3 -17.089 -13.140   3.087
   20    HE2  TYR   3           HE2      TYR   3 -13.904 -13.970   5.798
   21    HH   TYR   3           HH       TYR   3 -15.509 -15.417   5.239
   22    H    VAL   4           H        VAL   4 -10.628 -10.965   0.529
   23    HA   VAL   4           HA       VAL   4  -9.279 -12.251   2.801
   24    HB   VAL   4           HB       VAL   4 -10.316 -13.894   1.311
   25   1HG1  VAL   4          1HG1      VAL   4  -8.509 -12.775  -0.857
   26   2HG1  VAL   4          2HG1      VAL   4  -9.612 -14.165  -0.998
   27   3HG1  VAL   4          3HG1      VAL   4 -10.268 -12.527  -0.761
   28   1HG2  VAL   4          1HG2      VAL   4  -7.288 -13.839   1.083
   29   2HG2  VAL   4          2HG2      VAL   4  -8.216 -14.436   2.481
   30   3HG2  VAL   4          3HG2      VAL   4  -8.332 -15.271   0.913
   31    H    GLY   5           H        GLY   5  -8.879 -10.882  -0.539
   32   1HA   GLY   5          1HA       GLY   5  -6.086 -10.462  -0.261
   33   2HA   GLY   5          2HA       GLY   5  -7.148  -9.792  -1.485
   34    H    LEU   6           H        LEU   6  -8.570  -9.073   1.487
   35    HA   LEU   6           HA       LEU   6  -6.975  -6.668   1.902
   36   1HB   LEU   6          1HB       LEU   6  -9.106  -5.356   2.024
   37   2HB   LEU   6          2HB       LEU   6  -8.556  -5.823   0.406
   38    HG   LEU   6           HG       LEU   6 -11.022  -5.972   0.781
   39   1HD1  LEU   6          1HD1      LEU   6 -11.055  -7.465  -0.863
   40   2HD1  LEU   6          2HD1      LEU   6  -9.313  -7.713  -0.586
   41   3HD1  LEU   6          3HD1      LEU   6 -10.502  -8.765   0.221
   42   1HD2  LEU   6          1HD2      LEU   6 -10.632  -8.491   2.345
   43   2HD2  LEU   6          2HD2      LEU   6 -10.567  -6.929   3.196
   44   3HD2  LEU   6          3HD2      LEU   6 -12.023  -7.382   2.279
   45    H    SER   7           H        SER   7  -7.649  -9.411   3.199
   46    HA   SER   7           HA       SER   7  -8.809  -8.350   5.644
   47   1HB   SER   7          1HB       SER   7  -9.318 -10.695   4.220
   48   2HB   SER   7          2HB       SER   7  -8.316 -11.251   5.572
   49    HG   SER   7           HG       SER   7 -10.840 -10.983   5.741
   50    H    ALA   8           H        ALA   8  -7.784  -9.059   7.741
   51    HA   ALA   8           HA       ALA   8  -4.975  -8.677   7.614
   52   1HB   ALA   8          1HB       ALA   8  -5.197  -9.061  10.118
   53   2HB   ALA   8          2HB       ALA   8  -6.211  -7.756   9.455
   54   3HB   ALA   8          3HB       ALA   8  -6.934  -9.337   9.842
   55    H    ASN   9           H        ASN   9  -6.858 -11.337   6.867
   56    HA   ASN   9           HA       ASN   9  -5.174 -13.261   8.163
   57   1HB   ASN   9          1HB       ASN   9  -7.806 -13.249   7.193
   58   2HB   ASN   9          2HB       ASN   9  -6.952 -14.263   6.020
   59   1HD2  ASN   9          1HD2      ASN   9  -5.548 -15.966   6.918
   60   2HD2  ASN   9          2HD2      ASN   9  -6.064 -16.826   8.329
   61    H    GLN  10           H        GLN  10  -5.307 -11.384   5.245
   62    HA   GLN  10           HA       GLN  10  -4.202 -13.230   3.465
   63   1HB   GLN  10          1HB       GLN  10  -5.312 -10.775   3.221
   64   2HB   GLN  10          2HB       GLN  10  -3.602 -10.321   3.097
   65   1HG   GLN  10          1HG       GLN  10  -3.992 -12.665   1.501
   66   2HG   GLN  10          2HG       GLN  10  -5.311 -11.551   1.109
   67   1HE2  GLN  10          1HE2      GLN  10  -4.017  -9.130   1.611
   68   2HE2  GLN  10          2HE2      GLN  10  -2.790  -8.861   0.420
   69    H    CYS  11           H        CYS  11  -2.822 -10.903   5.816
   70    HA   CYS  11           HA       CYS  11  -0.174 -11.156   4.870
   71   1HB   CYS  11          1HB       CYS  11  -0.807  -9.210   6.084
   72   2HB   CYS  11          2HB       CYS  11  -1.326 -10.160   7.478
   73    H    ALA  12           H        ALA  12  -2.264 -13.405   6.179
   74    HA   ALA  12           HA       ALA  12  -0.125 -14.770   7.661
   75   1HB   ALA  12          1HB       ALA  12  -2.327 -14.152   8.817
   76   2HB   ALA  12          2HB       ALA  12  -3.102 -15.357   7.760
   77   3HB   ALA  12          3HB       ALA  12  -1.839 -15.861   8.909
   78    H    VAL  13           H        VAL  13  -1.050 -14.511   4.603
   79    HA   VAL  13           HA       VAL  13  -2.029 -16.820   3.635
   80    HB   VAL  13           HB       VAL  13  -0.717 -14.597   2.658
   81   1HG1  VAL  13          1HG1      VAL  13   1.452 -15.730   2.771
   82   2HG1  VAL  13          2HG1      VAL  13   0.815 -17.073   1.792
   83   3HG1  VAL  13          3HG1      VAL  13   0.971 -15.448   1.081
   84   1HG2  VAL  13          1HG2      VAL  13  -1.182 -16.376   0.481
   85   2HG2  VAL  13          2HG2      VAL  13  -2.419 -16.700   1.718
   86   3HG2  VAL  13          3HG2      VAL  13  -2.216 -15.053   1.073
   87    HA   PRO  14           HA       PRO  14   0.788 -20.005   4.407
   88   1HB   PRO  14          1HB       PRO  14   0.723 -21.519   2.135
   89   2HB   PRO  14          2HB       PRO  14  -0.530 -21.583   3.371
   90   1HG   PRO  14          1HG       PRO  14  -0.539 -20.278   0.727
   91   2HG   PRO  14          2HG       PRO  14  -1.943 -20.746   1.752
   92   1HD   PRO  14          1HD       PRO  14  -0.849 -18.136   1.318
   93   2HD   PRO  14          2HD       PRO  14  -2.129 -18.567   2.460
   94    H    ALA  15           H        ALA  15   1.907 -17.510   3.331
   95    HA   ALA  15           HA       ALA  15   3.788 -16.756   2.407
   96   1HB   ALA  15          1HB       ALA  15   5.685 -18.707   3.111
   97   2HB   ALA  15          2HB       ALA  15   5.192 -17.299   4.082
   98   3HB   ALA  15          3HB       ALA  15   4.392 -18.870   4.325
   99    H    LYS  16           H        LYS  16   2.525 -17.483   0.301
  100    HA   LYS  16           HA       LYS  16   4.401 -18.314  -1.528
  101   1HB   LYS  16          1HB       LYS  16   3.437 -20.574  -2.129
  102   2HB   LYS  16          2HB       LYS  16   4.451 -20.512  -0.677
  103   1HG   LYS  16          1HG       LYS  16   2.750 -21.404   0.495
  104   2HG   LYS  16          2HG       LYS  16   1.781 -19.956   0.168
  105   1HD   LYS  16          1HD       LYS  16   0.392 -21.254  -1.041
  106   2HD   LYS  16          2HD       LYS  16   1.694 -21.487  -2.219
  107   1HE   LYS  16          1HE       LYS  16   2.266 -23.571  -1.366
  108   2HE   LYS  16          2HE       LYS  16   1.720 -23.181   0.272
  109   1HZ   LYS  16          1HZ       LYS  16  -0.392 -23.713  -0.258
  110   2HZ   LYS  16          2HZ       LYS  16  -0.266 -23.287  -1.830
  111   3HZ   LYS  16          3HZ       LYS  16   0.355 -24.707  -1.317
  112    H    ASP  17           H        ASP  17   2.571 -16.228  -1.269
  113    HA   ASP  17           HA       ASP  17   1.149 -16.595  -3.698
  114   1HB   ASP  17          1HB       ASP  17  -0.381 -17.479  -1.826
  115   2HB   ASP  17          2HB       ASP  17  -0.466 -15.812  -1.235
  116    H    ARG  18           H        ARG  18   2.430 -14.805  -0.973
  117    HA   ARG  18           HA       ARG  18   1.408 -12.339  -1.254
  118   1HB   ARG  18          1HB       ARG  18   4.344 -13.030  -0.783
  119   2HB   ARG  18          2HB       ARG  18   3.566 -11.505  -0.322
  120   1HG   ARG  18          1HG       ARG  18   2.662 -12.418   1.545
  121   2HG   ARG  18          2HG       ARG  18   2.144 -13.885   0.696
  122   1HD   ARG  18          1HD       ARG  18   4.352 -14.864   0.916
  123   2HD   ARG  18          2HD       ARG  18   5.034 -13.347   1.522
  124    HE   ARG  18           HE       ARG  18   2.811 -14.436   3.116
  125   1HH1  ARG  18          1HH1      ARG  18   6.298 -14.329   2.661
  126   2HH1  ARG  18          2HH1      ARG  18   6.654 -14.810   4.287
  127   1HH2  ARG  18          1HH2      ARG  18   3.279 -15.070   5.262
  128   2HH2  ARG  18          2HH2      ARG  18   4.925 -15.235   5.775
  129    H    VAL  19           H        VAL  19   3.104 -10.373  -2.035
  130    HA   VAL  19           HA       VAL  19   3.629 -10.995  -4.859
  131    HB   VAL  19           HB       VAL  19   2.860  -8.366  -3.577
  132   1HG1  VAL  19          1HG1      VAL  19   3.746  -9.149  -6.305
  133   2HG1  VAL  19          2HG1      VAL  19   2.367  -8.030  -6.209
  134   3HG1  VAL  19          3HG1      VAL  19   3.913  -7.602  -5.440
  135   1HG2  VAL  19          1HG2      VAL  19   0.717  -8.949  -3.769
  136   2HG2  VAL  19          2HG2      VAL  19   0.946  -9.351  -5.487
  137   3HG2  VAL  19          3HG2      VAL  19   1.230 -10.587  -4.238
  138    H    ASP  20           H        ASP  20   5.329 -11.244  -2.285
  139    HA   ASP  20           HA       ASP  20   7.265 -10.545  -1.481
  140   1HB   ASP  20          1HB       ASP  20   8.278 -12.026  -2.923
  141   2HB   ASP  20          2HB       ASP  20   7.593 -11.265  -4.367
  142    H    CYS  21           H        CYS  21   6.941  -8.321  -0.819
  143    HA   CYS  21           HA       CYS  21   6.728  -6.158  -2.468
  144   1HB   CYS  21          1HB       CYS  21   6.759  -6.570   0.219
  145   2HB   CYS  21          2HB       CYS  21   8.271  -5.684  -0.002
  146    H    GLY  22           H        GLY  22   9.577  -8.042  -1.430
  147   1HA   GLY  22          1HA       GLY  22  11.735  -7.990  -2.052
  148   2HA   GLY  22          2HA       GLY  22  11.190  -7.266  -3.551
  149    H    TYR  23           H        TYR  23  11.355  -6.191  -0.074
  150    HA   TYR  23           HA       TYR  23  12.251  -3.584  -0.990
  151   1HB   TYR  23          1HB       TYR  23  10.598  -4.621   1.021
  152   2HB   TYR  23          2HB       TYR  23  12.095  -4.334   1.916
  153    HD1  TYR  23           HD1      TYR  23  11.462  -2.526   3.303
  154    HD2  TYR  23           HD2      TYR  23  10.744  -2.308  -0.909
  155    HE1  TYR  23           HE1      TYR  23  10.833  -0.073   3.530
  156    HE2  TYR  23           HE2      TYR  23  10.117   0.145  -0.668
  157    HH   TYR  23           HH       TYR  23  10.800   2.008   1.111
  158    HA   PRO  24           HA       PRO  24  16.400  -4.428  -0.048
  159   1HB   PRO  24          1HB       PRO  24  17.384  -1.879  -0.065
  160   2HB   PRO  24          2HB       PRO  24  17.128  -2.824  -1.531
  161   1HG   PRO  24          1HG       PRO  24  15.534  -0.617  -0.394
  162   2HG   PRO  24          2HG       PRO  24  15.550  -1.235  -2.085
  163   1HD   PRO  24          1HD       PRO  24  13.570  -1.650  -0.056
  164   2HD   PRO  24          2HD       PRO  24  13.621  -2.409  -1.653
  165    H    HIS  25           H        HIS  25  14.266  -2.967   2.009
  166    HA   HIS  25           HA       HIS  25  16.223  -3.275   4.153
  167   1HB   HIS  25          1HB       HIS  25  14.390  -0.929   3.674
  168   2HB   HIS  25          2HB       HIS  25  15.083  -1.280   5.262
  169    HD1  HIS  25           HD1      HIS  25  17.841  -1.357   5.275
  170    HD2  HIS  25           HD2      HIS  25  15.984   0.575   2.048
  171    HE1  HIS  25           HE1      HIS  25  19.627   0.115   4.200
  172    HE2  HIS  25           HE2      HIS  25  18.441   1.235   2.190
  173    H    VAL  26           H        VAL  26  14.578  -5.339   3.405
  174    HA   VAL  26           HA       VAL  26  12.030  -5.272   4.580
  175    HB   VAL  26           HB       VAL  26  12.376  -6.878   2.945
  176   1HG1  VAL  26          1HG1      VAL  26  15.024  -7.236   4.248
  177   2HG1  VAL  26          2HG1      VAL  26  14.305  -8.685   3.504
  178   3HG1  VAL  26          3HG1      VAL  26  14.581  -7.225   2.524
  179   1HG2  VAL  26          1HG2      VAL  26  11.656  -8.839   3.929
  180   2HG2  VAL  26          2HG2      VAL  26  12.792  -8.704   5.292
  181   3HG2  VAL  26          3HG2      VAL  26  11.343  -7.671   5.235
  182    H    THR  27           H        THR  27  11.440  -5.261   6.684
  183    HA   THR  27           HA       THR  27  12.764  -6.837   8.623
  184    HB   THR  27           HB       THR  27  13.937  -4.268   8.065
  185    HG1  THR  27           HG1      THR  27  15.390  -5.247   9.526
  186   1HG2  THR  27          1HG2      THR  27  12.355  -4.462  10.664
  187   2HG2  THR  27          2HG2      THR  27  13.887  -3.557  10.591
  188   3HG2  THR  27          3HG2      THR  27  12.514  -3.067   9.571
  189    HA   PRO  28           HA       PRO  28   8.944  -6.214  10.473
  190   1HB   PRO  28          1HB       PRO  28   9.448  -6.982  13.046
  191   2HB   PRO  28          2HB       PRO  28   9.163  -8.126  11.737
  192   1HG   PRO  28          1HG       PRO  28  11.684  -7.332  13.046
  193   2HG   PRO  28          2HG       PRO  28  11.338  -8.812  12.079
  194   1HD   PRO  28          1HD       PRO  28  12.812  -6.483  11.303
  195   2HD   PRO  28          2HD       PRO  28  12.362  -7.840  10.264
  196    H    LYS  29           H        LYS  29   9.816  -3.815   9.951
  197    HA   LYS  29           HA       LYS  29   8.634  -2.269  11.911
  198   1HB   LYS  29          1HB       LYS  29  10.529  -2.915  13.319
  199   2HB   LYS  29          2HB       LYS  29  11.660  -2.247  12.128
  200   1HG   LYS  29          1HG       LYS  29  11.288  -0.122  12.822
  201   2HG   LYS  29          2HG       LYS  29   9.531  -0.348  12.891
  202   1HD   LYS  29          1HD       LYS  29   9.622  -0.543  15.131
  203   2HD   LYS  29          2HD       LYS  29  10.773  -1.885  15.009
  204   1HE   LYS  29          1HE       LYS  29  12.283  -0.498  15.965
  205   2HE   LYS  29          2HE       LYS  29  12.323   0.383  14.429
  206   1HZ   LYS  29          1HZ       LYS  29  10.099   1.232  15.796
  207   2HZ   LYS  29          2HZ       LYS  29  11.306   1.205  16.896
  208   3HZ   LYS  29          3HZ       LYS  29  11.472   2.072  15.523
  209    H    GLU  30           H        GLU  30  10.745  -2.780   9.152
  210    HA   GLU  30           HA       GLU  30  10.409  -0.007   8.379
  211   1HB   GLU  30          1HB       GLU  30  12.372  -2.125   7.842
  212   2HB   GLU  30          2HB       GLU  30  11.884  -1.267   6.369
  213   1HG   GLU  30          1HG       GLU  30  13.512   0.197   7.027
  214   2HG   GLU  30          2HG       GLU  30  12.230   0.849   8.060
  215    H    CYS  31           H        CYS  31   9.770  -3.386   7.258
  216    HA   CYS  31           HA       CYS  31   8.534  -2.649   4.868
  217   1HB   CYS  31          1HB       CYS  31   8.654  -5.095   6.555
  218   2HB   CYS  31          2HB       CYS  31   7.383  -5.005   5.331
  219    H    ASN  32           H        ASN  32   7.194  -3.614   8.115
  220    HA   ASN  32           HA       ASN  32   4.559  -3.130   7.422
  221   1HB   ASN  32          1HB       ASN  32   6.131  -3.631   9.881
  222   2HB   ASN  32          2HB       ASN  32   4.686  -2.653  10.179
  223   1HD2  ASN  32          1HD2      ASN  32   5.686  -5.456   8.211
  224   2HD2  ASN  32          2HD2      ASN  32   4.323  -6.466   8.561
  225    H    ASN  33           H        ASN  33   7.154  -0.984   7.646
  226    HA   ASN  33           HA       ASN  33   5.490   1.173   8.660
  227   1HB   ASN  33          1HB       ASN  33   7.608   1.062   9.811
  228   2HB   ASN  33          2HB       ASN  33   8.509   0.860   8.300
  229   1HD2  ASN  33          1HD2      ASN  33   9.601   2.573   7.761
  230   2HD2  ASN  33          2HD2      ASN  33   9.149   4.230   7.983
  231    H    ARG  34           H        ARG  34   7.184  -0.190   5.864
  232    HA   ARG  34           HA       ARG  34   7.063   2.249   4.390
  233   1HB   ARG  34          1HB       ARG  34   8.294   1.119   2.731
  234   2HB   ARG  34          2HB       ARG  34   8.830   0.302   4.208
  235   1HG   ARG  34          1HG       ARG  34   8.351  -1.502   2.805
  236   2HG   ARG  34          2HG       ARG  34   6.824  -1.342   3.690
  237   1HD   ARG  34          1HD       ARG  34   5.809  -1.180   1.675
  238   2HD   ARG  34          2HD       ARG  34   6.554   0.416   1.502
  239    HE   ARG  34           HE       ARG  34   8.455  -1.587   0.752
  240   1HH1  ARG  34          1HH1      ARG  34   5.448  -0.160  -0.391
  241   2HH1  ARG  34          2HH1      ARG  34   5.783  -0.478  -2.061
  242   1HH2  ARG  34          1HH2      ARG  34   8.897  -2.006  -1.451
  243   2HH2  ARG  34          2HH2      ARG  34   7.758  -1.536  -2.668
  244    H    GLY  35           H        GLY  35   5.229  -0.778   4.787
  245   1HA   GLY  35          1HA       GLY  35   2.810  -0.365   4.237
  246   2HA   GLY  35          2HA       GLY  35   3.382   0.065   2.638
  247    H    CYS  36           H        CYS  36   5.120  -2.440   4.427
  248    HA   CYS  36           HA       CYS  36   3.823  -4.437   2.717
  249   1HB   CYS  36          1HB       CYS  36   6.713  -4.357   3.590
  250   2HB   CYS  36          2HB       CYS  36   5.957  -5.631   2.630
  251    H    CYS  37           H        CYS  37   4.588  -6.775   3.803
  252    HA   CYS  37           HA       CYS  37   4.069  -6.486   6.672
  253   1HB   CYS  37          1HB       CYS  37   2.137  -7.306   5.155
  254   2HB   CYS  37          2HB       CYS  37   3.040  -8.822   5.089
  255    H    PHE  38           H        PHE  38   5.568  -7.557   7.947
  256    HA   PHE  38           HA       PHE  38   7.632  -9.028   6.543
  257   1HB   PHE  38          1HB       PHE  38   7.942  -7.180   8.332
  258   2HB   PHE  38          2HB       PHE  38   7.275  -8.312   9.513
  259    HD1  PHE  38           HD1      PHE  38   8.646  -9.962  10.496
  260    HD2  PHE  38           HD2      PHE  38  10.089  -7.756   7.170
  261    HE1  PHE  38           HE1      PHE  38  10.943 -10.901  10.870
  262    HE2  PHE  38           HE2      PHE  38  12.386  -8.695   7.543
  263    HZ   PHE  38           HZ       PHE  38  12.785 -10.257   9.389
  264    H    ASP  39           H        ASP  39   7.689 -11.221   6.434
  265    HA   ASP  39           HA       ASP  39   5.694 -12.693   7.781
  266   1HB   ASP  39          1HB       ASP  39   6.294 -13.547   5.672
  267   2HB   ASP  39          2HB       ASP  39   8.027 -13.339   5.964
  268    H    SER  40           H        SER  40   9.109 -13.803   7.561
  269    HA   SER  40           HA       SER  40  10.666 -14.018   9.138
  270   1HB   SER  40          1HB       SER  40   9.348 -12.244  10.502
  271   2HB   SER  40          2HB       SER  40   8.658 -13.622  11.378
  272    HG   SER  40           HG       SER  40  10.758 -12.490  12.160
  273    H    ARG  41           H        ARG  41   7.455 -15.437   9.153
  274    HA   ARG  41           HA       ARG  41   8.058 -17.589  10.839
  275   1HB   ARG  41          1HB       ARG  41   5.963 -17.437   8.625
  276   2HB   ARG  41          2HB       ARG  41   5.938 -18.543  10.009
  277   1HG   ARG  41          1HG       ARG  41   6.159 -16.121  11.274
  278   2HG   ARG  41          2HG       ARG  41   5.220 -15.653   9.846
  279   1HD   ARG  41          1HD       ARG  41   3.360 -16.711  10.610
  280   2HD   ARG  41          2HD       ARG  41   4.261 -18.160  11.080
  281    HE   ARG  41           HE       ARG  41   4.970 -16.232  12.969
  282   1HH1  ARG  41          1HH1      ARG  41   1.944 -17.646  11.861
  283   2HH1  ARG  41          2HH1      ARG  41   1.142 -17.440  13.382
  284   1HH2  ARG  41          1HH2      ARG  41   3.912 -15.960  14.977
  285   2HH2  ARG  41          2HH2      ARG  41   2.270 -16.475  15.166
  286    H    ILE  42           H        ILE  42   8.082 -17.060   7.264
  287    HA   ILE  42           HA       ILE  42   9.531 -19.604   7.020
  288    HB   ILE  42           HB       ILE  42   7.938 -18.447   4.771
  289   1HG1  ILE  42          1HG1      ILE  42   6.860 -19.809   7.209
  290   2HG1  ILE  42          2HG1      ILE  42   6.193 -18.449   6.289
  291   1HG2  ILE  42          1HG2      ILE  42   7.891 -20.690   3.975
  292   2HG2  ILE  42          2HG2      ILE  42   9.562 -20.344   4.480
  293   3HG2  ILE  42          3HG2      ILE  42   8.503 -21.323   5.522
  294   1HD1  ILE  42          1HD1      ILE  42   6.135 -21.410   5.647
  295   2HD1  ILE  42          2HD1      ILE  42   4.788 -20.248   5.687
  296   3HD1  ILE  42          3HD1      ILE  42   5.961 -20.205   4.349
  297    HA   PRO  43           HA       PRO  43  12.522 -16.639   5.730
  298   1HB   PRO  43          1HB       PRO  43  14.706 -18.226   6.142
  299   2HB   PRO  43          2HB       PRO  43  14.015 -17.193   7.392
  300   1HG   PRO  43          1HG       PRO  43  13.812 -20.112   7.017
  301   2HG   PRO  43          2HG       PRO  43  13.529 -19.150   8.511
  302   1HD   PRO  43          1HD       PRO  43  11.596 -20.350   6.771
  303   2HD   PRO  43          2HD       PRO  43  11.263 -19.279   8.140
  304    H    GLY  44           H        GLY  44  11.378 -19.383   4.353
  305   1HA   GLY  44          1HA       GLY  44  13.298 -19.370   2.149
  306   2HA   GLY  44          2HA       GLY  44  12.010 -20.523   2.434
  307    H    VAL  45           H        VAL  45  10.549 -17.612   3.071
  308    HA   VAL  45           HA       VAL  45   9.825 -17.219   0.249
  309    HB   VAL  45           HB       VAL  45   7.593 -17.112   0.769
  310   1HG1  VAL  45          1HG1      VAL  45   8.697 -19.400   1.244
  311   2HG1  VAL  45          2HG1      VAL  45   8.387 -19.033   2.958
  312   3HG1  VAL  45          3HG1      VAL  45   7.031 -19.135   1.810
  313   1HG2  VAL  45          1HG2      VAL  45   7.868 -15.443   2.604
  314   2HG2  VAL  45          2HG2      VAL  45   6.628 -16.674   2.943
  315   3HG2  VAL  45          3HG2      VAL  45   8.226 -16.783   3.720
  316    HA   PRO  46           HA       PRO  46  10.242 -12.952   0.965
  317   1HB   PRO  46          1HB       PRO  46   7.891 -11.712   0.332
  318   2HB   PRO  46          2HB       PRO  46   9.035 -12.284  -0.878
  319   1HG   PRO  46          1HG       PRO  46   6.471 -13.446   0.004
  320   2HG   PRO  46          2HG       PRO  46   7.374 -13.747  -1.525
  321   1HD   PRO  46          1HD       PRO  46   7.157 -15.437   0.777
  322   2HD   PRO  46          2HD       PRO  46   8.186 -15.705  -0.635
  323    H    TRP  47           H        TRP  47  10.730 -11.871   2.760
  324    HA   TRP  47           HA       TRP  47   8.754 -12.114   4.895
  325   1HB   TRP  47          1HB       TRP  47  11.304 -10.811   5.493
  326   2HB   TRP  47          2HB       TRP  47  10.452 -12.100   6.342
  327    HD1  TRP  47           HD1      TRP  47  10.927 -14.673   5.345
  328    HE1  TRP  47           HE1      TRP  47  13.023 -15.770   4.177
  329    HE3  TRP  47           HE3      TRP  47  13.131 -10.291   4.007
  330    HZ2  TRP  47           HZ2      TRP  47  15.317 -14.705   2.854
  331    HZ3  TRP  47           HZ3      TRP  47  15.298 -10.408   2.780
  332    HH2  TRP  47           HH2      TRP  47  16.389 -12.518   2.202
  333    H    CYS  48           H        CYS  48   8.408 -10.385   2.460
  334    HA   CYS  48           HA       CYS  48   7.641  -8.040   3.841
  335   1HB   CYS  48          1HB       CYS  48  10.058  -7.596   3.561
  336   2HB   CYS  48          2HB       CYS  48   9.858  -7.707   1.811
  337    H    PHE  49           H        PHE  49   5.585  -8.150   2.951
  338    HA   PHE  49           HA       PHE  49   5.446  -7.962   0.046
  339   1HB   PHE  49          1HB       PHE  49   3.276  -9.541   0.642
  340   2HB   PHE  49          2HB       PHE  49   4.835 -10.225   0.166
  341    HD1  PHE  49           HD1      PHE  49   6.510 -10.540   2.225
  342    HD2  PHE  49           HD2      PHE  49   2.281 -10.367   2.531
  343    HE1  PHE  49           HE1      PHE  49   6.617 -11.772   4.409
  344    HE2  PHE  49           HE2      PHE  49   2.388 -11.599   4.716
  345    HZ   PHE  49           HZ       PHE  49   4.556 -12.286   5.628
  346    H    LYS  50           H        LYS  50   2.719  -7.889  -0.315
  347    HA   LYS  50           HA       LYS  50   1.855  -5.778   1.536
  348   1HB   LYS  50          1HB       LYS  50   0.735  -4.733  -0.437
  349   2HB   LYS  50          2HB       LYS  50   2.506  -4.670  -0.470
  350   1HG   LYS  50          1HG       LYS  50   1.712  -7.115  -1.720
  351   2HG   LYS  50          2HG       LYS  50   0.686  -5.838  -2.397
  352   1HD   LYS  50          1HD       LYS  50   3.714  -6.035  -2.381
  353   2HD   LYS  50          2HD       LYS  50   2.640  -5.909  -3.785
  354   1HE   LYS  50          1HE       LYS  50   2.064  -3.629  -2.242
  355   2HE   LYS  50          2HE       LYS  50   3.824  -3.790  -2.130
  356   1HZ   LYS  50          1HZ       LYS  50   2.623  -2.624  -4.135
  357   2HZ   LYS  50          2HZ       LYS  50   4.041  -3.413  -4.317
  358   3HZ   LYS  50          3HZ       LYS  50   2.640  -4.142  -4.736
  359    HA   PRO  51           HA       PRO  51  -1.163  -9.154   1.424
  360   1HB   PRO  51          1HB       PRO  51  -1.264  -9.641   4.110
  361   2HB   PRO  51          2HB       PRO  51  -0.245 -10.556   3.001
  362   1HG   PRO  51          1HG       PRO  51   0.470  -8.428   4.916
  363   2HG   PRO  51          2HG       PRO  51   1.538  -9.665   4.162
  364   1HD   PRO  51          1HD       PRO  51   1.313  -6.881   3.527
  365   2HD   PRO  51          2HD       PRO  51   2.261  -8.089   2.651
  366    H    LEU  52           H        LEU  52  -1.732  -8.012   4.606
  367    HA   LEU  52           HA       LEU  52  -4.170  -6.783   3.607
  368   1HB   LEU  52          1HB       LEU  52  -5.074  -7.141   5.650
  369   2HB   LEU  52          2HB       LEU  52  -3.942  -8.501   5.542
  370    HG   LEU  52           HG       LEU  52  -2.662  -6.223   6.772
  371   1HD1  LEU  52          1HD1      LEU  52  -4.434  -5.299   7.804
  372   2HD1  LEU  52          2HD1      LEU  52  -5.449  -6.747   7.598
  373   3HD1  LEU  52          3HD1      LEU  52  -4.258  -6.675   8.918
  374   1HD2  LEU  52          1HD2      LEU  52  -2.991  -9.101   7.161
  375   2HD2  LEU  52          2HD2      LEU  52  -1.600  -8.044   7.501
  376   3HD2  LEU  52          3HD2      LEU  52  -2.917  -8.192   8.690
  377    H    GLN  53           H        GLN  53  -1.555  -5.537   3.058
  378    HA   GLN  53           HA       GLN  53  -0.891  -3.576   4.817
  379   1HB   GLN  53          1HB       GLN  53  -0.869  -3.534   1.776
  380   2HB   GLN  53          2HB       GLN  53  -0.024  -2.347   2.784
  381   1HG   GLN  53          1HG       GLN  53   0.445  -5.357   2.706
  382   2HG   GLN  53          2HG       GLN  53   1.539  -4.111   2.084
  383   1HE2  GLN  53          1HE2      GLN  53   1.421  -2.223   4.055
  384   2HE2  GLN  53          2HE2      GLN  53   2.100  -2.823   5.530
  385    H    GLU  54           H        GLU  54  -3.795  -3.917   2.913
  386    HA   GLU  54           HA       GLU  54  -4.605  -1.482   2.300
  387   1HB   GLU  54          1HB       GLU  54  -6.218  -3.045   1.852
  388   2HB   GLU  54          2HB       GLU  54  -6.005  -3.888   3.397
  389   1HG   GLU  54          1HG       GLU  54  -7.127  -1.095   3.413
  390   2HG   GLU  54          2HG       GLU  54  -8.186  -2.414   2.889
  391    H    ALA  55           H        ALA  55  -4.025  -2.700   5.568
  392    HA   ALA  55           HA       ALA  55  -5.485  -1.218   7.215
  393   1HB   ALA  55          1HB       ALA  55  -2.599  -1.024   7.827
  394   2HB   ALA  55          2HB       ALA  55  -3.914  -1.800   8.742
  395   3HB   ALA  55          3HB       ALA  55  -3.146  -2.660   7.386
  396    H    GLU  56           H        GLU  56  -2.258   0.073   6.157
  397    HA   GLU  56           HA       GLU  56  -3.573   2.665   5.938
  398   1HB   GLU  56          1HB       GLU  56  -1.844   2.007   7.966
  399   2HB   GLU  56          2HB       GLU  56  -0.727   2.713   6.784
  400   1HG   GLU  56          1HG       GLU  56  -1.892   4.789   6.773
  401   2HG   GLU  56          2HG       GLU  56  -3.326   4.097   7.547
  402    H    CYS  57           H        CYS  57  -2.829   0.510   3.947
  403    HA   CYS  57           HA       CYS  57  -0.771   1.962   2.463
  404   1HB   CYS  57          1HB       CYS  57  -0.585  -0.547   3.048
  405   2HB   CYS  57          2HB       CYS  57  -1.769  -0.785   1.760
  406    H    THR  58           H        THR  58  -3.964   0.247   2.153
  407    HA   THR  58           HA       THR  58  -4.466   1.671  -0.340
  408    HB   THR  58           HB       THR  58  -4.918  -0.916   0.435
  409    HG1  THR  58           HG1      THR  58  -5.202   0.174  -1.688
  410   1HG2  THR  58          1HG2      THR  58  -6.825   0.300   1.983
  411   2HG2  THR  58          2HG2      THR  58  -7.717   0.165   0.449
  412   3HG2  THR  58          3HG2      THR  58  -7.066  -1.295   1.232
  413    H    PHE  59           H        PHE  59  -5.363   1.696   3.083
  414    HA   PHE  59           HA       PHE  59  -7.723   2.844   3.236
  415   1HB   PHE  59          1HB       PHE  59  -5.487   2.617   4.818
  416   2HB   PHE  59          2HB       PHE  59  -5.454   4.362   4.544
  417    HD1  PHE  59           HD1      PHE  59  -7.879   1.691   5.522
  418    HD2  PHE  59           HD2      PHE  59  -6.556   5.684   6.072
  419    HE1  PHE  59           HE1      PHE  59  -9.562   1.996   7.359
  420    HE2  PHE  59           HE2      PHE  59  -8.239   5.990   7.909
  421    HZ   PHE  59           HZ       PHE  59  -9.721   4.142   8.530
  422   1H    GLU   1           H1       GLU   1 -23.403   2.789  -7.506
  423    HA   GLU   1           HA       GLU   1 -21.207   2.094  -8.059
  424   1HB   GLU   1          1HB       GLU   1 -19.897   3.905  -6.749
  425   2HB   GLU   1          2HB       GLU   1 -21.257   4.437  -7.756
  426   1HG   GLU   1          1HG       GLU   1 -22.044   3.697  -5.009
  427   2HG   GLU   1          2HG       GLU   1 -20.884   5.034  -5.055
  428    H    GLU   2           H        GLU   2 -19.809   0.452  -7.606
  429    HA   GLU   2           HA       GLU   2 -19.694  -0.459  -4.877
  430   1HB   GLU   2          1HB       GLU   2 -19.998  -1.944  -6.973
  431   2HB   GLU   2          2HB       GLU   2 -18.261  -1.710  -7.244
  432   1HG   GLU   2          1HG       GLU   2 -17.854  -3.362  -5.770
  433   2HG   GLU   2          2HG       GLU   2 -18.577  -2.382  -4.486
  434    H    TYR   3           H        TYR   3 -16.871  -1.606  -5.959
  435    HA   TYR   3           HA       TYR   3 -15.356   0.399  -4.570
  436   1HB   TYR   3          1HB       TYR   3 -13.533  -1.349  -5.466
  437   2HB   TYR   3          2HB       TYR   3 -14.666  -1.869  -4.215
  438    HD1  TYR   3           HD1      TYR   3 -14.874  -4.178  -4.618
  439    HD2  TYR   3           HD2      TYR   3 -15.301  -1.433  -7.872
  440    HE1  TYR   3           HE1      TYR   3 -15.638  -6.075  -6.128
  441    HE2  TYR   3           HE2      TYR   3 -16.065  -3.340  -9.370
  442    HH   TYR   3           HH       TYR   3 -15.634  -6.548  -8.564
  443    H    VAL   4           H        VAL   4 -16.230   1.975  -6.446
  444    HA   VAL   4           HA       VAL   4 -14.109   1.997  -8.481
  445    HB   VAL   4           HB       VAL   4 -15.664   2.927 -10.042
  446   1HG1  VAL   4          1HG1      VAL   4 -17.453   1.021 -10.019
  447   2HG1  VAL   4          2HG1      VAL   4 -15.734   0.612 -10.237
  448   3HG1  VAL   4          3HG1      VAL   4 -16.506   0.396  -8.647
  449   1HG2  VAL   4          1HG2      VAL   4 -18.050   3.244  -9.524
  450   2HG2  VAL   4          2HG2      VAL   4 -17.740   2.799  -7.828
  451   3HG2  VAL   4          3HG2      VAL   4 -17.014   4.275  -8.508
  452    H    GLY   5           H        GLY   5 -16.378   3.896  -6.411
  453   1HA   GLY   5          1HA       GLY   5 -15.184   6.411  -6.959
  454   2HA   GLY   5          2HA       GLY   5 -16.266   6.010  -5.639
  455    H    LEU   6           H        LEU   6 -13.902   3.686  -5.407
  456    HA   LEU   6           HA       LEU   6 -12.298   5.382  -3.623
  457   1HB   LEU   6          1HB       LEU   6 -12.512   2.435  -3.265
  458   2HB   LEU   6          2HB       LEU   6 -12.202   3.707  -2.069
  459    HG   LEU   6           HG       LEU   6 -14.323   2.879  -1.541
  460   1HD1  LEU   6          1HD1      LEU   6 -14.112   5.517  -2.653
  461   2HD1  LEU   6          2HD1      LEU   6 -15.749   4.879  -2.940
  462   3HD1  LEU   6          3HD1      LEU   6 -15.096   4.941  -1.286
  463   1HD2  LEU   6          1HD2      LEU   6 -15.520   1.679  -2.968
  464   2HD2  LEU   6          2HD2      LEU   6 -15.892   3.144  -3.909
  465   3HD2  LEU   6          3HD2      LEU   6 -14.446   2.180  -4.297
  466    H    SER   7           H        SER   7 -12.363   3.722  -6.571
  467    HA   SER   7           HA       SER   7  -9.488   3.268  -6.393
  468   1HB   SER   7          1HB       SER   7  -9.710   1.589  -8.109
  469   2HB   SER   7          2HB       SER   7 -10.920   1.240  -6.862
  470    HG   SER   7           HG       SER   7 -11.313   2.460  -9.454
  471    H    ALA   8           H        ALA   8  -8.322   3.625  -8.583
  472    HA   ALA   8           HA       ALA   8  -7.637   5.305  -9.917
  473   1HB   ALA   8          1HB       ALA   8  -9.739   5.506 -11.724
  474   2HB   ALA   8          2HB       ALA   8  -8.451   4.277 -11.756
  475   3HB   ALA   8          3HB       ALA   8 -10.007   3.917 -10.968
  476    H    ASN   9           H        ASN   9 -11.054   6.177 -10.467
  477    HA   ASN   9           HA       ASN   9 -10.854   8.767 -10.481
  478   1HB   ASN   9          1HB       ASN   9 -13.021   7.728 -10.732
  479   2HB   ASN   9          2HB       ASN   9 -12.996   7.102  -9.077
  480   1HD2  ASN   9          1HD2      ASN   9 -12.086  10.290 -10.331
  481   2HD2  ASN   9          2HD2      ASN   9 -13.257  11.221  -9.458
  482    H    GLN  10           H        GLN  10 -10.631   6.684  -7.587
  483    HA   GLN  10           HA       GLN  10 -10.947   8.677  -5.677
  484   1HB   GLN  10          1HB       GLN  10 -10.842   6.017  -5.557
  485   2HB   GLN  10          2HB       GLN  10  -9.144   6.324  -5.152
  486   1HG   GLN  10          1HG       GLN  10 -10.106   8.035  -3.430
  487   2HG   GLN  10          2HG       GLN  10 -11.647   7.198  -3.668
  488   1HE2  GLN  10          1HE2      GLN  10  -8.218   6.243  -3.430
  489   2HE2  GLN  10          2HE2      GLN  10  -8.411   5.043  -2.194
  490    H    CYS  11           H        CYS  11  -7.998   7.249  -7.230
  491    HA   CYS  11           HA       CYS  11  -6.198   8.838  -5.784
  492   1HB   CYS  11          1HB       CYS  11  -5.495   6.790  -6.810
  493   2HB   CYS  11          2HB       CYS  11  -5.921   7.382  -8.419
  494    H    ALA  12           H        ALA  12  -8.592   9.664  -8.013
  495    HA   ALA  12           HA       ALA  12  -7.037  11.941  -9.028
  496   1HB   ALA  12          1HB       ALA  12  -8.595  10.032 -10.366
  497   2HB   ALA  12          2HB       ALA  12  -9.633  11.476 -10.287
  498   3HB   ALA  12          3HB       ALA  12  -8.015  11.580 -11.024
  499    H    VAL  13           H        VAL  13  -8.537  11.369  -6.338
  500    HA   VAL  13           HA       VAL  13 -10.862  12.756  -6.141
  501    HB   VAL  13           HB       VAL  13  -8.997  11.626  -4.442
  502   1HG1  VAL  13          1HG1      VAL  13  -8.631  13.300  -2.665
  503   2HG1  VAL  13          2HG1      VAL  13  -7.814  13.747  -4.181
  504   3HG1  VAL  13          3HG1      VAL  13  -9.329  14.556  -3.714
  505   1HG2  VAL  13          1HG2      VAL  13 -10.950  11.206  -3.454
  506   2HG2  VAL  13          2HG2      VAL  13 -10.982  12.876  -2.838
  507   3HG2  VAL  13          3HG2      VAL  13 -11.736  12.490  -4.403
  508    HA   PRO  14           HA       PRO  14  -9.991  16.953  -6.697
  509   1HB   PRO  14          1HB       PRO  14 -11.454  18.228  -4.776
  510   2HB   PRO  14          2HB       PRO  14 -12.159  17.596  -6.262
  511   1HG   PRO  14          1HG       PRO  14 -12.242  16.521  -3.515
  512   2HG   PRO  14          2HG       PRO  14 -13.335  16.154  -4.899
  513   1HD   PRO  14          1HD       PRO  14 -11.235  14.538  -3.810
  514   2HD   PRO  14          2HD       PRO  14 -12.175  14.205  -5.270
  515    H    ALA  15           H        ALA  15  -8.144  15.438  -4.949
  516    HA   ALA  15           HA       ALA  15  -6.458  15.828  -3.560
  517   1HB   ALA  15          1HB       ALA  15  -6.597  18.061  -5.476
  518   2HB   ALA  15          2HB       ALA  15  -5.688  18.454  -3.997
  519   3HB   ALA  15          3HB       ALA  15  -5.209  17.057  -4.990
  520    H    LYS  16           H        LYS  16  -8.362  15.676  -1.896
  521    HA   LYS  16           HA       LYS  16  -7.819  17.365   0.190
  522   1HB   LYS  16          1HB       LYS  16 -10.053  18.650   0.206
  523   2HB   LYS  16          2HB       LYS  16  -8.721  19.271  -0.784
  524   1HG   LYS  16          1HG       LYS  16  -9.993  19.105  -2.633
  525   2HG   LYS  16          2HG       LYS  16 -10.250  17.376  -2.347
  526   1HD   LYS  16          1HD       LYS  16 -11.836  19.606  -1.008
  527   2HD   LYS  16          2HD       LYS  16 -12.381  18.738  -2.454
  528   1HE   LYS  16          1HE       LYS  16 -11.897  16.606  -0.914
  529   2HE   LYS  16          2HE       LYS  16 -12.134  17.775   0.395
  530   1HZ   LYS  16          1HZ       LYS  16 -14.203  16.834  -0.142
  531   2HZ   LYS  16          2HZ       LYS  16 -14.240  18.355  -0.738
  532   3HZ   LYS  16          3HZ       LYS  16 -14.020  17.087  -1.745
  533    H    ASP  17           H        ASP  17  -8.229  14.588  -0.442
  534    HA   ASP  17           HA       ASP  17 -10.131  14.046   1.614
  535   1HB   ASP  17          1HB       ASP  17 -11.358  14.100  -0.680
  536   2HB   ASP  17          2HB       ASP  17 -10.482  12.605  -1.041
  537    H    ARG  18           H        ARG  18  -7.165  13.767   0.492
  538    HA   ARG  18           HA       ARG  18  -6.917  10.908   0.488
  539   1HB   ARG  18          1HB       ARG  18  -4.725  13.026   0.352
  540   2HB   ARG  18          2HB       ARG  18  -4.568  11.320  -0.102
  541   1HG   ARG  18          1HG       ARG  18  -5.550  11.651  -2.132
  542   2HG   ARG  18          2HG       ARG  18  -6.759  12.775  -1.490
  543   1HD   ARG  18          1HD       ARG  18  -5.178  14.606  -1.534
  544   2HD   ARG  18          2HD       ARG  18  -3.825  13.519  -1.885
  545    HE   ARG  18           HE       ARG  18  -6.004  13.462  -3.863
  546   1HH1  ARG  18          1HH1      ARG  18  -2.939  14.925  -2.942
  547   2HH1  ARG  18          2HH1      ARG  18  -2.564  15.457  -4.547
  548   1HH2  ARG  18          1HH2      ARG  18  -5.510  14.164  -5.981
  549   2HH2  ARG  18          2HH2      ARG  18  -4.036  15.022  -6.287
  550    H    VAL  19           H        VAL  19  -4.723  10.179   1.809
  551    HA   VAL  19           HA       VAL  19  -5.157  11.181   4.533
  552    HB   VAL  19           HB       VAL  19  -3.868   8.565   3.810
  553   1HG1  VAL  19          1HG1      VAL  19  -5.544   9.363   6.211
  554   2HG1  VAL  19          2HG1      VAL  19  -4.567   7.889   6.008
  555   3HG1  VAL  19          3HG1      VAL  19  -3.769   9.473   6.150
  556   1HG2  VAL  19          1HG2      VAL  19  -6.750   9.303   3.594
  557   2HG2  VAL  19          2HG2      VAL  19  -5.802   8.095   2.694
  558   3HG2  VAL  19          3HG2      VAL  19  -6.359   7.738   4.346
  559    H    ASP  20           H        ASP  20  -3.420  12.301   2.273
  560    HA   ASP  20           HA       ASP  20  -1.291  12.764   1.847
  561   1HB   ASP  20          1HB       ASP  20  -1.633  14.626   3.176
  562   2HB   ASP  20          2HB       ASP  20  -1.995  13.669   4.621
  563    H    CYS  21           H        CYS  21  -0.276  10.651   1.534
  564    HA   CYS  21           HA       CYS  21   0.430   8.870   3.451
  565   1HB   CYS  21          1HB       CYS  21   0.698   8.928   0.825
  566   2HB   CYS  21          2HB       CYS  21   2.361   9.365   1.227
  567    H    GLY  22           H        GLY  22   1.919  11.988   2.554
  568   1HA   GLY  22          1HA       GLY  22   3.559  13.207   3.487
  569   2HA   GLY  22          2HA       GLY  22   3.204  12.371   4.985
  570    H    TYR  23           H        TYR  23   4.570  11.267   1.797
  571    HA   TYR  23           HA       TYR  23   6.586   9.772   3.246
  572   1HB   TYR  23          1HB       TYR  23   5.045   9.484   0.926
  573   2HB   TYR  23          2HB       TYR  23   6.581  10.041   0.251
  574    HD1  TYR  23           HD1      TYR  23   5.994   7.815   3.199
  575    HD2  TYR  23           HD2      TYR  23   7.439   8.133  -0.815
  576    HE1  TYR  23           HE1      TYR  23   6.899   5.443   3.330
  577    HE2  TYR  23           HE2      TYR  23   8.339   5.759  -0.671
  578    HH   TYR  23           HH       TYR  23   9.022   4.191   0.949
  579    HA   PRO  24           HA       PRO  24   9.603  12.837   2.629
  580   1HB   PRO  24          1HB       PRO  24  11.788  11.427   3.463
  581   2HB   PRO  24          2HB       PRO  24  10.692  12.251   4.571
  582   1HG   PRO  24          1HG       PRO  24  10.932   9.382   3.925
  583   2HG   PRO  24          2HG       PRO  24  10.176  10.149   5.367
  584   1HD   PRO  24          1HD       PRO  24   8.888   8.967   3.100
  585   2HD   PRO  24          2HD       PRO  24   8.105   9.849   4.415
  586    H    HIS  25           H        HIS  25   9.196  10.126   0.811
  587    HA   HIS  25           HA       HIS  25  11.282  11.082  -1.012
  588   1HB   HIS  25          1HB       HIS  25  10.728   8.375   0.024
  589   2HB   HIS  25          2HB       HIS  25  10.986   8.468  -1.722
  590    HD1  HIS  25           HD1      HIS  25  13.312   9.980  -2.325
  591    HD2  HIS  25           HD2      HIS  25  13.043   8.072   1.401
  592    HE1  HIS  25           HE1      HIS  25  15.698   9.794  -1.443
  593    HE2  HIS  25           HE2      HIS  25  15.464   8.663   0.872
  594    H    VAL  26           H        VAL  26   8.380  11.811  -0.676
  595    HA   VAL  26           HA       VAL  26   6.700  10.570  -2.416
  596    HB   VAL  26           HB       VAL  26   5.796  12.236  -1.106
  597   1HG1  VAL  26          1HG1      VAL  26   7.127  13.821  -0.269
  598   2HG1  VAL  26          2HG1      VAL  26   8.317  13.576  -1.568
  599   3HG1  VAL  26          3HG1      VAL  26   6.963  14.706  -1.804
  600   1HG2  VAL  26          1HG2      VAL  26   5.275  12.325  -3.718
  601   2HG2  VAL  26          2HG2      VAL  26   4.550  13.479  -2.572
  602   3HG2  VAL  26          3HG2      VAL  26   5.961  13.958  -3.545
  603    H    THR  27           H        THR  27   6.759  10.103  -4.550
  604    HA   THR  27           HA       THR  27   7.656  11.991  -6.465
  605    HB   THR  27           HB       THR  27   9.637  10.199  -5.266
  606    HG1  THR  27           HG1      THR  27   9.803  11.977  -7.575
  607   1HG2  THR  27          1HG2      THR  27   8.840   9.751  -8.142
  608   2HG2  THR  27          2HG2      THR  27  10.577   9.889  -7.783
  609   3HG2  THR  27          3HG2      THR  27   9.604   8.623  -6.998
  610    HA   PRO  28           HA       PRO  28   5.125   9.468  -8.837
  611   1HB   PRO  28          1HB       PRO  28   5.803  10.255 -11.362
  612   2HB   PRO  28          2HB       PRO  28   4.706  11.171 -10.328
  613   1HG   PRO  28          1HG       PRO  28   7.533  11.672 -11.008
  614   2HG   PRO  28          2HG       PRO  28   6.310  12.828 -10.370
  615   1HD   PRO  28          1HD       PRO  28   8.476  11.580  -8.976
  616   2HD   PRO  28          2HD       PRO  28   7.205  12.585  -8.267
  617    H    LYS  29           H        LYS  29   7.103   7.974  -7.782
  618    HA   LYS  29           HA       LYS  29   7.208   5.874  -9.603
  619   1HB   LYS  29          1HB       LYS  29   8.745   7.277 -10.861
  620   2HB   LYS  29          2HB       LYS  29   9.792   7.454  -9.441
  621   1HG   LYS  29          1HG       LYS  29  10.743   5.426  -9.778
  622   2HG   LYS  29          2HG       LYS  29   9.178   4.637 -10.051
  623   1HD   LYS  29          1HD       LYS  29   9.259   4.981 -12.340
  624   2HD   LYS  29          2HD       LYS  29  10.235   6.454 -12.206
  625   1HE   LYS  29          1HE       LYS  29  12.010   4.650 -11.233
  626   2HE   LYS  29          2HE       LYS  29  11.088   3.579 -12.300
  627   1HZ   LYS  29          1HZ       LYS  29  12.435   6.081 -13.048
  628   2HZ   LYS  29          2HZ       LYS  29  12.859   4.569 -13.498
  629   3HZ   LYS  29          3HZ       LYS  29  11.473   5.228 -14.055
  630    H    GLU  30           H        GLU  30   8.129   7.596  -6.703
  631    HA   GLU  30           HA       GLU  30   9.183   5.160  -5.550
  632   1HB   GLU  30          1HB       GLU  30   9.546   8.012  -5.109
  633   2HB   GLU  30          2HB       GLU  30   9.152   7.197  -3.586
  634   1HG   GLU  30          1HG       GLU  30  11.068   5.663  -5.185
  635   2HG   GLU  30          2HG       GLU  30  11.668   7.295  -4.856
  636    H    CYS  31           H        CYS  31   6.546   7.594  -5.114
  637    HA   CYS  31           HA       CYS  31   5.422   6.421  -2.860
  638   1HB   CYS  31          1HB       CYS  31   4.463   8.289  -4.980
  639   2HB   CYS  31          2HB       CYS  31   3.282   7.587  -3.870
  640    H    ASN  32           H        ASN  32   4.455   6.215  -6.370
  641    HA   ASN  32           HA       ASN  32   2.527   4.300  -5.999
  642   1HB   ASN  32          1HB       ASN  32   4.051   5.464  -8.238
  643   2HB   ASN  32          2HB       ASN  32   3.608   3.779  -8.551
  644   1HD2  ASN  32          1HD2      ASN  32   2.093   6.528  -6.860
  645   2HD2  ASN  32          2HD2      ASN  32   0.579   6.494  -7.701
  646    H    ASN  33           H        ASN  33   5.906   4.107  -5.538
  647    HA   ASN  33           HA       ASN  33   6.019   1.312  -6.287
  648   1HB   ASN  33          1HB       ASN  33   7.921   2.568  -7.066
  649   2HB   ASN  33          2HB       ASN  33   8.132   3.374  -5.504
  650   1HD2  ASN  33          1HD2      ASN  33   9.876   2.710  -4.532
  651   2HD2  ASN  33          2HD2      ASN  33  10.486   1.092  -4.445
  652    H    ARG  34           H        ARG  34   5.923   3.590  -3.571
  653    HA   ARG  34           HA       ARG  34   6.739   1.575  -1.701
  654   1HB   ARG  34          1HB       ARG  34   6.979   3.305  -0.174
  655   2HB   ARG  34          2HB       ARG  34   7.132   4.239  -1.673
  656   1HG   ARG  34          1HG       ARG  34   5.511   5.513  -0.676
  657   2HG   ARG  34          2HG       ARG  34   4.428   4.298  -1.380
  658   1HD   ARG  34          1HD       ARG  34   5.361   3.250   1.108
  659   2HD   ARG  34          2HD       ARG  34   4.894   4.930   1.414
  660    HE   ARG  34           HE       ARG  34   2.969   3.346  -0.163
  661   1HH1  ARG  34          1HH1      ARG  34   3.925   4.463   3.035
  662   2HH1  ARG  34          2HH1      ARG  34   2.358   4.215   3.730
  663   1HH2  ARG  34          1HH2      ARG  34   0.902   3.019   0.754
  664   2HH2  ARG  34          2HH2      ARG  34   0.627   3.388   2.424
  665    H    GLY  35           H        GLY  35   3.823   2.985  -3.082
  666   1HA   GLY  35          1HA       GLY  35   1.859   1.525  -2.818
  667   2HA   GLY  35          2HA       GLY  35   2.184   1.525  -1.097
  668    H    CYS  36           H        CYS  36   2.835   4.483  -2.913
  669    HA   CYS  36           HA       CYS  36   0.357   5.603  -1.821
  670   1HB   CYS  36          1HB       CYS  36   3.069   6.914  -2.026
  671   2HB   CYS  36          2HB       CYS  36   1.579   7.741  -1.560
  672    H    CYS  37           H        CYS  37  -0.333   7.633  -3.112
  673    HA   CYS  37           HA       CYS  37   0.287   7.152  -5.934
  674   1HB   CYS  37          1HB       CYS  37  -2.086   6.807  -5.001
  675   2HB   CYS  37          2HB       CYS  37  -2.174   8.570  -4.941
  676    H    PHE  38           H        PHE  38   1.164   8.867  -7.107
  677    HA   PHE  38           HA       PHE  38   1.706  11.281  -5.572
  678   1HB   PHE  38          1HB       PHE  38   3.447   9.834  -6.840
  679   2HB   PHE  38          2HB       PHE  38   2.674  10.358  -8.340
  680    HD1  PHE  38           HD1      PHE  38   2.990  12.606  -9.163
  681    HD2  PHE  38           HD2      PHE  38   4.737  11.393  -5.490
  682    HE1  PHE  38           HE1      PHE  38   4.453  14.646  -9.185
  683    HE2  PHE  38           HE2      PHE  38   6.199  13.432  -5.512
  684    HZ   PHE  38           HZ       PHE  38   6.041  15.034  -7.359
  685    H    ASP  39           H        ASP  39   0.436  13.048  -5.845
  686    HA   ASP  39           HA       ASP  39  -1.432  13.093  -7.962
  687   1HB   ASP  39          1HB       ASP  39  -2.330  14.198  -6.165
  688   2HB   ASP  39          2HB       ASP  39  -0.752  14.741  -5.573
  689    H    SER  40           H        SER  40   0.632  15.880  -6.924
  690    HA   SER  40           HA       SER  40   2.201  17.000  -8.010
  691   1HB   SER  40          1HB       SER  40   2.498  14.796  -9.417
  692   2HB   SER  40          2HB       SER  40   1.616  15.688 -10.670
  693    HG   SER  40           HG       SER  40   3.919  16.798  -9.337
  694    H    ARG  41           H        ARG  41  -1.055  16.392  -9.167
  695    HA   ARG  41           HA       ARG  41  -1.220  18.486 -10.986
  696   1HB   ARG  41          1HB       ARG  41  -3.520  17.452  -9.281
  697   2HB   ARG  41          2HB       ARG  41  -3.606  18.095 -10.930
  698   1HG   ARG  41          1HG       ARG  41  -1.819  16.006 -11.214
  699   2HG   ARG  41          2HG       ARG  41  -2.916  15.370  -9.976
  700   1HD   ARG  41          1HD       ARG  41  -3.952  14.709 -11.979
  701   2HD   ARG  41          2HD       ARG  41  -4.817  16.204 -11.597
  702    HE   ARG  41           HE       ARG  41  -3.793  17.240 -13.447
  703   1HH1  ARG  41          1HH1      ARG  41  -2.226  14.160 -12.786
  704   2HH1  ARG  41          2HH1      ARG  41  -1.307  14.167 -14.254
  705   1HH2  ARG  41          1HH2      ARG  41  -2.581  17.250 -15.384
  706   2HH2  ARG  41          2HH2      ARG  41  -1.510  15.937 -15.742
  707    H    ILE  42           H        ILE  42  -1.880  18.205  -7.446
  708    HA   ILE  42           HA       ILE  42  -2.079  21.136  -7.375
  709    HB   ILE  42           HB       ILE  42  -3.429  19.329  -5.395
  710   1HG1  ILE  42          1HG1      ILE  42  -4.355  20.081  -8.146
  711   2HG1  ILE  42          2HG1      ILE  42  -4.448  18.516  -7.322
  712   1HG2  ILE  42          1HG2      ILE  42  -4.735  21.232  -4.865
  713   2HG2  ILE  42          2HG2      ILE  42  -3.046  21.788  -4.951
  714   3HG2  ILE  42          3HG2      ILE  42  -4.162  22.119  -6.298
  715   1HD1  ILE  42          1HD1      ILE  42  -6.219  20.933  -7.081
  716   2HD1  ILE  42          2HD1      ILE  42  -6.653  19.207  -7.103
  717   3HD1  ILE  42          3HD1      ILE  42  -5.978  19.936  -5.626
  718    HA   PRO  43           HA       PRO  43   1.511  20.341  -4.960
  719   1HB   PRO  43          1HB       PRO  43   2.548  22.864  -5.130
  720   2HB   PRO  43          2HB       PRO  43   2.880  21.602  -6.316
  721   1HG   PRO  43          1HG       PRO  43   1.076  23.931  -6.479
  722   2HG   PRO  43          2HG       PRO  43   1.768  22.949  -7.821
  723   1HD   PRO  43          1HD       PRO  43  -0.899  22.911  -6.777
  724   2HD   PRO  43          2HD       PRO  43  -0.225  21.815  -7.990
  725    H    GLY  44           H        GLY  44  -1.235  22.016  -4.342
  726   1HA   GLY  44          1HA       GLY  44  -0.298  23.122  -1.805
  727   2HA   GLY  44          2HA       GLY  44  -1.874  23.327  -2.544
  728    H    VAL  45           H        VAL  45  -1.329  20.103  -2.999
  729    HA   VAL  45           HA       VAL  45  -2.405  19.409  -0.353
  730    HB   VAL  45           HB       VAL  45  -4.026  18.090  -1.285
  731   1HG1  VAL  45          1HG1      VAL  45  -3.843  20.691  -2.248
  732   2HG1  VAL  45          2HG1      VAL  45  -4.186  19.726  -3.704
  733   3HG1  VAL  45          3HG1      VAL  45  -5.280  19.642  -2.303
  734   1HG2  VAL  45          1HG2      VAL  45  -2.420  16.803  -2.719
  735   2HG2  VAL  45          2HG2      VAL  45  -4.008  17.088  -3.473
  736   3HG2  VAL  45          3HG2      VAL  45  -2.602  18.061  -3.966
  737    HA   PRO  46           HA       PRO  46   0.425  16.114  -0.305
  738   1HB   PRO  46          1HB       PRO  46  -0.955  13.794   0.109
  739   2HB   PRO  46          2HB       PRO  46  -0.612  14.954   1.391
  740   1HG   PRO  46          1HG       PRO  46  -3.115  14.441  -0.085
  741   2HG   PRO  46          2HG       PRO  46  -2.897  15.254   1.507
  742   1HD   PRO  46          1HD       PRO  46  -3.457  16.443  -1.038
  743   2HD   PRO  46          2HD       PRO  46  -3.093  17.295   0.468
  744    H    TRP  47           H        TRP  47   1.798  15.539  -1.855
  745    HA   TRP  47           HA       TRP  47   0.562  14.526  -4.287
  746   1HB   TRP  47          1HB       TRP  47   3.465  14.816  -4.244
  747   2HB   TRP  47          2HB       TRP  47   2.272  15.434  -5.387
  748    HD1  TRP  47           HD1      TRP  47   1.024  17.837  -4.552
  749    HE1  TRP  47           HE1      TRP  47   1.956  19.917  -3.223
  750    HE3  TRP  47           HE3      TRP  47   5.031  15.428  -2.553
  751    HZ2  TRP  47           HZ2      TRP  47   4.214  20.313  -1.522
  752    HZ3  TRP  47           HZ3      TRP  47   6.549  16.735  -1.069
  753    HH2  TRP  47           HH2      TRP  47   6.193  19.094  -0.544
  754    H    CYS  48           H        CYS  48   0.625  12.965  -1.725
  755    HA   CYS  48           HA       CYS  48   1.559  10.545  -2.840
  756   1HB   CYS  48          1HB       CYS  48   3.702  11.578  -2.057
  757   2HB   CYS  48          2HB       CYS  48   3.082  11.489  -0.406
  758    H    PHE  49           H        PHE  49  -0.392   9.553  -2.339
  759    HA   PHE  49           HA       PHE  49  -1.054   9.425   0.500
  760   1HB   PHE  49          1HB       PHE  49  -3.525   9.493  -0.703
  761   2HB   PHE  49          2HB       PHE  49  -2.740  10.948  -0.080
  762    HD1  PHE  49           HD1      PHE  49  -1.057  12.055  -1.849
  763    HD2  PHE  49           HD2      PHE  49  -4.354   9.572  -2.836
  764    HE1  PHE  49           HE1      PHE  49  -1.124  13.057  -4.149
  765    HE2  PHE  49           HE2      PHE  49  -4.421  10.574  -5.136
  766    HZ   PHE  49           HZ       PHE  49  -2.804  12.305  -5.765
  767    H    LYS  50           H        LYS  50  -3.387   7.893   0.306
  768    HA   LYS  50           HA       LYS  50  -2.471   5.556  -1.219
  769   1HB   LYS  50          1HB       LYS  50  -3.670   4.320   0.769
  770   2HB   LYS  50          2HB       LYS  50  -1.973   4.822   0.891
  771   1HG   LYS  50          1HG       LYS  50  -4.019   6.835   1.712
  772   2HG   LYS  50          2HG       LYS  50  -3.867   5.418   2.765
  773   1HD   LYS  50          1HD       LYS  50  -1.585   7.239   1.891
  774   2HD   LYS  50          2HD       LYS  50  -2.380   7.298   3.475
  775   1HE   LYS  50          1HE       LYS  50  -1.533   4.583   2.852
  776   2HE   LYS  50          2HE       LYS  50  -0.162   5.693   2.702
  777   1HZ   LYS  50          1HZ       LYS  50  -0.827   4.691   4.972
  778   2HZ   LYS  50          2HZ       LYS  50  -0.308   6.237   4.885
  779   3HZ   LYS  50          3HZ       LYS  50  -1.905   5.918   5.013
  780    HA   PRO  51           HA       PRO  51  -6.693   6.726  -2.392
  781   1HB   PRO  51          1HB       PRO  51  -6.270   7.010  -5.076
  782   2HB   PRO  51          2HB       PRO  51  -6.245   8.363  -3.948
  783   1HG   PRO  51          1HG       PRO  51  -4.013   6.938  -5.248
  784   2HG   PRO  51          2HG       PRO  51  -4.018   8.579  -4.505
  785   1HD   PRO  51          1HD       PRO  51  -2.918   6.152  -3.455
  786   2HD   PRO  51          2HD       PRO  51  -3.038   7.705  -2.618
  787    H    LEU  52           H        LEU  52  -5.729   5.413  -5.391
  788    HA   LEU  52           HA       LEU  52  -7.261   3.033  -4.718
  789   1HB   LEU  52          1HB       LEU  52  -7.701   2.806  -6.925
  790   2HB   LEU  52          2HB       LEU  52  -7.555   4.567  -6.795
  791    HG   LEU  52           HG       LEU  52  -5.003   3.343  -7.435
  792   1HD1  LEU  52          1HD1      LEU  52  -5.387   2.071  -9.257
  793   2HD1  LEU  52          2HD1      LEU  52  -6.955   1.790  -8.462
  794   3HD1  LEU  52          3HD1      LEU  52  -6.817   3.009  -9.752
  795   1HD2  LEU  52          1HD2      LEU  52  -6.640   5.634  -8.170
  796   2HD2  LEU  52          2HD2      LEU  52  -4.870   5.437  -8.175
  797   3HD2  LEU  52          3HD2      LEU  52  -5.829   4.908  -9.579
  798    H    GLN  53           H        GLN  53  -4.652   3.429  -3.468
  799    HA   GLN  53           HA       GLN  53  -2.594   2.223  -4.764
  800   1HB   GLN  53          1HB       GLN  53  -3.348   2.099  -1.820
  801   2HB   GLN  53          2HB       GLN  53  -1.758   1.639  -2.456
  802   1HG   GLN  53          1HG       GLN  53  -3.084   4.378  -2.554
  803   2HG   GLN  53          2HG       GLN  53  -1.626   3.935  -1.653
  804   1HE2  GLN  53          1HE2      GLN  53  -3.048   4.606  -4.763
  805   2HE2  GLN  53          2HE2      GLN  53  -1.586   4.808  -5.671
  806    H    GLU  54           H        GLU  54  -5.585   0.824  -3.612
  807    HA   GLU  54           HA       GLU  54  -5.006  -1.679  -2.945
  808   1HB   GLU  54          1HB       GLU  54  -7.183  -2.310  -3.731
  809   2HB   GLU  54          2HB       GLU  54  -7.298  -0.617  -3.223
  810   1HG   GLU  54          1HG       GLU  54  -8.245  -0.295  -5.263
  811   2HG   GLU  54          2HG       GLU  54  -6.586  -0.356  -5.881
  812    H    ALA  55           H        ALA  55  -4.351  -0.171  -6.031
  813    HA   ALA  55           HA       ALA  55  -4.432  -2.044  -7.904
  814   1HB   ALA  55          1HB       ALA  55  -3.466   0.176  -8.231
  815   2HB   ALA  55          2HB       ALA  55  -2.063  -0.256  -7.226
  816   3HB   ALA  55          3HB       ALA  55  -2.317  -1.062  -8.793
  817    H    GLU  56           H        GLU  56  -1.653  -1.788  -5.566
  818    HA   GLU  56           HA       GLU  56  -1.540  -4.667  -5.576
  819   1HB   GLU  56          1HB       GLU  56   0.661  -2.856  -6.578
  820   2HB   GLU  56          2HB       GLU  56   1.059  -4.423  -5.852
  821   1HG   GLU  56          1HG       GLU  56  -0.273  -5.592  -7.511
  822   2HG   GLU  56          2HG       GLU  56  -0.917  -4.071  -8.151
  823    H    CYS  57           H        CYS  57  -2.212  -2.304  -3.743
  824    HA   CYS  57           HA       CYS  57  -0.097  -2.609  -1.767
  825   1HB   CYS  57          1HB       CYS  57  -1.665  -0.441  -2.584
  826   2HB   CYS  57          2HB       CYS  57  -2.261  -0.862  -0.974
  827    H    THR  58           H        THR  58  -3.722  -2.726  -2.103
  828    HA   THR  58           HA       THR  58  -4.059  -4.030   0.409
  829    HB   THR  58           HB       THR  58  -5.694  -2.490  -0.886
  830    HG1  THR  58           HG1      THR  58  -6.405  -5.209  -0.033
  831   1HG2  THR  58          1HG2      THR  58  -6.152  -5.156  -2.327
  832   2HG2  THR  58          2HG2      THR  58  -7.287  -3.785  -2.357
  833   3HG2  THR  58          3HG2      THR  58  -5.675  -3.621  -3.092
  834    H    PHE  59           H        PHE  59  -3.920  -5.114  -3.022
  835    HA   PHE  59           HA       PHE  59  -4.759  -7.604  -2.963
  836   1HB   PHE  59          1HB       PHE  59  -2.785  -6.028  -4.331
  837   2HB   PHE  59          2HB       PHE  59  -1.993  -7.565  -3.970
  838    HD1  PHE  59           HD1      PHE  59  -1.997  -8.970  -5.785
  839    HD2  PHE  59           HD2      PHE  59  -5.423  -6.566  -5.084
  840    HE1  PHE  59           HE1      PHE  59  -3.129 -10.004  -7.772
  841    HE2  PHE  59           HE2      PHE  59  -6.556  -7.600  -7.072
  842    HZ   PHE  59           HZ       PHE  59  -5.395  -9.306  -8.392
  Start of MODEL   22
    1   1H    GLU   1           H1       GLU   1 -15.010  -7.937  -4.148
    2    HA   GLU   1           HA       GLU   1 -15.461  -5.198  -3.965
    3   1HB   GLU   1          1HB       GLU   1 -17.874  -6.961  -4.160
    4   2HB   GLU   1          2HB       GLU   1 -17.922  -5.648  -2.971
    5   1HG   GLU   1          1HG       GLU   1 -17.489  -3.996  -4.698
    6   2HG   GLU   1          2HG       GLU   1 -17.185  -5.254  -5.906
    7    H    GLU   2           H        GLU   2 -15.973  -8.486  -2.607
    8    HA   GLU   2           HA       GLU   2 -15.668  -7.431   0.055
    9   1HB   GLU   2          1HB       GLU   2 -17.200  -9.440  -0.900
   10   2HB   GLU   2          2HB       GLU   2 -15.775 -10.384  -0.430
   11   1HG   GLU   2          1HG       GLU   2 -15.901  -9.484   1.849
   12   2HG   GLU   2          2HG       GLU   2 -17.248  -8.428   1.397
   13    H    TYR   3           H        TYR   3 -13.419  -6.635  -0.441
   14    HA   TYR   3           HA       TYR   3 -11.347  -8.345  -1.153
   15   1HB   TYR   3          1HB       TYR   3 -11.796  -5.740   0.341
   16   2HB   TYR   3          2HB       TYR   3 -10.176  -6.439   0.432
   17    HD1  TYR   3           HD1      TYR   3  -9.463  -7.359  -2.125
   18    HD2  TYR   3           HD2      TYR   3 -11.955  -4.013  -1.171
   19    HE1  TYR   3           HE1      TYR   3  -8.901  -6.292  -4.364
   20    HE2  TYR   3           HE2      TYR   3 -11.384  -2.959  -3.412
   21    HH   TYR   3           HH       TYR   3 -10.149  -4.598  -5.913
   22    H    VAL   4           H        VAL   4 -11.600 -10.360  -0.010
   23    HA   VAL   4           HA       VAL   4 -10.912 -10.139   2.840
   24    HB   VAL   4           HB       VAL   4 -12.035 -12.287   3.123
   25   1HG1  VAL   4          1HG1      VAL   4 -13.893 -10.352   1.710
   26   2HG1  VAL   4          2HG1      VAL   4 -14.292 -11.496   3.014
   27   3HG1  VAL   4          3HG1      VAL   4 -13.254 -10.090   3.351
   28   1HG2  VAL   4          1HG2      VAL   4 -12.613 -12.025   0.160
   29   2HG2  VAL   4          2HG2      VAL   4 -11.764 -13.343   1.003
   30   3HG2  VAL   4          3HG2      VAL   4 -13.513 -13.116   1.240
   31    H    GLY   5           H        GLY   5 -10.515 -12.101  -0.182
   32   1HA   GLY   5          1HA       GLY   5  -8.360 -13.644   0.845
   33   2HA   GLY   5          2HA       GLY   5  -8.866 -13.497  -0.827
   34    H    LEU   6           H        LEU   6  -8.518 -10.342   0.244
   35    HA   LEU   6           HA       LEU   6  -5.658 -10.294  -0.409
   36   1HB   LEU   6          1HB       LEU   6  -7.458  -8.112  -1.333
   37   2HB   LEU   6          2HB       LEU   6  -5.893  -8.644  -1.975
   38    HG   LEU   6           HG       LEU   6  -7.484  -9.200  -3.611
   39   1HD1  LEU   6          1HD1      LEU   6  -6.698 -11.248  -3.961
   40   2HD1  LEU   6          2HD1      LEU   6  -6.022 -11.200  -2.314
   41   3HD1  LEU   6          3HD1      LEU   6  -7.631 -11.909  -2.597
   42   1HD2  LEU   6          1HD2      LEU   6  -9.647  -9.413  -3.180
   43   2HD2  LEU   6          2HD2      LEU   6  -9.349 -10.920  -2.282
   44   3HD2  LEU   6          3HD2      LEU   6  -9.292  -9.355  -1.437
   45    H    SER   7           H        SER   7  -7.951  -9.876   1.923
   46    HA   SER   7           HA       SER   7  -6.591  -7.525   2.983
   47   1HB   SER   7          1HB       SER   7  -8.568  -7.068   4.289
   48   2HB   SER   7          2HB       SER   7  -9.084  -7.344   2.616
   49    HG   SER   7           HG       SER   7 -10.131  -8.490   4.682
   50    H    ALA   8           H        ALA   8  -7.866  -8.148   5.689
   51    HA   ALA   8           HA       ALA   8  -5.826  -9.261   7.005
   52   1HB   ALA   8          1HB       ALA   8  -8.229 -10.283   8.195
   53   2HB   ALA   8          2HB       ALA   8  -7.274  -8.859   8.672
   54   3HB   ALA   8          3HB       ALA   8  -8.591  -8.691   7.487
   55    H    ASN   9           H        ASN   9  -5.091 -11.333   7.628
   56    HA   ASN   9           HA       ASN   9  -5.099 -13.558   7.703
   57   1HB   ASN   9          1HB       ASN   9  -7.650 -13.377   6.961
   58   2HB   ASN   9          2HB       ASN   9  -7.024 -13.853   5.375
   59   1HD2  ASN   9          1HD2      ASN   9  -5.199 -15.643   5.713
   60   2HD2  ASN   9          2HD2      ASN   9  -5.722 -17.033   6.605
   61    H    GLN  10           H        GLN  10  -5.367 -11.728   4.632
   62    HA   GLN  10           HA       GLN  10  -4.073 -13.517   2.982
   63   1HB   GLN  10          1HB       GLN  10  -5.362 -11.379   2.395
   64   2HB   GLN  10          2HB       GLN  10  -3.868 -10.492   2.742
   65   1HG   GLN  10          1HG       GLN  10  -3.440 -12.825   0.999
   66   2HG   GLN  10          2HG       GLN  10  -4.573 -11.660   0.297
   67   1HE2  GLN  10          1HE2      GLN  10  -3.906  -9.572  -0.156
   68   2HE2  GLN  10          2HE2      GLN  10  -2.241  -9.112  -0.273
   69    H    CYS  11           H        CYS  11  -2.843 -11.090   5.305
   70    HA   CYS  11           HA       CYS  11  -0.187 -11.137   4.403
   71   1HB   CYS  11          1HB       CYS  11  -0.971  -9.317   5.723
   72   2HB   CYS  11          2HB       CYS  11  -1.416 -10.384   7.058
   73    H    ALA  12           H        ALA  12  -2.140 -13.570   5.677
   74    HA   ALA  12           HA       ALA  12   0.116 -14.871   7.035
   75   1HB   ALA  12          1HB       ALA  12  -2.546 -16.111   7.250
   76   2HB   ALA  12          2HB       ALA  12  -1.383 -15.676   8.525
   77   3HB   ALA  12          3HB       ALA  12  -2.491 -14.445   7.874
   78    H    VAL  13           H        VAL  13  -0.750 -14.525   4.009
   79    HA   VAL  13           HA       VAL  13  -1.643 -16.832   2.925
   80    HB   VAL  13           HB       VAL  13  -0.407 -14.502   2.070
   81   1HG1  VAL  13          1HG1      VAL  13   1.262 -15.275   0.398
   82   2HG1  VAL  13          2HG1      VAL  13   1.793 -15.527   2.078
   83   3HG1  VAL  13          3HG1      VAL  13   1.193 -16.901   1.118
   84   1HG2  VAL  13          1HG2      VAL  13  -1.860 -14.894   0.426
   85   2HG2  VAL  13          2HG2      VAL  13  -0.862 -16.241  -0.171
   86   3HG2  VAL  13          3HG2      VAL  13  -2.112 -16.537   1.061
   87    HA   PRO  14           HA       PRO  14   1.332 -19.908   3.534
   88   1HB   PRO  14          1HB       PRO  14   1.409 -21.265   1.165
   89   2HB   PRO  14          2HB       PRO  14   0.130 -21.481   2.358
   90   1HG   PRO  14          1HG       PRO  14   0.115 -19.998  -0.193
   91   2HG   PRO  14          2HG       PRO  14  -1.285 -20.612   0.757
   92   1HD   PRO  14          1HD       PRO  14  -0.329 -17.923   0.530
   93   2HD   PRO  14          2HD       PRO  14  -1.610 -18.499   1.603
   94    H    ALA  15           H        ALA  15   2.326 -17.283   2.627
   95    HA   ALA  15           HA       ALA  15   4.192 -16.370   1.835
   96   1HB   ALA  15          1HB       ALA  15   5.503 -17.002   3.568
   97   2HB   ALA  15          2HB       ALA  15   4.911 -18.681   3.518
   98   3HB   ALA  15          3HB       ALA  15   6.216 -18.165   2.423
   99    H    LYS  16           H        LYS  16   2.985 -17.018  -0.344
  100    HA   LYS  16           HA       LYS  16   4.952 -17.610  -2.188
  101   1HB   LYS  16          1HB       LYS  16   3.984 -19.851  -2.985
  102   2HB   LYS  16          2HB       LYS  16   5.093 -19.860  -1.603
  103   1HG   LYS  16          1HG       LYS  16   3.507 -20.896  -0.392
  104   2HG   LYS  16          2HG       LYS  16   2.471 -19.466  -0.546
  105   1HD   LYS  16          1HD       LYS  16   2.621 -21.424  -2.832
  106   2HD   LYS  16          2HD       LYS  16   1.661 -21.862  -1.407
  107   1HE   LYS  16          1HE       LYS  16  -0.023 -20.578  -2.173
  108   2HE   LYS  16          2HE       LYS  16   1.015 -19.147  -2.077
  109   1HZ   LYS  16          1HZ       LYS  16   1.581 -19.362  -4.263
  110   2HZ   LYS  16          2HZ       LYS  16   1.257 -20.961  -4.340
  111   3HZ   LYS  16          3HZ       LYS  16   0.033 -19.880  -4.312
  112    H    ASP  17           H        ASP  17   2.832 -15.720  -1.614
  113    HA   ASP  17           HA       ASP  17   1.604 -15.821  -4.186
  114   1HB   ASP  17          1HB       ASP  17   0.090 -17.085  -2.493
  115   2HB   ASP  17          2HB       ASP  17  -0.215 -15.500  -1.767
  116    H    ARG  18           H        ARG  18   3.413 -14.255  -2.101
  117    HA   ARG  18           HA       ARG  18   1.908 -11.830  -1.843
  118   1HB   ARG  18          1HB       ARG  18   4.823 -12.388  -1.131
  119   2HB   ARG  18          2HB       ARG  18   3.851 -11.020  -0.560
  120   1HG   ARG  18          1HG       ARG  18   2.786 -12.281   1.016
  121   2HG   ARG  18          2HG       ARG  18   2.676 -13.705  -0.034
  122   1HD   ARG  18          1HD       ARG  18   4.924 -14.363   0.477
  123   2HD   ARG  18          2HD       ARG  18   5.306 -12.797   1.210
  124    HE   ARG  18           HE       ARG  18   3.101 -14.229   2.513
  125   1HH1  ARG  18          1HH1      ARG  18   6.585 -13.756   2.414
  126   2HH1  ARG  18          2HH1      ARG  18   6.835 -14.299   4.040
  127   1HH2  ARG  18          1HH2      ARG  18   3.428 -14.946   4.658
  128   2HH2  ARG  18          2HH2      ARG  18   5.025 -14.980   5.325
  129    H    VAL  19           H        VAL  19   3.393  -9.710  -2.347
  130    HA   VAL  19           HA       VAL  19   4.272 -10.071  -5.120
  131    HB   VAL  19           HB       VAL  19   3.477  -7.520  -3.712
  132   1HG1  VAL  19          1HG1      VAL  19   2.907  -7.263  -6.398
  133   2HG1  VAL  19          2HG1      VAL  19   4.366  -6.650  -5.583
  134   3HG1  VAL  19          3HG1      VAL  19   4.405  -8.225  -6.410
  135   1HG2  VAL  19          1HG2      VAL  19   1.787  -9.590  -5.106
  136   2HG2  VAL  19          2HG2      VAL  19   1.492  -8.734  -3.574
  137   3HG2  VAL  19          3HG2      VAL  19   1.319  -7.873  -5.123
  138    H    ASP  20           H        ASP  20   5.789 -10.602  -2.499
  139    HA   ASP  20           HA       ASP  20   7.629  -9.931  -1.452
  140   1HB   ASP  20          1HB       ASP  20   8.748 -11.317  -2.920
  141   2HB   ASP  20          2HB       ASP  20   8.208 -10.426  -4.350
  142    H    CYS  21           H        CYS  21   7.127  -7.740  -0.710
  143    HA   CYS  21           HA       CYS  21   7.086  -5.478  -2.206
  144   1HB   CYS  21          1HB       CYS  21   6.884  -6.076   0.441
  145   2HB   CYS  21          2HB       CYS  21   8.394  -5.158   0.415
  146    H    GLY  22           H        GLY  22   9.849  -7.415  -1.036
  147   1HA   GLY  22          1HA       GLY  22  12.081  -7.191  -1.287
  148   2HA   GLY  22          2HA       GLY  22  11.665  -6.699  -2.917
  149    H    TYR  23           H        TYR  23  11.537  -5.249   0.425
  150    HA   TYR  23           HA       TYR  23  12.257  -2.678  -0.722
  151   1HB   TYR  23          1HB       TYR  23  10.925  -3.871   1.628
  152   2HB   TYR  23          2HB       TYR  23  12.127  -2.687   2.150
  153    HD1  TYR  23           HD1      TYR  23   8.923  -3.199   0.440
  154    HD2  TYR  23           HD2      TYR  23  11.861  -0.308   1.587
  155    HE1  TYR  23           HE1      TYR  23   7.272  -1.324  -0.028
  156    HE2  TYR  23           HE2      TYR  23  10.200   1.557   1.115
  157    HH   TYR  23           HH       TYR  23   7.488   1.144  -0.677
  158    HA   PRO  24           HA       PRO  24  16.411  -2.996   0.457
  159   1HB   PRO  24          1HB       PRO  24  17.119  -0.359   0.451
  160   2HB   PRO  24          2HB       PRO  24  17.025  -1.334  -1.013
  161   1HG   PRO  24          1HG       PRO  24  15.161   0.696   0.035
  162   2HG   PRO  24          2HG       PRO  24  15.311   0.072  -1.647
  163   1HD   PRO  24          1HD       PRO  24  13.305  -0.537   0.306
  164   2HD   PRO  24          2HD       PRO  24  13.501  -1.298  -1.279
  165    H    HIS  25           H        HIS  25  14.067  -1.618   2.391
  166    HA   HIS  25           HA       HIS  25  15.964  -1.714   4.618
  167   1HB   HIS  25          1HB       HIS  25  14.233   0.479   3.728
  168   2HB   HIS  25          2HB       HIS  25  14.046   0.085   5.441
  169    HD1  HIS  25           HD1      HIS  25  16.734  -0.328   6.538
  170    HD2  HIS  25           HD2      HIS  25  16.074   2.445   3.459
  171    HE1  HIS  25           HE1      HIS  25  18.687   1.311   6.622
  172    HE2  HIS  25           HE2      HIS  25  18.255   2.958   4.673
  173    H    VAL  26           H        VAL  26  14.360  -3.880   3.570
  174    HA   VAL  26           HA       VAL  26  11.902  -4.140   4.832
  175    HB   VAL  26           HB       VAL  26  12.396  -5.609   3.098
  176   1HG1  VAL  26          1HG1      VAL  26  14.691  -5.624   2.797
  177   2HG1  VAL  26          2HG1      VAL  26  15.023  -6.007   4.504
  178   3HG1  VAL  26          3HG1      VAL  26  14.409  -7.271   3.411
  179   1HG2  VAL  26          1HG2      VAL  26  11.438  -6.594   5.374
  180   2HG2  VAL  26          2HG2      VAL  26  11.759  -7.634   3.965
  181   3HG2  VAL  26          3HG2      VAL  26  12.932  -7.560   5.302
  182    H    THR  27           H        THR  27  11.280  -4.508   6.911
  183    HA   THR  27           HA       THR  27  12.854  -5.954   8.749
  184    HB   THR  27           HB       THR  27  13.575  -3.183   8.391
  185    HG1  THR  27           HG1      THR  27  15.038  -3.964  10.144
  186   1HG2  THR  27          1HG2      THR  27  12.105  -3.869  10.971
  187   2HG2  THR  27          2HG2      THR  27  13.460  -2.715  10.971
  188   3HG2  THR  27          3HG2      THR  27  12.003  -2.375  10.006
  189    HA   PRO  28           HA       PRO  28   8.999  -6.083  10.624
  190   1HB   PRO  28          1HB       PRO  28   9.633  -6.876  13.161
  191   2HB   PRO  28          2HB       PRO  28   9.547  -7.987  11.796
  192   1HG   PRO  28          1HG       PRO  28  11.897  -6.837  13.158
  193   2HG   PRO  28          2HG       PRO  28  11.809  -8.304  12.118
  194   1HD   PRO  28          1HD       PRO  28  12.855  -5.719  11.465
  195   2HD   PRO  28          2HD       PRO  28  12.645  -7.083  10.358
  196    H    LYS  29           H        LYS  29   9.468  -3.540  10.228
  197    HA   LYS  29           HA       LYS  29   8.005  -2.299  12.189
  198   1HB   LYS  29          1HB       LYS  29  10.354  -2.873  13.350
  199   2HB   LYS  29          2HB       LYS  29  10.770  -1.305  12.635
  200   1HG   LYS  29          1HG       LYS  29   9.644  -0.263  14.281
  201   2HG   LYS  29          2HG       LYS  29   8.149  -1.087  13.806
  202   1HD   LYS  29          1HD       LYS  29   8.392  -2.733  15.416
  203   2HD   LYS  29          2HD       LYS  29  10.162  -2.646  15.409
  204   1HE   LYS  29          1HE       LYS  29  10.118  -0.572  16.679
  205   2HE   LYS  29          2HE       LYS  29   8.358  -0.452  16.530
  206   1HZ   LYS  29          1HZ       LYS  29   9.933  -2.333  18.110
  207   2HZ   LYS  29          2HZ       LYS  29   8.706  -1.369  18.592
  208   3HZ   LYS  29          3HZ       LYS  29   8.397  -2.695  17.690
  209    H    GLU  30           H        GLU  30  10.254  -2.368   9.519
  210    HA   GLU  30           HA       GLU  30   9.621   0.392   8.894
  211   1HB   GLU  30          1HB       GLU  30  11.835  -1.456   8.297
  212   2HB   GLU  30          2HB       GLU  30  11.311  -0.523   6.885
  213   1HG   GLU  30          1HG       GLU  30  12.479   1.230   7.678
  214   2HG   GLU  30          2HG       GLU  30  11.381   1.308   9.064
  215    H    CYS  31           H        CYS  31   9.452  -2.959   7.543
  216    HA   CYS  31           HA       CYS  31   8.314  -2.329   5.122
  217   1HB   CYS  31          1HB       CYS  31   8.236  -4.741   6.891
  218   2HB   CYS  31          2HB       CYS  31   7.233  -4.691   5.439
  219    H    ASN  32           H        ASN  32   6.773  -3.120   8.318
  220    HA   ASN  32           HA       ASN  32   4.175  -2.772   7.371
  221   1HB   ASN  32          1HB       ASN  32   5.543  -3.125   9.988
  222   2HB   ASN  32          2HB       ASN  32   4.012  -2.246  10.096
  223   1HD2  ASN  32          1HD2      ASN  32   5.355  -4.990   8.255
  224   2HD2  ASN  32          2HD2      ASN  32   4.051  -6.097   8.530
  225    H    ASN  33           H        ASN  33   6.668  -0.558   7.644
  226    HA   ASN  33           HA       ASN  33   4.962   1.579   8.608
  227   1HB   ASN  33          1HB       ASN  33   7.514   1.061   9.283
  228   2HB   ASN  33          2HB       ASN  33   7.853   2.011   7.827
  229   1HD2  ASN  33          1HD2      ASN  33   8.872   3.453   9.367
  230   2HD2  ASN  33          2HD2      ASN  33   7.930   4.647  10.196
  231    H    ARG  34           H        ARG  34   6.783   0.294   5.809
  232    HA   ARG  34           HA       ARG  34   6.421   2.654   4.275
  233   1HB   ARG  34          1HB       ARG  34   7.101  -0.065   3.116
  234   2HB   ARG  34          2HB       ARG  34   7.667   1.529   2.585
  235   1HG   ARG  34          1HG       ARG  34   8.491   1.237   5.290
  236   2HG   ARG  34          2HG       ARG  34   8.860  -0.307   4.501
  237   1HD   ARG  34          1HD       ARG  34  10.521   0.615   3.245
  238   2HD   ARG  34          2HD       ARG  34   9.575   2.064   2.871
  239    HE   ARG  34           HE       ARG  34  10.343   2.148   5.624
  240   1HH1  ARG  34          1HH1      ARG  34  11.788   2.378   2.424
  241   2HH1  ARG  34          2HH1      ARG  34  13.101   3.378   2.949
  242   1HH2  ARG  34          1HH2      ARG  34  12.075   3.467   6.317
  243   2HH2  ARG  34          2HH2      ARG  34  13.265   4.002   5.179
  244    H    GLY  35           H        GLY  35   4.664  -0.322   4.944
  245   1HA   GLY  35          1HA       GLY  35   2.271  -0.153   4.408
  246   2HA   GLY  35          2HA       GLY  35   2.740   0.338   2.793
  247    H    CYS  36           H        CYS  36   4.678  -2.085   4.512
  248    HA   CYS  36           HA       CYS  36   3.526  -4.110   2.734
  249   1HB   CYS  36          1HB       CYS  36   6.352  -4.028   3.786
  250   2HB   CYS  36          2HB       CYS  36   5.679  -5.175   2.624
  251    H    CYS  37           H        CYS  37   4.357  -6.436   3.807
  252    HA   CYS  37           HA       CYS  37   3.694  -6.242   6.654
  253   1HB   CYS  37          1HB       CYS  37   1.852  -7.087   5.046
  254   2HB   CYS  37          2HB       CYS  37   2.812  -8.566   4.964
  255    H    PHE  38           H        PHE  38   5.251  -7.200   7.934
  256    HA   PHE  38           HA       PHE  38   7.392  -8.593   6.587
  257   1HB   PHE  38          1HB       PHE  38   7.619  -6.787   8.396
  258   2HB   PHE  38          2HB       PHE  38   6.871  -7.904   9.541
  259    HD1  PHE  38           HD1      PHE  38   8.139  -9.659  10.537
  260    HD2  PHE  38           HD2      PHE  38   9.857  -7.281   7.471
  261    HE1  PHE  38           HE1      PHE  38  10.401 -10.610  11.066
  262    HE2  PHE  38           HE2      PHE  38  12.119  -8.232   8.001
  263    HZ   PHE  38           HZ       PHE  38  12.364  -9.885   9.792
  264    H    ASP  39           H        ASP  39   7.500 -10.777   6.401
  265    HA   ASP  39           HA       ASP  39   5.573 -12.330   7.814
  266   1HB   ASP  39          1HB       ASP  39   5.828 -13.295   5.756
  267   2HB   ASP  39          2HB       ASP  39   7.483 -12.693   5.563
  268    H    SER  40           H        SER  40   9.014 -13.233   7.155
  269    HA   SER  40           HA       SER  40  10.713 -13.578   8.523
  270   1HB   SER  40          1HB       SER  40   9.273 -11.983  10.173
  271   2HB   SER  40          2HB       SER  40   9.186 -13.494  11.096
  272    HG   SER  40           HG       SER  40  11.212 -13.191  11.697
  273    H    ARG  41           H        ARG  41   7.551 -15.058   8.779
  274    HA   ARG  41           HA       ARG  41   8.218 -17.238  10.344
  275   1HB   ARG  41          1HB       ARG  41   6.212 -17.289   8.056
  276   2HB   ARG  41          2HB       ARG  41   6.134 -18.193   9.578
  277   1HG   ARG  41          1HG       ARG  41   6.176 -15.724  10.613
  278   2HG   ARG  41          2HG       ARG  41   5.519 -15.296   9.024
  279   1HD   ARG  41          1HD       ARG  41   4.360 -17.528  10.733
  280   2HD   ARG  41          2HD       ARG  41   3.812 -15.852  10.884
  281    HE   ARG  41           HE       ARG  41   3.723 -16.519   8.133
  282   1HH1  ARG  41          1HH1      ARG  41   2.158 -17.528  11.119
  283   2HH1  ARG  41          2HH1      ARG  41   0.690 -18.007  10.337
  284   1HH2  ARG  41          1HH2      ARG  41   1.784 -17.151   7.101
  285   2HH2  ARG  41          2HH2      ARG  41   0.475 -17.790   8.037
  286    H    ILE  42           H        ILE  42   8.376 -16.624   6.791
  287    HA   ILE  42           HA       ILE  42   9.908 -19.119   6.548
  288    HB   ILE  42           HB       ILE  42   8.275 -17.935   4.324
  289   1HG1  ILE  42          1HG1      ILE  42   7.351 -19.662   6.598
  290   2HG1  ILE  42          2HG1      ILE  42   6.565 -18.250   5.871
  291   1HG2  ILE  42          1HG2      ILE  42   8.395 -20.182   3.411
  292   2HG2  ILE  42          2HG2      ILE  42  10.029 -19.570   3.763
  293   3HG2  ILE  42          3HG2      ILE  42   9.267 -20.749   4.856
  294   1HD1  ILE  42          1HD1      ILE  42   5.293 -20.003   4.985
  295   2HD1  ILE  42          2HD1      ILE  42   6.514 -19.789   3.707
  296   3HD1  ILE  42          3HD1      ILE  42   6.690 -21.104   4.893
  297    HA   PRO  43           HA       PRO  43  12.860 -16.066   5.415
  298   1HB   PRO  43          1HB       PRO  43  15.065 -17.640   5.762
  299   2HB   PRO  43          2HB       PRO  43  14.346 -16.691   7.061
  300   1HG   PRO  43          1HG       PRO  43  14.192 -19.587   6.520
  301   2HG   PRO  43          2HG       PRO  43  13.878 -18.714   8.063
  302   1HD   PRO  43          1HD       PRO  43  11.981 -19.843   6.239
  303   2HD   PRO  43          2HD       PRO  43  11.619 -18.857   7.661
  304    H    GLY  44           H        GLY  44  11.797 -18.774   3.887
  305   1HA   GLY  44          1HA       GLY  44  13.732 -18.594   1.703
  306   2HA   GLY  44          2HA       GLY  44  12.465 -19.787   1.912
  307    H    VAL  45           H        VAL  45  10.883 -17.002   2.691
  308    HA   VAL  45           HA       VAL  45  10.211 -16.436  -0.114
  309    HB   VAL  45           HB       VAL  45   7.970 -16.463   0.353
  310   1HG1  VAL  45          1HG1      VAL  45   7.727 -18.641   0.792
  311   2HG1  VAL  45          2HG1      VAL  45   9.454 -18.673   1.224
  312   3HG1  VAL  45          3HG1      VAL  45   8.226 -18.422   2.487
  313   1HG2  VAL  45          1HG2      VAL  45   8.507 -16.258   3.334
  314   2HG2  VAL  45          2HG2      VAL  45   8.136 -14.876   2.275
  315   3HG2  VAL  45          3HG2      VAL  45   6.931 -16.164   2.513
  316    HA   PRO  46           HA       PRO  46  10.476 -12.218   0.889
  317   1HB   PRO  46          1HB       PRO  46   8.114 -11.014   0.229
  318   2HB   PRO  46          2HB       PRO  46   9.329 -11.471  -0.963
  319   1HG   PRO  46          1HG       PRO  46   6.770 -12.765  -0.273
  320   2HG   PRO  46          2HG       PRO  46   7.747 -12.941  -1.773
  321   1HD   PRO  46          1HD       PRO  46   7.487 -14.779   0.408
  322   2HD   PRO  46          2HD       PRO  46   8.585 -14.926  -0.971
  323    H    TRP  47           H        TRP  47  10.900 -11.386   2.824
  324    HA   TRP  47           HA       TRP  47   8.846 -11.797   4.838
  325   1HB   TRP  47          1HB       TRP  47  11.280 -10.386   5.619
  326   2HB   TRP  47          2HB       TRP  47  10.499 -11.797   6.332
  327    HD1  TRP  47           HD1      TRP  47  11.177 -14.239   5.126
  328    HE1  TRP  47           HE1      TRP  47  13.390 -15.087   3.965
  329    HE3  TRP  47           HE3      TRP  47  13.131  -9.621   4.288
  330    HZ2  TRP  47           HZ2      TRP  47  15.659 -13.760   2.851
  331    HZ3  TRP  47           HZ3      TRP  47  15.349  -9.485   3.159
  332    HH2  TRP  47           HH2      TRP  47  16.605 -11.458   2.448
  333    H    CYS  48           H        CYS  48   8.377  -9.965   2.547
  334    HA   CYS  48           HA       CYS  48   7.419  -7.777   4.014
  335   1HB   CYS  48          1HB       CYS  48   9.829  -7.165   3.938
  336   2HB   CYS  48          2HB       CYS  48   9.724  -7.104   2.176
  337    H    PHE  49           H        PHE  49   5.469  -7.649   2.956
  338    HA   PHE  49           HA       PHE  49   5.514  -7.321   0.083
  339   1HB   PHE  49          1HB       PHE  49   3.445  -9.085   0.302
  340   2HB   PHE  49          2HB       PHE  49   5.091  -9.637  -0.020
  341    HD1  PHE  49           HD1      PHE  49   6.518 -10.222   2.071
  342    HD2  PHE  49           HD2      PHE  49   2.286  -9.919   2.118
  343    HE1  PHE  49           HE1      PHE  49   6.441 -11.619   4.154
  344    HE2  PHE  49           HE2      PHE  49   2.209 -11.316   4.202
  345    HZ   PHE  49           HZ       PHE  49   4.288 -12.150   5.195
  346    H    LYS  50           H        LYS  50   2.803  -7.417  -0.461
  347    HA   LYS  50           HA       LYS  50   1.688  -5.519   1.485
  348   1HB   LYS  50          1HB       LYS  50   0.497  -4.788  -0.832
  349   2HB   LYS  50          2HB       LYS  50   1.945  -4.014  -0.166
  350   1HG   LYS  50          1HG       LYS  50   2.327  -6.458  -1.862
  351   2HG   LYS  50          2HG       LYS  50   1.836  -4.972  -2.692
  352   1HD   LYS  50          1HD       LYS  50   4.286  -5.405  -0.938
  353   2HD   LYS  50          2HD       LYS  50   4.270  -5.078  -2.680
  354   1HE   LYS  50          1HE       LYS  50   3.714  -3.217  -0.366
  355   2HE   LYS  50          2HE       LYS  50   4.777  -2.965  -1.758
  356   1HZ   LYS  50          1HZ       LYS  50   1.845  -2.908  -1.711
  357   2HZ   LYS  50          2HZ       LYS  50   2.860  -1.682  -2.073
  358   3HZ   LYS  50          3HZ       LYS  50   2.704  -2.943  -3.099
  359    HA   PRO  51           HA       PRO  51  -1.068  -9.074   1.029
  360   1HB   PRO  51          1HB       PRO  51  -1.320  -9.669   3.684
  361   2HB   PRO  51          2HB       PRO  51  -0.156 -10.462   2.625
  362   1HG   PRO  51          1HG       PRO  51   0.252  -8.359   4.653
  363   2HG   PRO  51          2HG       PRO  51   1.464  -9.483   3.941
  364   1HD   PRO  51          1HD       PRO  51   1.069  -6.703   3.380
  365   2HD   PRO  51          2HD       PRO  51   2.168  -7.803   2.538
  366    H    LEU  52           H        LEU  52  -1.954  -8.110   4.194
  367    HA   LEU  52           HA       LEU  52  -4.384  -6.990   3.044
  368   1HB   LEU  52          1HB       LEU  52  -5.433  -7.480   5.014
  369   2HB   LEU  52          2HB       LEU  52  -4.293  -8.825   4.832
  370    HG   LEU  52           HG       LEU  52  -3.067  -6.716   6.358
  371   1HD1  LEU  52          1HD1      LEU  52  -5.913  -7.277   6.997
  372   2HD1  LEU  52          2HD1      LEU  52  -4.771  -7.233   8.362
  373   3HD1  LEU  52          3HD1      LEU  52  -4.928  -5.823   7.287
  374   1HD2  LEU  52          1HD2      LEU  52  -2.965  -9.433   6.235
  375   2HD2  LEU  52          2HD2      LEU  52  -2.278  -8.448   7.548
  376   3HD2  LEU  52          3HD2      LEU  52  -3.885  -9.189   7.739
  377    H    GLN  53           H        GLN  53  -1.863  -5.530   2.786
  378    HA   GLN  53           HA       GLN  53  -1.474  -3.668   4.738
  379   1HB   GLN  53          1HB       GLN  53  -1.209  -3.372   1.722
  380   2HB   GLN  53          2HB       GLN  53  -0.497  -2.256   2.902
  381   1HG   GLN  53          1HG       GLN  53   0.106  -5.229   2.600
  382   2HG   GLN  53          2HG       GLN  53   1.184  -3.897   2.160
  383   1HE2  GLN  53          1HE2      GLN  53  -0.082  -5.903   4.645
  384   2HE2  GLN  53          2HE2      GLN  53   0.845  -5.304   5.979
  385    H    GLU  54           H        GLU  54  -4.144  -4.026   2.496
  386    HA   GLU  54           HA       GLU  54  -5.058  -1.595   2.023
  387   1HB   GLU  54          1HB       GLU  54  -7.115  -2.565   1.675
  388   2HB   GLU  54          2HB       GLU  54  -6.129  -4.034   1.778
  389   1HG   GLU  54          1HG       GLU  54  -7.824  -4.571   3.262
  390   2HG   GLU  54          2HG       GLU  54  -6.685  -3.809   4.384
  391    H    ALA  55           H        ALA  55  -4.727  -3.087   5.205
  392    HA   ALA  55           HA       ALA  55  -6.527  -1.647   6.693
  393   1HB   ALA  55          1HB       ALA  55  -4.452  -1.877   8.412
  394   2HB   ALA  55          2HB       ALA  55  -5.480  -3.253   7.947
  395   3HB   ALA  55          3HB       ALA  55  -3.909  -3.007   7.148
  396    H    GLU  56           H        GLU  56  -3.057  -0.810   7.062
  397    HA   GLU  56           HA       GLU  56  -3.843   1.934   7.267
  398   1HB   GLU  56          1HB       GLU  56  -1.179   0.512   7.611
  399   2HB   GLU  56          2HB       GLU  56  -1.394   2.255   7.856
  400   1HG   GLU  56          1HG       GLU  56  -3.355   1.473   9.455
  401   2HG   GLU  56          2HG       GLU  56  -2.469  -0.060   9.478
  402    H    CYS  57           H        CYS  57  -3.648   0.156   4.641
  403    HA   CYS  57           HA       CYS  57  -1.879   1.959   3.173
  404   1HB   CYS  57          1HB       CYS  57  -1.493  -0.511   3.052
  405   2HB   CYS  57          2HB       CYS  57  -3.048  -0.664   2.229
  406    H    THR  58           H        THR  58  -4.941   0.075   2.559
  407    HA   THR  58           HA       THR  58  -5.963   1.661   0.583
  408    HB   THR  58           HB       THR  58  -6.727  -0.593   1.964
  409    HG1  THR  58           HG1      THR  58  -8.708  -0.214   0.580
  410   1HG2  THR  58          1HG2      THR  58  -7.806   1.247   3.645
  411   2HG2  THR  58          2HG2      THR  58  -9.073   1.249   2.394
  412   3HG2  THR  58          3HG2      THR  58  -8.657  -0.263   3.237
  413    H    PHE  59           H        PHE  59  -5.797   2.331   4.057
  414    HA   PHE  59           HA       PHE  59  -7.687   4.077   4.582
  415   1HB   PHE  59          1HB       PHE  59  -5.083   3.497   5.445
  416   2HB   PHE  59          2HB       PHE  59  -4.945   5.204   5.012
  417    HD1  PHE  59           HD1      PHE  59  -6.476   6.854   6.140
  418    HD2  PHE  59           HD2      PHE  59  -6.135   2.827   7.435
  419    HE1  PHE  59           HE1      PHE  59  -7.476   7.481   8.355
  420    HE2  PHE  59           HE2      PHE  59  -7.135   3.455   9.650
  421    HZ   PHE  59           HZ       PHE  59  -7.793   5.774  10.084
  422   1H    GLU   1           H1       GLU   1 -19.172  -1.915   2.320
  423    HA   GLU   1           HA       GLU   1 -19.533  -3.096  -0.168
  424   1HB   GLU   1          1HB       GLU   1 -21.403  -1.523   1.636
  425   2HB   GLU   1          2HB       GLU   1 -21.954  -2.353   0.171
  426   1HG   GLU   1          1HG       GLU   1 -22.099  -4.273   1.338
  427   2HG   GLU   1          2HG       GLU   1 -20.361  -4.212   1.667
  428    H    GLU   2           H        GLU   2 -20.029   0.334   0.934
  429    HA   GLU   2           HA       GLU   2 -20.316   1.118  -1.816
  430   1HB   GLU   2          1HB       GLU   2 -20.541   2.581   0.829
  431   2HB   GLU   2          2HB       GLU   2 -20.619   3.436  -0.720
  432   1HG   GLU   2          1HG       GLU   2 -22.603   2.281  -1.366
  433   2HG   GLU   2          2HG       GLU   2 -22.402   1.047  -0.112
  434    H    TYR   3           H        TYR   3 -17.899   0.136  -1.892
  435    HA   TYR   3           HA       TYR   3 -15.948   2.116  -1.054
  436   1HB   TYR   3          1HB       TYR   3 -16.132  -0.718  -2.097
  437   2HB   TYR   3          2HB       TYR   3 -14.633   0.141  -2.467
  438    HD1  TYR   3           HD1      TYR   3 -13.070   0.749  -0.682
  439    HD2  TYR   3           HD2      TYR   3 -16.693  -1.357   0.180
  440    HE1  TYR   3           HE1      TYR   3 -12.186   0.157   1.627
  441    HE2  TYR   3           HE2      TYR   3 -15.796  -1.942   2.486
  442    HH   TYR   3           HH       TYR   3 -12.765  -0.584   3.639
  443    H    VAL   4           H        VAL   4 -16.787   3.838  -2.515
  444    HA   VAL   4           HA       VAL   4 -15.861   3.369  -5.265
  445    HB   VAL   4           HB       VAL   4 -17.558   4.932  -6.004
  446   1HG1  VAL   4          1HG1      VAL   4 -18.011   2.414  -5.607
  447   2HG1  VAL   4          2HG1      VAL   4 -19.009   2.961  -4.239
  448   3HG1  VAL   4          3HG1      VAL   4 -19.399   3.491  -5.892
  449   1HG2  VAL   4          1HG2      VAL   4 -18.319   5.099  -3.071
  450   2HG2  VAL   4          2HG2      VAL   4 -17.739   6.415  -4.120
  451   3HG2  VAL   4          3HG2      VAL   4 -19.339   5.688  -4.405
  452    H    GLY   5           H        GLY   5 -16.408   5.852  -2.675
  453   1HA   GLY   5          1HA       GLY   5 -14.701   7.782  -3.876
  454   2HA   GLY   5          2HA       GLY   5 -15.333   7.786  -2.242
  455    H    LEU   6           H        LEU   6 -13.950   4.761  -2.597
  456    HA   LEU   6           HA       LEU   6 -11.282   5.720  -1.851
  457   1HB   LEU   6          1HB       LEU   6 -12.145   3.329  -0.437
  458   2HB   LEU   6          2HB       LEU   6 -11.302   4.772   0.156
  459    HG   LEU   6           HG       LEU   6 -13.372   4.519   1.341
  460   1HD1  LEU   6          1HD1      LEU   6 -12.661   6.823  -0.095
  461   2HD1  LEU   6          2HD1      LEU   6 -14.428   6.679  -0.262
  462   3HD1  LEU   6          3HD1      LEU   6 -13.686   6.716   1.356
  463   1HD2  LEU   6          1HD2      LEU   6 -15.245   4.925  -0.861
  464   2HD2  LEU   6          2HD2      LEU   6 -14.351   3.391  -0.988
  465   3HD2  LEU   6          3HD2      LEU   6 -15.284   3.759   0.484
  466    H    SER   7           H        SER   7 -12.919   4.364  -4.225
  467    HA   SER   7           HA       SER   7 -11.126   2.086  -4.487
  468   1HB   SER   7          1HB       SER   7 -13.910   2.439  -5.004
  469   2HB   SER   7          2HB       SER   7 -13.126   2.188  -6.573
  470    HG   SER   7           HG       SER   7 -12.464   0.171  -5.959
  471    H    ALA   8           H        ALA   8 -11.364   1.838  -7.363
  472    HA   ALA   8           HA       ALA   8  -9.307   3.522  -8.179
  473   1HB   ALA   8          1HB       ALA   8  -9.996   1.280  -9.136
  474   2HB   ALA   8          2HB       ALA   8 -11.345   2.113  -9.942
  475   3HB   ALA   8          3HB       ALA   8  -9.666   2.540 -10.349
  476    H    ASN   9           H        ASN   9  -9.908   5.692  -7.571
  477    HA   ASN   9           HA       ASN   9 -10.818   7.230  -9.566
  478   1HB   ASN   9          1HB       ASN   9 -13.053   6.394  -9.505
  479   2HB   ASN   9          2HB       ASN   9 -13.084   6.334  -7.737
  480   1HD2  ASN   9          1HD2      ASN   9 -11.919   8.903  -9.878
  481   2HD2  ASN   9          2HD2      ASN   9 -13.044  10.129  -9.397
  482    H    GLN  10           H        GLN  10 -10.706   6.504  -6.080
  483    HA   GLN  10           HA       GLN  10 -10.953   9.102  -5.134
  484   1HB   GLN  10          1HB       GLN  10 -11.198   7.103  -3.725
  485   2HB   GLN  10          2HB       GLN  10  -9.480   6.718  -3.928
  486   1HG   GLN  10          1HG       GLN  10  -8.829   8.735  -2.751
  487   2HG   GLN  10          2HG       GLN  10 -10.495   9.333  -2.728
  488   1HE2  GLN  10          1HE2      GLN  10  -8.659   6.394  -1.885
  489   2HE2  GLN  10          2HE2      GLN  10  -9.397   6.109  -0.344
  490    H    CYS  11           H        CYS  11  -8.229   7.264  -6.500
  491    HA   CYS  11           HA       CYS  11  -6.181   8.902  -5.538
  492   1HB   CYS  11          1HB       CYS  11  -5.630   6.759  -6.346
  493   2HB   CYS  11          2HB       CYS  11  -6.392   7.054  -7.912
  494    H    ALA  12           H        ALA  12  -8.808   9.580  -7.568
  495    HA   ALA  12           HA       ALA  12  -7.304  11.588  -9.088
  496   1HB   ALA  12          1HB       ALA  12  -8.626  11.013 -10.812
  497   2HB   ALA  12          2HB       ALA  12  -9.292   9.705  -9.807
  498   3HB   ALA  12          3HB       ALA  12 -10.090  11.295  -9.840
  499    H    VAL  13           H        VAL  13  -8.601  11.357  -6.134
  500    HA   VAL  13           HA       VAL  13 -10.634  13.044  -5.759
  501    HB   VAL  13           HB       VAL  13  -8.428  12.053  -4.268
  502   1HG1  VAL  13          1HG1      VAL  13  -7.399  14.189  -4.147
  503   2HG1  VAL  13          2HG1      VAL  13  -8.955  15.010  -3.877
  504   3HG1  VAL  13          3HG1      VAL  13  -8.261  13.975  -2.605
  505   1HG2  VAL  13          1HG2      VAL  13 -10.805  13.421  -3.029
  506   2HG2  VAL  13          2HG2      VAL  13 -11.023  11.931  -3.980
  507   3HG2  VAL  13          3HG2      VAL  13  -9.976  11.923  -2.541
  508    HA   PRO  14           HA       PRO  14  -9.523  16.988  -7.122
  509   1HB   PRO  14          1HB       PRO  14 -10.920  18.622  -5.437
  510   2HB   PRO  14          2HB       PRO  14 -11.656  17.799  -6.810
  511   1HG   PRO  14          1HG       PRO  14 -11.794  17.177  -3.930
  512   2HG   PRO  14          2HG       PRO  14 -12.903  16.650  -5.247
  513   1HD   PRO  14          1HD       PRO  14 -10.889  15.124  -3.901
  514   2HD   PRO  14          2HD       PRO  14 -11.844  14.611  -5.299
  515    H    ALA  15           H        ALA  15  -7.710  15.691  -5.220
  516    HA   ALA  15           HA       ALA  15  -5.966  16.203  -3.953
  517   1HB   ALA  15          1HB       ALA  15  -5.150  17.277  -5.934
  518   2HB   ALA  15          2HB       ALA  15  -6.180  18.704  -5.666
  519   3HB   ALA  15          3HB       ALA  15  -4.804  18.383  -4.583
  520    H    LYS  16           H        LYS  16  -7.671  16.154  -2.155
  521    HA   LYS  16           HA       LYS  16  -7.131  17.921  -0.220
  522   1HB   LYS  16          1HB       LYS  16  -9.321  19.353  -0.322
  523   2HB   LYS  16          2HB       LYS  16  -7.861  19.874  -1.183
  524   1HG   LYS  16          1HG       LYS  16  -8.890  19.692  -3.185
  525   2HG   LYS  16          2HG       LYS  16  -9.490  18.064  -2.819
  526   1HD   LYS  16          1HD       LYS  16 -10.739  20.685  -1.888
  527   2HD   LYS  16          2HD       LYS  16 -11.348  19.680  -3.216
  528   1HE   LYS  16          1HE       LYS  16 -11.386  17.782  -1.385
  529   2HE   LYS  16          2HE       LYS  16 -11.352  19.128  -0.235
  530   1HZ   LYS  16          1HZ       LYS  16 -13.299  20.003  -1.361
  531   2HZ   LYS  16          2HZ       LYS  16 -13.331  18.720  -2.370
  532   3HZ   LYS  16          3HZ       LYS  16 -13.584  18.508  -0.771
  533    H    ASP  17           H        ASP  17  -7.686  15.190  -0.569
  534    HA   ASP  17           HA       ASP  17  -9.671  14.912   1.436
  535   1HB   ASP  17          1HB       ASP  17 -10.951  14.950  -0.785
  536   2HB   ASP  17          2HB       ASP  17 -10.120  13.442  -1.198
  537    H    ARG  18           H        ARG  18  -6.739  14.319   0.322
  538    HA   ARG  18           HA       ARG  18  -6.744  11.452   0.534
  539   1HB   ARG  18          1HB       ARG  18  -4.378  13.340   0.155
  540   2HB   ARG  18          2HB       ARG  18  -4.396  11.595  -0.163
  541   1HG   ARG  18          1HG       ARG  18  -5.441  11.854  -2.178
  542   2HG   ARG  18          2HG       ARG  18  -6.483  13.166  -1.597
  543   1HD   ARG  18          1HD       ARG  18  -4.738  14.791  -1.890
  544   2HD   ARG  18          2HD       ARG  18  -3.502  13.544  -2.114
  545    HE   ARG  18           HE       ARG  18  -5.660  13.403  -4.082
  546   1HH1  ARG  18          1HH1      ARG  18  -2.590  14.936  -3.302
  547   2HH1  ARG  18          2HH1      ARG  18  -2.212  15.311  -4.950
  548   1HH2  ARG  18          1HH2      ARG  18  -5.162  13.897  -6.257
  549   2HH2  ARG  18          2HH2      ARG  18  -3.686  14.716  -6.643
  550    H    VAL  19           H        VAL  19  -4.491  10.710   1.823
  551    HA   VAL  19           HA       VAL  19  -4.796  11.924   4.478
  552    HB   VAL  19           HB       VAL  19  -3.831   9.158   3.728
  553   1HG1  VAL  19          1HG1      VAL  19  -2.974   9.330   5.820
  554   2HG1  VAL  19          2HG1      VAL  19  -4.062  10.665   6.275
  555   3HG1  VAL  19          3HG1      VAL  19  -4.652   8.985   6.307
  556   1HG2  VAL  19          1HG2      VAL  19  -5.988   8.705   3.313
  557   2HG2  VAL  19          2HG2      VAL  19  -6.238   8.868   5.068
  558   3HG2  VAL  19          3HG2      VAL  19  -6.535  10.257   3.994
  559    H    ASP  20           H        ASP  20  -3.065  12.725   2.050
  560    HA   ASP  20           HA       ASP  20  -0.944  13.077   1.543
  561   1HB   ASP  20          1HB       ASP  20  -1.133  15.036   2.755
  562   2HB   ASP  20          2HB       ASP  20  -1.493  14.197   4.272
  563    H    CYS  21           H        CYS  21  -0.022  10.918   1.324
  564    HA   CYS  21           HA       CYS  21   0.671   9.247   3.368
  565   1HB   CYS  21          1HB       CYS  21   0.683   8.892   0.829
  566   2HB   CYS  21          2HB       CYS  21   2.339   9.506   0.875
  567    H    GLY  22           H        GLY  22   2.315  12.132   2.030
  568   1HA   GLY  22          1HA       GLY  22   4.275  13.138   2.564
  569   2HA   GLY  22          2HA       GLY  22   3.670  12.944   4.197
  570    H    TYR  23           H        TYR  23   5.119  10.761   1.663
  571    HA   TYR  23           HA       TYR  23   6.604   9.413   3.768
  572   1HB   TYR  23          1HB       TYR  23   5.790   9.073   0.872
  573   2HB   TYR  23          2HB       TYR  23   7.274   8.248   1.360
  574    HD1  TYR  23           HD1      TYR  23   4.874   8.574   4.016
  575    HD2  TYR  23           HD2      TYR  23   5.941   6.179   0.635
  576    HE1  TYR  23           HE1      TYR  23   3.488   6.649   4.933
  577    HE2  TYR  23           HE2      TYR  23   4.550   4.263   1.563
  578    HH   TYR  23           HH       TYR  23   3.826   3.621   4.082
  579    HA   PRO  24           HA       PRO  24  10.319  11.425   2.830
  580   1HB   PRO  24          1HB       PRO  24  12.123   9.638   3.837
  581   2HB   PRO  24          2HB       PRO  24  11.248  10.793   4.839
  582   1HG   PRO  24          1HG       PRO  24  10.820   7.898   4.469
  583   2HG   PRO  24          2HG       PRO  24  10.264   8.952   5.819
  584   1HD   PRO  24          1HD       PRO  24   8.733   7.885   3.647
  585   2HD   PRO  24          2HD       PRO  24   8.177   9.046   4.859
  586    H    HIS  25           H        HIS  25   9.272   8.758   1.242
  587    HA   HIS  25           HA       HIS  25  11.541   8.995  -0.597
  588   1HB   HIS  25          1HB       HIS  25  10.985   6.772   0.869
  589   2HB   HIS  25          2HB       HIS  25  10.057   6.440  -0.598
  590    HD1  HIS  25           HD1      HIS  25  12.938   5.209   0.577
  591    HD2  HIS  25           HD2      HIS  25  12.248   7.594  -2.804
  592    HE1  HIS  25           HE1      HIS  25  14.903   4.803  -0.997
  593    HE2  HIS  25           HE2      HIS  25  14.397   6.253  -3.080
  594    H    VAL  26           H        VAL  26   8.639  10.180  -0.206
  595    HA   VAL  26           HA       VAL  26   6.890   9.280  -2.051
  596    HB   VAL  26           HB       VAL  26   6.264  11.051  -0.669
  597   1HG1  VAL  26          1HG1      VAL  26   8.890  11.935  -0.945
  598   2HG1  VAL  26          2HG1      VAL  26   7.920  13.234  -1.681
  599   3HG1  VAL  26          3HG1      VAL  26   7.600  12.722  -0.006
  600   1HG2  VAL  26          1HG2      VAL  26   5.113  12.385  -2.125
  601   2HG2  VAL  26          2HG2      VAL  26   6.541  12.706  -3.138
  602   3HG2  VAL  26          3HG2      VAL  26   5.682  11.152  -3.276
  603    H    THR  27           H        THR  27   6.933   8.872  -4.198
  604    HA   THR  27           HA       THR  27   8.194  10.637  -6.026
  605    HB   THR  27           HB       THR  27   9.821   8.546  -4.815
  606    HG1  THR  27           HG1      THR  27  11.350   9.818  -6.073
  607   1HG2  THR  27          1HG2      THR  27  10.751   7.974  -7.254
  608   2HG2  THR  27          2HG2      THR  27   9.462   6.974  -6.542
  609   3HG2  THR  27          3HG2      THR  27   9.056   8.233  -7.732
  610    HA   PRO  28           HA       PRO  28   5.378   8.644  -8.574
  611   1HB   PRO  28          1HB       PRO  28   6.326   9.285 -11.054
  612   2HB   PRO  28          2HB       PRO  28   5.376  10.396 -10.068
  613   1HG   PRO  28          1HG       PRO  28   8.278  10.339 -10.599
  614   2HG   PRO  28          2HG       PRO  28   7.271  11.710 -10.013
  615   1HD   PRO  28          1HD       PRO  28   9.078  10.065  -8.522
  616   2HD   PRO  28          2HD       PRO  28   7.992  11.296  -7.869
  617    H    LYS  29           H        LYS  29   6.984   6.798  -7.436
  618    HA   LYS  29           HA       LYS  29   6.742   4.697  -9.218
  619   1HB   LYS  29          1HB       LYS  29   8.708   6.129 -10.218
  620   2HB   LYS  29          2HB       LYS  29   9.666   5.307  -8.975
  621   1HG   LYS  29          1HG       LYS  29   9.516   3.286 -10.027
  622   2HG   LYS  29          2HG       LYS  29   7.834   3.543 -10.524
  623   1HD   LYS  29          1HD       LYS  29   9.035   5.387 -12.094
  624   2HD   LYS  29          2HD       LYS  29  10.388   4.254 -11.930
  625   1HE   LYS  29          1HE       LYS  29   9.304   3.384 -13.795
  626   2HE   LYS  29          2HE       LYS  29   8.524   2.444 -12.514
  627   1HZ   LYS  29          1HZ       LYS  29   7.448   4.507 -14.188
  628   2HZ   LYS  29          2HZ       LYS  29   6.698   3.238 -13.484
  629   3HZ   LYS  29          3HZ       LYS  29   6.990   4.595 -12.623
  630    H    GLU  30           H        GLU  30   7.818   6.273  -6.324
  631    HA   GLU  30           HA       GLU  30   8.478   3.713  -5.132
  632   1HB   GLU  30          1HB       GLU  30   9.250   6.509  -4.671
  633   2HB   GLU  30          2HB       GLU  30   8.829   5.669  -3.169
  634   1HG   GLU  30          1HG       GLU  30  11.069   5.105  -3.334
  635   2HG   GLU  30          2HG       GLU  30  10.365   3.748  -4.226
  636    H    CYS  31           H        CYS  31   6.287   6.564  -4.786
  637    HA   CYS  31           HA       CYS  31   4.975   5.780  -2.508
  638   1HB   CYS  31          1HB       CYS  31   4.106   7.370  -4.906
  639   2HB   CYS  31          2HB       CYS  31   3.011   7.074  -3.552
  640    H    ASN  32           H        ASN  32   4.071   5.190  -5.991
  641    HA   ASN  32           HA       ASN  32   1.912   3.588  -5.439
  642   1HB   ASN  32          1HB       ASN  32   3.699   4.128  -7.760
  643   2HB   ASN  32          2HB       ASN  32   2.866   2.567  -7.838
  644   1HD2  ASN  32          1HD2      ASN  32   1.879   5.659  -6.402
  645   2HD2  ASN  32          2HD2      ASN  32   0.462   5.912  -7.364
  646    H    ASN  33           H        ASN  33   5.287   3.063  -4.949
  647    HA   ASN  33           HA       ASN  33   5.120   0.216  -5.311
  648   1HB   ASN  33          1HB       ASN  33   7.168   1.838  -5.778
  649   2HB   ASN  33          2HB       ASN  33   7.477   1.655  -4.045
  650   1HD2  ASN  33          1HD2      ASN  33   9.491   0.757  -5.007
  651   2HD2  ASN  33          2HD2      ASN  33   9.555  -0.940  -5.352
  652    H    ARG  34           H        ARG  34   5.105   2.750  -2.805
  653    HA   ARG  34           HA       ARG  34   5.514   0.867  -0.700
  654   1HB   ARG  34          1HB       ARG  34   4.530   3.717  -0.354
  655   2HB   ARG  34          2HB       ARG  34   5.530   2.767   0.758
  656   1HG   ARG  34          1HG       ARG  34   7.025   2.834  -1.605
  657   2HG   ARG  34          2HG       ARG  34   6.326   4.460  -1.516
  658   1HD   ARG  34          1HD       ARG  34   7.694   5.032   0.198
  659   2HD   ARG  34          2HD       ARG  34   7.327   3.550   1.095
  660    HE   ARG  34           HE       ARG  34   8.991   2.722  -0.981
  661   1HH1  ARG  34          1HH1      ARG  34   9.243   5.093   1.608
  662   2HH1  ARG  34          2HH1      ARG  34  10.966   4.961   1.734
  663   1HH2  ARG  34          1HH2      ARG  34  11.263   2.548  -0.816
  664   2HH2  ARG  34          2HH2      ARG  34  12.123   3.504   0.346
  665    H    GLY  35           H        GLY  35   2.859   2.375  -2.468
  666   1HA   GLY  35          1HA       GLY  35   0.759   1.117  -2.312
  667   2HA   GLY  35          2HA       GLY  35   0.932   1.173  -0.569
  668    H    CYS  36           H        CYS  36   2.006   3.986  -2.404
  669    HA   CYS  36           HA       CYS  36  -0.406   5.378  -1.492
  670   1HB   CYS  36          1HB       CYS  36   2.425   6.376  -1.795
  671   2HB   CYS  36          2HB       CYS  36   1.036   7.430  -1.508
  672    H    CYS  37           H        CYS  37  -0.616   7.551  -2.954
  673    HA   CYS  37           HA       CYS  37  -0.215   6.691  -5.728
  674   1HB   CYS  37          1HB       CYS  37  -2.602   6.681  -4.763
  675   2HB   CYS  37          2HB       CYS  37  -2.501   8.441  -4.856
  676    H    PHE  38           H        PHE  38   1.014   8.119  -6.923
  677    HA   PHE  38           HA       PHE  38   1.747  10.610  -5.634
  678   1HB   PHE  38          1HB       PHE  38   3.345   8.904  -6.718
  679   2HB   PHE  38          2HB       PHE  38   2.620   9.303  -8.278
  680    HD1  PHE  38           HD1      PHE  38   4.672  10.595  -5.501
  681    HD2  PHE  38           HD2      PHE  38   3.243  11.291  -9.435
  682    HE1  PHE  38           HE1      PHE  38   6.314  12.474  -5.765
  683    HE2  PHE  38           HE2      PHE  38   4.886  13.171  -9.700
  684    HZ   PHE  38           HZ       PHE  38   6.403  13.739  -7.861
  685    H    ASP  39           H        ASP  39   0.790  12.523  -6.125
  686    HA   ASP  39           HA       ASP  39  -1.030  12.573  -8.322
  687   1HB   ASP  39          1HB       ASP  39  -1.966  13.846  -6.670
  688   2HB   ASP  39          2HB       ASP  39  -0.402  14.232  -5.938
  689    H    SER  40           H        SER  40   1.205  15.214  -7.244
  690    HA   SER  40           HA       SER  40   2.914  16.171  -8.264
  691   1HB   SER  40          1HB       SER  40   3.027  13.853  -9.604
  692   2HB   SER  40          2HB       SER  40   2.480  14.879 -10.942
  693    HG   SER  40           HG       SER  40   4.352  16.332 -10.186
  694    H    ARG  41           H        ARG  41  -0.284  15.746  -9.649
  695    HA   ARG  41           HA       ARG  41  -0.180  17.722 -11.577
  696   1HB   ARG  41          1HB       ARG  41  -2.645  17.062  -9.924
  697   2HB   ARG  41          2HB       ARG  41  -2.583  17.545 -11.629
  698   1HG   ARG  41          1HG       ARG  41  -1.038  15.301 -11.702
  699   2HG   ARG  41          2HG       ARG  41  -2.124  14.873 -10.367
  700   1HD   ARG  41          1HD       ARG  41  -3.052  14.095 -12.503
  701   2HD   ARG  41          2HD       ARG  41  -4.084  15.373 -11.845
  702    HE   ARG  41           HE       ARG  41  -1.990  16.302 -13.693
  703   1HH1  ARG  41          1HH1      ARG  41  -5.316  15.201 -13.370
  704   2HH1  ARG  41          2HH1      ARG  41  -5.836  15.932 -14.852
  705   1HH2  ARG  41          1HH2      ARG  41  -2.674  17.266 -15.648
  706   2HH2  ARG  41          2HH2      ARG  41  -4.323  17.113 -16.156
  707    H    ILE  42           H        ILE  42  -0.970  17.773  -8.059
  708    HA   ILE  42           HA       ILE  42  -0.910  20.708  -8.210
  709    HB   ILE  42           HB       ILE  42  -2.457  19.273  -6.096
  710   1HG1  ILE  42          1HG1      ILE  42  -3.350  19.704  -8.947
  711   2HG1  ILE  42          2HG1      ILE  42  -3.337  18.191  -8.024
  712   1HG2  ILE  42          1HG2      ILE  42  -3.728  21.604  -7.105
  713   2HG2  ILE  42          2HG2      ILE  42  -2.945  21.357  -5.525
  714   3HG2  ILE  42          3HG2      ILE  42  -1.999  21.977  -6.900
  715   1HD1  ILE  42          1HD1      ILE  42  -5.361  20.313  -8.129
  716   2HD1  ILE  42          2HD1      ILE  42  -5.498  18.650  -7.508
  717   3HD1  ILE  42          3HD1      ILE  42  -4.875  19.945  -6.457
  718    HA   PRO  43           HA       PRO  43   2.504  19.802  -5.593
  719   1HB   PRO  43          1HB       PRO  43   3.735  22.227  -5.857
  720   2HB   PRO  43          2HB       PRO  43   4.013  20.879  -6.958
  721   1HG   PRO  43          1HG       PRO  43   2.399  23.322  -7.320
  722   2HG   PRO  43          2HG       PRO  43   3.063  22.218  -8.578
  723   1HD   PRO  43          1HD       PRO  43   0.364  22.435  -7.644
  724   2HD   PRO  43          2HD       PRO  43   0.998  21.225  -8.768
  725    H    GLY  44           H        GLY  44  -0.126  21.718  -5.184
  726   1HA   GLY  44          1HA       GLY  44   0.795  22.901  -2.679
  727   2HA   GLY  44          2HA       GLY  44  -0.739  23.161  -3.486
  728    H    VAL  45           H        VAL  45  -0.456  19.903  -3.757
  729    HA   VAL  45           HA       VAL  45  -1.614  19.429  -1.096
  730    HB   VAL  45           HB       VAL  45  -3.320  18.188  -1.993
  731   1HG1  VAL  45          1HG1      VAL  45  -3.353  19.738  -4.467
  732   2HG1  VAL  45          2HG1      VAL  45  -4.445  19.803  -3.062
  733   3HG1  VAL  45          3HG1      VAL  45  -2.926  20.732  -3.053
  734   1HG2  VAL  45          1HG2      VAL  45  -1.872  17.957  -4.650
  735   2HG2  VAL  45          2HG2      VAL  45  -1.817  16.730  -3.362
  736   3HG2  VAL  45          3HG2      VAL  45  -3.362  17.121  -4.154
  737    HA   PRO  46           HA       PRO  46   0.928  15.916  -0.846
  738   1HB   PRO  46          1HB       PRO  46  -0.645  13.737  -0.358
  739   2HB   PRO  46          2HB       PRO  46  -0.230  14.922   0.878
  740   1HG   PRO  46          1HG       PRO  46  -2.741  14.548  -0.625
  741   2HG   PRO  46          2HG       PRO  46  -2.482  15.414   0.935
  742   1HD   PRO  46          1HD       PRO  46  -2.901  16.527  -1.670
  743   2HD   PRO  46          2HD       PRO  46  -2.492  17.414  -0.197
  744    H    TRP  47           H        TRP  47   2.268  15.204  -2.368
  745    HA   TRP  47           HA       TRP  47   0.999  14.182  -4.773
  746   1HB   TRP  47          1HB       TRP  47   3.910  14.202  -4.687
  747   2HB   TRP  47          2HB       TRP  47   2.797  14.905  -5.862
  748    HD1  TRP  47           HD1      TRP  47   1.817  17.450  -5.146
  749    HE1  TRP  47           HE1      TRP  47   2.924  19.459  -3.841
  750    HE3  TRP  47           HE3      TRP  47   5.467  14.686  -2.934
  751    HZ2  TRP  47           HZ2      TRP  47   5.152  19.661  -2.069
  752    HZ3  TRP  47           HZ3      TRP  47   7.067  15.866  -1.431
  753    HH2  TRP  47           HH2      TRP  47   6.952  18.267  -0.985
  754    H    CYS  48           H        CYS  48   0.902  12.740  -2.125
  755    HA   CYS  48           HA       CYS  48   1.514  10.189  -3.109
  756   1HB   CYS  48          1HB       CYS  48   3.817  10.910  -2.603
  757   2HB   CYS  48          2HB       CYS  48   3.361  11.152  -0.913
  758    H    PHE  49           H        PHE  49  -0.491   9.471  -2.399
  759    HA   PHE  49           HA       PHE  49  -0.940   9.620   0.484
  760   1HB   PHE  49          1HB       PHE  49  -3.477   9.812  -0.589
  761   2HB   PHE  49          2HB       PHE  49  -2.534  11.228  -0.111
  762    HD1  PHE  49           HD1      PHE  49  -0.764  11.901  -2.096
  763    HD2  PHE  49           HD2      PHE  49  -4.510   9.978  -2.617
  764    HE1  PHE  49           HE1      PHE  49  -0.871  12.749  -4.455
  765    HE2  PHE  49           HE2      PHE  49  -4.618  10.825  -4.977
  766    HZ   PHE  49           HZ       PHE  49  -2.797  12.201  -5.868
  767    H    LYS  50           H        LYS  50  -3.423   8.313   0.559
  768    HA   LYS  50           HA       LYS  50  -2.821   5.772  -0.787
  769   1HB   LYS  50          1HB       LYS  50  -4.186   5.136   1.551
  770   2HB   LYS  50          2HB       LYS  50  -2.465   4.872   1.217
  771   1HG   LYS  50          1HG       LYS  50  -3.411   7.573   2.181
  772   2HG   LYS  50          2HG       LYS  50  -3.228   6.256   3.352
  773   1HD   LYS  50          1HD       LYS  50  -1.099   7.425   1.517
  774   2HD   LYS  50          2HD       LYS  50  -1.146   7.516   3.287
  775   1HE   LYS  50          1HE       LYS  50  -0.540   5.151   1.500
  776   2HE   LYS  50          2HE       LYS  50   0.404   5.774   2.861
  777   1HZ   LYS  50          1HZ       LYS  50  -1.284   4.980   4.330
  778   2HZ   LYS  50          2HZ       LYS  50  -2.232   4.495   3.093
  779   3HZ   LYS  50          3HZ       LYS  50  -0.808   3.746   3.374
  780    HA   PRO  51           HA       PRO  51  -7.001   7.263  -1.780
  781   1HB   PRO  51          1HB       PRO  51  -6.728   7.411  -4.495
  782   2HB   PRO  51          2HB       PRO  51  -6.532   8.800  -3.430
  783   1HG   PRO  51          1HG       PRO  51  -4.500   7.158  -4.798
  784   2HG   PRO  51          2HG       PRO  51  -4.335   8.822  -4.130
  785   1HD   PRO  51          1HD       PRO  51  -3.352   6.361  -3.044
  786   2HD   PRO  51          2HD       PRO  51  -3.306   7.950  -2.268
  787    H    LEU  52           H        LEU  52  -6.217   5.714  -4.743
  788    HA   LEU  52           HA       LEU  52  -7.781   3.421  -3.797
  789   1HB   LEU  52          1HB       LEU  52  -8.724   3.246  -5.826
  790   2HB   LEU  52          2HB       LEU  52  -8.440   4.995  -5.795
  791    HG   LEU  52           HG       LEU  52  -7.681   4.544  -7.883
  792   1HD1  LEU  52          1HD1      LEU  52  -5.560   5.182  -7.741
  793   2HD1  LEU  52          2HD1      LEU  52  -5.622   4.829  -5.998
  794   3HD1  LEU  52          3HD1      LEU  52  -5.061   3.583  -7.139
  795   1HD2  LEU  52          1HD2      LEU  52  -7.690   2.477  -8.683
  796   2HD2  LEU  52          2HD2      LEU  52  -6.228   2.073  -7.749
  797   3HD2  LEU  52          3HD2      LEU  52  -7.838   1.854  -7.022
  798    H    GLN  53           H        GLN  53  -4.902   3.898  -3.225
  799    HA   GLN  53           HA       GLN  53  -3.180   2.680  -4.874
  800   1HB   GLN  53          1HB       GLN  53  -2.392   1.721  -2.382
  801   2HB   GLN  53          2HB       GLN  53  -1.960   3.298  -3.068
  802   1HG   GLN  53          1HG       GLN  53  -2.956   3.393  -0.747
  803   2HG   GLN  53          2HG       GLN  53  -3.825   4.369  -1.939
  804   1HE2  GLN  53          1HE2      GLN  53  -3.794   0.861  -1.414
  805   2HE2  GLN  53          2HE2      GLN  53  -5.476   0.672  -1.050
  806    H    GLU  54           H        GLU  54  -5.947   1.247  -3.359
  807    HA   GLU  54           HA       GLU  54  -5.293  -1.271  -2.818
  808   1HB   GLU  54          1HB       GLU  54  -7.562  -1.895  -3.391
  809   2HB   GLU  54          2HB       GLU  54  -7.591  -0.253  -2.726
  810   1HG   GLU  54          1HG       GLU  54  -7.862   0.719  -4.896
  811   2HG   GLU  54          2HG       GLU  54  -7.428  -0.787  -5.719
  812    H    ALA  55           H        ALA  55  -5.056   0.301  -5.935
  813    HA   ALA  55           HA       ALA  55  -5.387  -1.439  -7.856
  814   1HB   ALA  55          1HB       ALA  55  -3.704   0.769  -7.402
  815   2HB   ALA  55          2HB       ALA  55  -2.629  -0.510  -8.016
  816   3HB   ALA  55          3HB       ALA  55  -4.049  -0.010  -8.965
  817    H    GLU  56           H        GLU  56  -2.185  -1.490  -6.133
  818    HA   GLU  56           HA       GLU  56  -2.344  -4.394  -6.319
  819   1HB   GLU  56          1HB       GLU  56  -0.468  -2.632  -7.613
  820   2HB   GLU  56          2HB       GLU  56   0.409  -3.616  -6.428
  821   1HG   GLU  56          1HG       GLU  56   0.128  -5.512  -7.646
  822   2HG   GLU  56          2HG       GLU  56  -1.570  -5.154  -7.998
  823    H    CYS  57           H        CYS  57  -2.631  -1.988  -4.233
  824    HA   CYS  57           HA       CYS  57  -0.593  -2.768  -2.345
  825   1HB   CYS  57          1HB       CYS  57  -1.453  -0.390  -2.772
  826   2HB   CYS  57          2HB       CYS  57  -2.863  -0.861  -1.814
  827    H    THR  58           H        THR  58  -4.173  -2.229  -1.984
  828    HA   THR  58           HA       THR  58  -4.616  -3.801   0.167
  829    HB   THR  58           HB       THR  58  -6.175  -2.291  -1.356
  830    HG1  THR  58           HG1      THR  58  -7.947  -3.540  -0.321
  831   1HG2  THR  58          1HG2      THR  58  -7.798  -3.718  -2.635
  832   2HG2  THR  58          2HG2      THR  58  -6.177  -3.758  -3.371
  833   3HG2  THR  58          3HG2      THR  58  -6.737  -5.125  -2.379
  834    H    PHE  59           H        PHE  59  -4.105  -4.901  -3.196
  835    HA   PHE  59           HA       PHE  59  -4.975  -7.351  -3.333
  836   1HB   PHE  59          1HB       PHE  59  -2.935  -5.873  -4.464
  837   2HB   PHE  59          2HB       PHE  59  -1.982  -7.117  -3.650
  838    HD1  PHE  59           HD1      PHE  59  -2.919  -6.328  -6.719
  839    HD2  PHE  59           HD2      PHE  59  -3.542  -9.524  -3.998
  840    HE1  PHE  59           HE1      PHE  59  -3.332  -7.885  -8.643
  841    HE2  PHE  59           HE2      PHE  59  -3.955 -11.082  -5.923
  842    HZ   PHE  59           HZ       PHE  59  -3.845 -10.244  -8.222
  Start of MODEL   23
    1   1H    GLU   1           H1       GLU   1 -16.633 -10.847   3.465
    2    HA   GLU   1           HA       GLU   1 -16.976 -11.968   1.517
    3   1HB   GLU   1          1HB       GLU   1 -18.957 -10.595   2.284
    4   2HB   GLU   1          2HB       GLU   1 -18.523  -9.382   1.068
    5   1HG   GLU   1          1HG       GLU   1 -20.073 -10.672  -0.097
    6   2HG   GLU   1          2HG       GLU   1 -18.562 -11.456  -0.583
    7    H    GLU   2           H        GLU   2 -16.634  -8.465   0.566
    8    HA   GLU   2           HA       GLU   2 -15.735  -9.214  -2.007
    9   1HB   GLU   2          1HB       GLU   2 -17.020  -7.131  -1.499
   10   2HB   GLU   2          2HB       GLU   2 -15.610  -6.492  -0.637
   11   1HG   GLU   2          1HG       GLU   2 -14.613  -5.880  -2.571
   12   2HG   GLU   2          2HG       GLU   2 -14.882  -7.469  -3.303
   13    H    TYR   3           H        TYR   3 -14.074  -7.057   0.402
   14    HA   TYR   3           HA       TYR   3 -11.525  -8.019  -0.600
   15   1HB   TYR   3          1HB       TYR   3 -12.681  -5.812   1.148
   16   2HB   TYR   3          2HB       TYR   3 -10.961  -6.176   1.322
   17    HD1  TYR   3           HD1      TYR   3 -12.979  -3.851  -0.031
   18    HD2  TYR   3           HD2      TYR   3  -9.971  -6.602  -1.331
   19    HE1  TYR   3           HE1      TYR   3 -12.471  -2.363  -2.028
   20    HE2  TYR   3           HE2      TYR   3  -9.474  -5.104  -3.325
   21    HH   TYR   3           HH       TYR   3 -10.912  -1.932  -3.598
   22    H    VAL   4           H        VAL   4 -11.679 -10.227   0.265
   23    HA   VAL   4           HA       VAL   4 -11.082 -10.243   3.141
   24    HB   VAL   4           HB       VAL   4 -12.664 -12.302   1.589
   25   1HG1  VAL   4          1HG1      VAL   4 -11.972 -12.102   4.539
   26   2HG1  VAL   4          2HG1      VAL   4 -13.105 -13.277   3.830
   27   3HG1  VAL   4          3HG1      VAL   4 -11.382 -13.321   3.385
   28   1HG2  VAL   4          1HG2      VAL   4 -14.496 -11.499   3.250
   29   2HG2  VAL   4          2HG2      VAL   4 -13.502 -10.029   3.382
   30   3HG2  VAL   4          3HG2      VAL   4 -14.155 -10.522   1.802
   31    H    GLY   5           H        GLY   5 -10.809 -11.998  -0.022
   32   1HA   GLY   5          1HA       GLY   5  -8.643 -13.631   0.831
   33   2HA   GLY   5          2HA       GLY   5  -9.202 -13.370  -0.809
   34    H    LEU   6           H        LEU   6  -8.766 -10.299   0.476
   35    HA   LEU   6           HA       LEU   6  -5.933 -10.243  -0.285
   36   1HB   LEU   6          1HB       LEU   6  -7.740  -7.983  -0.989
   37   2HB   LEU   6          2HB       LEU   6  -6.199  -8.475  -1.717
   38    HG   LEU   6           HG       LEU   6  -7.920  -8.864  -3.310
   39   1HD1  LEU   6          1HD1      LEU   6  -7.893 -11.663  -2.720
   40   2HD1  LEU   6          2HD1      LEU   6  -6.947 -10.757  -3.925
   41   3HD1  LEU   6          3HD1      LEU   6  -6.319 -10.963  -2.273
   42   1HD2  LEU   6          1HD2      LEU   6  -9.686  -9.001  -1.336
   43   2HD2  LEU   6          2HD2      LEU   6 -10.004  -9.711  -2.937
   44   3HD2  LEU   6          3HD2      LEU   6  -9.471 -10.750  -1.594
   45    H    SER   7           H        SER   7  -8.150  -9.942   2.147
   46    HA   SER   7           HA       SER   7  -6.713  -7.692   3.318
   47   1HB   SER   7          1HB       SER   7  -9.380  -8.840   4.217
   48   2HB   SER   7          2HB       SER   7  -8.650  -7.308   4.728
   49    HG   SER   7           HG       SER   7  -9.144  -6.383   2.776
   50    H    ALA   8           H        ALA   8  -7.875  -8.476   6.023
   51    HA   ALA   8           HA       ALA   8  -5.809  -9.698   7.181
   52   1HB   ALA   8          1HB       ALA   8  -8.529 -10.588   8.072
   53   2HB   ALA   8          2HB       ALA   8  -7.185  -9.907   9.018
   54   3HB   ALA   8          3HB       ALA   8  -8.204  -8.839   8.024
   55    H    ASN   9           H        ASN   9  -5.089 -11.822   7.655
   56    HA   ASN   9           HA       ASN   9  -5.111 -14.043   7.569
   57   1HB   ASN   9          1HB       ASN   9  -7.608 -14.050   7.148
   58   2HB   ASN   9          2HB       ASN   9  -7.285 -13.885   5.416
   59   1HD2  ASN   9          1HD2      ASN   9  -5.638 -15.744   7.956
   60   2HD2  ASN   9          2HD2      ASN   9  -5.850 -17.314   7.259
   61    H    GLN  10           H        GLN  10  -5.519 -12.049   4.606
   62    HA   GLN  10           HA       GLN  10  -4.275 -13.721   2.813
   63   1HB   GLN  10          1HB       GLN  10  -5.579 -11.568   2.382
   64   2HB   GLN  10          2HB       GLN  10  -4.093 -10.683   2.769
   65   1HG   GLN  10          1HG       GLN  10  -3.622 -12.870   0.872
   66   2HG   GLN  10          2HG       GLN  10  -4.828 -11.727   0.262
   67   1HE2  GLN  10          1HE2      GLN  10  -4.275  -9.435   0.342
   68   2HE2  GLN  10          2HE2      GLN  10  -2.639  -8.936   0.069
   69    H    CYS  11           H        CYS  11  -2.934 -11.312   5.125
   70    HA   CYS  11           HA       CYS  11  -0.321 -11.377   4.151
   71   1HB   CYS  11          1HB       CYS  11  -1.000  -9.594   5.550
   72   2HB   CYS  11          2HB       CYS  11  -1.470 -10.688   6.855
   73    H    ALA  12           H        ALA  12  -2.259 -13.807   5.530
   74    HA   ALA  12           HA       ALA  12   0.010 -15.154   6.789
   75   1HB   ALA  12          1HB       ALA  12  -2.567 -16.528   6.879
   76   2HB   ALA  12          2HB       ALA  12  -1.523 -15.986   8.215
   77   3HB   ALA  12          3HB       ALA  12  -2.690 -14.858   7.484
   78    H    VAL  13           H        VAL  13  -0.531 -14.683   3.781
   79    HA   VAL  13           HA       VAL  13  -1.426 -16.823   2.437
   80    HB   VAL  13           HB       VAL  13   0.824 -16.269   1.028
   81   1HG1  VAL  13          1HG1      VAL  13  -1.354 -16.009   0.098
   82   2HG1  VAL  13          2HG1      VAL  13  -1.764 -14.707   1.239
   83   3HG1  VAL  13          3HG1      VAL  13  -0.555 -14.425  -0.036
   84   1HG2  VAL  13          1HG2      VAL  13   0.265 -13.657   2.435
   85   2HG2  VAL  13          2HG2      VAL  13   1.516 -14.780   3.021
   86   3HG2  VAL  13          3HG2      VAL  13   1.631 -14.097   1.381
   87    HA   PRO  14           HA       PRO  14   1.115 -20.229   3.231
   88   1HB   PRO  14          1HB       PRO  14   1.449 -21.433   0.801
   89   2HB   PRO  14          2HB       PRO  14  -0.022 -21.587   1.759
   90   1HG   PRO  14          1HG       PRO  14   0.517 -19.949  -0.635
   91   2HG   PRO  14          2HG       PRO  14  -1.070 -20.472   0.034
   92   1HD   PRO  14          1HD       PRO  14   0.160 -17.889   0.178
   93   2HD   PRO  14          2HD       PRO  14  -1.328 -18.395   0.986
   94    H    ALA  15           H        ALA  15   2.369 -17.606   1.899
   95    HA   ALA  15           HA       ALA  15   4.487 -16.891   1.940
   96   1HB   ALA  15          1HB       ALA  15   6.096 -18.066   3.059
   97   2HB   ALA  15          2HB       ALA  15   4.715 -19.087   3.525
   98   3HB   ALA  15          3HB       ALA  15   5.763 -19.572   2.171
   99    H    LYS  16           H        LYS  16   3.061 -17.302  -0.394
  100    HA   LYS  16           HA       LYS  16   5.031 -17.300  -2.312
  101   1HB   LYS  16          1HB       LYS  16   4.119 -19.591  -3.384
  102   2HB   LYS  16          2HB       LYS  16   5.586 -19.486  -2.396
  103   1HG   LYS  16          1HG       LYS  16   4.625 -20.583  -0.635
  104   2HG   LYS  16          2HG       LYS  16   3.041 -19.825  -0.878
  105   1HD   LYS  16          1HD       LYS  16   2.355 -21.784  -1.759
  106   2HD   LYS  16          2HD       LYS  16   3.410 -21.462  -3.147
  107   1HE   LYS  16          1HE       LYS  16   4.993 -22.965  -2.447
  108   2HE   LYS  16          2HE       LYS  16   4.763 -22.585  -0.734
  109   1HZ   LYS  16          1HZ       LYS  16   2.753 -24.050  -2.275
  110   2HZ   LYS  16          2HZ       LYS  16   3.996 -24.818  -1.546
  111   3HZ   LYS  16          3HZ       LYS  16   2.923 -23.971  -0.653
  112    H    ASP  17           H        ASP  17   2.843 -15.719  -1.603
  113    HA   ASP  17           HA       ASP  17   1.387 -15.879  -4.072
  114   1HB   ASP  17          1HB       ASP  17  -0.014 -17.157  -2.481
  115   2HB   ASP  17          2HB       ASP  17   0.007 -15.797  -1.347
  116    H    ARG  18           H        ARG  18   3.346 -14.221  -2.148
  117    HA   ARG  18           HA       ARG  18   1.802 -11.805  -1.932
  118   1HB   ARG  18          1HB       ARG  18   4.739 -12.218  -1.231
  119   2HB   ARG  18          2HB       ARG  18   3.665 -10.945  -0.623
  120   1HG   ARG  18          1HG       ARG  18   2.828 -12.295   0.995
  121   2HG   ARG  18          2HG       ARG  18   2.633 -13.664  -0.113
  122   1HD   ARG  18          1HD       ARG  18   5.067 -14.150   0.094
  123   2HD   ARG  18          2HD       ARG  18   5.249 -12.790   1.211
  124    HE   ARG  18           HE       ARG  18   3.251 -14.856   1.934
  125   1HH1  ARG  18          1HH1      ARG  18   6.486 -13.556   2.402
  126   2HH1  ARG  18          2HH1      ARG  18   6.729 -14.362   3.917
  127   1HH2  ARG  18          1HH2      ARG  18   3.570 -15.918   3.932
  128   2HH2  ARG  18          2HH2      ARG  18   5.058 -15.714   4.792
  129    H    VAL  19           H        VAL  19   3.553  -9.751  -2.409
  130    HA   VAL  19           HA       VAL  19   4.369 -10.205  -5.197
  131    HB   VAL  19           HB       VAL  19   3.607  -7.540  -4.040
  132   1HG1  VAL  19          1HG1      VAL  19   4.424  -8.551  -6.612
  133   2HG1  VAL  19          2HG1      VAL  19   2.786  -7.865  -6.730
  134   3HG1  VAL  19          3HG1      VAL  19   4.124  -6.872  -6.103
  135   1HG2  VAL  19          1HG2      VAL  19   1.329  -8.146  -5.276
  136   2HG2  VAL  19          2HG2      VAL  19   1.794  -9.795  -4.797
  137   3HG2  VAL  19          3HG2      VAL  19   1.597  -8.532  -3.560
  138    H    ASP  20           H        ASP  20   5.824 -10.571  -2.515
  139    HA   ASP  20           HA       ASP  20   7.639  -9.865  -1.473
  140   1HB   ASP  20          1HB       ASP  20   8.864 -11.179  -2.910
  141   2HB   ASP  20          2HB       ASP  20   8.269 -10.349  -4.356
  142    H    CYS  21           H        CYS  21   7.112  -7.712  -0.693
  143    HA   CYS  21           HA       CYS  21   6.957  -5.435  -2.164
  144   1HB   CYS  21          1HB       CYS  21   6.725  -6.032   0.442
  145   2HB   CYS  21          2HB       CYS  21   8.277  -5.188   0.481
  146    H    GLY  22           H        GLY  22   9.806  -7.275  -1.043
  147   1HA   GLY  22          1HA       GLY  22  12.002  -7.078  -1.472
  148   2HA   GLY  22          2HA       GLY  22  11.541  -6.279  -2.963
  149    H    TYR  23           H        TYR  23  11.368  -5.434   0.578
  150    HA   TYR  23           HA       TYR  23  12.199  -2.733  -0.092
  151   1HB   TYR  23          1HB       TYR  23  10.450  -3.977   1.705
  152   2HB   TYR  23          2HB       TYR  23  11.855  -3.690   2.737
  153    HD1  TYR  23           HD1      TYR  23  10.641  -1.526  -0.047
  154    HD2  TYR  23           HD2      TYR  23  11.018  -2.016   4.186
  155    HE1  TYR  23           HE1      TYR  23   9.879   0.873   0.306
  156    HE2  TYR  23           HE2      TYR  23  10.254   0.384   4.525
  157    HH   TYR  23           HH       TYR  23  10.419   2.614   2.601
  158    HA   PRO  24           HA       PRO  24  16.298  -3.425   1.136
  159   1HB   PRO  24          1HB       PRO  24  17.131  -0.838   1.409
  160   2HB   PRO  24          2HB       PRO  24  17.048  -1.666  -0.146
  161   1HG   PRO  24          1HG       PRO  24  15.243   0.350   1.028
  162   2HG   PRO  24          2HG       PRO  24  15.429  -0.120  -0.699
  163   1HD   PRO  24          1HD       PRO  24  13.322  -0.806   1.117
  164   2HD   PRO  24          2HD       PRO  24  13.543  -1.424  -0.526
  165    H    HIS  25           H        HIS  25  13.940  -2.173   3.115
  166    HA   HIS  25           HA       HIS  25  15.725  -2.610   5.386
  167   1HB   HIS  25          1HB       HIS  25  14.091  -0.211   4.739
  168   2HB   HIS  25          2HB       HIS  25  14.119  -0.733   6.428
  169    HD1  HIS  25           HD1      HIS  25  15.454   1.933   5.196
  170    HD2  HIS  25           HD2      HIS  25  17.435  -1.608   6.258
  171    HE1  HIS  25           HE1      HIS  25  17.883   2.577   5.633
  172    HE2  HIS  25           HE2      HIS  25  19.038   0.371   6.335
  173    H    VAL  26           H        VAL  26  14.285  -4.690   4.419
  174    HA   VAL  26           HA       VAL  26  11.628  -4.798   5.342
  175    HB   VAL  26           HB       VAL  26  12.191  -6.272   3.643
  176   1HG1  VAL  26          1HG1      VAL  26  14.432  -6.517   3.395
  177   2HG1  VAL  26          2HG1      VAL  26  14.728  -6.602   5.148
  178   3HG1  VAL  26          3HG1      VAL  26  14.143  -8.037   4.273
  179   1HG2  VAL  26          1HG2      VAL  26  11.482  -8.328   4.427
  180   2HG2  VAL  26          2HG2      VAL  26  12.475  -8.232   5.901
  181   3HG2  VAL  26          3HG2      VAL  26  10.989  -7.261   5.764
  182    H    THR  27           H        THR  27  10.861  -4.946   7.382
  183    HA   THR  27           HA       THR  27  12.064  -6.605   9.325
  184    HB   THR  27           HB       THR  27  13.233  -4.004   9.032
  185    HG1  THR  27           HG1      THR  27  14.537  -5.029  10.595
  186   1HG2  THR  27          1HG2      THR  27  11.403  -4.332  11.449
  187   2HG2  THR  27          2HG2      THR  27  12.908  -3.390  11.556
  188   3HG2  THR  27          3HG2      THR  27  11.626  -2.892  10.425
  189    HA   PRO  28           HA       PRO  28   8.089  -6.189  10.880
  190   1HB   PRO  28          1HB       PRO  28   8.398  -7.103  13.437
  191   2HB   PRO  28          2HB       PRO  28   8.256  -8.171  12.042
  192   1HG   PRO  28          1HG       PRO  28  10.636  -7.398  13.606
  193   2HG   PRO  28          2HG       PRO  28  10.415  -8.823  12.527
  194   1HD   PRO  28          1HD       PRO  28  11.879  -6.415  12.021
  195   2HD   PRO  28          2HD       PRO  28  11.558  -7.717  10.868
  196    H    LYS  29           H        LYS  29   8.907  -3.743  10.573
  197    HA   LYS  29           HA       LYS  29   7.535  -2.360  12.536
  198   1HB   LYS  29          1HB       LYS  29   9.347  -3.005  14.036
  199   2HB   LYS  29          2HB       LYS  29  10.539  -2.271  12.951
  200   1HG   LYS  29          1HG       LYS  29  10.070  -0.176  13.692
  201   2HG   LYS  29          2HG       LYS  29   8.320  -0.448  13.661
  202   1HD   LYS  29          1HD       LYS  29   8.951  -2.008  15.769
  203   2HD   LYS  29          2HD       LYS  29  10.298  -0.862  15.884
  204   1HE   LYS  29          1HE       LYS  29   8.850   0.466  17.015
  205   2HE   LYS  29          2HE       LYS  29   8.100   0.800  15.446
  206   1HZ   LYS  29          1HZ       LYS  29   7.258  -1.034  17.535
  207   2HZ   LYS  29          2HZ       LYS  29   6.366   0.024  16.667
  208   3HZ   LYS  29          3HZ       LYS  29   6.860  -1.378  15.989
  209    H    GLU  30           H        GLU  30   9.867  -2.616   9.914
  210    HA   GLU  30           HA       GLU  30   9.438   0.177   9.269
  211   1HB   GLU  30          1HB       GLU  30  11.557  -1.792   8.792
  212   2HB   GLU  30          2HB       GLU  30  11.126  -0.911   7.315
  213   1HG   GLU  30          1HG       GLU  30  12.531   0.688   8.102
  214   2HG   GLU  30          2HG       GLU  30  11.206   1.122   9.193
  215    H    CYS  31           H        CYS  31   9.080  -3.157   7.910
  216    HA   CYS  31           HA       CYS  31   7.984  -2.341   5.479
  217   1HB   CYS  31          1HB       CYS  31   8.121  -4.877   7.024
  218   2HB   CYS  31          2HB       CYS  31   6.942  -4.780   5.714
  219    H    ASN  32           H        ASN  32   6.466  -3.575   8.552
  220    HA   ASN  32           HA       ASN  32   3.866  -3.197   7.689
  221   1HB   ASN  32          1HB       ASN  32   5.283  -3.753  10.228
  222   2HB   ASN  32          2HB       ASN  32   3.764  -2.875  10.469
  223   1HD2  ASN  32          1HD2      ASN  32   5.052  -5.486   8.408
  224   2HD2  ASN  32          2HD2      ASN  32   3.735  -6.592   8.607
  225    H    ASN  33           H        ASN  33   6.308  -0.927   8.238
  226    HA   ASN  33           HA       ASN  33   4.445   1.071   9.229
  227   1HB   ASN  33          1HB       ASN  33   6.474   1.006  10.537
  228   2HB   ASN  33          2HB       ASN  33   7.495   0.951   9.092
  229   1HD2  ASN  33          1HD2      ASN  33   8.518   2.754   8.743
  230   2HD2  ASN  33          2HD2      ASN  33   7.947   4.366   9.025
  231    H    ARG  34           H        ARG  34   6.437  -0.024   6.511
  232    HA   ARG  34           HA       ARG  34   6.272   2.487   5.165
  233   1HB   ARG  34          1HB       ARG  34   7.706   1.537   3.558
  234   2HB   ARG  34          2HB       ARG  34   8.171   0.662   5.027
  235   1HG   ARG  34          1HG       ARG  34   7.922  -1.079   3.494
  236   2HG   ARG  34          2HG       ARG  34   6.315  -1.057   4.242
  237   1HD   ARG  34          1HD       ARG  34   5.456  -0.802   2.169
  238   2HD   ARG  34          2HD       ARG  34   6.170   0.818   2.124
  239    HE   ARG  34           HE       ARG  34   8.235  -0.975   1.451
  240   1HH1  ARG  34          1HH1      ARG  34   5.101  -0.058   0.144
  241   2HH1  ARG  34          2HH1      ARG  34   5.538  -0.409  -1.495
  242   1HH2  ARG  34          1HH2      ARG  34   8.814  -1.440  -0.711
  243   2HH2  ARG  34          2HH2      ARG  34   7.665  -1.201  -1.984
  244    H    GLY  35           H        GLY  35   4.584  -0.636   5.286
  245   1HA   GLY  35          1HA       GLY  35   2.207  -0.355   4.552
  246   2HA   GLY  35          2HA       GLY  35   2.867   0.212   3.031
  247    H    CYS  36           H        CYS  36   4.630  -2.290   4.799
  248    HA   CYS  36           HA       CYS  36   3.606  -4.247   2.872
  249   1HB   CYS  36          1HB       CYS  36   6.406  -4.028   3.983
  250   2HB   CYS  36          2HB       CYS  36   5.820  -5.307   2.914
  251    H    CYS  37           H        CYS  37   4.342  -6.606   3.848
  252    HA   CYS  37           HA       CYS  37   3.611  -6.536   6.687
  253   1HB   CYS  37          1HB       CYS  37   1.841  -7.340   5.004
  254   2HB   CYS  37          2HB       CYS  37   2.842  -8.785   4.842
  255    H    PHE  38           H        PHE  38   5.076  -7.591   8.011
  256    HA   PHE  38           HA       PHE  38   7.323  -8.860   6.699
  257   1HB   PHE  38          1HB       PHE  38   7.415  -7.125   8.601
  258   2HB   PHE  38          2HB       PHE  38   6.670  -8.329   9.658
  259    HD1  PHE  38           HD1      PHE  38   9.668  -7.648   7.581
  260    HD2  PHE  38           HD2      PHE  38   8.000  -9.927  10.748
  261    HE1  PHE  38           HE1      PHE  38  11.947  -8.544   8.136
  262    HE2  PHE  38           HE2      PHE  38  10.278 -10.822  11.304
  263    HZ   PHE  38           HZ       PHE  38  12.224 -10.120   9.991
  264    H    ASP  39           H        ASP  39   7.467 -11.031   6.418
  265    HA   ASP  39           HA       ASP  39   5.482 -12.691   7.535
  266   1HB   ASP  39          1HB       ASP  39   6.255 -13.366   5.418
  267   2HB   ASP  39          2HB       ASP  39   7.954 -13.089   5.834
  268    H    SER  40           H        SER  40   8.961 -13.608   7.469
  269    HA   SER  40           HA       SER  40  10.423 -13.872   9.121
  270   1HB   SER  40          1HB       SER  40   8.862 -12.266  10.501
  271   2HB   SER  40          2HB       SER  40   8.323 -13.756  11.294
  272    HG   SER  40           HG       SER  40  10.393 -14.106  12.085
  273    H    ARG  41           H        ARG  41   7.299 -15.427   8.813
  274    HA   ARG  41           HA       ARG  41   7.870 -17.649  10.417
  275   1HB   ARG  41          1HB       ARG  41   5.976 -17.581   8.033
  276   2HB   ARG  41          2HB       ARG  41   5.844 -18.599   9.478
  277   1HG   ARG  41          1HG       ARG  41   5.884 -16.084  10.587
  278   2HG   ARG  41          2HG       ARG  41   5.055 -15.758   9.054
  279   1HD   ARG  41          1HD       ARG  41   3.236 -16.360  10.348
  280   2HD   ARG  41          2HD       ARG  41   3.688 -17.969   9.765
  281    HE   ARG  41           HE       ARG  41   5.083 -17.243  12.216
  282   1HH1  ARG  41          1HH1      ARG  41   2.051 -18.502  10.950
  283   2HH1  ARG  41          2HH1      ARG  41   1.637 -19.333  12.412
  284   1HH2  ARG  41          1HH2      ARG  41   4.539 -18.339  14.145
  285   2HH2  ARG  41          2HH2      ARG  41   3.061 -19.240  14.242
  286    H    ILE  42           H        ILE  42   8.115 -16.926   6.880
  287    HA   ILE  42           HA       ILE  42   9.726 -19.371   6.619
  288    HB   ILE  42           HB       ILE  42   8.222 -18.172   4.327
  289   1HG1  ILE  42          1HG1      ILE  42   7.068 -19.597   6.657
  290   2HG1  ILE  42          2HG1      ILE  42   6.329 -18.414   5.563
  291   1HG2  ILE  42          1HG2      ILE  42  10.028 -20.015   4.188
  292   2HG2  ILE  42          2HG2      ILE  42   8.773 -21.081   4.865
  293   3HG2  ILE  42          3HG2      ILE  42   8.493 -20.249   3.317
  294   1HD1  ILE  42          1HD1      ILE  42   5.226 -20.381   4.938
  295   2HD1  ILE  42          2HD1      ILE  42   6.582 -20.373   3.785
  296   3HD1  ILE  42          3HD1      ILE  42   6.655 -21.399   5.238
  297    HA   PRO  43           HA       PRO  43  12.650 -16.218   5.695
  298   1HB   PRO  43          1HB       PRO  43  14.876 -17.751   6.093
  299   2HB   PRO  43          2HB       PRO  43  14.081 -16.851   7.384
  300   1HG   PRO  43          1HG       PRO  43  14.017 -19.735   6.763
  301   2HG   PRO  43          2HG       PRO  43  13.621 -18.911   8.314
  302   1HD   PRO  43          1HD       PRO  43  11.827 -20.035   6.383
  303   2HD   PRO  43          2HD       PRO  43  11.384 -19.094   7.814
  304    H    GLY  44           H        GLY  44  11.702 -18.895   4.049
  305   1HA   GLY  44          1HA       GLY  44  13.721 -18.613   1.953
  306   2HA   GLY  44          2HA       GLY  44  12.481 -19.844   2.081
  307    H    VAL  45           H        VAL  45  10.863 -17.047   2.868
  308    HA   VAL  45           HA       VAL  45  10.233 -16.486   0.052
  309    HB   VAL  45           HB       VAL  45   7.985 -16.514   0.483
  310   1HG1  VAL  45          1HG1      VAL  45   8.953 -18.785   0.755
  311   2HG1  VAL  45          2HG1      VAL  45   9.002 -18.527   2.516
  312   3HG1  VAL  45          3HG1      VAL  45   7.440 -18.564   1.665
  313   1HG2  VAL  45          1HG2      VAL  45   8.098 -14.920   2.391
  314   2HG2  VAL  45          2HG2      VAL  45   6.915 -16.226   2.640
  315   3HG2  VAL  45          3HG2      VAL  45   8.489 -16.281   3.469
  316    HA   PRO  46           HA       PRO  46  10.492 -12.267   1.056
  317   1HB   PRO  46          1HB       PRO  46   8.150 -11.060   0.339
  318   2HB   PRO  46          2HB       PRO  46   9.392 -11.522  -0.823
  319   1HG   PRO  46          1HG       PRO  46   6.814 -12.808  -0.189
  320   2HG   PRO  46          2HG       PRO  46   7.825 -12.989  -1.668
  321   1HD   PRO  46          1HD       PRO  46   7.510 -14.822   0.509
  322   2HD   PRO  46          2HD       PRO  46   8.640 -14.974  -0.843
  323    H    TRP  47           H        TRP  47  10.842 -11.336   2.961
  324    HA   TRP  47           HA       TRP  47   8.746 -11.765   4.939
  325   1HB   TRP  47          1HB       TRP  47  11.191 -10.376   5.755
  326   2HB   TRP  47          2HB       TRP  47  10.352 -11.743   6.490
  327    HD1  TRP  47           HD1      TRP  47  10.988 -14.238   5.370
  328    HE1  TRP  47           HE1      TRP  47  13.201 -15.181   4.287
  329    HE3  TRP  47           HE3      TRP  47  13.092  -9.702   4.447
  330    HZ2  TRP  47           HZ2      TRP  47  15.532 -13.952   3.190
  331    HZ3  TRP  47           HZ3      TRP  47  15.339  -9.662   3.367
  332    HH2  TRP  47           HH2      TRP  47  16.553 -11.690   2.743
  333    H    CYS  48           H        CYS  48   8.435  -9.918   2.595
  334    HA   CYS  48           HA       CYS  48   7.451  -7.708   4.046
  335   1HB   CYS  48          1HB       CYS  48   9.855  -7.121   3.989
  336   2HB   CYS  48          2HB       CYS  48   9.793  -7.119   2.224
  337    H    PHE  49           H        PHE  49   5.479  -7.891   2.988
  338    HA   PHE  49           HA       PHE  49   5.552  -7.511   0.098
  339   1HB   PHE  49          1HB       PHE  49   3.443  -9.235   0.411
  340   2HB   PHE  49          2HB       PHE  49   5.071  -9.809   0.039
  341    HD1  PHE  49           HD1      PHE  49   6.577 -10.147   2.228
  342    HD2  PHE  49           HD2      PHE  49   2.336 -10.241   2.145
  343    HE1  PHE  49           HE1      PHE  49   6.566 -11.503   4.340
  344    HE2  PHE  49           HE2      PHE  49   2.324 -11.597   4.257
  345    HZ   PHE  49           HZ       PHE  49   4.439 -12.211   5.329
  346    H    LYS  50           H        LYS  50   2.850  -7.577  -0.462
  347    HA   LYS  50           HA       LYS  50   1.736  -5.625   1.430
  348   1HB   LYS  50          1HB       LYS  50   0.685  -4.551  -0.579
  349   2HB   LYS  50          2HB       LYS  50   2.441  -4.353  -0.446
  350   1HG   LYS  50          1HG       LYS  50   1.864  -6.784  -1.896
  351   2HG   LYS  50          2HG       LYS  50   0.938  -5.458  -2.622
  352   1HD   LYS  50          1HD       LYS  50   3.941  -5.600  -2.154
  353   2HD   LYS  50          2HD       LYS  50   3.107  -5.556  -3.717
  354   1HE   LYS  50          1HE       LYS  50   2.257  -3.281  -2.177
  355   2HE   LYS  50          2HE       LYS  50   4.025  -3.350  -2.103
  356   1HZ   LYS  50          1HZ       LYS  50   3.562  -2.200  -4.023
  357   2HZ   LYS  50          2HZ       LYS  50   3.830  -3.707  -4.594
  358   3HZ   LYS  50          3HZ       LYS  50   2.303  -3.148  -4.451
  359    HA   PRO  51           HA       PRO  51  -1.062  -9.150   0.916
  360   1HB   PRO  51          1HB       PRO  51  -1.320  -9.797   3.558
  361   2HB   PRO  51          2HB       PRO  51  -0.174 -10.590   2.478
  362   1HG   PRO  51          1HG       PRO  51   0.279  -8.541   4.552
  363   2HG   PRO  51          2HG       PRO  51   1.469  -9.670   3.811
  364   1HD   PRO  51          1HD       PRO  51   1.124  -6.871   3.314
  365   2HD   PRO  51          2HD       PRO  51   2.200  -7.972   2.445
  366    H    LEU  52           H        LEU  52  -1.972  -8.314   4.095
  367    HA   LEU  52           HA       LEU  52  -4.352  -7.075   2.971
  368   1HB   LEU  52          1HB       LEU  52  -5.443  -7.646   4.891
  369   2HB   LEU  52          2HB       LEU  52  -4.314  -8.995   4.679
  370    HG   LEU  52           HG       LEU  52  -3.131  -6.930   6.321
  371   1HD1  LEU  52          1HD1      LEU  52  -5.967  -7.603   6.878
  372   2HD1  LEU  52          2HD1      LEU  52  -4.851  -7.624   8.264
  373   3HD1  LEU  52          3HD1      LEU  52  -5.023  -6.149   7.283
  374   1HD2  LEU  52          1HD2      LEU  52  -2.997  -9.659   6.053
  375   2HD2  LEU  52          2HD2      LEU  52  -2.270  -8.707   7.368
  376   3HD2  LEU  52          3HD2      LEU  52  -3.863  -9.467   7.598
  377    H    GLN  53           H        GLN  53  -1.830  -5.644   2.782
  378    HA   GLN  53           HA       GLN  53  -1.381  -3.900   4.822
  379   1HB   GLN  53          1HB       GLN  53  -1.159  -3.464   1.820
  380   2HB   GLN  53          2HB       GLN  53  -0.439  -2.389   3.032
  381   1HG   GLN  53          1HG       GLN  53   0.177  -5.342   2.596
  382   2HG   GLN  53          2HG       GLN  53   1.249  -3.983   2.226
  383   1HE2  GLN  53          1HE2      GLN  53  -0.029  -6.106   4.613
  384   2HE2  GLN  53          2HE2      GLN  53   0.902  -5.576   5.974
  385    H    GLU  54           H        GLU  54  -4.125  -4.122   2.675
  386    HA   GLU  54           HA       GLU  54  -5.011  -1.654   2.327
  387   1HB   GLU  54          1HB       GLU  54  -7.120  -2.565   2.051
  388   2HB   GLU  54          2HB       GLU  54  -6.131  -4.033   1.966
  389   1HG   GLU  54          1HG       GLU  54  -7.682  -4.734   3.518
  390   2HG   GLU  54          2HG       GLU  54  -6.532  -3.977   4.633
  391    H    ALA  55           H        ALA  55  -4.599  -3.287   5.429
  392    HA   ALA  55           HA       ALA  55  -6.289  -2.093   7.120
  393   1HB   ALA  55          1HB       ALA  55  -3.607  -1.910   8.209
  394   2HB   ALA  55          2HB       ALA  55  -4.902  -3.070   8.594
  395   3HB   ALA  55          3HB       ALA  55  -3.781  -3.400   7.250
  396    H    GLU  56           H        GLU  56  -3.017  -0.638   6.482
  397    HA   GLU  56           HA       GLU  56  -4.353   1.948   6.654
  398   1HB   GLU  56          1HB       GLU  56  -2.387   0.877   8.402
  399   2HB   GLU  56          2HB       GLU  56  -1.572   2.132   7.453
  400   1HG   GLU  56          1HG       GLU  56  -3.729   3.546   8.003
  401   2HG   GLU  56          2HG       GLU  56  -3.953   2.375   9.311
  402    H    CYS  57           H        CYS  57  -3.631   0.175   4.322
  403    HA   CYS  57           HA       CYS  57  -1.530   1.793   3.104
  404   1HB   CYS  57          1HB       CYS  57  -1.491  -0.778   3.171
  405   2HB   CYS  57          2HB       CYS  57  -2.725  -0.697   1.910
  406    H    THR  58           H        THR  58  -4.528   0.084   1.938
  407    HA   THR  58           HA       THR  58  -5.031   1.918  -0.111
  408    HB   THR  58           HB       THR  58  -5.870  -0.509   0.231
  409    HG1  THR  58           HG1      THR  58  -6.726   0.864  -1.437
  410   1HG2  THR  58          1HG2      THR  58  -7.870   1.054   1.944
  411   2HG2  THR  58          2HG2      THR  58  -8.212  -0.548   1.248
  412   3HG2  THR  58          3HG2      THR  58  -6.910  -0.357   2.447
  413    H    PHE  59           H        PHE  59  -6.070   1.839   3.317
  414    HA   PHE  59           HA       PHE  59  -8.091   3.518   3.460
  415   1HB   PHE  59          1HB       PHE  59  -6.416   2.537   5.241
  416   2HB   PHE  59          2HB       PHE  59  -5.496   4.028   5.012
  417    HD1  PHE  59           HD1      PHE  59  -5.990   5.856   6.345
  418    HD2  PHE  59           HD2      PHE  59  -8.931   2.838   5.844
  419    HE1  PHE  59           HE1      PHE  59  -7.449   6.997   8.039
  420    HE2  PHE  59           HE2      PHE  59 -10.391   3.979   7.539
  421    HZ   PHE  59           HZ       PHE  59  -9.631   6.045   8.615
  422   1H    GLU   1           H1       GLU   1 -17.898  -2.452   2.584
  423    HA   GLU   1           HA       GLU   1 -18.372  -3.491   0.736
  424   1HB   GLU   1          1HB       GLU   1 -21.223  -2.579   1.285
  425   2HB   GLU   1          2HB       GLU   1 -20.768  -3.880   0.170
  426   1HG   GLU   1          1HG       GLU   1 -21.342  -5.013   2.159
  427   2HG   GLU   1          2HG       GLU   1 -19.575  -4.940   2.236
  428    H    GLU   2           H        GLU   2 -19.814  -0.217   0.960
  429    HA   GLU   2           HA       GLU   2 -19.751   0.022  -1.908
  430   1HB   GLU   2          1HB       GLU   2 -20.689   1.841   0.331
  431   2HB   GLU   2          2HB       GLU   2 -20.659   2.366  -1.359
  432   1HG   GLU   2          1HG       GLU   2 -21.908  -0.176  -1.362
  433   2HG   GLU   2          2HG       GLU   2 -22.599   0.679   0.026
  434    H    TYR   3           H        TYR   3 -17.302  -0.349  -1.824
  435    HA   TYR   3           HA       TYR   3 -15.806   1.940  -0.843
  436   1HB   TYR   3          1HB       TYR   3 -15.403  -0.878  -1.865
  437   2HB   TYR   3          2HB       TYR   3 -14.054   0.231  -2.129
  438    HD1  TYR   3           HD1      TYR   3 -16.404  -0.693   0.660
  439    HD2  TYR   3           HD2      TYR   3 -12.388   0.186  -0.524
  440    HE1  TYR   3           HE1      TYR   3 -15.603  -1.118   3.035
  441    HE2  TYR   3           HE2      TYR   3 -11.600  -0.241   1.855
  442    HH   TYR   3           HH       TYR   3 -12.575  -0.164   4.113
  443    H    VAL   4           H        VAL   4 -16.473   3.632  -2.272
  444    HA   VAL   4           HA       VAL   4 -15.540   3.226  -5.031
  445    HB   VAL   4           HB       VAL   4 -17.259   4.658  -5.797
  446   1HG1  VAL   4          1HG1      VAL   4 -18.104   2.467  -5.590
  447   2HG1  VAL   4          2HG1      VAL   4 -18.236   2.590  -3.819
  448   3HG1  VAL   4          3HG1      VAL   4 -19.353   3.504  -4.861
  449   1HG2  VAL   4          1HG2      VAL   4 -17.916   5.192  -2.881
  450   2HG2  VAL   4          2HG2      VAL   4 -17.255   6.347  -4.064
  451   3HG2  VAL   4          3HG2      VAL   4 -18.910   5.720  -4.261
  452    H    GLY   5           H        GLY   5 -16.057   5.627  -2.362
  453   1HA   GLY   5          1HA       GLY   5 -14.366   7.595  -3.528
  454   2HA   GLY   5          2HA       GLY   5 -14.987   7.555  -1.890
  455    H    LEU   6           H        LEU   6 -13.580   4.542  -2.409
  456    HA   LEU   6           HA       LEU   6 -10.928   5.487  -1.590
  457   1HB   LEU   6          1HB       LEU   6 -11.779   3.001  -0.334
  458   2HB   LEU   6          2HB       LEU   6 -10.938   4.404   0.349
  459    HG   LEU   6           HG       LEU   6 -13.032   4.030   1.497
  460   1HD1  LEU   6          1HD1      LEU   6 -14.047   6.365   0.168
  461   2HD1  LEU   6          2HD1      LEU   6 -13.238   6.223   1.747
  462   3HD1  LEU   6          3HD1      LEU   6 -12.273   6.460   0.270
  463   1HD2  LEU   6          1HD2      LEU   6 -14.013   3.078  -0.843
  464   2HD2  LEU   6          2HD2      LEU   6 -15.015   3.544   0.552
  465   3HD2  LEU   6          3HD2      LEU   6 -14.780   4.684  -0.795
  466    H    SER   7           H        SER   7 -12.606   4.182  -4.011
  467    HA   SER   7           HA       SER   7 -10.698   2.025  -4.439
  468   1HB   SER   7          1HB       SER   7 -13.518   2.200  -4.800
  469   2HB   SER   7          2HB       SER   7 -12.810   2.089  -6.421
  470    HG   SER   7           HG       SER   7 -11.485   0.254  -5.277
  471    H    ALA   8           H        ALA   8 -11.107   1.888  -7.322
  472    HA   ALA   8           HA       ALA   8  -9.175   3.701  -8.168
  473   1HB   ALA   8          1HB       ALA   8  -9.322   2.540 -10.130
  474   2HB   ALA   8          2HB       ALA   8 -10.293   1.423  -9.140
  475   3HB   ALA   8          3HB       ALA   8 -11.100   2.627 -10.172
  476    H    ASN   9           H        ASN   9  -9.840   5.803  -7.393
  477    HA   ASN   9           HA       ASN   9 -10.927   7.402  -9.252
  478   1HB   ASN   9          1HB       ASN   9 -13.020   5.887  -8.128
  479   2HB   ASN   9          2HB       ASN   9 -13.135   7.443  -7.294
  480   1HD2  ASN   9          1HD2      ASN   9 -12.698   9.355  -8.879
  481   2HD2  ASN   9          2HD2      ASN   9 -13.630   9.343 -10.339
  482    H    GLN  10           H        GLN  10 -10.543   6.502  -5.831
  483    HA   GLN  10           HA       GLN  10 -10.822   9.061  -4.756
  484   1HB   GLN  10          1HB       GLN  10 -10.970   6.954  -3.455
  485   2HB   GLN  10          2HB       GLN  10  -9.235   6.685  -3.688
  486   1HG   GLN  10          1HG       GLN  10  -8.725   8.753  -2.472
  487   2HG   GLN  10          2HG       GLN  10 -10.446   9.136  -2.325
  488   1HE2  GLN  10          1HE2      GLN  10  -8.292   6.341  -1.808
  489   2HE2  GLN  10          2HE2      GLN  10  -8.872   5.906  -0.235
  490    H    CYS  11           H        CYS  11  -8.188   7.374  -6.409
  491    HA   CYS  11           HA       CYS  11  -6.105   8.997  -5.432
  492   1HB   CYS  11          1HB       CYS  11  -5.639   6.835  -6.339
  493   2HB   CYS  11          2HB       CYS  11  -6.334   7.272  -7.903
  494    H    ALA  12           H        ALA  12  -8.837   9.759  -7.209
  495    HA   ALA  12           HA       ALA  12  -7.423  11.855  -8.712
  496   1HB   ALA  12          1HB       ALA  12  -8.996  11.649 -10.418
  497   2HB   ALA  12          2HB       ALA  12  -8.843   9.959  -9.877
  498   3HB   ALA  12          3HB       ALA  12 -10.226  10.944  -9.342
  499    H    VAL  13           H        VAL  13  -8.711  11.430  -5.802
  500    HA   VAL  13           HA       VAL  13 -10.893  12.932  -5.404
  501    HB   VAL  13           HB       VAL  13  -8.819  11.907  -3.885
  502   1HG1  VAL  13          1HG1      VAL  13  -8.060  13.624  -2.391
  503   2HG1  VAL  13          2HG1      VAL  13  -7.713  14.161  -4.054
  504   3HG1  VAL  13          3HG1      VAL  13  -9.100  14.841  -3.169
  505   1HG2  VAL  13          1HG2      VAL  13 -10.602  13.342  -2.169
  506   2HG2  VAL  13          2HG2      VAL  13 -11.529  12.747  -3.568
  507   3HG2  VAL  13          3HG2      VAL  13 -10.593  11.608  -2.569
  508    HA   PRO  14           HA       PRO  14 -10.058  17.032  -6.479
  509   1HB   PRO  14          1HB       PRO  14 -11.387  18.490  -4.589
  510   2HB   PRO  14          2HB       PRO  14 -12.191  17.724  -5.957
  511   1HG   PRO  14          1HG       PRO  14 -12.082  16.914  -3.122
  512   2HG   PRO  14          2HG       PRO  14 -13.268  16.424  -4.385
  513   1HD   PRO  14          1HD       PRO  14 -11.096  14.908  -3.297
  514   2HD   PRO  14          2HD       PRO  14 -12.134  14.441  -4.650
  515    H    ALA  15           H        ALA  15  -7.994  15.741  -4.942
  516    HA   ALA  15           HA       ALA  15  -6.242  16.233  -3.648
  517   1HB   ALA  15          1HB       ALA  15  -5.984  17.488  -5.907
  518   2HB   ALA  15          2HB       ALA  15  -6.312  18.960  -4.962
  519   3HB   ALA  15          3HB       ALA  15  -4.904  17.945  -4.568
  520    H    LYS  16           H        LYS  16  -7.807  16.205  -1.743
  521    HA   LYS  16           HA       LYS  16  -7.166  18.089   0.085
  522   1HB   LYS  16          1HB       LYS  16  -9.385  19.393   0.188
  523   2HB   LYS  16          2HB       LYS  16  -8.151  19.907  -0.977
  524   1HG   LYS  16          1HG       LYS  16  -9.725  19.720  -2.580
  525   2HG   LYS  16          2HG       LYS  16  -9.681  17.964  -2.345
  526   1HD   LYS  16          1HD       LYS  16 -11.768  18.005  -1.506
  527   2HD   LYS  16          2HD       LYS  16 -11.281  19.154  -0.248
  528   1HE   LYS  16          1HE       LYS  16 -12.170  20.929  -1.369
  529   2HE   LYS  16          2HE       LYS  16 -11.596  20.360  -2.944
  530   1HZ   LYS  16          1HZ       LYS  16 -13.578  19.513  -3.326
  531   2HZ   LYS  16          2HZ       LYS  16 -13.601  18.677  -1.923
  532   3HZ   LYS  16          3HZ       LYS  16 -14.136  20.220  -1.965
  533    H    ASP  17           H        ASP  17  -7.522  15.308  -0.106
  534    HA   ASP  17           HA       ASP  17  -9.355  14.987   2.059
  535   1HB   ASP  17          1HB       ASP  17 -10.713  14.670  -0.075
  536   2HB   ASP  17          2HB       ASP  17  -9.685  13.277  -0.448
  537    H    ARG  18           H        ARG  18  -6.926  13.843  -0.284
  538    HA   ARG  18           HA       ARG  18  -6.420  11.345   0.485
  539   1HB   ARG  18          1HB       ARG  18  -4.341  13.516  -0.050
  540   2HB   ARG  18          2HB       ARG  18  -4.033  11.775  -0.163
  541   1HG   ARG  18          1HG       ARG  18  -5.086  11.602  -2.180
  542   2HG   ARG  18          2HG       ARG  18  -6.374  12.733  -1.729
  543   1HD   ARG  18          1HD       ARG  18  -4.768  14.626  -2.052
  544   2HD   ARG  18          2HD       ARG  18  -3.528  13.473  -2.568
  545    HE   ARG  18           HE       ARG  18  -6.086  13.373  -4.045
  546   1HH1  ARG  18          1HH1      ARG  18  -2.792  14.604  -3.931
  547   2HH1  ARG  18          2HH1      ARG  18  -2.722  14.939  -5.629
  548   1HH2  ARG  18          1HH2      ARG  18  -5.995  13.815  -6.285
  549   2HH2  ARG  18          2HH2      ARG  18  -4.557  14.487  -6.976
  550    H    VAL  19           H        VAL  19  -4.275  10.630   1.784
  551    HA   VAL  19           HA       VAL  19  -4.496  11.921   4.407
  552    HB   VAL  19           HB       VAL  19  -3.436   9.172   3.746
  553   1HG1  VAL  19          1HG1      VAL  19  -2.694   9.505   5.875
  554   2HG1  VAL  19          2HG1      VAL  19  -3.943  10.719   6.241
  555   3HG1  VAL  19          3HG1      VAL  19  -4.352   8.986   6.264
  556   1HG2  VAL  19          1HG2      VAL  19  -5.872   9.596   3.058
  557   2HG2  VAL  19          2HG2      VAL  19  -5.557   8.222   4.145
  558   3HG2  VAL  19          3HG2      VAL  19  -6.213   9.742   4.799
  559    H    ASP  20           H        ASP  20  -2.842  12.721   1.934
  560    HA   ASP  20           HA       ASP  20  -0.723  13.057   1.365
  561   1HB   ASP  20          1HB       ASP  20  -0.922  15.073   2.465
  562   2HB   ASP  20          2HB       ASP  20  -1.289  14.317   4.023
  563    H    CYS  21           H        CYS  21   0.201  10.878   1.266
  564    HA   CYS  21           HA       CYS  21   0.954   9.326   3.358
  565   1HB   CYS  21          1HB       CYS  21   1.083   9.063   0.723
  566   2HB   CYS  21          2HB       CYS  21   2.784   9.440   1.009
  567    H    GLY  22           H        GLY  22   2.556  12.191   1.917
  568   1HA   GLY  22          1HA       GLY  22   4.329  13.416   2.556
  569   2HA   GLY  22          2HA       GLY  22   3.933  12.933   4.193
  570    H    TYR  23           H        TYR  23   5.335  11.357   1.221
  571    HA   TYR  23           HA       TYR  23   7.138   9.860   2.941
  572   1HB   TYR  23          1HB       TYR  23   5.834   9.723   0.307
  573   2HB   TYR  23          2HB       TYR  23   7.573   9.483   0.112
  574    HD1  TYR  23           HD1      TYR  23   4.441   7.998   1.103
  575    HD2  TYR  23           HD2      TYR  23   8.689   7.615   1.441
  576    HE1  TYR  23           HE1      TYR  23   4.174   5.567   1.796
  577    HE2  TYR  23           HE2      TYR  23   8.407   5.185   2.133
  578    HH   TYR  23           HH       TYR  23   5.171   3.790   2.540
  579    HA   PRO  24           HA       PRO  24  10.447  12.546   2.122
  580   1HB   PRO  24          1HB       PRO  24  12.496  11.001   3.060
  581   2HB   PRO  24          2HB       PRO  24  11.475  11.987   4.105
  582   1HG   PRO  24          1HG       PRO  24  11.459   9.072   3.638
  583   2HG   PRO  24          2HG       PRO  24  10.771   9.993   5.026
  584   1HD   PRO  24          1HD       PRO  24   9.387   8.790   2.824
  585   2HD   PRO  24          2HD       PRO  24   8.684   9.819   4.079
  586    H    HIS  25           H        HIS  25   9.750   9.842   0.427
  587    HA   HIS  25           HA       HIS  25  11.934  10.470  -1.418
  588   1HB   HIS  25          1HB       HIS  25  11.901   8.192  -0.018
  589   2HB   HIS  25          2HB       HIS  25  10.860   7.693  -1.355
  590    HD1  HIS  25           HD1      HIS  25  12.435   6.186  -2.637
  591    HD2  HIS  25           HD2      HIS  25  14.130   9.917  -1.749
  592    HE1  HIS  25           HE1      HIS  25  14.654   6.280  -3.892
  593    HE2  HIS  25           HE2      HIS  25  15.623   8.617  -3.352
  594    H    VAL  26           H        VAL  26   8.895  11.158  -0.958
  595    HA   VAL  26           HA       VAL  26   7.221  10.052  -2.715
  596    HB   VAL  26           HB       VAL  26   6.457  11.816  -1.399
  597   1HG1  VAL  26          1HG1      VAL  26   7.730  14.160  -2.464
  598   2HG1  VAL  26          2HG1      VAL  26   7.745  13.534  -0.798
  599   3HG1  VAL  26          3HG1      VAL  26   8.980  12.997  -1.963
  600   1HG2  VAL  26          1HG2      VAL  26   6.536  13.264  -4.036
  601   2HG2  VAL  26          2HG2      VAL  26   5.679  11.709  -3.895
  602   3HG2  VAL  26          3HG2      VAL  26   5.197  13.088  -2.877
  603    H    THR  27           H        THR  27   7.095   9.664  -4.875
  604    HA   THR  27           HA       THR  27   8.208  11.422  -6.797
  605    HB   THR  27           HB       THR  27   9.961   9.395  -5.633
  606    HG1  THR  27           HG1      THR  27   9.943  11.445  -7.722
  607   1HG2  THR  27          1HG2      THR  27  10.810   8.883  -8.123
  608   2HG2  THR  27          2HG2      THR  27   9.615   7.817  -7.348
  609   3HG2  THR  27          3HG2      THR  27   9.081   9.054  -8.510
  610    HA   PRO  28           HA       PRO  28   5.347   9.267  -9.156
  611   1HB   PRO  28          1HB       PRO  28   6.138   9.899 -11.693
  612   2HB   PRO  28          2HB       PRO  28   5.196  10.988 -10.679
  613   1HG   PRO  28          1HG       PRO  28   8.065  11.038 -11.359
  614   2HG   PRO  28          2HG       PRO  28   7.033  12.380 -10.745
  615   1HD   PRO  28          1HD       PRO  28   8.983  10.837  -9.322
  616   2HD   PRO  28          2HD       PRO  28   7.881  12.038  -8.635
  617    H    LYS  29           H        LYS  29   7.145   7.535  -8.076
  618    HA   LYS  29           HA       LYS  29   6.872   5.372  -9.779
  619   1HB   LYS  29          1HB       LYS  29   8.664   6.849 -10.987
  620   2HB   LYS  29          2HB       LYS  29   9.767   6.163  -9.781
  621   1HG   LYS  29          1HG       LYS  29   9.670   4.073 -10.704
  622   2HG   LYS  29          2HG       LYS  29   7.951   4.206 -11.110
  623   1HD   LYS  29          1HD       LYS  29   9.639   6.055 -12.653
  624   2HD   LYS  29          2HD       LYS  29  10.094   4.361 -12.905
  625   1HE   LYS  29          1HE       LYS  29   7.178   4.792 -12.917
  626   2HE   LYS  29          2HE       LYS  29   8.004   5.717 -14.180
  627   1HZ   LYS  29          1HZ       LYS  29   7.407   3.047 -14.191
  628   2HZ   LYS  29          2HZ       LYS  29   8.311   3.854 -15.285
  629   3HZ   LYS  29          3HZ       LYS  29   9.030   3.113 -14.020
  630    H    GLU  30           H        GLU  30   7.995   7.071  -7.000
  631    HA   GLU  30           HA       GLU  30   8.932   4.600  -5.804
  632   1HB   GLU  30          1HB       GLU  30   9.518   7.454  -5.448
  633   2HB   GLU  30          2HB       GLU  30   9.248   6.625  -3.906
  634   1HG   GLU  30          1HG       GLU  30  11.630   6.558  -4.566
  635   2HG   GLU  30          2HG       GLU  30  10.947   4.925  -4.524
  636    H    CYS  31           H        CYS  31   6.560   7.290  -5.370
  637    HA   CYS  31           HA       CYS  31   5.450   6.450  -3.004
  638   1HB   CYS  31          1HB       CYS  31   4.320   7.939  -5.357
  639   2HB   CYS  31          2HB       CYS  31   3.344   7.596  -3.925
  640    H    ASN  32           H        ASN  32   4.419   5.728  -6.424
  641    HA   ASN  32           HA       ASN  32   2.405   3.988  -5.715
  642   1HB   ASN  32          1HB       ASN  32   4.014   4.592  -8.163
  643   2HB   ASN  32          2HB       ASN  32   3.201   3.019  -8.165
  644   1HD2  ASN  32          1HD2      ASN  32   2.362   6.207  -6.819
  645   2HD2  ASN  32          2HD2      ASN  32   0.844   6.397  -7.630
  646    H    ASN  33           H        ASN  33   5.820   3.727  -5.410
  647    HA   ASN  33           HA       ASN  33   5.828   0.862  -5.742
  648   1HB   ASN  33          1HB       ASN  33   7.710   2.469  -6.524
  649   2HB   ASN  33          2HB       ASN  33   8.151   2.617  -4.818
  650   1HD2  ASN  33          1HD2      ASN  33  10.160   1.750  -5.928
  651   2HD2  ASN  33          2HD2      ASN  33  10.381   0.033  -5.939
  652    H    ARG  34           H        ARG  34   5.752   3.442  -3.315
  653    HA   ARG  34           HA       ARG  34   6.548   1.676  -1.208
  654   1HB   ARG  34          1HB       ARG  34   5.376   4.472  -0.929
  655   2HB   ARG  34          2HB       ARG  34   6.425   3.629   0.223
  656   1HG   ARG  34          1HG       ARG  34   7.843   3.669  -2.228
  657   2HG   ARG  34          2HG       ARG  34   7.144   5.289  -2.068
  658   1HD   ARG  34          1HD       ARG  34   8.463   5.810  -0.268
  659   2HD   ARG  34          2HD       ARG  34   8.362   4.182   0.421
  660    HE   ARG  34           HE       ARG  34   9.906   3.916  -1.902
  661   1HH1  ARG  34          1HH1      ARG  34  10.124   5.774   1.079
  662   2HH1  ARG  34          2HH1      ARG  34  11.856   5.822   1.072
  663   1HH2  ARG  34          1HH2      ARG  34  12.190   3.980  -1.911
  664   2HH2  ARG  34          2HH2      ARG  34  13.039   4.794  -0.640
  665    H    GLY  35           H        GLY  35   3.624   2.876  -2.772
  666   1HA   GLY  35          1HA       GLY  35   1.669   1.446  -2.393
  667   2HA   GLY  35          2HA       GLY  35   1.987   1.576  -0.675
  668    H    CYS  36           H        CYS  36   2.608   4.392  -2.718
  669    HA   CYS  36           HA       CYS  36   0.134   5.576  -1.683
  670   1HB   CYS  36          1HB       CYS  36   2.771   6.973  -2.146
  671   2HB   CYS  36          2HB       CYS  36   1.285   7.715  -1.545
  672    H    CYS  37           H        CYS  37  -0.341   7.695  -3.135
  673    HA   CYS  37           HA       CYS  37   0.026   6.835  -5.913
  674   1HB   CYS  37          1HB       CYS  37  -2.312   6.813  -4.854
  675   2HB   CYS  37          2HB       CYS  37  -2.235   8.574  -4.950
  676    H    PHE  38           H        PHE  38   0.951   8.339  -7.324
  677    HA   PHE  38           HA       PHE  38   1.953  10.753  -6.085
  678   1HB   PHE  38          1HB       PHE  38   3.264   9.085  -7.554
  679   2HB   PHE  38          2HB       PHE  38   2.264   9.597  -8.918
  680    HD1  PHE  38           HD1      PHE  38   4.915  10.599  -6.583
  681    HD2  PHE  38           HD2      PHE  38   2.642  11.719  -9.988
  682    HE1  PHE  38           HE1      PHE  38   6.530  12.463  -7.049
  683    HE2  PHE  38           HE2      PHE  38   4.257  13.583 -10.453
  684    HZ   PHE  38           HZ       PHE  38   6.181  13.933  -8.978
  685    H    ASP  39           H        ASP  39   1.031  12.734  -6.323
  686    HA   ASP  39           HA       ASP  39  -1.325  12.985  -7.795
  687   1HB   ASP  39          1HB       ASP  39  -1.030  14.392  -5.892
  688   2HB   ASP  39          2HB       ASP  39   0.557  14.952  -6.440
  689    H    SER  40           H        SER  40   1.073  15.587  -8.146
  690    HA   SER  40           HA       SER  40   2.425  16.105  -9.855
  691   1HB   SER  40          1HB       SER  40   2.116  13.645 -10.680
  692   2HB   SER  40          2HB       SER  40   0.922  14.330 -11.796
  693    HG   SER  40           HG       SER  40   3.671  15.215 -11.555
  694    H    ARG  41           H        ARG  41  -0.983  16.061  -9.569
  695    HA   ARG  41           HA       ARG  41  -1.404  17.806 -11.808
  696   1HB   ARG  41          1HB       ARG  41  -3.394  17.003  -9.643
  697   2HB   ARG  41          2HB       ARG  41  -3.774  17.624 -11.258
  698   1HG   ARG  41          1HG       ARG  41  -2.232  15.443 -11.881
  699   2HG   ARG  41          2HG       ARG  41  -3.006  14.878 -10.391
  700   1HD   ARG  41          1HD       ARG  41  -4.589  14.232 -11.968
  701   2HD   ARG  41          2HD       ARG  41  -5.204  15.843 -11.569
  702    HE   ARG  41           HE       ARG  41  -3.261  15.757 -13.782
  703   1HH1  ARG  41          1HH1      ARG  41  -6.657  15.677 -12.867
  704   2HH1  ARG  41          2HH1      ARG  41  -7.222  16.167 -14.430
  705   1HH2  ARG  41          1HH2      ARG  41  -4.004  16.402 -15.844
  706   2HH2  ARG  41          2HH2      ARG  41  -5.702  16.582 -16.134
  707    H    ILE  42           H        ILE  42  -1.963  17.861  -8.205
  708    HA   ILE  42           HA       ILE  42  -1.813  20.787  -8.352
  709    HB   ILE  42           HB       ILE  42  -2.926  19.190  -6.064
  710   1HG1  ILE  42          1HG1      ILE  42  -4.221  19.871  -8.683
  711   2HG1  ILE  42          2HG1      ILE  42  -4.276  18.356  -7.765
  712   1HG2  ILE  42          1HG2      ILE  42  -4.063  21.806  -6.784
  713   2HG2  ILE  42          2HG2      ILE  42  -3.566  21.157  -5.202
  714   3HG2  ILE  42          3HG2      ILE  42  -2.350  21.852  -6.302
  715   1HD1  ILE  42          1HD1      ILE  42  -5.369  20.242  -6.005
  716   2HD1  ILE  42          2HD1      ILE  42  -6.005  20.728  -7.595
  717   3HD1  ILE  42          3HD1      ILE  42  -6.286  19.078  -6.991
  718    HA   PRO  43           HA       PRO  43   2.053  20.164  -6.408
  719   1HB   PRO  43          1HB       PRO  43   2.915  22.750  -6.572
  720   2HB   PRO  43          2HB       PRO  43   3.131  21.578  -7.870
  721   1HG   PRO  43          1HG       PRO  43   1.202  23.796  -7.620
  722   2HG   PRO  43          2HG       PRO  43   1.735  22.932  -9.107
  723   1HD   PRO  43          1HD       PRO  43  -0.739  22.673  -7.687
  724   2HD   PRO  43          2HD       PRO  43  -0.196  21.687  -9.051
  725    H    GLY  44           H        GLY  44  -0.568  22.018  -5.386
  726   1HA   GLY  44          1HA       GLY  44   0.706  22.756  -2.868
  727   2HA   GLY  44          2HA       GLY  44  -0.901  23.187  -3.423
  728    H    VAL  45           H        VAL  45  -0.770  19.989  -4.209
  729    HA   VAL  45           HA       VAL  45  -1.876  19.218  -1.601
  730    HB   VAL  45           HB       VAL  45  -3.000  19.170  -4.121
  731   1HG1  VAL  45          1HG1      VAL  45  -1.575  17.297  -4.805
  732   2HG1  VAL  45          2HG1      VAL  45  -2.133  16.347  -3.407
  733   3HG1  VAL  45          3HG1      VAL  45  -3.279  16.794  -4.694
  734   1HG2  VAL  45          1HG2      VAL  45  -3.643  18.336  -1.424
  735   2HG2  VAL  45          2HG2      VAL  45  -4.710  18.969  -2.701
  736   3HG2  VAL  45          3HG2      VAL  45  -4.366  17.225  -2.611
  737    HA   PRO  46           HA       PRO  46   1.076  16.075  -1.261
  738   1HB   PRO  46          1HB       PRO  46  -0.297  13.878  -0.395
  739   2HB   PRO  46          2HB       PRO  46   0.152  15.215   0.664
  740   1HG   PRO  46          1HG       PRO  46  -2.457  14.536  -0.532
  741   2HG   PRO  46          2HG       PRO  46  -2.114  15.582   0.892
  742   1HD   PRO  46          1HD       PRO  46  -2.846  16.374  -1.761
  743   2HD   PRO  46          2HD       PRO  46  -2.362  17.442  -0.436
  744    H    TRP  47           H        TRP  47   2.301  15.320  -2.858
  745    HA   TRP  47           HA       TRP  47   0.889  13.953  -4.992
  746   1HB   TRP  47          1HB       TRP  47   3.786  14.149  -5.205
  747   2HB   TRP  47          2HB       TRP  47   2.522  14.660  -6.324
  748    HD1  TRP  47           HD1      TRP  47   1.452  17.208  -5.772
  749    HE1  TRP  47           HE1      TRP  47   2.544  19.401  -4.791
  750    HE3  TRP  47           HE3      TRP  47   5.466  14.899  -3.672
  751    HZ2  TRP  47           HZ2      TRP  47   4.911  19.912  -3.281
  752    HZ3  TRP  47           HZ3      TRP  47   7.120  16.317  -2.463
  753    HH2  TRP  47           HH2      TRP  47   6.892  18.742  -2.249
  754    H    CYS  48           H        CYS  48   1.039  12.752  -2.277
  755    HA   CYS  48           HA       CYS  48   1.927  10.191  -3.083
  756   1HB   CYS  48          1HB       CYS  48   4.063  11.437  -2.389
  757   2HB   CYS  48          2HB       CYS  48   3.454  11.297  -0.737
  758    H    PHE  49           H        PHE  49  -0.154   9.479  -2.498
  759    HA   PHE  49           HA       PHE  49  -0.697   9.563   0.367
  760   1HB   PHE  49          1HB       PHE  49  -3.204   9.799  -0.682
  761   2HB   PHE  49          2HB       PHE  49  -2.240  11.224  -0.277
  762    HD1  PHE  49           HD1      PHE  49  -0.579  11.924  -2.285
  763    HD2  PHE  49           HD2      PHE  49  -4.220   9.790  -2.730
  764    HE1  PHE  49           HE1      PHE  49  -0.737  12.689  -4.671
  765    HE2  PHE  49           HE2      PHE  49  -4.378  10.555  -5.116
  766    HZ   PHE  49           HZ       PHE  49  -2.634  11.995  -6.058
  767    H    LYS  50           H        LYS  50  -3.066   8.188   0.479
  768    HA   LYS  50           HA       LYS  50  -2.489   5.730  -1.025
  769   1HB   LYS  50          1HB       LYS  50  -3.795   5.115   1.425
  770   2HB   LYS  50          2HB       LYS  50  -2.182   4.626   0.877
  771   1HG   LYS  50          1HG       LYS  50  -2.638   7.389   2.013
  772   2HG   LYS  50          2HG       LYS  50  -2.445   6.011   3.110
  773   1HD   LYS  50          1HD       LYS  50  -0.479   7.096   1.065
  774   2HD   LYS  50          2HD       LYS  50  -0.251   6.947   2.817
  775   1HE   LYS  50          1HE       LYS  50  -0.288   4.766   0.708
  776   2HE   LYS  50          2HE       LYS  50   0.994   5.138   1.872
  777   1HZ   LYS  50          1HZ       LYS  50  -0.309   4.277   3.589
  778   2HZ   LYS  50          2HZ       LYS  50  -1.671   4.229   2.687
  779   3HZ   LYS  50          3HZ       LYS  50  -0.450   3.190   2.378
  780    HA   PRO  51           HA       PRO  51  -6.709   7.160  -1.850
  781   1HB   PRO  51          1HB       PRO  51  -6.540   7.252  -4.575
  782   2HB   PRO  51          2HB       PRO  51  -6.298   8.662  -3.546
  783   1HG   PRO  51          1HG       PRO  51  -4.326   6.984  -4.960
  784   2HG   PRO  51          2HG       PRO  51  -4.128   8.659  -4.331
  785   1HD   PRO  51          1HD       PRO  51  -3.117   6.214  -3.235
  786   2HD   PRO  51          2HD       PRO  51  -3.031   7.818  -2.493
  787    H    LEU  52           H        LEU  52  -6.034   5.543  -4.806
  788    HA   LEU  52           HA       LEU  52  -7.649   3.322  -3.799
  789   1HB   LEU  52          1HB       LEU  52  -8.463   3.029  -5.888
  790   2HB   LEU  52          2HB       LEU  52  -8.229   4.786  -5.865
  791    HG   LEU  52           HG       LEU  52  -5.832   3.674  -6.861
  792   1HD1  LEU  52          1HD1      LEU  52  -7.942   1.851  -7.340
  793   2HD1  LEU  52          2HD1      LEU  52  -7.601   2.671  -8.883
  794   3HD1  LEU  52          3HD1      LEU  52  -6.293   1.835  -8.010
  795   1HD2  LEU  52          1HD2      LEU  52  -7.591   5.727  -7.455
  796   2HD2  LEU  52          2HD2      LEU  52  -6.092   5.331  -8.328
  797   3HD2  LEU  52          3HD2      LEU  52  -7.651   4.693  -8.902
  798    H    GLN  53           H        GLN  53  -4.972   3.481  -2.882
  799    HA   GLN  53           HA       GLN  53  -3.087   2.284  -4.404
  800   1HB   GLN  53          1HB       GLN  53  -3.633   1.946  -1.432
  801   2HB   GLN  53          2HB       GLN  53  -2.115   1.478  -2.219
  802   1HG   GLN  53          1HG       GLN  53  -3.318   4.278  -2.141
  803   2HG   GLN  53          2HG       GLN  53  -1.940   3.725  -1.178
  804   1HE2  GLN  53          1HE2      GLN  53  -0.714   2.118  -3.144
  805   2HE2  GLN  53          2HE2      GLN  53  -0.036   3.136  -4.371
  806    H    GLU  54           H        GLU  54  -6.081   0.937  -3.286
  807    HA   GLU  54           HA       GLU  54  -5.618  -1.630  -2.788
  808   1HB   GLU  54          1HB       GLU  54  -7.785  -0.173  -4.244
  809   2HB   GLU  54          2HB       GLU  54  -7.810  -1.942  -4.336
  810   1HG   GLU  54          1HG       GLU  54  -8.562  -2.104  -2.213
  811   2HG   GLU  54          2HG       GLU  54  -7.282  -1.045  -1.604
  812    H    ALA  55           H        ALA  55  -5.007   0.045  -5.819
  813    HA   ALA  55           HA       ALA  55  -5.165  -1.704  -7.786
  814   1HB   ALA  55          1HB       ALA  55  -4.095   0.198  -8.466
  815   2HB   ALA  55          2HB       ALA  55  -3.126   0.313  -6.977
  816   3HB   ALA  55          3HB       ALA  55  -2.648  -0.818  -8.265
  817    H    GLU  56           H        GLU  56  -2.146  -1.637  -5.757
  818    HA   GLU  56           HA       GLU  56  -2.207  -4.535  -5.834
  819   1HB   GLU  56          1HB       GLU  56  -0.347  -2.840  -7.276
  820   2HB   GLU  56          2HB       GLU  56   0.528  -3.824  -6.092
  821   1HG   GLU  56          1HG       GLU  56   0.058  -5.779  -7.188
  822   2HG   GLU  56          2HG       GLU  56  -1.570  -5.260  -7.652
  823    H    CYS  57           H        CYS  57  -2.721  -2.277  -3.835
  824    HA   CYS  57           HA       CYS  57  -0.529  -2.773  -1.982
  825   1HB   CYS  57          1HB       CYS  57  -1.693  -0.450  -2.620
  826   2HB   CYS  57          2HB       CYS  57  -2.743  -0.921  -1.281
  827    H    THR  58           H        THR  58  -4.161  -2.754  -2.206
  828    HA   THR  58           HA       THR  58  -4.479  -4.135   0.264
  829    HB   THR  58           HB       THR  58  -6.095  -2.510  -0.973
  830    HG1  THR  58           HG1      THR  58  -7.798  -3.741   0.041
  831   1HG2  THR  58          1HG2      THR  58  -7.816  -3.975  -2.298
  832   2HG2  THR  58          2HG2      THR  58  -6.355  -3.447  -3.167
  833   3HG2  THR  58          3HG2      THR  58  -6.461  -5.106  -2.531
  834    H    PHE  59           H        PHE  59  -4.016  -5.097  -3.117
  835    HA   PHE  59           HA       PHE  59  -5.031  -7.499  -3.377
  836   1HB   PHE  59          1HB       PHE  59  -2.887  -6.048  -4.405
  837   2HB   PHE  59          2HB       PHE  59  -2.046  -7.444  -3.724
  838    HD1  PHE  59           HD1      PHE  59  -1.354  -8.602  -5.631
  839    HD2  PHE  59           HD2      PHE  59  -5.395  -7.341  -5.333
  840    HE1  PHE  59           HE1      PHE  59  -1.919  -9.926  -7.688
  841    HE2  PHE  59           HE2      PHE  59  -5.960  -8.664  -7.389
  842    HZ   PHE  59           HZ       PHE  59  -4.216  -9.942  -8.542
  Start of MODEL   24
    1   1H    GLU   1           H1       GLU   1 -11.891 -12.005  -6.180
    2    HA   GLU   1           HA       GLU   1 -13.973 -11.570  -6.904
    3   1HB   GLU   1          1HB       GLU   1 -15.755 -13.513  -6.096
    4   2HB   GLU   1          2HB       GLU   1 -15.005 -13.434  -7.700
    5   1HG   GLU   1          1HG       GLU   1 -13.579 -14.804  -5.413
    6   2HG   GLU   1          2HG       GLU   1 -14.861 -15.661  -6.284
    7    H    GLU   2           H        GLU   2 -14.128 -13.656  -3.918
    8    HA   GLU   2           HA       GLU   2 -15.594 -11.533  -2.635
    9   1HB   GLU   2          1HB       GLU   2 -15.938 -14.202  -2.559
   10   2HB   GLU   2          2HB       GLU   2 -14.862 -14.038  -1.160
   11   1HG   GLU   2          1HG       GLU   2 -16.589 -11.991  -0.675
   12   2HG   GLU   2          2HG       GLU   2 -17.673 -13.084  -1.551
   13    H    TYR   3           H        TYR   3 -13.832  -9.967  -2.504
   14    HA   TYR   3           HA       TYR   3 -11.364 -10.049  -1.751
   15   1HB   TYR   3          1HB       TYR   3 -13.439  -8.515  -0.084
   16   2HB   TYR   3          2HB       TYR   3 -11.819  -7.954  -0.509
   17    HD1  TYR   3           HD1      TYR   3 -15.284  -8.340  -1.634
   18    HD2  TYR   3           HD2      TYR   3 -11.347  -7.118  -2.781
   19    HE1  TYR   3           HE1      TYR   3 -16.238  -7.148  -3.667
   20    HE2  TYR   3           HE2      TYR   3 -12.316  -5.930  -4.810
   21    HH   TYR   3           HH       TYR   3 -15.822  -5.810  -5.325
   22    H    VAL   4           H        VAL   4 -10.834 -12.079  -0.706
   23    HA   VAL   4           HA       VAL   4 -11.084 -11.852   2.190
   24    HB   VAL   4           HB       VAL   4 -12.906 -13.285   1.576
   25   1HG1  VAL   4          1HG1      VAL   4 -11.493 -13.962  -0.639
   26   2HG1  VAL   4          2HG1      VAL   4 -11.242 -15.416   0.356
   27   3HG1  VAL   4          3HG1      VAL   4 -12.893 -14.879  -0.035
   28   1HG2  VAL   4          1HG2      VAL   4 -10.556 -14.899   2.628
   29   2HG2  VAL   4          2HG2      VAL   4 -11.677 -13.905   3.590
   30   3HG2  VAL   4          3HG2      VAL   4 -12.271 -15.363   2.758
   31    H    GLY   5           H        GLY   5  -9.658 -13.551  -0.667
   32   1HA   GLY   5          1HA       GLY   5  -7.410 -14.546   0.769
   33   2HA   GLY   5          2HA       GLY   5  -7.624 -14.481  -0.969
   34    H    LEU   6           H        LEU   6  -8.296 -11.372   0.038
   35    HA   LEU   6           HA       LEU   6  -5.478 -10.575   0.033
   36   1HB   LEU   6          1HB       LEU   6  -7.239  -8.759  -1.402
   37   2HB   LEU   6          2HB       LEU   6  -5.623  -9.360  -1.818
   38    HG   LEU   6           HG       LEU   6  -6.753 -11.495  -2.580
   39   1HD1  LEU   6          1HD1      LEU   6  -9.033 -10.214  -1.438
   40   2HD1  LEU   6          2HD1      LEU   6  -9.313 -10.415  -3.184
   41   3HD1  LEU   6          3HD1      LEU   6  -8.906 -11.828  -2.180
   42   1HD2  LEU   6          1HD2      LEU   6  -7.054  -8.830  -3.916
   43   2HD2  LEU   6          2HD2      LEU   6  -6.011 -10.208  -4.336
   44   3HD2  LEU   6          3HD2      LEU   6  -7.757 -10.278  -4.674
   45    H    SER   7           H        SER   7  -7.959 -10.893   1.956
   46    HA   SER   7           HA       SER   7  -7.990  -8.125   2.846
   47   1HB   SER   7          1HB       SER   7  -9.990  -8.693   4.102
   48   2HB   SER   7          2HB       SER   7 -10.192  -9.247   2.430
   49    HG   SER   7           HG       SER   7 -10.625 -10.702   4.526
   50    H    ALA   8           H        ALA   8  -8.628  -8.480   5.562
   51    HA   ALA   8           HA       ALA   8  -6.124  -8.937   6.681
   52   1HB   ALA   8          1HB       ALA   8  -7.553  -8.994   8.845
   53   2HB   ALA   8          2HB       ALA   8  -7.615  -7.523   7.844
   54   3HB   ALA   8          3HB       ALA   8  -8.941  -8.708   7.768
   55    H    ASN   9           H        ASN   9  -5.341 -10.982   5.908
   56    HA   ASN   9           HA       ASN   9  -5.535 -13.032   7.601
   57   1HB   ASN   9          1HB       ASN   9  -7.969 -12.900   6.117
   58   2HB   ASN   9          2HB       ASN   9  -7.076 -14.277   5.454
   59   1HD2  ASN   9          1HD2      ASN   9  -5.840 -15.468   7.370
   60   2HD2  ASN   9          2HD2      ASN   9  -6.859 -15.968   8.678
   61    H    GLN  10           H        GLN  10  -5.371 -11.855   4.249
   62    HA   GLN  10           HA       GLN  10  -4.071 -14.043   3.133
   63   1HB   GLN  10          1HB       GLN  10  -5.174 -12.254   1.831
   64   2HB   GLN  10          2HB       GLN  10  -3.932 -11.099   2.341
   65   1HG   GLN  10          1HG       GLN  10  -2.215 -12.671   1.298
   66   2HG   GLN  10          2HG       GLN  10  -3.566 -13.587   0.614
   67   1HE2  GLN  10          1HE2      GLN  10  -2.932 -10.117   1.107
   68   2HE2  GLN  10          2HE2      GLN  10  -3.139  -9.618  -0.538
   69    H    CYS  11           H        CYS  11  -2.947 -11.241   5.033
   70    HA   CYS  11           HA       CYS  11  -0.249 -11.405   4.395
   71   1HB   CYS  11          1HB       CYS  11  -1.132  -9.474   5.473
   72   2HB   CYS  11          2HB       CYS  11  -1.667 -10.412   6.870
   73    H    ALA  12           H        ALA  12  -2.308 -13.684   5.839
   74    HA   ALA  12           HA       ALA  12  -0.115 -14.856   7.401
   75   1HB   ALA  12          1HB       ALA  12  -2.644 -14.260   8.214
   76   2HB   ALA  12          2HB       ALA  12  -2.885 -15.923   7.627
   77   3HB   ALA  12          3HB       ALA  12  -1.677 -15.592   8.892
   78    H    VAL  13           H        VAL  13  -0.610 -14.851   4.371
   79    HA   VAL  13           HA       VAL  13  -1.629 -17.213   3.464
   80    HB   VAL  13           HB       VAL  13   0.288 -16.912   1.704
   81   1HG1  VAL  13          1HG1      VAL  13  -1.723 -16.314   0.830
   82   2HG1  VAL  13          2HG1      VAL  13  -2.168 -15.325   2.242
   83   3HG1  VAL  13          3HG1      VAL  13  -1.057 -14.673   1.014
   84   1HG2  VAL  13          1HG2      VAL  13   1.467 -15.339   3.458
   85   2HG2  VAL  13          2HG2      VAL  13   1.522 -14.961   1.719
   86   3HG2  VAL  13          3HG2      VAL  13   0.373 -14.109   2.779
   87    HA   PRO  14           HA       PRO  14   1.107 -20.352   4.626
   88   1HB   PRO  14          1HB       PRO  14   1.306 -21.951   2.421
   89   2HB   PRO  14          2HB       PRO  14  -0.079 -21.978   3.508
   90   1HG   PRO  14          1HG       PRO  14   0.208 -20.769   0.831
   91   2HG   PRO  14          2HG       PRO  14  -1.302 -21.213   1.708
   92   1HD   PRO  14          1HD       PRO  14  -0.175 -18.611   1.304
   93   2HD   PRO  14          2HD       PRO  14  -1.575 -19.010   2.308
   94    H    ALA  15           H        ALA  15   2.146 -17.960   2.786
   95    HA   ALA  15           HA       ALA  15   4.251 -17.197   2.600
   96   1HB   ALA  15          1HB       ALA  15   5.620 -19.815   2.962
   97   2HB   ALA  15          2HB       ALA  15   5.987 -18.223   3.670
   98   3HB   ALA  15          3HB       ALA  15   4.688 -19.225   4.360
   99    H    LYS  16           H        LYS  16   2.818 -17.526   0.423
  100    HA   LYS  16           HA       LYS  16   4.570 -17.858  -1.621
  101   1HB   LYS  16          1HB       LYS  16   3.514 -20.151  -2.475
  102   2HB   LYS  16          2HB       LYS  16   5.006 -20.082  -1.519
  103   1HG   LYS  16          1HG       LYS  16   4.025 -21.069   0.280
  104   2HG   LYS  16          2HG       LYS  16   2.528 -20.135   0.110
  105   1HD   LYS  16          1HD       LYS  16   3.304 -22.484  -1.669
  106   2HD   LYS  16          2HD       LYS  16   2.260 -22.634  -0.245
  107   1HE   LYS  16          1HE       LYS  16   0.540 -21.334  -1.239
  108   2HE   LYS  16          2HE       LYS  16   1.624 -20.655  -2.463
  109   1HZ   LYS  16          1HZ       LYS  16   0.940 -23.506  -2.304
  110   2HZ   LYS  16          2HZ       LYS  16   0.128 -22.439  -3.238
  111   3HZ   LYS  16          3HZ       LYS  16   1.707 -22.739  -3.525
  112    H    ASP  17           H        ASP  17   2.550 -16.094  -0.896
  113    HA   ASP  17           HA       ASP  17   0.880 -16.365  -3.215
  114   1HB   ASP  17          1HB       ASP  17  -0.356 -17.401  -1.245
  115   2HB   ASP  17          2HB       ASP  17  -0.337 -15.810  -0.471
  116    H    ARG  18           H        ARG  18   3.061 -14.683  -1.515
  117    HA   ARG  18           HA       ARG  18   1.685 -12.161  -1.455
  118   1HB   ARG  18          1HB       ARG  18   4.612 -12.754  -0.837
  119   2HB   ARG  18          2HB       ARG  18   3.704 -11.312  -0.355
  120   1HG   ARG  18          1HG       ARG  18   2.770 -12.366   1.429
  121   2HG   ARG  18          2HG       ARG  18   2.455 -13.852   0.517
  122   1HD   ARG  18          1HD       ARG  18   4.882 -14.444   0.736
  123   2HD   ARG  18          2HD       ARG  18   5.131 -12.995   1.723
  124    HE   ARG  18           HE       ARG  18   3.194 -15.143   2.522
  125   1HH1  ARG  18          1HH1      ARG  18   5.886 -13.004   3.266
  126   2HH1  ARG  18          2HH1      ARG  18   5.946 -13.451   4.938
  127   1HH2  ARG  18          1HH2      ARG  18   3.272 -15.734   4.728
  128   2HH2  ARG  18          2HH2      ARG  18   4.449 -15.014   5.775
  129    H    VAL  19           H        VAL  19   3.318 -10.223  -2.271
  130    HA   VAL  19           HA       VAL  19   4.115 -11.012  -4.988
  131    HB   VAL  19           HB       VAL  19   3.149  -8.318  -4.013
  132   1HG1  VAL  19          1HG1      VAL  19   2.750  -8.385  -6.717
  133   2HG1  VAL  19          2HG1      VAL  19   4.174  -7.676  -5.918
  134   3HG1  VAL  19          3HG1      VAL  19   4.248  -9.334  -6.560
  135   1HG2  VAL  19          1HG2      VAL  19   1.419  -9.788  -5.876
  136   2HG2  VAL  19          2HG2      VAL  19   1.585 -10.577  -4.289
  137   3HG2  VAL  19          3HG2      VAL  19   1.011  -8.895  -4.391
  138    H    ASP  20           H        ASP  20   5.640 -11.065  -2.346
  139    HA   ASP  20           HA       ASP  20   7.459 -10.209  -1.421
  140   1HB   ASP  20          1HB       ASP  20   8.665 -11.664  -2.737
  141   2HB   ASP  20          2HB       ASP  20   8.042 -10.989  -4.251
  142    H    CYS  21           H        CYS  21   6.895  -7.989  -0.879
  143    HA   CYS  21           HA       CYS  21   6.677  -5.895  -2.594
  144   1HB   CYS  21          1HB       CYS  21   6.498  -6.197   0.066
  145   2HB   CYS  21          2HB       CYS  21   8.035  -5.334  -0.017
  146    H    GLY  22           H        GLY  22   9.578  -7.548  -1.322
  147   1HA   GLY  22          1HA       GLY  22  11.765  -7.357  -1.802
  148   2HA   GLY  22          2HA       GLY  22  11.264  -6.761  -3.373
  149    H    TYR  23           H        TYR  23  11.174  -5.501   0.047
  150    HA   TYR  23           HA       TYR  23  11.891  -2.875  -0.965
  151   1HB   TYR  23          1HB       TYR  23  10.266  -3.963   1.048
  152   2HB   TYR  23          2HB       TYR  23  11.699  -3.490   1.968
  153    HD1  TYR  23           HD1      TYR  23  10.837  -1.688   3.238
  154    HD2  TYR  23           HD2      TYR  23  10.282  -1.741  -1.004
  155    HE1  TYR  23           HE1      TYR  23   9.980   0.705   3.312
  156    HE2  TYR  23           HE2      TYR  23   9.427   0.651  -0.915
  157    HH   TYR  23           HH       TYR  23   8.334   2.108   0.774
  158    HA   PRO  24           HA       PRO  24  16.063  -3.369   0.126
  159   1HB   PRO  24          1HB       PRO  24  16.873  -0.771  -0.112
  160   2HB   PRO  24          2HB       PRO  24  16.730  -1.867  -1.486
  161   1HG   PRO  24          1HG       PRO  24  14.954   0.320  -0.610
  162   2HG   PRO  24          2HG       PRO  24  15.066  -0.453  -2.232
  163   1HD   PRO  24          1HD       PRO  24  13.056  -0.811  -0.224
  164   2HD   PRO  24          2HD       PRO  24  13.208  -1.713  -1.738
  165    H    HIS  25           H        HIS  25  13.766  -1.910   1.985
  166    HA   HIS  25           HA       HIS  25  15.723  -1.689   4.154
  167   1HB   HIS  25          1HB       HIS  25  13.747   0.241   3.168
  168   2HB   HIS  25          2HB       HIS  25  13.655  -0.036   4.911
  169    HD1  HIS  25           HD1      HIS  25  16.326   0.001   6.010
  170    HD2  HIS  25           HD2      HIS  25  15.440   2.271   2.596
  171    HE1  HIS  25           HE1      HIS  25  18.119   1.811   5.870
  172    HE2  HIS  25           HE2      HIS  25  17.553   3.140   3.723
  173    H    VAL  26           H        VAL  26  13.841  -3.878   3.024
  174    HA   VAL  26           HA       VAL  26  11.634  -4.342   4.462
  175    HB   VAL  26           HB       VAL  26  12.221  -5.915   2.870
  176   1HG1  VAL  26          1HG1      VAL  26  14.586  -7.209   3.801
  177   2HG1  VAL  26          2HG1      VAL  26  14.348  -6.271   2.307
  178   3HG1  VAL  26          3HG1      VAL  26  14.893  -5.456   3.794
  179   1HG2  VAL  26          1HG2      VAL  26  11.510  -6.787   5.314
  180   2HG2  VAL  26          2HG2      VAL  26  11.769  -7.877   3.931
  181   3HG2  VAL  26          3HG2      VAL  26  13.056  -7.652   5.140
  182    H    THR  27           H        THR  27  11.069  -4.440   6.575
  183    HA   THR  27           HA       THR  27  12.736  -5.650   8.521
  184    HB   THR  27           HB       THR  27  13.235  -2.864   7.913
  185    HG1  THR  27           HG1      THR  27  14.934  -3.439   9.355
  186   1HG2  THR  27          1HG2      THR  27  12.344  -1.702   9.665
  187   2HG2  THR  27          2HG2      THR  27  11.369  -3.135  10.068
  188   3HG2  THR  27          3HG2      THR  27  12.970  -2.908  10.813
  189    HA   PRO  28           HA       PRO  28   8.892  -5.886  10.410
  190   1HB   PRO  28          1HB       PRO  28   9.585  -6.481  12.985
  191   2HB   PRO  28          2HB       PRO  28   9.552  -7.680  11.694
  192   1HG   PRO  28          1HG       PRO  28  11.841  -6.315  12.959
  193   2HG   PRO  28          2HG       PRO  28  11.830  -7.848  12.015
  194   1HD   PRO  28          1HD       PRO  28  12.727  -5.257  11.190
  195   2HD   PRO  28          2HD       PRO  28  12.587  -6.697  10.174
  196    H    LYS  29           H        LYS  29   9.277  -3.337   9.857
  197    HA   LYS  29           HA       LYS  29   7.727  -2.053  11.724
  198   1HB   LYS  29          1HB       LYS  29   9.554  -2.305  13.298
  199   2HB   LYS  29          2HB       LYS  29  10.678  -1.519  12.176
  200   1HG   LYS  29          1HG       LYS  29   9.983   0.537  12.800
  201   2HG   LYS  29          2HG       LYS  29   8.275   0.105  12.620
  202   1HD   LYS  29          1HD       LYS  29   9.437  -1.215  14.940
  203   2HD   LYS  29          2HD       LYS  29   9.705   0.533  15.034
  204   1HE   LYS  29          1HE       LYS  29   7.216   0.806  14.497
  205   2HE   LYS  29          2HE       LYS  29   7.050  -0.938  14.740
  206   1HZ   LYS  29          1HZ       LYS  29   8.324  -0.269  16.925
  207   2HZ   LYS  29          2HZ       LYS  29   7.555   1.148  16.662
  208   3HZ   LYS  29          3HZ       LYS  29   6.694  -0.230  16.822
  209    H    GLU  30           H        GLU  30  10.074  -2.139   9.121
  210    HA   GLU  30           HA       GLU  30   9.365   0.548   8.334
  211   1HB   GLU  30          1HB       GLU  30  11.607  -1.261   7.888
  212   2HB   GLU  30          2HB       GLU  30  11.026  -0.587   6.354
  213   1HG   GLU  30          1HG       GLU  30  12.311   1.206   6.888
  214   2HG   GLU  30          2HG       GLU  30  11.013   1.636   8.011
  215    H    CYS  31           H        CYS  31   9.079  -2.878   7.255
  216    HA   CYS  31           HA       CYS  31   7.912  -2.352   4.793
  217   1HB   CYS  31          1HB       CYS  31   7.814  -4.708   6.657
  218   2HB   CYS  31          2HB       CYS  31   6.931  -4.703   5.127
  219    H    ASN  32           H        ASN  32   6.417  -3.231   7.999
  220    HA   ASN  32           HA       ASN  32   3.816  -2.859   7.119
  221   1HB   ASN  32          1HB       ASN  32   5.236  -3.259   9.688
  222   2HB   ASN  32          2HB       ASN  32   3.741  -2.328   9.865
  223   1HD2  ASN  32          1HD2      ASN  32   4.970  -5.132   8.036
  224   2HD2  ASN  32          2HD2      ASN  32   3.622  -6.183   8.314
  225    H    ASN  33           H        ASN  33   6.307  -0.623   7.410
  226    HA   ASN  33           HA       ASN  33   4.546   1.495   8.331
  227   1HB   ASN  33          1HB       ASN  33   6.640   1.498   9.519
  228   2HB   ASN  33          2HB       ASN  33   7.577   1.273   8.035
  229   1HD2  ASN  33          1HD2      ASN  33   8.662   3.003   7.529
  230   2HD2  ASN  33          2HD2      ASN  33   8.145   4.651   7.662
  231    H    ARG  34           H        ARG  34   6.370   0.150   5.600
  232    HA   ARG  34           HA       ARG  34   6.141   2.549   4.068
  233   1HB   ARG  34          1HB       ARG  34   7.494   1.471   2.474
  234   2HB   ARG  34          2HB       ARG  34   8.032   0.710   3.981
  235   1HG   ARG  34          1HG       ARG  34   7.707  -1.140   2.593
  236   2HG   ARG  34          2HG       ARG  34   6.147  -1.061   3.430
  237   1HD   ARG  34          1HD       ARG  34   5.185  -0.991   1.385
  238   2HD   ARG  34          2HD       ARG  34   5.837   0.644   1.207
  239    HE   ARG  34           HE       ARG  34   7.918  -1.144   0.532
  240   1HH1  ARG  34          1HH1      ARG  34   4.717  -0.315  -0.670
  241   2HH1  ARG  34          2HH1      ARG  34   5.086  -0.729  -2.311
  242   1HH2  ARG  34          1HH2      ARG  34   8.406  -1.690  -1.633
  243   2HH2  ARG  34          2HH2      ARG  34   7.198  -1.517  -2.863
  244    H    GLY  35           H        GLY  35   4.454  -0.538   4.540
  245   1HA   GLY  35          1HA       GLY  35   2.049  -0.314   3.904
  246   2HA   GLY  35          2HA       GLY  35   2.627   0.128   2.310
  247    H    CYS  36           H        CYS  36   4.489  -2.228   4.170
  248    HA   CYS  36           HA       CYS  36   3.377  -4.328   2.452
  249   1HB   CYS  36          1HB       CYS  36   6.217  -4.039   3.440
  250   2HB   CYS  36          2HB       CYS  36   5.589  -5.391   2.495
  251    H    CYS  37           H        CYS  37   4.178  -6.605   3.588
  252    HA   CYS  37           HA       CYS  37   3.488  -6.316   6.423
  253   1HB   CYS  37          1HB       CYS  37   1.752  -7.336   4.808
  254   2HB   CYS  37          2HB       CYS  37   2.803  -8.756   4.806
  255    H    PHE  38           H        PHE  38   4.971  -7.237   7.834
  256    HA   PHE  38           HA       PHE  38   7.335  -8.373   6.670
  257   1HB   PHE  38          1HB       PHE  38   7.079  -6.729   8.670
  258   2HB   PHE  38          2HB       PHE  38   6.458  -8.095   9.602
  259    HD1  PHE  38           HD1      PHE  38   7.937  -9.707  10.525
  260    HD2  PHE  38           HD2      PHE  38   9.428  -6.757   7.865
  261    HE1  PHE  38           HE1      PHE  38  10.286 -10.340  11.141
  262    HE2  PHE  38           HE2      PHE  38  11.778  -7.390   8.480
  263    HZ   PHE  38           HZ       PHE  38  12.180  -9.174  10.110
  264    H    ASP  39           H        ASP  39   7.862 -10.515   6.519
  265    HA   ASP  39           HA       ASP  39   5.919 -12.423   6.973
  266   1HB   ASP  39          1HB       ASP  39   7.611 -12.900   5.371
  267   2HB   ASP  39          2HB       ASP  39   8.919 -12.535   6.506
  268    H    SER  40           H        SER  40   9.106 -13.241   8.283
  269    HA   SER  40           HA       SER  40   9.867 -13.383  10.367
  270   1HB   SER  40          1HB       SER  40   7.955 -11.648  10.957
  271   2HB   SER  40          2HB       SER  40   7.152 -13.068  11.649
  272    HG   SER  40           HG       SER  40   8.724 -11.635  13.000
  273    H    ARG  41           H        ARG  41   7.409 -15.056   8.755
  274    HA   ARG  41           HA       ARG  41   7.206 -17.137  10.725
  275   1HB   ARG  41          1HB       ARG  41   6.075 -17.120   7.896
  276   2HB   ARG  41          2HB       ARG  41   5.520 -18.105   9.261
  277   1HG   ARG  41          1HG       ARG  41   5.405 -15.406  10.131
  278   2HG   ARG  41          2HG       ARG  41   4.737 -15.406   8.490
  279   1HD   ARG  41          1HD       ARG  41   2.922 -15.810  10.044
  280   2HD   ARG  41          2HD       ARG  41   3.235 -17.332   9.194
  281    HE   ARG  41           HE       ARG  41   4.828 -17.288  11.555
  282   1HH1  ARG  41          1HH1      ARG  41   1.432 -17.431  10.645
  283   2HH1  ARG  41          2HH1      ARG  41   0.955 -18.295  12.069
  284   1HH2  ARG  41          1HH2      ARG  41   4.200 -18.427  13.434
  285   2HH2  ARG  41          2HH2      ARG  41   2.540 -18.865  13.666
  286    H    ILE  42           H        ILE  42   8.064 -16.888   7.186
  287    HA   ILE  42           HA       ILE  42   9.968 -19.081   7.643
  288    HB   ILE  42           HB       ILE  42   8.738 -18.630   4.966
  289   1HG1  ILE  42          1HG1      ILE  42   7.345 -19.923   7.311
  290   2HG1  ILE  42          2HG1      ILE  42   6.755 -18.604   6.283
  291   1HG2  ILE  42          1HG2      ILE  42  10.552 -20.222   5.174
  292   2HG2  ILE  42          2HG2      ILE  42   9.693 -21.077   6.477
  293   3HG2  ILE  42          3HG2      ILE  42   9.029 -21.077   4.826
  294   1HD1  ILE  42          1HD1      ILE  42   7.100 -21.543   5.594
  295   2HD1  ILE  42          2HD1      ILE  42   5.629 -20.548   5.492
  296   3HD1  ILE  42          3HD1      ILE  42   6.952 -20.302   4.327
  297    HA   PRO  43           HA       PRO  43  12.817 -16.104   6.287
  298   1HB   PRO  43          1HB       PRO  43  15.047 -17.681   6.272
  299   2HB   PRO  43          2HB       PRO  43  14.432 -16.896   7.725
  300   1HG   PRO  43          1HG       PRO  43  14.243 -19.711   6.864
  301   2HG   PRO  43          2HG       PRO  43  14.051 -19.028   8.518
  302   1HD   PRO  43          1HD       PRO  43  12.018 -19.961   6.731
  303   2HD   PRO  43          2HD       PRO  43  11.767 -19.150   8.283
  304    H    GLY  44           H        GLY  44  11.821 -18.802   4.580
  305   1HA   GLY  44          1HA       GLY  44  13.485 -18.191   2.261
  306   2HA   GLY  44          2HA       GLY  44  12.374 -19.532   2.457
  307    H    VAL  45           H        VAL  45  10.582 -17.052   3.660
  308    HA   VAL  45           HA       VAL  45   9.387 -16.541   1.036
  309    HB   VAL  45           HB       VAL  45   8.328 -17.449   3.427
  310   1HG1  VAL  45          1HG1      VAL  45   7.662 -14.511   3.069
  311   2HG1  VAL  45          2HG1      VAL  45   6.704 -15.639   4.057
  312   3HG1  VAL  45          3HG1      VAL  45   8.396 -15.294   4.488
  313   1HG2  VAL  45          1HG2      VAL  45   7.453 -16.785   0.756
  314   2HG2  VAL  45          2HG2      VAL  45   6.831 -18.021   1.876
  315   3HG2  VAL  45          3HG2      VAL  45   6.190 -16.362   1.937
  316    HA   PRO  46           HA       PRO  46  10.210 -12.308   1.344
  317   1HB   PRO  46          1HB       PRO  46   7.920 -11.071   0.513
  318   2HB   PRO  46          2HB       PRO  46   9.079 -11.803  -0.597
  319   1HG   PRO  46          1HG       PRO  46   6.452 -12.784   0.324
  320   2HG   PRO  46          2HG       PRO  46   7.386 -13.274  -1.135
  321   1HD   PRO  46          1HD       PRO  46   7.048 -14.701   1.326
  322   2HD   PRO  46          2HD       PRO  46   8.107 -15.150  -0.018
  323    H    TRP  47           H        TRP  47  10.750 -11.299   3.166
  324    HA   TRP  47           HA       TRP  47   8.729 -11.213   5.229
  325   1HB   TRP  47          1HB       TRP  47  11.251  -9.801   5.687
  326   2HB   TRP  47          2HB       TRP  47  10.422 -11.010   6.669
  327    HD1  TRP  47           HD1      TRP  47  10.930 -13.668   5.924
  328    HE1  TRP  47           HE1      TRP  47  13.055 -14.842   4.888
  329    HE3  TRP  47           HE3      TRP  47  13.092  -9.404   4.192
  330    HZ2  TRP  47           HZ2      TRP  47  15.350 -13.877   3.493
  331    HZ3  TRP  47           HZ3      TRP  47  15.274  -9.607   3.004
  332    HH2  TRP  47           HH2      TRP  47  16.400 -11.747   2.645
  333    H    CYS  48           H        CYS  48   8.278  -9.766   2.666
  334    HA   CYS  48           HA       CYS  48   7.439  -7.327   3.769
  335   1HB   CYS  48          1HB       CYS  48   9.976  -7.005   3.405
  336   2HB   CYS  48          2HB       CYS  48   9.570  -6.913   1.689
  337    H    PHE  49           H        PHE  49   5.432  -7.857   2.834
  338    HA   PHE  49           HA       PHE  49   5.403  -7.772  -0.087
  339   1HB   PHE  49          1HB       PHE  49   3.390  -9.526   0.436
  340   2HB   PHE  49          2HB       PHE  49   5.047 -10.090   0.189
  341    HD1  PHE  49           HD1      PHE  49   6.489 -10.004   2.473
  342    HD2  PHE  49           HD2      PHE  49   2.270 -10.388   2.232
  343    HE1  PHE  49           HE1      PHE  49   6.453 -11.056   4.752
  344    HE2  PHE  49           HE2      PHE  49   2.234 -11.439   4.511
  345    HZ   PHE  49           HZ       PHE  49   4.326 -11.761   5.743
  346    H    LYS  50           H        LYS  50   2.732  -7.923  -0.605
  347    HA   LYS  50           HA       LYS  50   1.566  -5.860   1.132
  348   1HB   LYS  50          1HB       LYS  50   0.495  -4.957  -0.938
  349   2HB   LYS  50          2HB       LYS  50   2.251  -4.732  -0.850
  350   1HG   LYS  50          1HG       LYS  50   1.690  -7.272  -2.096
  351   2HG   LYS  50          2HG       LYS  50   0.719  -6.029  -2.902
  352   1HD   LYS  50          1HD       LYS  50   3.735  -6.077  -2.498
  353   2HD   LYS  50          2HD       LYS  50   2.863  -6.163  -4.039
  354   1HE   LYS  50          1HE       LYS  50   1.973  -3.800  -2.708
  355   2HE   LYS  50          2HE       LYS  50   3.738  -3.825  -2.559
  356   1HZ   LYS  50          1HZ       LYS  50   2.288  -4.215  -5.083
  357   2HZ   LYS  50          2HZ       LYS  50   2.906  -2.783  -4.597
  358   3HZ   LYS  50          3HZ       LYS  50   3.902  -4.042  -4.901
  359    HA   PRO  51           HA       PRO  51  -1.137  -9.486   0.906
  360   1HB   PRO  51          1HB       PRO  51  -1.387  -9.919   3.592
  361   2HB   PRO  51          2HB       PRO  51  -0.216 -10.766   2.584
  362   1HG   PRO  51          1HG       PRO  51   0.170  -8.539   4.480
  363   2HG   PRO  51          2HG       PRO  51   1.395  -9.692   3.839
  364   1HD   PRO  51          1HD       PRO  51   0.974  -6.956   3.110
  365   2HD   PRO  51          2HD       PRO  51   2.085  -8.095   2.338
  366    H    LEU  52           H        LEU  52  -2.093  -8.428   4.000
  367    HA   LEU  52           HA       LEU  52  -4.493  -7.336   2.766
  368   1HB   LEU  52          1HB       LEU  52  -5.593  -7.810   4.699
  369   2HB   LEU  52          2HB       LEU  52  -4.410  -9.127   4.618
  370    HG   LEU  52           HG       LEU  52  -3.154  -7.112   6.101
  371   1HD1  LEU  52          1HD1      LEU  52  -4.753  -5.808   6.940
  372   2HD1  LEU  52          2HD1      LEU  52  -6.049  -6.882   6.361
  373   3HD1  LEU  52          3HD1      LEU  52  -5.246  -7.213   7.915
  374   1HD2  LEU  52          1HD2      LEU  52  -2.749  -8.839   7.451
  375   2HD2  LEU  52          2HD2      LEU  52  -4.482  -9.137   7.732
  376   3HD2  LEU  52          3HD2      LEU  52  -3.682  -9.819   6.295
  377    H    GLN  53           H        GLN  53  -1.988  -5.867   2.514
  378    HA   GLN  53           HA       GLN  53  -1.598  -3.973   4.419
  379   1HB   GLN  53          1HB       GLN  53  -1.387  -3.726   1.394
  380   2HB   GLN  53          2HB       GLN  53  -0.686  -2.564   2.535
  381   1HG   GLN  53          1HG       GLN  53  -0.021  -5.530   2.305
  382   2HG   GLN  53          2HG       GLN  53   1.022  -4.187   1.807
  383   1HE2  GLN  53          1HE2      GLN  53  -0.184  -6.132   4.379
  384   2HE2  GLN  53          2HE2      GLN  53   0.760  -5.481   5.677
  385    H    GLU  54           H        GLU  54  -4.335  -4.409   2.297
  386    HA   GLU  54           HA       GLU  54  -5.277  -1.982   1.793
  387   1HB   GLU  54          1HB       GLU  54  -7.374  -2.956   1.573
  388   2HB   GLU  54          2HB       GLU  54  -6.333  -4.389   1.529
  389   1HG   GLU  54          1HG       GLU  54  -7.958  -5.027   3.078
  390   2HG   GLU  54          2HG       GLU  54  -6.702  -4.387   4.149
  391    H    ALA  55           H        ALA  55  -4.821  -3.416   4.980
  392    HA   ALA  55           HA       ALA  55  -6.549  -2.231   6.617
  393   1HB   ALA  55          1HB       ALA  55  -5.055  -2.846   8.201
  394   2HB   ALA  55          2HB       ALA  55  -4.068  -3.441   6.844
  395   3HB   ALA  55          3HB       ALA  55  -3.774  -1.818   7.515
  396    H    GLU  56           H        GLU  56  -3.392  -0.567   5.935
  397    HA   GLU  56           HA       GLU  56  -4.932   1.905   5.829
  398   1HB   GLU  56          1HB       GLU  56  -2.458   1.247   7.422
  399   2HB   GLU  56          2HB       GLU  56  -2.732   2.915   6.890
  400   1HG   GLU  56          1HG       GLU  56  -5.181   2.390   7.895
  401   2HG   GLU  56          2HG       GLU  56  -4.250   1.250   8.880
  402    H    CYS  57           H        CYS  57  -3.866   0.026   3.720
  403    HA   CYS  57           HA       CYS  57  -1.803   1.722   2.548
  404   1HB   CYS  57          1HB       CYS  57  -1.574  -0.828   2.833
  405   2HB   CYS  57          2HB       CYS  57  -2.681  -0.942   1.463
  406    H    THR  58           H        THR  58  -4.752  -0.185   1.559
  407    HA   THR  58           HA       THR  58  -5.157   1.385  -0.773
  408    HB   THR  58           HB       THR  58  -5.837  -1.060  -0.325
  409    HG1  THR  58           HG1      THR  58  -6.734   0.684  -1.924
  410   1HG2  THR  58          1HG2      THR  58  -8.279  -1.140   0.572
  411   2HG2  THR  58          2HG2      THR  58  -6.991  -0.992   1.790
  412   3HG2  THR  58          3HG2      THR  58  -7.931   0.442   1.312
  413    H    PHE  59           H        PHE  59  -6.333   1.541   2.594
  414    HA   PHE  59           HA       PHE  59  -8.507   3.049   2.469
  415   1HB   PHE  59          1HB       PHE  59  -6.641   2.371   4.347
  416   2HB   PHE  59          2HB       PHE  59  -6.213   4.077   4.167
  417    HD1  PHE  59           HD1      PHE  59  -7.380   5.680   5.380
  418    HD2  PHE  59           HD2      PHE  59  -9.115   1.845   4.850
  419    HE1  PHE  59           HE1      PHE  59  -9.227   6.296   6.964
  420    HE2  PHE  59           HE2      PHE  59 -10.961   2.460   6.434
  421    HZ   PHE  59           HZ       PHE  59 -10.995   4.680   7.472
  422   1H    GLU   1           H1       GLU   1 -22.755   5.523  -1.071
  423    HA   GLU   1           HA       GLU   1 -21.918   3.807  -2.211
  424   1HB   GLU   1          1HB       GLU   1 -19.946   4.515  -3.541
  425   2HB   GLU   1          2HB       GLU   1 -21.142   5.816  -3.391
  426   1HG   GLU   1          1HG       GLU   1 -19.256   5.904  -1.178
  427   2HG   GLU   1          2HG       GLU   1 -18.379   5.903  -2.716
  428    H    GLU   2           H        GLU   2 -20.246   2.091  -2.502
  429    HA   GLU   2           HA       GLU   2 -19.026   1.559   0.052
  430   1HB   GLU   2          1HB       GLU   2 -20.444  -0.101  -1.319
  431   2HB   GLU   2          2HB       GLU   2 -19.027  -0.278  -2.369
  432   1HG   GLU   2          1HG       GLU   2 -17.729  -0.727  -0.150
  433   2HG   GLU   2          2HG       GLU   2 -19.324  -0.990   0.569
  434    H    TYR   3           H        TYR   3 -17.218  -0.299  -1.930
  435    HA   TYR   3           HA       TYR   3 -14.899   1.265  -1.601
  436   1HB   TYR   3          1HB       TYR   3 -14.095  -0.632  -3.258
  437   2HB   TYR   3          2HB       TYR   3 -14.726  -1.150  -1.691
  438    HD1  TYR   3           HD1      TYR   3 -17.124   0.109  -4.125
  439    HD2  TYR   3           HD2      TYR   3 -15.114  -3.396  -2.717
  440    HE1  TYR   3           HE1      TYR   3 -18.831  -1.355  -5.311
  441    HE2  TYR   3           HE2      TYR   3 -16.828  -4.848  -3.907
  442    HH   TYR   3           HH       TYR   3 -19.542  -4.180  -4.656
  443    H    VAL   4           H        VAL   4 -16.002   3.261  -2.700
  444    HA   VAL   4           HA       VAL   4 -15.281   3.150  -5.547
  445    HB   VAL   4           HB       VAL   4 -17.599   4.557  -4.212
  446   1HG1  VAL   4          1HG1      VAL   4 -16.129   5.576  -6.310
  447   2HG1  VAL   4          2HG1      VAL   4 -17.431   4.693  -7.143
  448   3HG1  VAL   4          3HG1      VAL   4 -17.831   5.957  -5.956
  449   1HG2  VAL   4          1HG2      VAL   4 -18.531   3.113  -6.391
  450   2HG2  VAL   4          2HG2      VAL   4 -17.294   2.047  -5.684
  451   3HG2  VAL   4          3HG2      VAL   4 -18.644   2.630  -4.682
  452    H    GLY   5           H        GLY   5 -15.830   5.303  -2.673
  453   1HA   GLY   5          1HA       GLY   5 -14.239   7.420  -3.716
  454   2HA   GLY   5          2HA       GLY   5 -14.833   7.237  -2.077
  455    H    LEU   6           H        LEU   6 -13.312   4.330  -2.826
  456    HA   LEU   6           HA       LEU   6 -10.680   5.323  -2.007
  457   1HB   LEU   6          1HB       LEU   6 -10.495   3.388  -0.488
  458   2HB   LEU   6          2HB       LEU   6 -11.670   4.613   0.021
  459    HG   LEU   6           HG       LEU   6 -12.377   2.256   0.410
  460   1HD1  LEU   6          1HD1      LEU   6 -14.553   2.799   0.163
  461   2HD1  LEU   6          2HD1      LEU   6 -13.882   4.387  -0.278
  462   3HD1  LEU   6          3HD1      LEU   6 -14.367   3.243  -1.550
  463   1HD2  LEU   6          1HD2      LEU   6 -11.298   1.472  -1.795
  464   2HD2  LEU   6          2HD2      LEU   6 -12.844   0.742  -1.300
  465   3HD2  LEU   6          3HD2      LEU   6 -12.816   2.000  -2.559
  466    H    SER   7           H        SER   7 -12.340   4.124  -4.469
  467    HA   SER   7           HA       SER   7 -10.431   1.999  -5.023
  468   1HB   SER   7          1HB       SER   7 -12.871   1.453  -5.149
  469   2HB   SER   7          2HB       SER   7 -13.049   2.642  -6.451
  470    HG   SER   7           HG       SER   7 -12.303   0.050  -6.628
  471    H    ALA   8           H        ALA   8 -10.752   2.034  -7.900
  472    HA   ALA   8           HA       ALA   8  -8.821   3.912  -8.593
  473   1HB   ALA   8          1HB       ALA   8  -9.111   1.900  -9.876
  474   2HB   ALA   8          2HB       ALA   8 -10.816   2.288 -10.214
  475   3HB   ALA   8          3HB       ALA   8  -9.519   3.263 -10.947
  476    H    ASN   9           H        ASN   9  -9.566   5.952  -7.700
  477    HA   ASN   9           HA       ASN   9 -10.628   7.630  -9.521
  478   1HB   ASN   9          1HB       ASN   9 -12.716   6.037  -8.545
  479   2HB   ASN   9          2HB       ASN   9 -12.858   7.509  -7.574
  480   1HD2  ASN   9          1HD2      ASN   9 -12.240   9.524  -9.102
  481   2HD2  ASN   9          2HD2      ASN   9 -13.223   9.649 -10.522
  482    H    GLN  10           H        GLN  10 -10.345   6.580  -6.121
  483    HA   GLN  10           HA       GLN  10 -10.645   9.090  -4.950
  484   1HB   GLN  10          1HB       GLN  10 -10.810   6.909  -3.759
  485   2HB   GLN  10          2HB       GLN  10  -9.058   6.691  -3.933
  486   1HG   GLN  10          1HG       GLN  10  -8.671   8.754  -2.630
  487   2HG   GLN  10          2HG       GLN  10 -10.415   9.019  -2.491
  488   1HE2  GLN  10          1HE2      GLN  10  -8.185   6.257  -2.148
  489   2HE2  GLN  10          2HE2      GLN  10  -8.722   5.735  -0.586
  490    H    CYS  11           H        CYS  11  -7.960   7.477  -6.598
  491    HA   CYS  11           HA       CYS  11  -5.905   9.051  -5.502
  492   1HB   CYS  11          1HB       CYS  11  -5.426   6.937  -6.523
  493   2HB   CYS  11          2HB       CYS  11  -6.078   7.474  -8.075
  494    H    ALA  12           H        ALA  12  -8.595   9.881  -7.340
  495    HA   ALA  12           HA       ALA  12  -7.154  12.064  -8.684
  496   1HB   ALA  12          1HB       ALA  12  -9.850  11.727  -9.632
  497   2HB   ALA  12          2HB       ALA  12  -8.322  11.514 -10.520
  498   3HB   ALA  12          3HB       ALA  12  -9.039  10.143  -9.640
  499    H    VAL  13           H        VAL  13  -8.475  11.503  -5.818
  500    HA   VAL  13           HA       VAL  13 -10.662  12.990  -5.377
  501    HB   VAL  13           HB       VAL  13  -8.511  11.954  -3.891
  502   1HG1  VAL  13          1HG1      VAL  13  -8.291  13.716  -2.109
  503   2HG1  VAL  13          2HG1      VAL  13  -7.496  14.115  -3.650
  504   3HG1  VAL  13          3HG1      VAL  13  -9.056  14.865  -3.232
  505   1HG2  VAL  13          1HG2      VAL  13 -11.214  12.069  -3.696
  506   2HG2  VAL  13          2HG2      VAL  13 -10.143  11.535  -2.378
  507   3HG2  VAL  13          3HG2      VAL  13 -10.752  13.208  -2.409
  508    HA   PRO  14           HA       PRO  14  -9.791  17.130  -6.253
  509   1HB   PRO  14          1HB       PRO  14 -11.200  18.498  -4.354
  510   2HB   PRO  14          2HB       PRO  14 -11.946  17.795  -5.788
  511   1HG   PRO  14          1HG       PRO  14 -11.953  16.853  -2.991
  512   2HG   PRO  14          2HG       PRO  14 -13.083  16.421  -4.325
  513   1HD   PRO  14          1HD       PRO  14 -10.954  14.858  -3.219
  514   2HD   PRO  14          2HD       PRO  14 -11.934  14.455  -4.635
  515    H    ALA  15           H        ALA  15  -7.843  15.730  -4.585
  516    HA   ALA  15           HA       ALA  15  -6.083  16.185  -3.315
  517   1HB   ALA  15          1HB       ALA  15  -6.179  19.067  -4.181
  518   2HB   ALA  15          2HB       ALA  15  -4.788  17.962  -4.068
  519   3HB   ALA  15          3HB       ALA  15  -5.947  17.799  -5.408
  520    H    LYS  16           H        LYS  16  -7.693  15.851  -1.472
  521    HA   LYS  16           HA       LYS  16  -7.172  17.418   0.626
  522   1HB   LYS  16          1HB       LYS  16  -9.428  18.743   0.752
  523   2HB   LYS  16          2HB       LYS  16  -8.021  19.429  -0.080
  524   1HG   LYS  16          1HG       LYS  16  -9.116  19.445  -2.053
  525   2HG   LYS  16          2HG       LYS  16  -9.597  17.747  -1.884
  526   1HD   LYS  16          1HD       LYS  16 -10.986  19.985  -0.372
  527   2HD   LYS  16          2HD       LYS  16 -11.484  19.525  -2.009
  528   1HE   LYS  16          1HE       LYS  16 -12.793  17.963  -1.030
  529   2HE   LYS  16          2HE       LYS  16 -11.310  17.078  -0.642
  530   1HZ   LYS  16          1HZ       LYS  16 -12.857  17.677   1.233
  531   2HZ   LYS  16          2HZ       LYS  16 -11.276  18.016   1.459
  532   3HZ   LYS  16          3HZ       LYS  16 -12.323  19.213   1.083
  533    H    ASP  17           H        ASP  17  -7.610  14.721   0.008
  534    HA   ASP  17           HA       ASP  17  -9.560  14.150   1.999
  535   1HB   ASP  17          1HB       ASP  17 -10.808  14.277  -0.249
  536   2HB   ASP  17          2HB       ASP  17  -9.889  12.844  -0.735
  537    H    ARG  18           H        ARG  18  -6.594  13.836   0.777
  538    HA   ARG  18           HA       ARG  18  -6.407  10.970   0.829
  539   1HB   ARG  18          1HB       ARG  18  -4.182  13.032   0.522
  540   2HB   ARG  18          2HB       ARG  18  -4.085  11.312   0.106
  541   1HG   ARG  18          1HG       ARG  18  -5.173  11.608  -1.877
  542   2HG   ARG  18          2HG       ARG  18  -6.308  12.794  -1.206
  543   1HD   ARG  18          1HD       ARG  18  -4.643  14.560  -1.368
  544   2HD   ARG  18          2HD       ARG  18  -3.378  13.404  -1.813
  545    HE   ARG  18           HE       ARG  18  -5.725  13.468  -3.599
  546   1HH1  ARG  18          1HH1      ARG  18  -2.478  14.673  -2.975
  547   2HH1  ARG  18          2HH1      ARG  18  -2.198  15.145  -4.617
  548   1HH2  ARG  18          1HH2      ARG  18  -5.357  14.092  -5.767
  549   2HH2  ARG  18          2HH2      ARG  18  -3.848  14.813  -6.217
  550    H    VAL  19           H        VAL  19  -4.109  10.281   2.040
  551    HA   VAL  19           HA       VAL  19  -4.417  11.334   4.763
  552    HB   VAL  19           HB       VAL  19  -3.188   8.697   3.992
  553   1HG1  VAL  19          1HG1      VAL  19  -3.212   8.201   6.208
  554   2HG1  VAL  19          2HG1      VAL  19  -3.191   9.973   6.372
  555   3HG1  VAL  19          3HG1      VAL  19  -4.728   9.085   6.504
  556   1HG2  VAL  19          1HG2      VAL  19  -6.107   9.410   4.240
  557   2HG2  VAL  19          2HG2      VAL  19  -5.288   8.412   3.015
  558   3HG2  VAL  19          3HG2      VAL  19  -5.528   7.781   4.662
  559    H    ASP  20           H        ASP  20  -2.763  12.298   2.311
  560    HA   ASP  20           HA       ASP  20  -0.670  12.776   1.795
  561   1HB   ASP  20          1HB       ASP  20  -0.933  14.688   3.063
  562   2HB   ASP  20          2HB       ASP  20  -1.246  13.791   4.558
  563    H    CYS  21           H        CYS  21   0.267  10.601   1.535
  564    HA   CYS  21           HA       CYS  21   1.094   8.935   3.508
  565   1HB   CYS  21          1HB       CYS  21   1.181   8.861   0.848
  566   2HB   CYS  21          2HB       CYS  21   2.884   9.215   1.147
  567    H    GLY  22           H        GLY  22   2.630  11.903   2.201
  568   1HA   GLY  22          1HA       GLY  22   4.402  13.111   2.873
  569   2HA   GLY  22          2HA       GLY  22   4.034  12.544   4.489
  570    H    TYR  23           H        TYR  23   5.412  11.134   1.424
  571    HA   TYR  23           HA       TYR  23   7.257   9.577   3.046
  572   1HB   TYR  23          1HB       TYR  23   5.915   9.551   0.423
  573   2HB   TYR  23          2HB       TYR  23   7.653   9.320   0.202
  574    HD1  TYR  23           HD1      TYR  23   8.781   7.400   1.445
  575    HD2  TYR  23           HD2      TYR  23   4.531   7.791   1.155
  576    HE1  TYR  23           HE1      TYR  23   8.507   4.942   2.037
  577    HE2  TYR  23           HE2      TYR  23   4.272   5.332   1.748
  578    HH   TYR  23           HH       TYR  23   5.290   3.546   2.492
  579    HA   PRO  24           HA       PRO  24  10.528  12.323   2.289
  580   1HB   PRO  24          1HB       PRO  24  12.610  10.750   3.093
  581   2HB   PRO  24          2HB       PRO  24  11.608  11.668   4.215
  582   1HG   PRO  24          1HG       PRO  24  11.605   8.785   3.593
  583   2HG   PRO  24          2HG       PRO  24  10.942   9.621   5.043
  584   1HD   PRO  24          1HD       PRO  24   9.518   8.527   2.813
  585   2HD   PRO  24          2HD       PRO  24   8.834   9.480   4.137
  586    H    HIS  25           H        HIS  25   9.829   9.688   0.480
  587    HA   HIS  25           HA       HIS  25  11.960  10.440  -1.383
  588   1HB   HIS  25          1HB       HIS  25  12.028   8.111  -0.120
  589   2HB   HIS  25          2HB       HIS  25  10.882   7.649  -1.385
  590    HD1  HIS  25           HD1      HIS  25  14.240   7.186  -0.774
  591    HD2  HIS  25           HD2      HIS  25  12.222   8.901  -4.026
  592    HE1  HIS  25           HE1      HIS  25  15.842   7.060  -2.756
  593    HE2  HIS  25           HE2      HIS  25  14.526   8.079  -4.738
  594    H    VAL  26           H        VAL  26   8.917  11.064  -0.813
  595    HA   VAL  26           HA       VAL  26   7.222  10.045  -2.602
  596    HB   VAL  26           HB       VAL  26   6.465  11.713  -1.160
  597   1HG1  VAL  26          1HG1      VAL  26   7.717  13.435  -0.494
  598   2HG1  VAL  26          2HG1      VAL  26   8.958  12.951  -1.675
  599   3HG1  VAL  26          3HG1      VAL  26   7.704  14.128  -2.134
  600   1HG2  VAL  26          1HG2      VAL  26   5.194  13.126  -2.534
  601   2HG2  VAL  26          2HG2      VAL  26   6.481  13.256  -3.756
  602   3HG2  VAL  26          3HG2      VAL  26   5.569  11.737  -3.583
  603    H    THR  27           H        THR  27   7.072   9.776  -4.777
  604    HA   THR  27           HA       THR  27   8.066  11.666  -6.621
  605    HB   THR  27           HB       THR  27   9.982   9.758  -5.564
  606    HG1  THR  27           HG1      THR  27  11.245  11.107  -7.130
  607   1HG2  THR  27          1HG2      THR  27  10.800   9.209  -8.022
  608   2HG2  THR  27          2HG2      THR  27   9.594   8.140  -7.263
  609   3HG2  THR  27          3HG2      THR  27   9.078   9.371  -8.441
  610    HA   PRO  28           HA       PRO  28   5.315   9.451  -9.055
  611   1HB   PRO  28          1HB       PRO  28   6.054  10.214 -11.572
  612   2HB   PRO  28          2HB       PRO  28   5.065  11.217 -10.513
  613   1HG   PRO  28          1HG       PRO  28   7.923  11.437 -11.207
  614   2HG   PRO  28          2HG       PRO  28   6.829  12.701 -10.538
  615   1HD   PRO  28          1HD       PRO  28   8.864  11.210  -9.184
  616   2HD   PRO  28          2HD       PRO  28   7.708  12.327  -8.448
  617    H    LYS  29           H        LYS  29   7.177   7.763  -8.046
  618    HA   LYS  29           HA       LYS  29   7.017   5.664  -9.844
  619   1HB   LYS  29          1HB       LYS  29   8.764   7.286 -10.946
  620   2HB   LYS  29          2HB       LYS  29   9.877   6.556  -9.777
  621   1HG   LYS  29          1HG       LYS  29   9.843   4.526 -10.830
  622   2HG   LYS  29          2HG       LYS  29   8.125   4.641 -11.248
  623   1HD   LYS  29          1HD       LYS  29   8.614   5.392 -13.317
  624   2HD   LYS  29          2HD       LYS  29   9.689   6.652 -12.683
  625   1HE   LYS  29          1HE       LYS  29  11.577   5.245 -12.764
  626   2HE   LYS  29          2HE       LYS  29  10.607   3.764 -12.767
  627   1HZ   LYS  29          1HZ       LYS  29  11.403   5.419 -14.942
  628   2HZ   LYS  29          2HZ       LYS  29  10.946   3.851 -14.941
  629   3HZ   LYS  29          3HZ       LYS  29   9.817   5.029 -14.988
  630    H    GLU  30           H        GLU  30   8.043   7.291  -6.983
  631    HA   GLU  30           HA       GLU  30   9.064   4.807  -5.882
  632   1HB   GLU  30          1HB       GLU  30   9.512   7.676  -5.375
  633   2HB   GLU  30          2HB       GLU  30   9.328   6.724  -3.891
  634   1HG   GLU  30          1HG       GLU  30  11.693   6.848  -4.611
  635   2HG   GLU  30          2HG       GLU  30  11.107   5.179  -4.658
  636    H    CYS  31           H        CYS  31   6.609   7.406  -5.335
  637    HA   CYS  31           HA       CYS  31   5.514   6.412  -3.020
  638   1HB   CYS  31          1HB       CYS  31   4.344   7.989  -5.299
  639   2HB   CYS  31          2HB       CYS  31   3.386   7.554  -3.882
  640    H    ASN  32           H        ASN  32   4.506   5.853  -6.478
  641    HA   ASN  32           HA       ASN  32   2.536   4.029  -5.881
  642   1HB   ASN  32          1HB       ASN  32   4.157   4.788  -8.277
  643   2HB   ASN  32          2HB       ASN  32   3.382   3.199  -8.364
  644   1HD2  ASN  32          1HD2      ASN  32   2.494   6.341  -6.938
  645   2HD2  ASN  32          2HD2      ASN  32   0.967   6.522  -7.736
  646    H    ASN  33           H        ASN  33   5.951   3.830  -5.542
  647    HA   ASN  33           HA       ASN  33   6.037   0.989  -6.025
  648   1HB   ASN  33          1HB       ASN  33   7.891   2.711  -6.655
  649   2HB   ASN  33          2HB       ASN  33   8.302   2.719  -4.935
  650   1HD2  ASN  33          1HD2      ASN  33  10.340   1.987  -6.112
  651   2HD2  ASN  33          2HD2      ASN  33  10.594   0.280  -6.256
  652    H    ARG  34           H        ARG  34   5.924   3.440  -3.451
  653    HA   ARG  34           HA       ARG  34   6.671   1.552  -1.437
  654   1HB   ARG  34          1HB       ARG  34   5.484   4.310  -0.966
  655   2HB   ARG  34          2HB       ARG  34   6.592   3.411   0.086
  656   1HG   ARG  34          1HG       ARG  34   7.938   3.650  -2.382
  657   2HG   ARG  34          2HG       ARG  34   7.183   5.234  -2.127
  658   1HD   ARG  34          1HD       ARG  34   8.536   5.718  -0.343
  659   2HD   ARG  34          2HD       ARG  34   8.493   4.061   0.280
  660    HE   ARG  34           HE       ARG  34  10.002   3.854  -2.032
  661   1HH1  ARG  34          1HH1      ARG  34  10.205   5.883   0.835
  662   2HH1  ARG  34          2HH1      ARG  34  11.928   6.046   0.753
  663   1HH2  ARG  34          1HH2      ARG  34  12.275   4.067  -2.140
  664   2HH2  ARG  34          2HH2      ARG  34  13.113   5.006  -0.950
  665    H    GLY  35           H        GLY  35   3.782   2.804  -3.003
  666   1HA   GLY  35          1HA       GLY  35   1.817   1.379  -2.729
  667   2HA   GLY  35          2HA       GLY  35   2.107   1.408  -1.001
  668    H    CYS  36           H        CYS  36   2.773   4.342  -2.850
  669    HA   CYS  36           HA       CYS  36   0.271   5.463  -1.810
  670   1HB   CYS  36          1HB       CYS  36   2.936   6.860  -2.074
  671   2HB   CYS  36          2HB       CYS  36   1.431   7.591  -1.511
  672    H    CYS  37           H        CYS  37  -0.322   7.551  -3.138
  673    HA   CYS  37           HA       CYS  37   0.233   6.948  -5.950
  674   1HB   CYS  37          1HB       CYS  37  -2.150   6.782  -4.939
  675   2HB   CYS  37          2HB       CYS  37  -2.133   8.546  -5.018
  676    H    PHE  38           H        PHE  38   1.106   8.606  -7.224
  677    HA   PHE  38           HA       PHE  38   1.838  11.019  -5.760
  678   1HB   PHE  38          1HB       PHE  38   3.477   9.481  -7.027
  679   2HB   PHE  38          2HB       PHE  38   2.661   9.945  -8.523
  680    HD1  PHE  38           HD1      PHE  38   3.056  12.091  -9.520
  681    HD2  PHE  38           HD2      PHE  38   4.822  11.113  -5.788
  682    HE1  PHE  38           HE1      PHE  38   4.576  14.079  -9.718
  683    HE2  PHE  38           HE2      PHE  38   6.341  13.100  -5.986
  684    HZ   PHE  38           HZ       PHE  38   6.201  14.559  -7.948
  685    H    ASP  39           H        ASP  39   0.585  12.804  -6.006
  686    HA   ASP  39           HA       ASP  39  -1.321  12.904  -8.078
  687   1HB   ASP  39          1HB       ASP  39  -2.101  14.056  -6.247
  688   2HB   ASP  39          2HB       ASP  39  -0.486  14.589  -5.754
  689    H    SER  40           H        SER  40   0.854  15.642  -7.154
  690    HA   SER  40           HA       SER  40   2.448  16.669  -8.301
  691   1HB   SER  40          1HB       SER  40   2.588  14.427  -9.691
  692   2HB   SER  40          2HB       SER  40   1.737  15.364 -10.932
  693    HG   SER  40           HG       SER  40   3.469  16.877 -10.937
  694    H    ARG  41           H        ARG  41  -0.856  16.159  -9.398
  695    HA   ARG  41           HA       ARG  41  -0.981  18.253 -11.217
  696   1HB   ARG  41          1HB       ARG  41  -3.288  17.300  -9.474
  697   2HB   ARG  41          2HB       ARG  41  -3.376  17.938 -11.126
  698   1HG   ARG  41          1HG       ARG  41  -1.691  15.813 -11.487
  699   2HG   ARG  41          2HG       ARG  41  -2.690  15.199 -10.156
  700   1HD   ARG  41          1HD       ARG  41  -3.772  14.531 -12.193
  701   2HD   ARG  41          2HD       ARG  41  -4.736  15.871 -11.553
  702    HE   ARG  41           HE       ARG  41  -2.646  16.758 -13.385
  703   1HH1  ARG  41          1HH1      ARG  41  -5.912  15.459 -13.207
  704   2HH1  ARG  41          2HH1      ARG  41  -6.386  16.098 -14.745
  705   1HH2  ARG  41          1HH2      ARG  41  -3.271  17.600 -15.415
  706   2HH2  ARG  41          2HH2      ARG  41  -4.875  17.323 -16.010
  707    H    ILE  42           H        ILE  42  -1.600  18.004  -7.667
  708    HA   ILE  42           HA       ILE  42  -1.712  20.940  -7.603
  709    HB   ILE  42           HB       ILE  42  -3.054  19.209  -5.559
  710   1HG1  ILE  42          1HG1      ILE  42  -4.042  19.871  -8.316
  711   2HG1  ILE  42          2HG1      ILE  42  -4.097  18.325  -7.452
  712   1HG2  ILE  42          1HG2      ILE  42  -4.199  21.121  -4.953
  713   2HG2  ILE  42          2HG2      ILE  42  -2.603  21.769  -5.399
  714   3HG2  ILE  42          3HG2      ILE  42  -3.965  21.898  -6.536
  715   1HD1  ILE  42          1HD1      ILE  42  -5.552  19.983  -5.775
  716   2HD1  ILE  42          2HD1      ILE  42  -5.972  20.618  -7.384
  717   3HD1  ILE  42          3HD1      ILE  42  -6.258  18.903  -7.001
  718    HA   PRO  43           HA       PRO  43   1.909  20.046  -5.264
  719   1HB   PRO  43          1HB       PRO  43   3.032  22.525  -5.498
  720   2HB   PRO  43          2HB       PRO  43   3.293  21.234  -6.670
  721   1HG   PRO  43          1HG       PRO  43   1.570  23.624  -6.832
  722   2HG   PRO  43          2HG       PRO  43   2.196  22.598  -8.173
  723   1HD   PRO  43          1HD       PRO  43  -0.445  22.674  -7.072
  724   2HD   PRO  43          2HD       PRO  43   0.161  21.533  -8.281
  725    H    GLY  44           H        GLY  44  -0.764  21.819  -4.612
  726   1HA   GLY  44          1HA       GLY  44   0.257  22.967  -2.135
  727   2HA   GLY  44          2HA       GLY  44  -1.345  23.152  -2.821
  728    H    VAL  45           H        VAL  45  -0.852  19.923  -3.213
  729    HA   VAL  45           HA       VAL  45  -1.794  19.300  -0.499
  730    HB   VAL  45           HB       VAL  45  -3.495  18.013  -1.307
  731   1HG1  VAL  45          1HG1      VAL  45  -3.434  19.779  -3.735
  732   2HG1  VAL  45          2HG1      VAL  45  -4.792  19.362  -2.661
  733   3HG1  VAL  45          3HG1      VAL  45  -3.551  20.518  -2.120
  734   1HG2  VAL  45          1HG2      VAL  45  -3.545  16.751  -3.262
  735   2HG2  VAL  45          2HG2      VAL  45  -2.439  17.848  -4.124
  736   3HG2  VAL  45          3HG2      VAL  45  -1.811  16.765  -2.858
  737    HA   PRO  46           HA       PRO  46   0.999  15.977  -0.531
  738   1HB   PRO  46          1HB       PRO  46  -0.379  13.695   0.057
  739   2HB   PRO  46          2HB       PRO  46   0.065  14.891   1.271
  740   1HG   PRO  46          1HG       PRO  46  -2.539  14.369  -0.012
  741   2HG   PRO  46          2HG       PRO  46  -2.201  15.232   1.532
  742   1HD   PRO  46          1HD       PRO  46  -2.919  16.343  -1.008
  743   2HD   PRO  46          2HD       PRO  46  -2.440  17.241   0.438
  744    H    TRP  47           H        TRP  47   2.249  15.348  -2.163
  745    HA   TRP  47           HA       TRP  47   0.839  14.274  -4.468
  746   1HB   TRP  47          1HB       TRP  47   3.739  14.488  -4.638
  747   2HB   TRP  47          2HB       TRP  47   2.481  15.125  -5.701
  748    HD1  TRP  47           HD1      TRP  47   1.355  17.571  -4.787
  749    HE1  TRP  47           HE1      TRP  47   2.454  19.646  -3.584
  750    HE3  TRP  47           HE3      TRP  47   5.473  15.093  -3.130
  751    HZ2  TRP  47           HZ2      TRP  47   4.869  20.010  -2.108
  752    HZ3  TRP  47           HZ3      TRP  47   7.154  16.381  -1.816
  753    HH2  TRP  47           HH2      TRP  47   6.903  18.758  -1.299
  754    H    CYS  48           H        CYS  48   1.048  12.796  -1.859
  755    HA   CYS  48           HA       CYS  48   1.872  10.323  -2.961
  756   1HB   CYS  48          1HB       CYS  48   4.054  11.417  -2.256
  757   2HB   CYS  48          2HB       CYS  48   3.502  11.225  -0.589
  758    H    PHE  49           H        PHE  49  -0.104   9.430  -2.354
  759    HA   PHE  49           HA       PHE  49  -0.592   9.298   0.513
  760   1HB   PHE  49          1HB       PHE  49  -3.132   9.576  -0.447
  761   2HB   PHE  49          2HB       PHE  49  -2.180  10.977   0.058
  762    HD1  PHE  49           HD1      PHE  49  -0.618  11.931  -1.898
  763    HD2  PHE  49           HD2      PHE  49  -4.167   9.679  -2.486
  764    HE1  PHE  49           HE1      PHE  49  -0.851  12.900  -4.201
  765    HE2  PHE  49           HE2      PHE  49  -4.400  10.648  -4.789
  766    HZ   PHE  49           HZ       PHE  49  -2.740  12.247  -5.619
  767    H    LYS  50           H        LYS  50  -3.002   7.911   0.490
  768    HA   LYS  50           HA       LYS  50  -2.372   5.572  -1.171
  769   1HB   LYS  50          1HB       LYS  50  -3.718   4.737   1.174
  770   2HB   LYS  50          2HB       LYS  50  -2.063   4.362   0.663
  771   1HG   LYS  50          1HG       LYS  50  -2.686   7.009   1.983
  772   2HG   LYS  50          2HG       LYS  50  -2.491   5.559   2.983
  773   1HD   LYS  50          1HD       LYS  50  -0.473   6.838   1.104
  774   2HD   LYS  50          2HD       LYS  50  -0.328   6.626   2.858
  775   1HE   LYS  50          1HE       LYS  50  -0.148   4.545   0.659
  776   2HE   LYS  50          2HE       LYS  50   1.034   4.903   1.926
  777   1HZ   LYS  50          1HZ       LYS  50  -0.408   3.953   3.515
  778   2HZ   LYS  50          2HZ       LYS  50  -1.639   3.810   2.450
  779   3HZ   LYS  50          3HZ       LYS  50  -0.304   2.885   2.284
  780    HA   PRO  51           HA       PRO  51  -6.583   7.026  -1.993
  781   1HB   PRO  51          1HB       PRO  51  -6.358   7.286  -4.702
  782   2HB   PRO  51          2HB       PRO  51  -6.142   8.631  -3.584
  783   1HG   PRO  51          1HG       PRO  51  -4.133   7.049  -5.056
  784   2HG   PRO  51          2HG       PRO  51  -3.957   8.683  -4.321
  785   1HD   PRO  51          1HD       PRO  51  -2.957   6.179  -3.355
  786   2HD   PRO  51          2HD       PRO  51  -2.896   7.735  -2.515
  787    H    LEU  52           H        LEU  52  -5.820   5.589  -5.023
  788    HA   LEU  52           HA       LEU  52  -7.474   3.320  -4.205
  789   1HB   LEU  52          1HB       LEU  52  -8.189   3.141  -6.343
  790   2HB   LEU  52          2HB       LEU  52  -7.948   4.892  -6.219
  791    HG   LEU  52           HG       LEU  52  -5.510   3.829  -7.156
  792   1HD1  LEU  52          1HD1      LEU  52  -7.828   2.258  -8.091
  793   2HD1  LEU  52          2HD1      LEU  52  -6.747   2.860  -9.370
  794   3HD1  LEU  52          3HD1      LEU  52  -6.095   1.853  -8.055
  795   1HD2  LEU  52          1HD2      LEU  52  -7.229   4.927  -9.239
  796   2HD2  LEU  52          2HD2      LEU  52  -7.262   5.896  -7.747
  797   3HD2  LEU  52          3HD2      LEU  52  -5.711   5.554  -8.551
  798    H    GLN  53           H        GLN  53  -4.824   3.439  -3.173
  799    HA   GLN  53           HA       GLN  53  -2.906   2.267  -4.696
  800   1HB   GLN  53          1HB       GLN  53  -3.494   1.912  -1.733
  801   2HB   GLN  53          2HB       GLN  53  -1.970   1.437  -2.503
  802   1HG   GLN  53          1HG       GLN  53  -3.152   4.247  -2.442
  803   2HG   GLN  53          2HG       GLN  53  -1.809   3.683  -1.437
  804   1HE2  GLN  53          1HE2      GLN  53  -0.535   2.067  -3.364
  805   2HE2  GLN  53          2HE2      GLN  53   0.189   3.079  -4.570
  806    H    GLU  54           H        GLU  54  -5.928   0.936  -3.662
  807    HA   GLU  54           HA       GLU  54  -5.468  -1.648  -3.175
  808   1HB   GLU  54          1HB       GLU  54  -7.677  -2.111  -4.148
  809   2HB   GLU  54          2HB       GLU  54  -7.709  -0.592  -3.237
  810   1HG   GLU  54          1HG       GLU  54  -7.819   0.713  -5.183
  811   2HG   GLU  54          2HG       GLU  54  -7.119  -0.550  -6.205
  812    H    ALA  55           H        ALA  55  -4.739   0.073  -6.124
  813    HA   ALA  55           HA       ALA  55  -4.942  -1.557  -8.174
  814   1HB   ALA  55          1HB       ALA  55  -2.163  -0.559  -7.648
  815   2HB   ALA  55          2HB       ALA  55  -3.177  -0.397  -9.101
  816   3HB   ALA  55          3HB       ALA  55  -3.484   0.633  -7.683
  817    H    GLU  56           H        GLU  56  -2.037  -1.845  -6.000
  818    HA   GLU  56           HA       GLU  56  -2.312  -4.719  -6.259
  819   1HB   GLU  56          1HB       GLU  56   0.075  -3.059  -7.074
  820   2HB   GLU  56          2HB       GLU  56   0.305  -4.725  -6.519
  821   1HG   GLU  56          1HG       GLU  56  -0.016  -5.198  -8.735
  822   2HG   GLU  56          2HG       GLU  56  -1.729  -5.100  -8.298
  823    H    CYS  57           H        CYS  57  -2.513  -2.302  -4.222
  824    HA   CYS  57           HA       CYS  57  -0.520  -3.122  -2.301
  825   1HB   CYS  57          1HB       CYS  57  -1.604  -0.718  -2.862
  826   2HB   CYS  57          2HB       CYS  57  -2.640  -1.210  -1.519
  827    H    THR  58           H        THR  58  -4.146  -2.773  -2.477
  828    HA   THR  58           HA       THR  58  -4.640  -4.237  -0.134
  829    HB   THR  58           HB       THR  58  -6.121  -2.580  -1.543
  830    HG1  THR  58           HG1      THR  58  -7.793  -3.554  -0.353
  831   1HG2  THR  58          1HG2      THR  58  -6.821  -5.288  -2.798
  832   2HG2  THR  58          2HG2      THR  58  -7.768  -3.792  -2.981
  833   3HG2  THR  58          3HG2      THR  58  -6.131  -3.899  -3.673
  834    H    PHE  59           H        PHE  59  -4.096  -5.225  -3.514
  835    HA   PHE  59           HA       PHE  59  -5.146  -7.654  -3.678
  836   1HB   PHE  59          1HB       PHE  59  -2.611  -6.294  -4.476
  837   2HB   PHE  59          2HB       PHE  59  -2.493  -8.055  -4.526
  838    HD1  PHE  59           HD1      PHE  59  -2.642  -8.770  -6.709
  839    HD2  PHE  59           HD2      PHE  59  -5.218  -5.655  -5.418
  840    HE1  PHE  59           HE1      PHE  59  -3.764  -8.768  -8.954
  841    HE2  PHE  59           HE2      PHE  59  -6.340  -5.653  -7.663
  842    HZ   PHE  59           HZ       PHE  59  -5.599  -7.209  -9.404
  Start of MODEL   25
    1   1H    GLU   1           H1       GLU   1 -10.712 -13.130  -4.059
    2    HA   GLU   1           HA       GLU   1 -12.656 -13.978  -5.857
    3   1HB   GLU   1          1HB       GLU   1 -12.457 -16.186  -4.978
    4   2HB   GLU   1          2HB       GLU   1 -12.397 -15.608  -3.304
    5   1HG   GLU   1          1HG       GLU   1 -14.638 -15.772  -3.168
    6   2HG   GLU   1          2HG       GLU   1 -14.825 -14.627  -4.505
    7    H    GLU   2           H        GLU   2 -13.429 -14.182  -2.405
    8    HA   GLU   2           HA       GLU   2 -14.829 -11.683  -2.671
    9   1HB   GLU   2          1HB       GLU   2 -15.768 -13.869  -1.657
   10   2HB   GLU   2          2HB       GLU   2 -14.811 -13.473  -0.219
   11   1HG   GLU   2          1HG       GLU   2 -16.404 -12.031   0.452
   12   2HG   GLU   2          2HG       GLU   2 -16.236 -11.104  -1.047
   13    H    TYR   3           H        TYR   3 -14.465 -11.787   0.547
   14    HA   TYR   3           HA       TYR   3 -12.272  -9.881   0.479
   15   1HB   TYR   3          1HB       TYR   3 -13.166  -9.888   3.023
   16   2HB   TYR   3          2HB       TYR   3 -14.128  -9.108   1.764
   17    HD1  TYR   3           HD1      TYR   3 -13.695 -12.726   2.661
   18    HD2  TYR   3           HD2      TYR   3 -16.368  -9.402   2.331
   19    HE1  TYR   3           HE1      TYR   3 -15.656 -14.237   3.239
   20    HE2  TYR   3           HE2      TYR   3 -18.321 -10.924   2.910
   21    HH   TYR   3           HH       TYR   3 -17.881 -14.395   3.181
   22    H    VAL   4           H        VAL   4 -10.833 -11.906  -0.058
   23    HA   VAL   4           HA       VAL   4  -9.869 -12.914   2.524
   24    HB   VAL   4           HB       VAL   4 -10.201 -14.438  -0.066
   25   1HG1  VAL   4          1HG1      VAL   4  -8.566 -14.979   2.378
   26   2HG1  VAL   4          2HG1      VAL   4  -9.413 -16.346   1.618
   27   3HG1  VAL   4          3HG1      VAL   4  -8.251 -15.384   0.674
   28   1HG2  VAL   4          1HG2      VAL   4 -12.125 -15.202   0.765
   29   2HG2  VAL   4          2HG2      VAL   4 -11.324 -15.697   2.275
   30   3HG2  VAL   4          3HG2      VAL   4 -11.963 -14.045   2.107
   31    H    GLY   5           H        GLY   5  -9.155 -12.320  -0.979
   32   1HA   GLY   5          1HA       GLY   5  -6.335 -12.402  -0.647
   33   2HA   GLY   5          2HA       GLY   5  -7.229 -11.784  -2.022
   34    H    LEU   6           H        LEU   6  -8.477 -10.297   0.760
   35    HA   LEU   6           HA       LEU   6  -6.454  -8.219   0.854
   36   1HB   LEU   6          1HB       LEU   6  -7.639  -6.539  -0.026
   37   2HB   LEU   6          2HB       LEU   6  -8.299  -7.863  -1.003
   38    HG   LEU   6           HG       LEU   6  -9.567  -6.309   1.236
   39   1HD1  LEU   6          1HD1      LEU   6 -11.436  -6.793  -0.739
   40   2HD1  LEU   6          2HD1      LEU   6 -10.458  -5.317  -0.552
   41   3HD1  LEU   6          3HD1      LEU   6  -9.917  -6.609  -1.650
   42   1HD2  LEU   6          1HD2      LEU   6 -10.014  -9.169   0.587
   43   2HD2  LEU   6          2HD2      LEU   6 -10.266  -8.276   2.105
   44   3HD2  LEU   6          3HD2      LEU   6 -11.465  -8.160   0.794
   45    H    SER   7           H        SER   7  -7.803 -10.449   2.528
   46    HA   SER   7           HA       SER   7  -9.092  -8.835   4.532
   47   1HB   SER   7          1HB       SER   7  -9.647 -10.934   5.606
   48   2HB   SER   7          2HB       SER   7  -9.988 -11.090   3.872
   49    HG   SER   7           HG       SER   7  -8.876 -12.940   4.335
   50    H    ALA   8           H        ALA   8  -8.394  -9.252   6.916
   51    HA   ALA   8           HA       ALA   8  -5.668  -8.560   7.147
   52   1HB   ALA   8          1HB       ALA   8  -6.927  -7.643   8.842
   53   2HB   ALA   8          2HB       ALA   8  -8.002  -9.057   8.956
   54   3HB   ALA   8          3HB       ALA   8  -6.376  -9.115   9.677
   55    H    ASN   9           H        ASN   9  -7.147 -11.521   6.486
   56    HA   ASN   9           HA       ASN   9  -5.236 -13.025   8.043
   57   1HB   ASN   9          1HB       ASN   9  -7.891 -13.487   7.153
   58   2HB   ASN   9          2HB       ASN   9  -6.897 -14.608   6.210
   59   1HD2  ASN   9          1HD2      ASN   9  -5.167 -15.745   7.532
   60   2HD2  ASN   9          2HD2      ASN   9  -5.642 -16.399   9.063
   61    H    GLN  10           H        GLN  10  -5.436 -11.424   5.076
   62    HA   GLN  10           HA       GLN  10  -4.439 -13.340   3.316
   63   1HB   GLN  10          1HB       GLN  10  -5.422 -10.821   3.069
   64   2HB   GLN  10          2HB       GLN  10  -3.695 -10.482   2.869
   65   1HG   GLN  10          1HG       GLN  10  -4.325 -12.834   1.348
   66   2HG   GLN  10          2HG       GLN  10  -5.547 -11.612   0.968
   67   1HE2  GLN  10          1HE2      GLN  10  -4.036  -9.308   1.362
   68   2HE2  GLN  10          2HE2      GLN  10  -2.822  -9.179   0.133
   69    H    CYS  11           H        CYS  11  -2.891 -10.991   5.553
   70    HA   CYS  11           HA       CYS  11  -0.292 -11.324   4.585
   71   1HB   CYS  11          1HB       CYS  11  -0.877  -9.435   5.930
   72   2HB   CYS  11          2HB       CYS  11  -1.328 -10.466   7.290
   73    H    ALA  12           H        ALA  12  -2.439 -13.522   6.017
   74    HA   ALA  12           HA       ALA  12  -0.314 -15.010   7.366
   75   1HB   ALA  12          1HB       ALA  12  -1.949 -15.460   8.838
   76   2HB   ALA  12          2HB       ALA  12  -3.104 -14.537   7.847
   77   3HB   ALA  12          3HB       ALA  12  -2.874 -16.278   7.558
   78    H    VAL  13           H        VAL  13  -0.733 -14.608   4.339
   79    HA   VAL  13           HA       VAL  13  -1.796 -16.726   3.062
   80    HB   VAL  13           HB       VAL  13   0.501 -16.380   1.658
   81   1HG1  VAL  13          1HG1      VAL  13  -1.922 -14.552   1.755
   82   2HG1  VAL  13          2HG1      VAL  13  -0.729 -14.595   0.433
   83   3HG1  VAL  13          3HG1      VAL  13  -1.729 -16.027   0.778
   84   1HG2  VAL  13          1HG2      VAL  13   1.257 -14.852   3.605
   85   2HG2  VAL  13          2HG2      VAL  13   1.446 -14.256   1.938
   86   3HG2  VAL  13          3HG2      VAL  13   0.094 -13.679   2.942
   87    HA   PRO  14           HA       PRO  14   0.495 -20.268   4.009
   88   1HB   PRO  14          1HB       PRO  14   0.745 -21.589   1.631
   89   2HB   PRO  14          2HB       PRO  14  -0.733 -21.600   2.590
   90   1HG   PRO  14          1HG       PRO  14  -0.077 -20.107   0.133
   91   2HG   PRO  14          2HG       PRO  14  -1.700 -20.486   0.817
   92   1HD   PRO  14          1HD       PRO  14  -0.290 -17.994   0.858
   93   2HD   PRO  14          2HD       PRO  14  -1.811 -18.360   1.683
   94    H    ALA  15           H        ALA  15   1.923 -17.808   2.502
   95    HA   ALA  15           HA       ALA  15   4.090 -17.238   2.541
   96   1HB   ALA  15          1HB       ALA  15   5.287 -19.912   2.861
   97   2HB   ALA  15          2HB       ALA  15   5.529 -18.430   3.817
   98   3HB   ALA  15          3HB       ALA  15   4.140 -19.490   4.154
   99    H    LYS  16           H        LYS  16   2.637 -17.645   0.227
  100    HA   LYS  16           HA       LYS  16   4.564 -17.824  -1.699
  101   1HB   LYS  16          1HB       LYS  16   3.627 -20.149  -2.651
  102   2HB   LYS  16          2HB       LYS  16   5.084 -20.024  -1.648
  103   1HG   LYS  16          1HG       LYS  16   4.084 -21.040   0.134
  104   2HG   LYS  16          2HG       LYS  16   2.531 -20.227  -0.130
  105   1HD   LYS  16          1HD       LYS  16   1.890 -22.348  -0.724
  106   2HD   LYS  16          2HD       LYS  16   2.541 -21.859  -2.298
  107   1HE   LYS  16          1HE       LYS  16   4.441 -23.166  -2.063
  108   2HE   LYS  16          2HE       LYS  16   4.454 -23.042  -0.298
  109   1HZ   LYS  16          1HZ       LYS  16   2.289 -24.463  -1.624
  110   2HZ   LYS  16          2HZ       LYS  16   3.732 -25.207  -1.445
  111   3HZ   LYS  16          3HZ       LYS  16   2.909 -24.691  -0.132
  112    H    ASP  17           H        ASP  17   2.360 -16.209  -1.010
  113    HA   ASP  17           HA       ASP  17   0.882 -16.480  -3.468
  114   1HB   ASP  17          1HB       ASP  17  -0.521 -17.612  -1.780
  115   2HB   ASP  17          2HB       ASP  17  -0.434 -16.192  -0.726
  116    H    ARG  18           H        ARG  18   2.924 -14.738  -1.724
  117    HA   ARG  18           HA       ARG  18   1.439 -12.281  -1.612
  118   1HB   ARG  18          1HB       ARG  18   4.393 -12.731  -1.010
  119   2HB   ARG  18          2HB       ARG  18   3.393 -11.374  -0.463
  120   1HG   ARG  18          1HG       ARG  18   2.601 -12.554   1.300
  121   2HG   ARG  18          2HG       ARG  18   2.272 -13.986   0.310
  122   1HD   ARG  18          1HD       ARG  18   4.726 -14.537   0.400
  123   2HD   ARG  18          2HD       ARG  18   4.970 -13.165   1.492
  124    HE   ARG  18           HE       ARG  18   2.961 -15.220   2.262
  125   1HH1  ARG  18          1HH1      ARG  18   6.147 -13.808   2.748
  126   2HH1  ARG  18          2HH1      ARG  18   6.381 -14.552   4.294
  127   1HH2  ARG  18          1HH2      ARG  18   3.270 -16.203   4.301
  128   2HH2  ARG  18          2HH2      ARG  18   4.734 -15.924   5.183
  129    H    VAL  19           H        VAL  19   3.146 -10.286  -2.323
  130    HA   VAL  19           HA       VAL  19   3.840 -10.942  -5.102
  131    HB   VAL  19           HB       VAL  19   3.158  -8.205  -4.053
  132   1HG1  VAL  19          1HG1      VAL  19   3.436  -7.558  -6.173
  133   2HG1  VAL  19          2HG1      VAL  19   4.073  -9.182  -6.526
  134   3HG1  VAL  19          3HG1      VAL  19   2.344  -8.832  -6.765
  135   1HG2  VAL  19          1HG2      VAL  19   1.075  -8.919  -3.618
  136   2HG2  VAL  19          2HG2      VAL  19   0.887  -9.059  -5.382
  137   3HG2  VAL  19          3HG2      VAL  19   1.349 -10.484  -4.421
  138    H    ASP  20           H        ASP  20   5.420 -11.169  -2.477
  139    HA   ASP  20           HA       ASP  20   7.297 -10.428  -1.570
  140   1HB   ASP  20          1HB       ASP  20   8.395 -11.891  -2.974
  141   2HB   ASP  20          2HB       ASP  20   7.787 -11.115  -4.444
  142    H    CYS  21           H        CYS  21   6.841  -8.207  -0.938
  143    HA   CYS  21           HA       CYS  21   6.667  -6.044  -2.562
  144   1HB   CYS  21          1HB       CYS  21   6.547  -6.426   0.081
  145   2HB   CYS  21          2HB       CYS  21   8.137  -5.660  -0.008
  146    H    GLY  22           H        GLY  22   9.534  -7.870  -1.465
  147   1HA   GLY  22          1HA       GLY  22  11.704  -7.767  -2.036
  148   2HA   GLY  22          2HA       GLY  22  11.176  -7.056  -3.548
  149    H    TYR  23           H        TYR  23  11.237  -5.977  -0.067
  150    HA   TYR  23           HA       TYR  23  12.099  -3.352  -0.967
  151   1HB   TYR  23          1HB       TYR  23  10.416  -4.425   1.005
  152   2HB   TYR  23          2HB       TYR  23  11.880  -4.087   1.936
  153    HD1  TYR  23           HD1      TYR  23  10.529  -2.130  -0.939
  154    HD2  TYR  23           HD2      TYR  23  11.172  -2.282   3.288
  155    HE1  TYR  23           HE1      TYR  23   9.823   0.305  -0.736
  156    HE2  TYR  23           HE2      TYR  23  10.465   0.152   3.477
  157    HH   TYR  23           HH       TYR  23  10.162   2.033   2.287
  158    HA   PRO  24           HA       PRO  24  16.235  -4.105   0.093
  159   1HB   PRO  24          1HB       PRO  24  17.167  -1.536   0.095
  160   2HB   PRO  24          2HB       PRO  24  16.972  -2.490  -1.374
  161   1HG   PRO  24          1HG       PRO  24  15.300  -0.314  -0.290
  162   2HG   PRO  24          2HG       PRO  24  15.377  -0.937  -1.978
  163   1HD   PRO  24          1HD       PRO  24  13.350  -1.386  -0.006
  164   2HD   PRO  24          2HD       PRO  24  13.461  -2.150  -1.596
  165    H    HIS  25           H        HIS  25  14.017  -2.663   2.082
  166    HA   HIS  25           HA       HIS  25  15.906  -2.960   4.287
  167   1HB   HIS  25          1HB       HIS  25  14.718  -0.506   3.367
  168   2HB   HIS  25          2HB       HIS  25  14.131  -0.876   4.992
  169    HD1  HIS  25           HD1      HIS  25  15.573   1.310   5.673
  170    HD2  HIS  25           HD2      HIS  25  17.763  -2.046   4.433
  171    HE1  HIS  25           HE1      HIS  25  17.974   1.698   6.443
  172    HE2  HIS  25           HE2      HIS  25  19.260  -0.421   5.701
  173    H    VAL  26           H        VAL  26  14.428  -5.079   3.698
  174    HA   VAL  26           HA       VAL  26  11.783  -4.975   4.716
  175    HB   VAL  26           HB       VAL  26  12.213  -6.606   3.114
  176   1HG1  VAL  26          1HG1      VAL  26  14.385  -7.089   2.780
  177   2HG1  VAL  26          2HG1      VAL  26  14.800  -6.868   4.497
  178   3HG1  VAL  26          3HG1      VAL  26  14.111  -8.412   3.939
  179   1HG2  VAL  26          1HG2      VAL  26  11.027  -7.339   5.335
  180   2HG2  VAL  26          2HG2      VAL  26  11.437  -8.554   4.100
  181   3HG2  VAL  26          3HG2      VAL  26  12.468  -8.365   5.539
  182    H    THR  27           H        THR  27  11.098  -4.997   6.796
  183    HA   THR  27           HA       THR  27  12.377  -6.501   8.805
  184    HB   THR  27           HB       THR  27  13.588  -3.967   8.237
  185    HG1  THR  27           HG1      THR  27  14.926  -4.858   9.881
  186   1HG2  THR  27          1HG2      THR  27  13.407  -3.128  10.709
  187   2HG2  THR  27          2HG2      THR  27  12.076  -2.699   9.607
  188   3HG2  THR  27          3HG2      THR  27  11.878  -4.039  10.761
  189    HA   PRO  28           HA       PRO  28   8.506  -5.856  10.534
  190   1HB   PRO  28          1HB       PRO  28   8.941  -6.536  13.144
  191   2HB   PRO  28          2HB       PRO  28   8.705  -7.724  11.865
  192   1HG   PRO  28          1HG       PRO  28  11.180  -6.864  13.221
  193   2HG   PRO  28          2HG       PRO  28  10.876  -8.375  12.293
  194   1HD   PRO  28          1HD       PRO  28  12.349  -6.056  11.486
  195   2HD   PRO  28          2HD       PRO  28  11.944  -7.451  10.479
  196    H    LYS  29           H        LYS  29   9.343  -3.466   9.958
  197    HA   LYS  29           HA       LYS  29   8.097  -1.872  11.834
  198   1HB   LYS  29          1HB       LYS  29   9.938  -2.430  13.329
  199   2HB   LYS  29          2HB       LYS  29  11.114  -1.837  12.144
  200   1HG   LYS  29          1HG       LYS  29  10.713   0.339  12.673
  201   2HG   LYS  29          2HG       LYS  29   8.961   0.101  12.776
  202   1HD   LYS  29          1HD       LYS  29   9.262  -0.950  15.015
  203   2HD   LYS  29          2HD       LYS  29  11.009  -0.665  14.911
  204   1HE   LYS  29          1HE       LYS  29  10.251   1.840  14.476
  205   2HE   LYS  29          2HE       LYS  29   8.753   1.320  15.260
  206   1HZ   LYS  29          1HZ       LYS  29  11.465   1.157  16.376
  207   2HZ   LYS  29          2HZ       LYS  29  10.269   2.156  16.867
  208   3HZ   LYS  29          3HZ       LYS  29  10.136   0.544  17.102
  209    H    GLU  30           H        GLU  30  10.301  -2.442   9.159
  210    HA   GLU  30           HA       GLU  30   9.956   0.299   8.285
  211   1HB   GLU  30          1HB       GLU  30  11.949  -1.820   7.863
  212   2HB   GLU  30          2HB       GLU  30  11.498  -0.999   6.357
  213   1HG   GLU  30          1HG       GLU  30  13.159   0.431   7.069
  214   2HG   GLU  30          2HG       GLU  30  11.797   1.178   7.917
  215    H    CYS  31           H        CYS  31   9.415  -3.118   7.220
  216    HA   CYS  31           HA       CYS  31   8.199  -2.431   4.797
  217   1HB   CYS  31          1HB       CYS  31   8.379  -4.873   6.490
  218   2HB   CYS  31          2HB       CYS  31   7.142  -4.830   5.229
  219    H    ASN  32           H        ASN  32   6.860  -3.428   8.035
  220    HA   ASN  32           HA       ASN  32   4.216  -3.086   7.316
  221   1HB   ASN  32          1HB       ASN  32   5.554  -2.799  10.050
  222   2HB   ASN  32          2HB       ASN  32   3.813  -3.004   9.808
  223   1HD2  ASN  32          1HD2      ASN  32   3.637  -4.848   7.865
  224   2HD2  ASN  32          2HD2      ASN  32   4.309  -6.369   8.353
  225    H    ASN  33           H        ASN  33   6.715  -0.806   7.560
  226    HA   ASN  33           HA       ASN  33   4.912   1.290   8.457
  227   1HB   ASN  33          1HB       ASN  33   6.991   1.306   9.685
  228   2HB   ASN  33          2HB       ASN  33   7.953   1.122   8.210
  229   1HD2  ASN  33          1HD2      ASN  33   8.903   2.873   7.533
  230   2HD2  ASN  33          2HD2      ASN  33   8.384   4.511   7.755
  231    H    ARG  34           H        ARG  34   6.774  -0.054   5.760
  232    HA   ARG  34           HA       ARG  34   6.613   2.338   4.220
  233   1HB   ARG  34          1HB       ARG  34   7.943   1.216   2.645
  234   2HB   ARG  34          2HB       ARG  34   8.425   0.409   4.147
  235   1HG   ARG  34          1HG       ARG  34   8.032  -1.396   2.712
  236   2HG   ARG  34          2HG       ARG  34   6.477  -1.268   3.552
  237   1HD   ARG  34          1HD       ARG  34   5.513  -1.110   1.514
  238   2HD   ARG  34          2HD       ARG  34   6.247   0.493   1.358
  239    HE   ARG  34           HE       ARG  34   8.179  -1.509   0.664
  240   1HH1  ARG  34          1HH1      ARG  34   5.218  -0.058  -0.566
  241   2HH1  ARG  34          2HH1      ARG  34   5.606  -0.365  -2.226
  242   1HH2  ARG  34          1HH2      ARG  34   8.691  -1.915  -1.525
  243   2HH2  ARG  34          2HH2      ARG  34   7.595  -1.429  -2.775
  244    H    GLY  35           H        GLY  35   4.800  -0.671   4.702
  245   1HA   GLY  35          1HA       GLY  35   2.411  -0.378   4.062
  246   2HA   GLY  35          2HA       GLY  35   3.000   0.069   2.473
  247    H    CYS  36           H        CYS  36   4.789  -2.372   4.296
  248    HA   CYS  36           HA       CYS  36   3.596  -4.413   2.561
  249   1HB   CYS  36          1HB       CYS  36   6.462  -4.211   3.495
  250   2HB   CYS  36          2HB       CYS  36   5.780  -5.542   2.556
  251    H    CYS  37           H        CYS  37   4.382  -6.727   3.662
  252    HA   CYS  37           HA       CYS  37   3.780  -6.452   6.517
  253   1HB   CYS  37          1HB       CYS  37   1.919  -7.338   4.983
  254   2HB   CYS  37          2HB       CYS  37   2.891  -8.807   4.867
  255    H    PHE  38           H        PHE  38   5.358  -7.356   7.809
  256    HA   PHE  38           HA       PHE  38   7.524  -8.726   6.505
  257   1HB   PHE  38          1HB       PHE  38   7.652  -6.947   8.361
  258   2HB   PHE  38          2HB       PHE  38   6.931  -8.125   9.463
  259    HD1  PHE  38           HD1      PHE  38   9.874  -7.551   7.267
  260    HD2  PHE  38           HD2      PHE  38   8.296  -9.637  10.608
  261    HE1  PHE  38           HE1      PHE  38  12.164  -8.431   7.799
  262    HE2  PHE  38           HE2      PHE  38  10.585 -10.518  11.140
  263    HZ   PHE  38           HZ       PHE  38  12.492  -9.904   9.730
  264    H    ASP  39           H        ASP  39   7.821 -10.907   6.404
  265    HA   ASP  39           HA       ASP  39   5.803 -12.587   7.362
  266   1HB   ASP  39          1HB       ASP  39   7.007 -13.259   5.411
  267   2HB   ASP  39          2HB       ASP  39   8.578 -13.046   6.200
  268    H    SER  40           H        SER  40   9.150 -13.651   7.888
  269    HA   SER  40           HA       SER  40  10.387 -13.726   9.753
  270   1HB   SER  40          1HB       SER  40   8.779 -11.932  10.748
  271   2HB   SER  40          2HB       SER  40   7.982 -13.299  11.547
  272    HG   SER  40           HG       SER  40  10.554 -13.679  12.021
  273    H    ARG  41           H        ARG  41   7.476 -15.319   8.887
  274    HA   ARG  41           HA       ARG  41   7.787 -17.406  10.824
  275   1HB   ARG  41          1HB       ARG  41   5.909 -17.188   8.425
  276   2HB   ARG  41          2HB       ARG  41   5.780 -18.389   9.721
  277   1HG   ARG  41          1HG       ARG  41   5.887 -15.940  11.074
  278   2HG   ARG  41          2HG       ARG  41   4.890 -15.582   9.652
  279   1HD   ARG  41          1HD       ARG  41   3.143 -16.627  10.622
  280   2HD   ARG  41          2HD       ARG  41   4.064 -18.136  10.705
  281    HE   ARG  41           HE       ARG  41   3.578 -16.245  12.881
  282   1HH1  ARG  41          1HH1      ARG  41   5.760 -18.737  11.690
  283   2HH1  ARG  41          2HH1      ARG  41   6.377 -19.126  13.261
  284   1HH2  ARG  41          1HH2      ARG  41   4.392 -16.757  14.952
  285   2HH2  ARG  41          2HH2      ARG  41   5.595 -17.992  15.129
  286    H    ILE  42           H        ILE  42   7.891 -17.007   7.209
  287    HA   ILE  42           HA       ILE  42   9.526 -19.447   7.121
  288    HB   ILE  42           HB       ILE  42   7.968 -18.404   4.784
  289   1HG1  ILE  42          1HG1      ILE  42   6.892 -19.707   7.227
  290   2HG1  ILE  42          2HG1      ILE  42   6.123 -18.566   6.110
  291   1HG2  ILE  42          1HG2      ILE  42   8.228 -20.535   3.898
  292   2HG2  ILE  42          2HG2      ILE  42   9.782 -20.250   4.721
  293   3HG2  ILE  42          3HG2      ILE  42   8.543 -21.273   5.487
  294   1HD1  ILE  42          1HD1      ILE  42   6.413 -21.563   5.909
  295   2HD1  ILE  42          2HD1      ILE  42   4.988 -20.543   5.595
  296   3HD1  ILE  42          3HD1      ILE  42   6.315 -20.607   4.410
  297    HA   PRO  43           HA       PRO  43  12.484 -16.447   5.883
  298   1HB   PRO  43          1HB       PRO  43  14.685 -18.020   6.263
  299   2HB   PRO  43          2HB       PRO  43  13.971 -17.037   7.539
  300   1HG   PRO  43          1HG       PRO  43  13.807 -19.944   7.068
  301   2HG   PRO  43          2HG       PRO  43  13.498 -19.035   8.591
  302   1HD   PRO  43          1HD       PRO  43  11.596 -20.202   6.797
  303   2HD   PRO  43          2HD       PRO  43  11.238 -19.180   8.196
  304    H    GLY  44           H        GLY  44  11.374 -19.149   4.404
  305   1HA   GLY  44          1HA       GLY  44  13.306 -18.995   2.201
  306   2HA   GLY  44          2HA       GLY  44  12.093 -20.233   2.465
  307    H    VAL  45           H        VAL  45  10.516 -17.377   3.184
  308    HA   VAL  45           HA       VAL  45   9.674 -17.030   0.389
  309    HB   VAL  45           HB       VAL  45   7.473 -16.988   1.001
  310   1HG1  VAL  45          1HG1      VAL  45   8.785 -18.856   3.001
  311   2HG1  VAL  45          2HG1      VAL  45   7.047 -18.857   2.612
  312   3HG1  VAL  45          3HG1      VAL  45   8.242 -19.244   1.351
  313   1HG2  VAL  45          1HG2      VAL  45   8.231 -16.465   3.895
  314   2HG2  VAL  45          2HG2      VAL  45   7.739 -15.220   2.723
  315   3HG2  VAL  45          3HG2      VAL  45   6.589 -16.488   3.209
  316    HA   PRO  46           HA       PRO  46  10.082 -12.750   0.993
  317   1HB   PRO  46          1HB       PRO  46   7.715 -11.559   0.332
  318   2HB   PRO  46          2HB       PRO  46   8.864 -12.150  -0.866
  319   1HG   PRO  46          1HG       PRO  46   6.317 -13.319   0.056
  320   2HG   PRO  46          2HG       PRO  46   7.220 -13.651  -1.466
  321   1HD   PRO  46          1HD       PRO  46   7.031 -15.278   0.883
  322   2HD   PRO  46          2HD       PRO  46   8.059 -15.573  -0.525
  323    H    TRP  47           H        TRP  47  10.585 -11.678   2.787
  324    HA   TRP  47           HA       TRP  47   8.603 -11.859   4.918
  325   1HB   TRP  47          1HB       TRP  47  11.154 -10.533   5.475
  326   2HB   TRP  47          2HB       TRP  47  10.302 -11.794   6.366
  327    HD1  TRP  47           HD1      TRP  47  10.754 -14.399   5.427
  328    HE1  TRP  47           HE1      TRP  47  12.851 -15.537   4.299
  329    HE3  TRP  47           HE3      TRP  47  13.000 -10.064   4.003
  330    HZ2  TRP  47           HZ2      TRP  47  15.162 -14.519   2.969
  331    HZ3  TRP  47           HZ3      TRP  47  15.175 -10.225   2.795
  332    HH2  TRP  47           HH2      TRP  47  16.254 -12.354   2.275
  333    H    CYS  48           H        CYS  48   8.240 -10.192   2.448
  334    HA   CYS  48           HA       CYS  48   7.440  -7.828   3.762
  335   1HB   CYS  48          1HB       CYS  48   9.869  -7.378   3.528
  336   2HB   CYS  48          2HB       CYS  48   9.693  -7.488   1.774
  337    H    PHE  49           H        PHE  49   5.402  -8.110   2.831
  338    HA   PHE  49           HA       PHE  49   5.330  -7.897  -0.080
  339   1HB   PHE  49          1HB       PHE  49   3.209  -9.548   0.441
  340   2HB   PHE  49          2HB       PHE  49   4.810 -10.186   0.053
  341    HD1  PHE  49           HD1      PHE  49   6.389 -10.368   2.225
  342    HD2  PHE  49           HD2      PHE  49   2.146 -10.435   2.260
  343    HE1  PHE  49           HE1      PHE  49   6.426 -11.567   4.430
  344    HE2  PHE  49           HE2      PHE  49   2.183 -11.635   4.465
  345    HZ   PHE  49           HZ       PHE  49   4.322 -12.187   5.523
  346    H    LYS  50           H        LYS  50   2.603  -7.929  -0.497
  347    HA   LYS  50           HA       LYS  50   1.634  -5.830   1.316
  348   1HB   LYS  50          1HB       LYS  50   0.485  -4.887  -0.718
  349   2HB   LYS  50          2HB       LYS  50   2.247  -4.694  -0.668
  350   1HG   LYS  50          1HG       LYS  50   1.735  -7.197  -1.922
  351   2HG   LYS  50          2HG       LYS  50   0.597  -6.046  -2.644
  352   1HD   LYS  50          1HD       LYS  50   2.462  -5.751  -4.002
  353   2HD   LYS  50          2HD       LYS  50   2.746  -4.489  -2.791
  354   1HE   LYS  50          1HE       LYS  50   4.576  -5.556  -1.944
  355   2HE   LYS  50          2HE       LYS  50   3.832  -7.158  -2.059
  356   1HZ   LYS  50          1HZ       LYS  50   5.401  -5.713  -4.002
  357   2HZ   LYS  50          2HZ       LYS  50   5.355  -7.313  -3.683
  358   3HZ   LYS  50          3HZ       LYS  50   4.182  -6.628  -4.589
  359    HA   PRO  51           HA       PRO  51  -1.259  -9.317   1.193
  360   1HB   PRO  51          1HB       PRO  51  -1.366  -9.800   3.879
  361   2HB   PRO  51          2HB       PRO  51  -0.305 -10.683   2.782
  362   1HG   PRO  51          1HG       PRO  51   0.318  -8.526   4.695
  363   2HG   PRO  51          2HG       PRO  51   1.436  -9.727   3.955
  364   1HD   PRO  51          1HD       PRO  51   1.119  -6.956   3.311
  365   2HD   PRO  51          2HD       PRO  51   2.116  -8.131   2.446
  366    H    LEU  52           H        LEU  52  -1.921  -8.226   4.365
  367    HA   LEU  52           HA       LEU  52  -4.363  -7.036   3.322
  368   1HB   LEU  52          1HB       LEU  52  -5.310  -7.418   5.365
  369   2HB   LEU  52          2HB       LEU  52  -4.227  -8.809   5.174
  370    HG   LEU  52           HG       LEU  52  -2.710  -6.875   6.521
  371   1HD1  LEU  52          1HD1      LEU  52  -4.166  -5.485   7.484
  372   2HD1  LEU  52          2HD1      LEU  52  -5.558  -6.524   7.096
  373   3HD1  LEU  52          3HD1      LEU  52  -4.578  -6.854   8.545
  374   1HD2  LEU  52          1HD2      LEU  52  -3.824  -8.728   8.387
  375   2HD2  LEU  52          2HD2      LEU  52  -3.569  -9.564   6.837
  376   3HD2  LEU  52          3HD2      LEU  52  -2.213  -8.727   7.630
  377    H    GLN  53           H        GLN  53  -1.813  -5.689   2.853
  378    HA   GLN  53           HA       GLN  53  -1.225  -3.780   4.708
  379   1HB   GLN  53          1HB       GLN  53  -1.131  -3.632   1.671
  380   2HB   GLN  53          2HB       GLN  53  -0.336  -2.465   2.744
  381   1HG   GLN  53          1HG       GLN  53   0.205  -5.458   2.553
  382   2HG   GLN  53          2HG       GLN  53   1.288  -4.159   2.032
  383   1HE2  GLN  53          1HE2      GLN  53   0.083  -6.065   4.623
  384   2HE2  GLN  53          2HE2      GLN  53   1.064  -5.438   5.904
  385    H    GLU  54           H        GLU  54  -4.109  -4.170   2.823
  386    HA   GLU  54           HA       GLU  54  -4.950  -1.708   2.244
  387   1HB   GLU  54          1HB       GLU  54  -7.096  -2.585   2.176
  388   2HB   GLU  54          2HB       GLU  54  -6.132  -4.073   2.147
  389   1HG   GLU  54          1HG       GLU  54  -7.503  -4.670   3.873
  390   2HG   GLU  54          2HG       GLU  54  -6.388  -3.702   4.848
  391    H    ALA  55           H        ALA  55  -4.330  -3.016   5.446
  392    HA   ALA  55           HA       ALA  55  -5.910  -1.708   7.143
  393   1HB   ALA  55          1HB       ALA  55  -4.350  -2.388   8.621
  394   2HB   ALA  55          2HB       ALA  55  -3.402  -2.951   7.223
  395   3HB   ALA  55          3HB       ALA  55  -3.110  -1.333   7.902
  396    H    GLU  56           H        GLU  56  -2.807  -0.209   5.966
  397    HA   GLU  56           HA       GLU  56  -4.249   2.308   5.872
  398   1HB   GLU  56          1HB       GLU  56  -2.339   3.466   6.954
  399   2HB   GLU  56          2HB       GLU  56  -3.104   2.296   8.043
  400   1HG   GLU  56          1HG       GLU  56  -1.256   0.953   8.096
  401   2HG   GLU  56          2HG       GLU  56  -0.877   1.214   6.385
  402    H    CYS  57           H        CYS  57  -3.264   0.264   3.874
  403    HA   CYS  57           HA       CYS  57  -1.219   1.872   2.543
  404   1HB   CYS  57          1HB       CYS  57  -0.911  -0.627   3.052
  405   2HB   CYS  57          2HB       CYS  57  -2.049  -0.904   1.731
  406    H    THR  58           H        THR  58  -4.308   0.026   2.017
  407    HA   THR  58           HA       THR  58  -4.732   1.301  -0.530
  408    HB   THR  58           HB       THR  58  -5.377  -1.125   0.389
  409    HG1  THR  58           HG1      THR  58  -7.280   0.591  -1.035
  410   1HG2  THR  58          1HG2      THR  58  -6.864  -0.410   2.232
  411   2HG2  THR  58          2HG2      THR  58  -7.780   0.632   1.116
  412   3HG2  THR  58          3HG2      THR  58  -7.846  -1.138   0.938
  413    H    PHE  59           H        PHE  59  -6.048   1.566   2.811
  414    HA   PHE  59           HA       PHE  59  -8.171   3.088   2.581
  415   1HB   PHE  59          1HB       PHE  59  -6.781   2.497   4.649
  416   2HB   PHE  59          2HB       PHE  59  -5.683   3.819   4.238
  417    HD1  PHE  59           HD1      PHE  59  -6.143   6.002   4.959
  418    HD2  PHE  59           HD2      PHE  59  -9.200   3.065   5.153
  419    HE1  PHE  59           HE1      PHE  59  -7.581   7.585   6.274
  420    HE2  PHE  59           HE2      PHE  59 -10.639   4.648   6.467
  421    HZ   PHE  59           HZ       PHE  59  -9.812   6.889   7.011
  422   1H    GLU   1           H1       GLU   1 -21.832   3.580   0.323
  423    HA   GLU   1           HA       GLU   1 -20.200   3.621  -1.108
  424   1HB   GLU   1          1HB       GLU   1 -18.736   4.992   1.172
  425   2HB   GLU   1          2HB       GLU   1 -18.054   4.848  -0.457
  426   1HG   GLU   1          1HG       GLU   1 -19.152   6.759  -0.949
  427   2HG   GLU   1          2HG       GLU   1 -20.653   5.824  -0.888
  428    H    GLU   2           H        GLU   2 -19.620   1.540  -1.631
  429    HA   GLU   2           HA       GLU   2 -18.184  -0.009   0.301
  430   1HB   GLU   2          1HB       GLU   2 -19.252  -0.584  -2.480
  431   2HB   GLU   2          2HB       GLU   2 -18.325  -1.778  -1.557
  432   1HG   GLU   2          1HG       GLU   2 -20.184  -0.969   0.303
  433   2HG   GLU   2          2HG       GLU   2 -21.120  -0.824  -1.191
  434    H    TYR   3           H        TYR   3 -17.255  -0.871  -2.883
  435    HA   TYR   3           HA       TYR   3 -14.560   0.062  -2.351
  436   1HB   TYR   3          1HB       TYR   3 -14.511  -1.293  -4.729
  437   2HB   TYR   3          2HB       TYR   3 -14.545  -2.151  -3.185
  438    HD1  TYR   3           HD1      TYR   3 -16.863  -0.704  -5.756
  439    HD2  TYR   3           HD2      TYR   3 -16.191  -3.761  -2.840
  440    HE1  TYR   3           HE1      TYR   3 -19.020  -1.854  -6.455
  441    HE2  TYR   3           HE2      TYR   3 -18.351  -4.902  -3.548
  442    HH   TYR   3           HH       TYR   3 -20.580  -4.002  -4.654
  443    H    VAL   4           H        VAL   4 -15.325   2.401  -2.645
  444    HA   VAL   4           HA       VAL   4 -15.065   3.049  -5.491
  445    HB   VAL   4           HB       VAL   4 -16.620   5.068  -4.624
  446   1HG1  VAL   4          1HG1      VAL   4 -17.169   4.031  -6.642
  447   2HG1  VAL   4          2HG1      VAL   4 -17.315   2.423  -5.894
  448   3HG1  VAL   4          3HG1      VAL   4 -18.566   3.656  -5.607
  449   1HG2  VAL   4          1HG2      VAL   4 -16.802   3.672  -2.405
  450   2HG2  VAL   4          2HG2      VAL   4 -18.238   4.480  -3.079
  451   3HG2  VAL   4          3HG2      VAL   4 -17.999   2.734  -3.330
  452    H    GLY   5           H        GLY   5 -14.985   4.265  -2.074
  453   1HA   GLY   5          1HA       GLY   5 -13.324   6.491  -2.691
  454   2HA   GLY   5          2HA       GLY   5 -13.700   5.846  -1.106
  455    H    LEU   6           H        LEU   6 -12.630   3.240  -2.963
  456    HA   LEU   6           HA       LEU   6  -9.810   3.764  -2.442
  457   1HB   LEU   6          1HB       LEU   6  -9.649   1.446  -1.474
  458   2HB   LEU   6          2HB       LEU   6 -10.346   2.709  -0.442
  459    HG   LEU   6           HG       LEU   6 -12.554   1.830  -0.750
  460   1HD1  LEU   6          1HD1      LEU   6 -11.296   0.283  -2.977
  461   2HD1  LEU   6          2HD1      LEU   6 -12.684  -0.425  -2.118
  462   3HD1  LEU   6          3HD1      LEU   6 -12.846   1.157  -2.917
  463   1HD2  LEU   6          1HD2      LEU   6 -10.929   0.708   0.863
  464   2HD2  LEU   6          2HD2      LEU   6 -12.389  -0.206   0.414
  465   3HD2  LEU   6          3HD2      LEU   6 -10.824  -0.608  -0.331
  466    H    SER   7           H        SER   7 -11.852   3.491  -4.764
  467    HA   SER   7           HA       SER   7 -10.577   1.222  -6.064
  468   1HB   SER   7          1HB       SER   7 -12.469   0.988  -7.393
  469   2HB   SER   7          2HB       SER   7 -13.188   1.586  -5.888
  470    HG   SER   7           HG       SER   7 -13.995   2.705  -7.781
  471    H    ALA   8           H        ALA   8 -10.372   1.648  -8.614
  472    HA   ALA   8           HA       ALA   8  -8.468   3.655  -8.932
  473   1HB   ALA   8          1HB       ALA   8  -8.803   3.105 -11.394
  474   2HB   ALA   8          2HB       ALA   8  -8.452   1.713 -10.342
  475   3HB   ALA   8          3HB       ALA   8 -10.117   2.017 -10.890
  476    H    ASN   9           H        ASN   9  -9.375   5.633  -8.114
  477    HA   ASN   9           HA       ASN   9 -10.334   7.310  -9.995
  478   1HB   ASN   9          1HB       ASN   9 -12.427   5.607  -9.295
  479   2HB   ASN   9          2HB       ASN   9 -12.723   7.009  -8.254
  480   1HD2  ASN   9          1HD2      ASN   9 -12.163   9.153  -9.545
  481   2HD2  ASN   9          2HD2      ASN   9 -12.992   9.321 -11.056
  482    H    GLN  10           H        GLN  10 -10.316   6.189  -6.607
  483    HA   GLN  10           HA       GLN  10 -10.875   8.607  -5.382
  484   1HB   GLN  10          1HB       GLN  10 -10.754   6.217  -4.404
  485   2HB   GLN  10          2HB       GLN  10  -9.014   6.505  -4.222
  486   1HG   GLN  10          1HG       GLN  10 -10.324   8.816  -3.207
  487   2HG   GLN  10          2HG       GLN  10 -11.223   7.433  -2.567
  488   1HE2  GLN  10          1HE2      GLN  10  -9.118   5.570  -2.517
  489   2HE2  GLN  10          2HE2      GLN  10  -7.992   6.006  -1.276
  490    H    CYS  11           H        CYS  11  -7.916   7.282  -6.840
  491    HA   CYS  11           HA       CYS  11  -6.135   9.063  -5.590
  492   1HB   CYS  11          1HB       CYS  11  -5.397   6.980  -6.568
  493   2HB   CYS  11          2HB       CYS  11  -5.898   7.510  -8.175
  494    H    ALA  12           H        ALA  12  -8.726   9.591  -7.675
  495    HA   ALA  12           HA       ALA  12  -7.403  11.865  -8.979
  496   1HB   ALA  12          1HB       ALA  12 -10.115  10.773  -9.731
  497   2HB   ALA  12          2HB       ALA  12  -8.924  11.628 -10.740
  498   3HB   ALA  12          3HB       ALA  12  -8.638   9.937 -10.266
  499    H    VAL  13           H        VAL  13  -8.719  11.325  -6.125
  500    HA   VAL  13           HA       VAL  13 -11.017  12.655  -5.757
  501    HB   VAL  13           HB       VAL  13  -8.910  11.761  -4.204
  502   1HG1  VAL  13          1HG1      VAL  13  -8.417  13.561  -2.619
  503   2HG1  VAL  13          2HG1      VAL  13  -7.875  13.995  -4.257
  504   3HG1  VAL  13          3HG1      VAL  13  -9.369  14.702  -3.598
  505   1HG2  VAL  13          1HG2      VAL  13 -10.707  11.314  -2.963
  506   2HG2  VAL  13          2HG2      VAL  13 -10.797  13.026  -2.488
  507   3HG2  VAL  13          3HG2      VAL  13 -11.679  12.454  -3.925
  508    HA   PRO  14           HA       PRO  14 -10.462  16.822  -6.758
  509   1HB   PRO  14          1HB       PRO  14 -11.910  18.158  -4.865
  510   2HB   PRO  14          2HB       PRO  14 -12.644  17.356  -6.251
  511   1HG   PRO  14          1HG       PRO  14 -12.508  16.514  -3.426
  512   2HG   PRO  14          2HG       PRO  14 -13.643  15.961  -4.710
  513   1HD   PRO  14          1HD       PRO  14 -11.381  14.587  -3.617
  514   2HD   PRO  14          2HD       PRO  14 -12.371  14.067  -4.988
  515    H    ALA  15           H        ALA  15  -8.397  15.603  -5.059
  516    HA   ALA  15           HA       ALA  15  -6.662  16.217  -3.818
  517   1HB   ALA  15          1HB       ALA  15  -6.945  18.983  -5.013
  518   2HB   ALA  15          2HB       ALA  15  -5.463  18.065  -4.655
  519   3HB   ALA  15          3HB       ALA  15  -6.499  17.587  -6.021
  520    H    LYS  16           H        LYS  16  -8.138  15.973  -1.896
  521    HA   LYS  16           HA       LYS  16  -7.696  17.767   0.024
  522   1HB   LYS  16          1HB       LYS  16 -10.022  18.951   0.104
  523   2HB   LYS  16          2HB       LYS  16  -8.704  19.633  -0.865
  524   1HG   LYS  16          1HG       LYS  16  -9.927  19.421  -2.743
  525   2HG   LYS  16          2HG       LYS  16 -10.171  17.691  -2.448
  526   1HD   LYS  16          1HD       LYS  16 -11.773  19.736  -0.907
  527   2HD   LYS  16          2HD       LYS  16 -12.251  19.323  -2.562
  528   1HE   LYS  16          1HE       LYS  16 -13.293  17.492  -1.766
  529   2HE   LYS  16          2HE       LYS  16 -11.738  16.856  -1.209
  530   1HZ   LYS  16          1HZ       LYS  16 -12.079  18.200   0.805
  531   2HZ   LYS  16          2HZ       LYS  16 -13.577  18.590   0.284
  532   3HZ   LYS  16          3HZ       LYS  16 -13.206  17.034   0.615
  533    H    ASP  17           H        ASP  17  -7.886  15.030  -0.212
  534    HA   ASP  17           HA       ASP  17  -9.846  14.528   1.796
  535   1HB   ASP  17          1HB       ASP  17 -11.024  14.199  -0.447
  536   2HB   ASP  17          2HB       ASP  17  -9.900  12.869  -0.764
  537    H    ARG  18           H        ARG  18  -7.190  13.616  -0.393
  538    HA   ARG  18           HA       ARG  18  -6.580  11.128   0.314
  539   1HB   ARG  18          1HB       ARG  18  -4.626  13.457   0.035
  540   2HB   ARG  18          2HB       ARG  18  -4.172  11.748  -0.091
  541   1HG   ARG  18          1HG       ARG  18  -5.059  11.541  -2.188
  542   2HG   ARG  18          2HG       ARG  18  -6.434  12.603  -1.838
  543   1HD   ARG  18          1HD       ARG  18  -4.826  14.562  -1.935
  544   2HD   ARG  18          2HD       ARG  18  -3.570  13.444  -2.488
  545    HE   ARG  18           HE       ARG  18  -6.115  13.491  -4.015
  546   1HH1  ARG  18          1HH1      ARG  18  -2.743  14.473  -3.804
  547   2HH1  ARG  18          2HH1      ARG  18  -2.615  14.849  -5.490
  548   1HH2  ARG  18          1HH2      ARG  18  -5.947  13.986  -6.238
  549   2HH2  ARG  18          2HH2      ARG  18  -4.450  14.570  -6.884
  550    H    VAL  19           H        VAL  19  -4.476  10.510   1.752
  551    HA   VAL  19           HA       VAL  19  -4.961  11.703   4.391
  552    HB   VAL  19           HB       VAL  19  -3.810   8.978   3.807
  553   1HG1  VAL  19          1HG1      VAL  19  -5.237   8.977   6.215
  554   2HG1  VAL  19          2HG1      VAL  19  -3.469   9.013   6.016
  555   3HG1  VAL  19          3HG1      VAL  19  -4.375  10.534   6.199
  556   1HG2  VAL  19          1HG2      VAL  19  -5.986   7.996   4.034
  557   2HG2  VAL  19          2HG2      VAL  19  -6.723   9.573   4.407
  558   3HG2  VAL  19          3HG2      VAL  19  -6.089   9.249   2.775
  559    H    ASP  20           H        ASP  20  -3.143  12.605   2.104
  560    HA   ASP  20           HA       ASP  20  -1.001  12.994   1.698
  561   1HB   ASP  20          1HB       ASP  20  -1.256  14.923   2.932
  562   2HB   ASP  20          2HB       ASP  20  -1.724  14.056   4.402
  563    H    CYS  21           H        CYS  21   0.013  10.890   1.465
  564    HA   CYS  21           HA       CYS  21   0.616   9.146   3.467
  565   1HB   CYS  21          1HB       CYS  21   0.890   9.042   0.867
  566   2HB   CYS  21          2HB       CYS  21   2.553   9.529   1.215
  567    H    GLY  22           H        GLY  22   2.184  12.195   2.490
  568   1HA   GLY  22          1HA       GLY  22   3.854  13.397   3.391
  569   2HA   GLY  22          2HA       GLY  22   3.460  12.626   4.913
  570    H    TYR  23           H        TYR  23   4.834  11.376   1.784
  571    HA   TYR  23           HA       TYR  23   6.781   9.865   3.303
  572   1HB   TYR  23          1HB       TYR  23   5.285   9.579   0.952
  573   2HB   TYR  23          2HB       TYR  23   6.851  10.078   0.305
  574    HD1  TYR  23           HD1      TYR  23   6.195   7.952   3.304
  575    HD2  TYR  23           HD2      TYR  23   7.605   8.098  -0.733
  576    HE1  TYR  23           HE1      TYR  23   7.022   5.556   3.499
  577    HE2  TYR  23           HE2      TYR  23   8.429   5.702  -0.524
  578    HH   TYR  23           HH       TYR  23   7.753   3.810   2.378
  579    HA   PRO  24           HA       PRO  24   9.886  12.847   2.702
  580   1HB   PRO  24          1HB       PRO  24  12.001  11.416   3.673
  581   2HB   PRO  24          2HB       PRO  24  10.886  12.309   4.705
  582   1HG   PRO  24          1HG       PRO  24  11.075   9.411   4.175
  583   2HG   PRO  24          2HG       PRO  24  10.286  10.252   5.558
  584   1HD   PRO  24          1HD       PRO  24   9.054   9.015   3.287
  585   2HD   PRO  24          2HD       PRO  24   8.245   9.967   4.539
  586    H    HIS  25           H        HIS  25   9.394  10.181   0.904
  587    HA   HIS  25           HA       HIS  25  11.617  10.964  -0.833
  588   1HB   HIS  25          1HB       HIS  25  11.391   8.538   0.483
  589   2HB   HIS  25          2HB       HIS  25  10.766   8.183  -1.131
  590    HD1  HIS  25           HD1      HIS  25  12.648   9.907  -2.864
  591    HD2  HIS  25           HD2      HIS  25  13.938   7.564   0.367
  592    HE1  HIS  25           HE1      HIS  25  15.123   9.436  -3.266
  593    HE2  HIS  25           HE2      HIS  25  15.873   8.039  -1.222
  594    H    VAL  26           H        VAL  26   8.682  11.757  -0.579
  595    HA   VAL  26           HA       VAL  26   7.045  10.587  -2.387
  596    HB   VAL  26           HB       VAL  26   6.204  12.320  -1.081
  597   1HG1  VAL  26          1HG1      VAL  26   7.171  14.754  -1.570
  598   2HG1  VAL  26          2HG1      VAL  26   7.906  13.674  -0.360
  599   3HG1  VAL  26          3HG1      VAL  26   8.629  13.820  -1.981
  600   1HG2  VAL  26          1HG2      VAL  26   4.973  13.545  -2.591
  601   2HG2  VAL  26          2HG2      VAL  26   6.376  13.883  -3.633
  602   3HG2  VAL  26          3HG2      VAL  26   5.613  12.275  -3.662
  603    H    THR  27           H        THR  27   7.088  10.162  -4.535
  604    HA   THR  27           HA       THR  27   8.193  11.978  -6.407
  605    HB   THR  27           HB       THR  27   9.989  10.023  -5.161
  606    HG1  THR  27           HG1      THR  27  10.317  11.855  -7.420
  607   1HG2  THR  27          1HG2      THR  27  11.001   9.657  -7.629
  608   2HG2  THR  27          2HG2      THR  27   9.866   8.480  -6.927
  609   3HG2  THR  27          3HG2      THR  27   9.280   9.701  -8.082
  610    HA   PRO  28           HA       PRO  28   5.560   9.664  -8.879
  611   1HB   PRO  28          1HB       PRO  28   6.394  10.387 -11.377
  612   2HB   PRO  28          2HB       PRO  28   5.340  11.393 -10.385
  613   1HG   PRO  28          1HG       PRO  28   8.222  11.656 -10.958
  614   2HG   PRO  28          2HG       PRO  28   7.075  12.912 -10.367
  615   1HD   PRO  28          1HD       PRO  28   9.078  11.491  -8.891
  616   2HD   PRO  28          2HD       PRO  28   7.868  12.600  -8.232
  617    H    LYS  29           H        LYS  29   7.379   8.020  -7.753
  618    HA   LYS  29           HA       LYS  29   7.357   5.897  -9.534
  619   1HB   LYS  29          1HB       LYS  29   9.002   7.174 -10.805
  620   2HB   LYS  29          2HB       LYS  29  10.059   7.268  -9.387
  621   1HG   LYS  29          1HG       LYS  29  10.848   5.178  -9.736
  622   2HG   LYS  29          2HG       LYS  29   9.222   4.508  -9.955
  623   1HD   LYS  29          1HD       LYS  29  10.205   6.216 -12.180
  624   2HD   LYS  29          2HD       LYS  29  11.113   4.711 -11.947
  625   1HE   LYS  29          1HE       LYS  29   9.471   3.608 -13.026
  626   2HE   LYS  29          2HE       LYS  29   8.347   4.036 -11.726
  627   1HZ   LYS  29          1HZ       LYS  29   7.511   4.839 -13.766
  628   2HZ   LYS  29          2HZ       LYS  29   8.011   6.145 -12.924
  629   3HZ   LYS  29          3HZ       LYS  29   8.914   5.577 -14.160
  630    H    GLU  30           H        GLU  30   8.310   7.590  -6.649
  631    HA   GLU  30           HA       GLU  30   9.228   5.120  -5.450
  632   1HB   GLU  30          1HB       GLU  30   9.743   7.953  -5.044
  633   2HB   GLU  30          2HB       GLU  30   9.283   7.184  -3.516
  634   1HG   GLU  30          1HG       GLU  30  11.591   6.830  -3.556
  635   2HG   GLU  30          2HG       GLU  30  11.001   5.319  -4.260
  636    H    CYS  31           H        CYS  31   6.697   7.673  -5.143
  637    HA   CYS  31           HA       CYS  31   5.484   6.654  -2.866
  638   1HB   CYS  31          1HB       CYS  31   4.485   8.342  -5.144
  639   2HB   CYS  31          2HB       CYS  31   3.431   7.871  -3.809
  640    H    ASN  32           H        ASN  32   4.602   6.284  -6.385
  641    HA   ASN  32           HA       ASN  32   2.619   4.418  -5.916
  642   1HB   ASN  32          1HB       ASN  32   4.204   5.398  -8.248
  643   2HB   ASN  32          2HB       ASN  32   3.486   3.795  -8.463
  644   1HD2  ASN  32          1HD2      ASN  32   2.564   6.878  -6.922
  645   2HD2  ASN  32          2HD2      ASN  32   1.003   7.031  -7.656
  646    H    ASN  33           H        ASN  33   5.943   4.196  -5.372
  647    HA   ASN  33           HA       ASN  33   6.065   1.397  -6.126
  648   1HB   ASN  33          1HB       ASN  33   7.979   2.627  -6.909
  649   2HB   ASN  33          2HB       ASN  33   8.180   3.462  -5.362
  650   1HD2  ASN  33          1HD2      ASN  33   9.871   2.798  -4.301
  651   2HD2  ASN  33          2HD2      ASN  33  10.489   1.184  -4.201
  652    H    ARG  34           H        ARG  34   5.942   3.707  -3.442
  653    HA   ARG  34           HA       ARG  34   6.745   1.716  -1.539
  654   1HB   ARG  34          1HB       ARG  34   6.999   3.465  -0.044
  655   2HB   ARG  34          2HB       ARG  34   7.129   4.389  -1.551
  656   1HG   ARG  34          1HG       ARG  34   5.519   5.654  -0.501
  657   2HG   ARG  34          2HG       ARG  34   4.443   4.463  -1.255
  658   1HD   ARG  34          1HD       ARG  34   5.244   3.261   1.157
  659   2HD   ARG  34          2HD       ARG  34   4.994   4.960   1.589
  660    HE   ARG  34           HE       ARG  34   2.810   4.087  -0.037
  661   1HH1  ARG  34          1HH1      ARG  34   4.141   3.576   3.180
  662   2HH1  ARG  34          2HH1      ARG  34   2.611   3.182   3.890
  663   1HH2  ARG  34          1HH2      ARG  34   0.791   3.567   0.900
  664   2HH2  ARG  34          2HH2      ARG  34   0.692   3.177   2.584
  665    H    GLY  35           H        GLY  35   3.842   3.145  -2.941
  666   1HA   GLY  35          1HA       GLY  35   1.872   1.677  -2.675
  667   2HA   GLY  35          2HA       GLY  35   2.183   1.715  -0.950
  668    H    CYS  36           H        CYS  36   2.876   4.637  -2.796
  669    HA   CYS  36           HA       CYS  36   0.401   5.793  -1.733
  670   1HB   CYS  36          1HB       CYS  36   3.120   7.073  -2.025
  671   2HB   CYS  36          2HB       CYS  36   1.645   7.939  -1.591
  672    H    CYS  37           H        CYS  37  -0.178   7.891  -3.072
  673    HA   CYS  37           HA       CYS  37   0.276   7.231  -5.890
  674   1HB   CYS  37          1HB       CYS  37  -2.070   7.086  -4.873
  675   2HB   CYS  37          2HB       CYS  37  -2.037   8.852  -4.847
  676    H    PHE  38           H        PHE  38   1.175   8.839  -7.202
  677    HA   PHE  38           HA       PHE  38   2.126  11.189  -5.811
  678   1HB   PHE  38          1HB       PHE  38   3.434   9.623  -7.416
  679   2HB   PHE  38          2HB       PHE  38   2.444  10.272  -8.728
  680    HD1  PHE  38           HD1      PHE  38   4.901  11.216  -6.114
  681    HD2  PHE  38           HD2      PHE  38   3.031  12.294  -9.768
  682    HE1  PHE  38           HE1      PHE  38   6.530  13.106  -6.390
  683    HE2  PHE  38           HE2      PHE  38   4.660  14.185 -10.044
  684    HZ   PHE  38           HZ       PHE  38   6.389  14.567  -8.353
  685    H    ASP  39           H        ASP  39   1.223  13.192  -5.958
  686    HA   ASP  39           HA       ASP  39  -1.180  13.506  -7.324
  687   1HB   ASP  39          1HB       ASP  39  -0.806  14.864  -5.409
  688   2HB   ASP  39          2HB       ASP  39   0.774  15.411  -5.990
  689    H    SER  40           H        SER  40   1.197  16.115  -7.718
  690    HA   SER  40           HA       SER  40   2.428  16.752  -9.455
  691   1HB   SER  40          1HB       SER  40   2.260  14.257 -10.258
  692   2HB   SER  40          2HB       SER  40   1.043  14.878 -11.388
  693    HG   SER  40           HG       SER  40   2.834  16.542 -11.892
  694    H    ARG  41           H        ARG  41  -0.919  16.584  -9.023
  695    HA   ARG  41           HA       ARG  41  -1.541  18.183 -11.326
  696   1HB   ARG  41          1HB       ARG  41  -3.367  17.389  -9.016
  697   2HB   ARG  41          2HB       ARG  41  -3.872  17.940 -10.623
  698   1HG   ARG  41          1HG       ARG  41  -2.234  15.787 -11.216
  699   2HG   ARG  41          2HG       ARG  41  -3.008  15.254  -9.712
  700   1HD   ARG  41          1HD       ARG  41  -5.016  14.973 -10.737
  701   2HD   ARG  41          2HD       ARG  41  -4.903  16.517 -11.595
  702    HE   ARG  41           HE       ARG  41  -3.072  14.580 -12.715
  703   1HH1  ARG  41          1HH1      ARG  41  -6.484  15.437 -12.620
  704   2HH1  ARG  41          2HH1      ARG  41  -6.838  14.719 -14.156
  705   1HH2  ARG  41          1HH2      ARG  41  -3.539  13.634 -14.742
  706   2HH2  ARG  41          2HH2      ARG  41  -5.152  13.687 -15.372
  707    H    ILE  42           H        ILE  42  -1.864  18.396  -7.702
  708    HA   ILE  42           HA       ILE  42  -1.651  21.312  -7.998
  709    HB   ILE  42           HB       ILE  42  -3.052  20.146  -5.654
  710   1HG1  ILE  42          1HG1      ILE  42  -4.297  20.301  -8.408
  711   2HG1  ILE  42          2HG1      ILE  42  -4.016  18.829  -7.460
  712   1HG2  ILE  42          1HG2      ILE  42  -4.448  22.186  -5.990
  713   2HG2  ILE  42          2HG2      ILE  42  -2.721  22.520  -5.717
  714   3HG2  ILE  42          3HG2      ILE  42  -3.399  22.624  -7.360
  715   1HD1  ILE  42          1HD1      ILE  42  -6.271  19.293  -6.998
  716   2HD1  ILE  42          2HD1      ILE  42  -5.455  20.084  -5.628
  717   3HD1  ILE  42          3HD1      ILE  42  -6.015  21.054  -7.011
  718    HA   PRO  43           HA       PRO  43   1.878  20.655  -5.548
  719   1HB   PRO  43          1HB       PRO  43   2.678  23.260  -5.353
  720   2HB   PRO  43          2HB       PRO  43   3.077  22.229  -6.725
  721   1HG   PRO  43          1HG       PRO  43   1.068  24.377  -6.488
  722   2HG   PRO  43          2HG       PRO  43   1.794  23.678  -7.980
  723   1HD   PRO  43          1HD       PRO  43  -0.818  23.233  -6.894
  724   2HD   PRO  43          2HD       PRO  43  -0.094  22.399  -8.275
  725    H    GLY  44           H        GLY  44  -0.917  22.282  -4.659
  726   1HA   GLY  44          1HA       GLY  44   0.029  22.855  -1.962
  727   2HA   GLY  44          2HA       GLY  44  -1.541  23.225  -2.649
  728    H    VAL  45           H        VAL  45  -1.154  20.150  -3.705
  729    HA   VAL  45           HA       VAL  45  -2.472  19.072  -1.320
  730    HB   VAL  45           HB       VAL  45  -3.217  19.129  -3.982
  731   1HG1  VAL  45          1HG1      VAL  45  -3.238  16.747  -4.684
  732   2HG1  VAL  45          2HG1      VAL  45  -1.596  17.427  -4.597
  733   3HG1  VAL  45          3HG1      VAL  45  -2.184  16.354  -3.305
  734   1HG2  VAL  45          1HG2      VAL  45  -4.172  18.070  -1.463
  735   2HG2  VAL  45          2HG2      VAL  45  -5.092  18.709  -2.846
  736   3HG2  VAL  45          3HG2      VAL  45  -4.625  16.992  -2.805
  737    HA   PRO  46           HA       PRO  46   0.681  16.165  -0.764
  738   1HB   PRO  46          1HB       PRO  46  -0.596  13.814  -0.218
  739   2HB   PRO  46          2HB       PRO  46  -0.408  15.105   0.966
  740   1HG   PRO  46          1HG       PRO  46  -2.771  14.309  -0.611
  741   2HG   PRO  46          2HG       PRO  46  -2.707  15.276   0.907
  742   1HD   PRO  46          1HD       PRO  46  -3.154  16.190  -1.771
  743   2HD   PRO  46          2HD       PRO  46  -2.941  17.198  -0.333
  744    H    TRP  47           H        TRP  47   2.160  15.636  -2.232
  745    HA   TRP  47           HA       TRP  47   1.173  14.339  -4.622
  746   1HB   TRP  47          1HB       TRP  47   4.057  14.709  -4.348
  747   2HB   TRP  47          2HB       TRP  47   2.959  15.196  -5.642
  748    HD1  TRP  47           HD1      TRP  47   1.619  17.632  -5.165
  749    HE1  TRP  47           HE1      TRP  47   2.367  19.836  -3.922
  750    HE3  TRP  47           HE3      TRP  47   5.403  15.488  -2.529
  751    HZ2  TRP  47           HZ2      TRP  47   4.410  20.423  -2.019
  752    HZ3  TRP  47           HZ3      TRP  47   6.725  16.948  -1.000
  753    HH2  TRP  47           HH2      TRP  47   6.281  19.336  -0.724
  754    H    CYS  48           H        CYS  48   1.015  12.956  -1.981
  755    HA   CYS  48           HA       CYS  48   2.046  10.482  -2.814
  756   1HB   CYS  48          1HB       CYS  48   4.107  11.767  -1.915
  757   2HB   CYS  48          2HB       CYS  48   3.418  11.442  -0.321
  758    H    PHE  49           H        PHE  49  -0.105   9.802  -2.399
  759    HA   PHE  49           HA       PHE  49  -0.804   9.762   0.444
  760   1HB   PHE  49          1HB       PHE  49  -3.238   9.884  -0.782
  761   2HB   PHE  49          2HB       PHE  49  -2.375  11.350  -0.307
  762    HD1  PHE  49           HD1      PHE  49  -0.569  12.082  -2.208
  763    HD2  PHE  49           HD2      PHE  49  -4.142   9.894  -2.879
  764    HE1  PHE  49           HE1      PHE  49  -0.591  12.853  -4.596
  765    HE2  PHE  49           HE2      PHE  49  -4.164  10.664  -5.269
  766    HZ   PHE  49           HZ       PHE  49  -2.389  12.134  -6.098
  767    H    LYS  50           H        LYS  50  -3.128   8.284   0.351
  768    HA   LYS  50           HA       LYS  50  -2.350   5.875  -1.137
  769   1HB   LYS  50          1HB       LYS  50  -3.172   4.568   0.831
  770   2HB   LYS  50          2HB       LYS  50  -1.665   5.462   1.106
  771   1HG   LYS  50          1HG       LYS  50  -3.818   7.214   1.771
  772   2HG   LYS  50          2HG       LYS  50  -4.190   5.651   2.521
  773   1HD   LYS  50          1HD       LYS  50  -2.875   7.032   4.056
  774   2HD   LYS  50          2HD       LYS  50  -1.903   5.640   3.545
  775   1HE   LYS  50          1HE       LYS  50  -0.397   7.428   3.332
  776   2HE   LYS  50          2HE       LYS  50  -1.013   7.271   1.679
  777   1HZ   LYS  50          1HZ       LYS  50  -2.627   9.003   2.267
  778   2HZ   LYS  50          2HZ       LYS  50  -1.898   9.192   3.716
  779   3HZ   LYS  50          3HZ       LYS  50  -1.082   9.528   2.341
  780    HA   PRO  51           HA       PRO  51  -6.616   7.103  -2.048
  781   1HB   PRO  51          1HB       PRO  51  -6.383   7.248  -4.766
  782   2HB   PRO  51          2HB       PRO  51  -6.236   8.651  -3.711
  783   1HG   PRO  51          1HG       PRO  51  -4.148   7.096  -5.098
  784   2HG   PRO  51          2HG       PRO  51  -4.051   8.768  -4.438
  785   1HD   PRO  51          1HD       PRO  51  -2.947   6.358  -3.352
  786   2HD   PRO  51          2HD       PRO  51  -2.960   7.952  -2.585
  787    H    LEU  52           H        LEU  52  -5.843   5.593  -5.024
  788    HA   LEU  52           HA       LEU  52  -7.387   3.291  -4.112
  789   1HB   LEU  52          1HB       LEU  52  -8.055   2.982  -6.249
  790   2HB   LEU  52          2HB       LEU  52  -7.870   4.746  -6.211
  791    HG   LEU  52           HG       LEU  52  -5.383   3.708  -7.047
  792   1HD1  LEU  52          1HD1      LEU  52  -7.667   2.076  -8.016
  793   2HD1  LEU  52          2HD1      LEU  52  -6.466   2.582  -9.227
  794   3HD1  LEU  52          3HD1      LEU  52  -5.952   1.650  -7.800
  795   1HD2  LEU  52          1HD2      LEU  52  -6.749   4.627  -9.320
  796   2HD2  LEU  52          2HD2      LEU  52  -7.434   5.531  -7.949
  797   3HD2  LEU  52          3HD2      LEU  52  -5.679   5.554  -8.241
  798    H    GLN  53           H        GLN  53  -4.670   3.678  -3.137
  799    HA   GLN  53           HA       GLN  53  -2.719   2.471  -4.526
  800   1HB   GLN  53          1HB       GLN  53  -3.355   2.227  -1.563
  801   2HB   GLN  53          2HB       GLN  53  -1.799   1.765  -2.277
  802   1HG   GLN  53          1HG       GLN  53  -3.069   4.536  -2.370
  803   2HG   GLN  53          2HG       GLN  53  -1.725   4.061  -1.322
  804   1HE2  GLN  53          1HE2      GLN  53  -0.388   2.390  -3.172
  805   2HE2  GLN  53          2HE2      GLN  53   0.327   3.373  -4.407
  806    H    GLU  54           H        GLU  54  -5.664   1.027  -3.319
  807    HA   GLU  54           HA       GLU  54  -5.114  -1.492  -2.770
  808   1HB   GLU  54          1HB       GLU  54  -7.291  -2.084  -3.575
  809   2HB   GLU  54          2HB       GLU  54  -7.398  -0.400  -3.032
  810   1HG   GLU  54          1HG       GLU  54  -8.222   0.102  -5.071
  811   2HG   GLU  54          2HG       GLU  54  -6.619  -0.235  -5.740
  812    H    ALA  55           H        ALA  55  -4.547   0.097  -5.860
  813    HA   ALA  55           HA       ALA  55  -4.597  -1.694  -7.773
  814   1HB   ALA  55          1HB       ALA  55  -2.310  -0.768  -8.493
  815   2HB   ALA  55          2HB       ALA  55  -3.593   0.424  -8.180
  816   3HB   ALA  55          3HB       ALA  55  -2.323   0.145  -6.966
  817    H    GLU  56           H        GLU  56  -1.668  -1.545  -5.616
  818    HA   GLU  56           HA       GLU  56  -1.610  -4.450  -5.808
  819   1HB   GLU  56          1HB       GLU  56   0.626  -2.481  -6.321
  820   2HB   GLU  56          2HB       GLU  56   0.988  -4.133  -5.792
  821   1HG   GLU  56          1HG       GLU  56  -0.964  -4.273  -7.895
  822   2HG   GLU  56          2HG       GLU  56   0.327  -3.188  -8.436
  823    H    CYS  57           H        CYS  57  -2.430  -2.206  -3.786
  824    HA   CYS  57           HA       CYS  57  -0.559  -2.832  -1.651
  825   1HB   CYS  57          1HB       CYS  57  -2.243  -0.592  -2.321
  826   2HB   CYS  57          2HB       CYS  57  -2.596  -1.152  -0.684
  827    H    THR  58           H        THR  58  -4.093  -2.189  -1.390
  828    HA   THR  58           HA       THR  58  -4.708  -3.903   0.568
  829    HB   THR  58           HB       THR  58  -6.105  -2.251  -1.064
  830    HG1  THR  58           HG1      THR  58  -7.921  -3.211   0.118
  831   1HG2  THR  58          1HG2      THR  58  -6.923  -5.094  -1.868
  832   2HG2  THR  58          2HG2      THR  58  -7.837  -3.613  -2.244
  833   3HG2  THR  58          3HG2      THR  58  -6.231  -3.875  -2.965
  834    H    PHE  59           H        PHE  59  -3.952  -4.802  -2.788
  835    HA   PHE  59           HA       PHE  59  -4.952  -7.202  -3.156
  836   1HB   PHE  59          1HB       PHE  59  -2.599  -5.729  -3.852
  837   2HB   PHE  59          2HB       PHE  59  -2.011  -7.330  -3.392
  838    HD1  PHE  59           HD1      PHE  59  -4.657  -5.749  -5.503
  839    HD2  PHE  59           HD2      PHE  59  -1.917  -8.954  -5.028
  840    HE1  PHE  59           HE1      PHE  59  -5.274  -6.614  -7.777
  841    HE2  PHE  59           HE2      PHE  59  -2.533  -9.819  -7.302
  842    HZ   PHE  59           HZ       PHE  59  -4.205  -8.638  -8.650
  Start of MODEL   26
    1   1H    GLU   1           H1       GLU   1 -15.774  -6.150  -2.373
    2    HA   GLU   1           HA       GLU   1 -17.261  -8.505  -2.801
    3   1HB   GLU   1          1HB       GLU   1 -14.807  -7.387  -3.676
    4   2HB   GLU   1          2HB       GLU   1 -14.392  -8.940  -2.931
    5   1HG   GLU   1          1HG       GLU   1 -15.655 -10.159  -4.467
    6   2HG   GLU   1          2HG       GLU   1 -16.750  -8.811  -4.814
    7    H    GLU   2           H        GLU   2 -15.836 -10.692  -2.108
    8    HA   GLU   2           HA       GLU   2 -16.301 -10.832   0.655
    9   1HB   GLU   2          1HB       GLU   2 -15.207 -12.697  -1.445
   10   2HB   GLU   2          2HB       GLU   2 -15.096 -13.155   0.264
   11   1HG   GLU   2          1HG       GLU   2 -17.215 -13.913   0.089
   12   2HG   GLU   2          2HG       GLU   2 -17.740 -12.228  -0.054
   13    H    TYR   3           H        TYR   3 -14.826  -8.968   1.254
   14    HA   TYR   3           HA       TYR   3 -12.085  -9.030   0.917
   15   1HB   TYR   3          1HB       TYR   3 -12.354  -7.744   3.253
   16   2HB   TYR   3          2HB       TYR   3 -13.085  -7.041   1.805
   17    HD1  TYR   3           HD1      TYR   3 -14.562 -10.035   3.323
   18    HD2  TYR   3           HD2      TYR   3 -14.670  -5.760   3.182
   19    HE1  TYR   3           HE1      TYR   3 -16.829 -10.047   4.476
   20    HE2  TYR   3           HE2      TYR   3 -16.936  -5.787   4.334
   21    HH   TYR   3           HH       TYR   3 -18.907  -7.919   4.380
   22    H    VAL   4           H        VAL   4 -11.451 -11.302   1.154
   23    HA   VAL   4           HA       VAL   4 -10.995 -11.931   3.974
   24    HB   VAL   4           HB       VAL   4 -11.563 -14.243   3.611
   25   1HG1  VAL   4          1HG1      VAL   4 -13.697 -12.247   2.819
   26   2HG1  VAL   4          2HG1      VAL   4 -14.050 -13.969   3.097
   27   3HG1  VAL   4          3HG1      VAL   4 -13.392 -12.973   4.416
   28   1HG2  VAL   4          1HG2      VAL   4 -10.986 -14.619   1.332
   29   2HG2  VAL   4          2HG2      VAL   4 -12.738 -14.905   1.462
   30   3HG2  VAL   4          3HG2      VAL   4 -12.134 -13.383   0.762
   31    H    GLY   5           H        GLY   5 -10.283 -12.878   0.538
   32   1HA   GLY   5          1HA       GLY   5  -7.817 -14.073   1.019
   33   2HA   GLY   5          2HA       GLY   5  -8.343 -13.352  -0.490
   34    H    LEU   6           H        LEU   6  -8.753 -10.768   1.416
   35    HA   LEU   6           HA       LEU   6  -5.927 -10.034   1.540
   36   1HB   LEU   6          1HB       LEU   6  -7.715  -7.926   0.568
   37   2HB   LEU   6          2HB       LEU   6  -6.056  -8.334   0.098
   38    HG   LEU   6           HG       LEU   6  -7.570  -8.548  -1.783
   39   1HD1  LEU   6          1HD1      LEU   6  -6.334 -10.225  -2.540
   40   2HD1  LEU   6          2HD1      LEU   6  -5.802 -10.541  -0.872
   41   3HD1  LEU   6          3HD1      LEU   6  -7.218 -11.395  -1.531
   42   1HD2  LEU   6          1HD2      LEU   6  -9.057 -10.884  -0.814
   43   2HD2  LEU   6          2HD2      LEU   6  -9.450  -9.373   0.040
   44   3HD2  LEU   6          3HD2      LEU   6  -9.611  -9.461  -1.730
   45    H    SER   7           H        SER   7  -8.036 -10.891   3.507
   46    HA   SER   7           HA       SER   7  -8.340  -8.367   4.924
   47   1HB   SER   7          1HB       SER   7 -10.364  -9.830   4.433
   48   2HB   SER   7          2HB       SER   7  -9.693 -11.021   5.561
   49    HG   SER   7           HG       SER   7 -10.826  -8.452   6.050
   50    H    ALA   8           H        ALA   8  -6.800  -7.976   6.469
   51    HA   ALA   8           HA       ALA   8  -4.898  -8.516   7.622
   52   1HB   ALA   8          1HB       ALA   8  -7.348  -9.553   9.067
   53   2HB   ALA   8          2HB       ALA   8  -5.742  -9.576   9.836
   54   3HB   ALA   8          3HB       ALA   8  -6.460  -8.030   9.321
   55    H    ASN   9           H        ASN   9  -6.851 -11.506   8.240
   56    HA   ASN   9           HA       ASN   9  -4.941 -13.249   8.583
   57   1HB   ASN   9          1HB       ASN   9  -7.551 -13.538   8.222
   58   2HB   ASN   9          2HB       ASN   9  -7.095 -14.004   6.576
   59   1HD2  ASN   9          1HD2      ASN   9  -5.324 -15.643   6.428
   60   2HD2  ASN   9          2HD2      ASN   9  -5.351 -16.979   7.530
   61    H    GLN  10           H        GLN  10  -5.654 -11.528   5.583
   62    HA   GLN  10           HA       GLN  10  -4.590 -13.227   3.724
   63   1HB   GLN  10          1HB       GLN  10  -5.003 -11.511   2.321
   64   2HB   GLN  10          2HB       GLN  10  -5.637 -10.657   3.740
   65   1HG   GLN  10          1HG       GLN  10  -3.444  -9.635   4.137
   66   2HG   GLN  10          2HG       GLN  10  -2.727 -10.567   2.814
   67   1HE2  GLN  10          1HE2      GLN  10  -2.799  -9.807   0.814
   68   2HE2  GLN  10          2HE2      GLN  10  -3.648  -8.392   0.286
   69    H    CYS  11           H        CYS  11  -2.963 -10.759   5.804
   70    HA   CYS  11           HA       CYS  11  -0.441 -11.041   4.654
   71   1HB   CYS  11          1HB       CYS  11  -0.888  -9.132   5.956
   72   2HB   CYS  11          2HB       CYS  11  -1.365 -10.089   7.361
   73    H    ALA  12           H        ALA  12  -2.378 -13.288   6.277
   74    HA   ALA  12           HA       ALA  12  -0.048 -14.700   7.376
   75   1HB   ALA  12          1HB       ALA  12  -2.442 -15.958   8.190
   76   2HB   ALA  12          2HB       ALA  12  -1.377 -14.927   9.176
   77   3HB   ALA  12          3HB       ALA  12  -2.757 -14.210   8.309
   78    H    VAL  13           H        VAL  13  -1.229 -14.414   4.481
   79    HA   VAL  13           HA       VAL  13  -2.467 -16.653   3.621
   80    HB   VAL  13           HB       VAL  13  -1.127 -14.502   2.515
   81   1HG1  VAL  13          1HG1      VAL  13   0.294 -15.486   0.736
   82   2HG1  VAL  13          2HG1      VAL  13   0.966 -15.734   2.366
   83   3HG1  VAL  13          3HG1      VAL  13   0.150 -17.075   1.525
   84   1HG2  VAL  13          1HG2      VAL  13  -3.035 -16.516   1.744
   85   2HG2  VAL  13          2HG2      VAL  13  -2.848 -14.852   1.142
   86   3HG2  VAL  13          3HG2      VAL  13  -1.941 -16.179   0.381
   87    HA   PRO  14           HA       PRO  14   0.232 -20.003   4.046
   88   1HB   PRO  14          1HB       PRO  14  -0.071 -21.436   1.740
   89   2HB   PRO  14          2HB       PRO  14  -1.236 -21.479   3.063
   90   1HG   PRO  14          1HG       PRO  14  -1.365 -20.085   0.465
   91   2HG   PRO  14          2HG       PRO  14  -2.714 -20.518   1.575
   92   1HD   PRO  14          1HD       PRO  14  -1.520 -17.952   1.141
   93   2HD   PRO  14          2HD       PRO  14  -2.737 -18.357   2.359
   94    H    ALA  15           H        ALA  15   1.376 -17.522   2.917
   95    HA   ALA  15           HA       ALA  15   3.265 -16.833   1.984
   96   1HB   ALA  15          1HB       ALA  15   4.551 -19.492   2.569
   97   2HB   ALA  15          2HB       ALA  15   5.180 -17.847   2.824
   98   3HB   ALA  15          3HB       ALA  15   3.943 -18.505   3.921
   99    H    LYS  16           H        LYS  16   1.976 -17.004  -0.107
  100    HA   LYS  16           HA       LYS  16   3.505 -17.784  -2.172
  101   1HB   LYS  16          1HB       LYS  16   2.153 -19.936  -2.856
  102   2HB   LYS  16          2HB       LYS  16   3.604 -20.045  -1.843
  103   1HG   LYS  16          1HG       LYS  16   2.410 -20.880  -0.120
  104   2HG   LYS  16          2HG       LYS  16   1.222 -19.569  -0.214
  105   1HD   LYS  16          1HD       LYS  16   1.266 -22.075  -1.948
  106   2HD   LYS  16          2HD       LYS  16   0.173 -21.798  -0.580
  107   1HE   LYS  16          1HE       LYS  16  -0.437 -19.595  -1.933
  108   2HE   LYS  16          2HE       LYS  16   0.206 -20.501  -3.313
  109   1HZ   LYS  16          1HZ       LYS  16  -1.976 -21.105  -3.273
  110   2HZ   LYS  16          2HZ       LYS  16  -1.335 -22.320  -2.390
  111   3HZ   LYS  16          3HZ       LYS  16  -2.104 -21.088  -1.646
  112    H    ASP  17           H        ASP  17   1.744 -15.717  -1.422
  113    HA   ASP  17           HA       ASP  17   0.093 -15.736  -3.741
  114   1HB   ASP  17          1HB       ASP  17  -1.268 -16.812  -1.833
  115   2HB   ASP  17          2HB       ASP  17  -1.245 -15.224  -1.052
  116    H    ARG  18           H        ARG  18   2.332 -14.346  -1.903
  117    HA   ARG  18           HA       ARG  18   1.133 -11.748  -1.638
  118   1HB   ARG  18          1HB       ARG  18   4.013 -12.574  -1.072
  119   2HB   ARG  18          2HB       ARG  18   3.182 -11.136  -0.454
  120   1HG   ARG  18          1HG       ARG  18   2.133 -12.308   1.196
  121   2HG   ARG  18          2HG       ARG  18   1.831 -13.714   0.161
  122   1HD   ARG  18          1HD       ARG  18   4.077 -14.533   0.499
  123   2HD   ARG  18          2HD       ARG  18   4.589 -13.025   1.271
  124    HE   ARG  18           HE       ARG  18   2.363 -14.446   2.590
  125   1HH1  ARG  18          1HH1      ARG  18   5.836 -13.895   2.461
  126   2HH1  ARG  18          2HH1      ARG  18   6.114 -14.449   4.078
  127   1HH2  ARG  18          1HH2      ARG  18   2.729 -15.176   4.725
  128   2HH2  ARG  18          2HH2      ARG  18   4.333 -15.182   5.375
  129    H    VAL  19           H        VAL  19   2.897  -9.866  -2.291
  130    HA   VAL  19           HA       VAL  19   3.536 -10.429  -5.098
  131    HB   VAL  19           HB       VAL  19   3.246  -7.721  -3.812
  132   1HG1  VAL  19          1HG1      VAL  19   3.935  -7.110  -5.855
  133   2HG1  VAL  19          2HG1      VAL  19   3.724  -8.753  -6.506
  134   3HG1  VAL  19          3HG1      VAL  19   2.337  -7.637  -6.436
  135   1HG2  VAL  19          1HG2      VAL  19   1.095  -9.604  -4.761
  136   2HG2  VAL  19          2HG2      VAL  19   1.144  -8.583  -3.304
  137   3HG2  VAL  19          3HG2      VAL  19   0.882  -7.842  -4.901
  138    H    ASP  20           H        ASP  20   5.118 -11.060  -2.531
  139    HA   ASP  20           HA       ASP  20   7.096 -10.637  -1.627
  140   1HB   ASP  20          1HB       ASP  20   7.942 -12.170  -3.128
  141   2HB   ASP  20          2HB       ASP  20   7.428 -11.238  -4.543
  142    H    CYS  21           H        CYS  21   6.897  -8.385  -0.908
  143    HA   CYS  21           HA       CYS  21   7.073  -6.161  -2.454
  144   1HB   CYS  21          1HB       CYS  21   6.829  -6.629   0.177
  145   2HB   CYS  21          2HB       CYS  21   8.497  -6.051   0.145
  146    H    GLY  22           H        GLY  22   9.637  -8.369  -1.274
  147   1HA   GLY  22          1HA       GLY  22  11.878  -8.387  -1.581
  148   2HA   GLY  22          2HA       GLY  22  11.451  -8.016  -3.239
  149    H    TYR  23           H        TYR  23  11.677  -6.278  -0.045
  150    HA   TYR  23           HA       TYR  23  12.563  -3.900  -1.462
  151   1HB   TYR  23          1HB       TYR  23  11.269  -4.740   1.054
  152   2HB   TYR  23          2HB       TYR  23  12.613  -3.647   1.401
  153    HD1  TYR  23           HD1      TYR  23  12.390  -1.310   1.064
  154    HD2  TYR  23           HD2      TYR  23   9.432  -3.969  -0.510
  155    HE1  TYR  23           HE1      TYR  23  10.894   0.670   0.510
  156    HE2  TYR  23           HE2      TYR  23   7.946  -1.981  -1.059
  157    HH   TYR  23           HH       TYR  23   7.627   0.286  -0.310
  158    HA   PRO  24           HA       PRO  24  16.731  -4.494  -0.459
  159   1HB   PRO  24          1HB       PRO  24  17.660  -1.929  -0.593
  160   2HB   PRO  24          2HB       PRO  24  17.401  -2.937  -2.015
  161   1HG   PRO  24          1HG       PRO  24  15.777  -0.720  -0.939
  162   2HG   PRO  24          2HG       PRO  24  15.781  -1.405  -2.605
  163   1HD   PRO  24          1HD       PRO  24  13.843  -1.780  -0.530
  164   2HD   PRO  24          2HD       PRO  24  13.885  -2.600  -2.095
  165    H    HIS  25           H        HIS  25  14.621  -2.878   1.552
  166    HA   HIS  25           HA       HIS  25  16.651  -2.992   3.660
  167   1HB   HIS  25          1HB       HIS  25  15.238  -0.735   2.720
  168   2HB   HIS  25          2HB       HIS  25  14.542  -1.137   4.294
  169    HD1  HIS  25           HD1      HIS  25  16.385   1.406   3.616
  170    HD2  HIS  25           HD2      HIS  25  17.604  -2.125   5.525
  171    HE1  HIS  25           HE1      HIS  25  18.459   2.008   4.976
  172    HE2  HIS  25           HE2      HIS  25  19.129  -0.189   6.170
  173    H    VAL  26           H        VAL  26  14.509  -4.907   2.509
  174    HA   VAL  26           HA       VAL  26  12.320  -5.151   4.076
  175    HB   VAL  26           HB       VAL  26  12.591  -6.607   2.274
  176   1HG1  VAL  26          1HG1      VAL  26  15.305  -6.619   2.972
  177   2HG1  VAL  26          2HG1      VAL  26  14.782  -8.312   3.135
  178   3HG1  VAL  26          3HG1      VAL  26  14.545  -7.453   1.595
  179   1HG2  VAL  26          1HG2      VAL  26  11.844  -8.571   3.167
  180   2HG2  VAL  26          2HG2      VAL  26  13.154  -8.656   4.370
  181   3HG2  VAL  26          3HG2      VAL  26  11.770  -7.567   4.634
  182    H    THR  27           H        THR  27  11.955  -5.276   6.226
  183    HA   THR  27           HA       THR  27  13.567  -6.926   7.896
  184    HB   THR  27           HB       THR  27  14.398  -4.184   7.478
  185    HG1  THR  27           HG1      THR  27  16.122  -5.130   8.645
  186   1HG2  THR  27          1HG2      THR  27  13.202  -4.856  10.199
  187   2HG2  THR  27          2HG2      THR  27  14.608  -3.774  10.063
  188   3HG2  THR  27          3HG2      THR  27  13.071  -3.337   9.281
  189    HA   PRO  28           HA       PRO  28   9.907  -6.827  10.128
  190   1HB   PRO  28          1HB       PRO  28  10.725  -7.684  12.588
  191   2HB   PRO  28          2HB       PRO  28  10.439  -8.775  11.234
  192   1HG   PRO  28          1HG       PRO  28  12.978  -7.790  12.370
  193   2HG   PRO  28          2HG       PRO  28  12.696  -9.238  11.337
  194   1HD   PRO  28          1HD       PRO  28  13.841  -6.720  10.598
  195   2HD   PRO  28          2HD       PRO  28  13.439  -8.055   9.511
  196    H    LYS  29           H        LYS  29  10.500  -4.317   9.697
  197    HA   LYS  29           HA       LYS  29   9.309  -3.002  11.788
  198   1HB   LYS  29          1HB       LYS  29  11.713  -3.742  12.725
  199   2HB   LYS  29          2HB       LYS  29  12.162  -2.195  11.987
  200   1HG   LYS  29          1HG       LYS  29  11.303  -1.139  13.780
  201   2HG   LYS  29          2HG       LYS  29   9.697  -1.764  13.367
  202   1HD   LYS  29          1HD       LYS  29  10.456  -3.934  14.574
  203   2HD   LYS  29          2HD       LYS  29  11.775  -2.954  15.242
  204   1HE   LYS  29          1HE       LYS  29   8.854  -2.135  15.445
  205   2HE   LYS  29          2HE       LYS  29   9.628  -3.156  16.666
  206   1HZ   LYS  29          1HZ       LYS  29  11.366  -1.230  16.545
  207   2HZ   LYS  29          2HZ       LYS  29  10.071  -0.367  16.049
  208   3HZ   LYS  29          3HZ       LYS  29  10.043  -1.120  17.498
  209    H    GLU  30           H        GLU  30  11.277  -3.200   8.916
  210    HA   GLU  30           HA       GLU  30  10.783  -0.395   8.367
  211   1HB   GLU  30          1HB       GLU  30  12.860  -2.309   7.669
  212   2HB   GLU  30          2HB       GLU  30  12.220  -1.527   6.213
  213   1HG   GLU  30          1HG       GLU  30  13.916  -0.053   6.876
  214   2HG   GLU  30          2HG       GLU  30  12.483   0.692   7.604
  215    H    CYS  31           H        CYS  31  10.210  -3.724   7.099
  216    HA   CYS  31           HA       CYS  31   8.946  -3.033   4.756
  217   1HB   CYS  31          1HB       CYS  31   8.693  -5.394   6.596
  218   2HB   CYS  31          2HB       CYS  31   7.716  -5.269   5.130
  219    H    ASN  32           H        ASN  32   7.578  -3.665   8.068
  220    HA   ASN  32           HA       ASN  32   4.967  -3.054   7.313
  221   1HB   ASN  32          1HB       ASN  32   6.479  -3.576   9.814
  222   2HB   ASN  32          2HB       ASN  32   5.081  -2.516  10.048
  223   1HD2  ASN  32          1HD2      ASN  32   5.910  -5.379   8.089
  224   2HD2  ASN  32          2HD2      ASN  32   4.510  -6.323   8.479
  225    H    ASN  33           H        ASN  33   7.686  -1.101   7.405
  226    HA   ASN  33           HA       ASN  33   6.244   1.198   8.441
  227   1HB   ASN  33          1HB       ASN  33   8.702   0.472   9.120
  228   2HB   ASN  33          2HB       ASN  33   9.163   1.237   7.591
  229   1HD2  ASN  33          1HD2      ASN  33  10.379   2.573   9.163
  230   2HD2  ASN  33          2HD2      ASN  33   9.617   3.980   9.827
  231    H    ARG  34           H        ARG  34   7.708  -0.329   5.583
  232    HA   ARG  34           HA       ARG  34   7.599   2.072   4.048
  233   1HB   ARG  34          1HB       ARG  34   7.970  -0.737   2.952
  234   2HB   ARG  34          2HB       ARG  34   8.602   0.780   2.289
  235   1HG   ARG  34          1HG       ARG  34   9.641   0.662   4.895
  236   2HG   ARG  34          2HG       ARG  34   9.751  -1.010   4.316
  237   1HD   ARG  34          1HD       ARG  34  11.279  -0.471   2.668
  238   2HD   ARG  34          2HD       ARG  34  10.620   1.153   2.421
  239    HE   ARG  34           HE       ARG  34  11.900   0.767   5.032
  240   1HH1  ARG  34          1HH1      ARG  34  12.413   1.660   1.667
  241   2HH1  ARG  34          2HH1      ARG  34  13.860   2.557   1.992
  242   1HH2  ARG  34          1HH2      ARG  34  13.808   1.949   5.462
  243   2HH2  ARG  34          2HH2      ARG  34  14.658   2.722   4.165
  244    H    GLY  35           H        GLY  35   5.554  -0.683   4.817
  245   1HA   GLY  35          1HA       GLY  35   3.177  -0.265   4.360
  246   2HA   GLY  35          2HA       GLY  35   3.638   0.160   2.723
  247    H    CYS  36           H        CYS  36   5.379  -2.440   4.385
  248    HA   CYS  36           HA       CYS  36   3.929  -4.350   2.699
  249   1HB   CYS  36          1HB       CYS  36   6.820  -4.484   3.556
  250   2HB   CYS  36          2HB       CYS  36   5.975  -5.649   2.533
  251    H    CYS  37           H        CYS  37   4.563  -6.738   3.749
  252    HA   CYS  37           HA       CYS  37   4.098  -6.454   6.628
  253   1HB   CYS  37          1HB       CYS  37   2.086  -7.118   5.183
  254   2HB   CYS  37          2HB       CYS  37   2.900  -8.671   4.980
  255    H    PHE  38           H        PHE  38   5.613  -7.556   7.843
  256    HA   PHE  38           HA       PHE  38   7.530  -9.170   6.398
  257   1HB   PHE  38          1HB       PHE  38   8.014  -7.337   8.152
  258   2HB   PHE  38          2HB       PHE  38   7.297  -8.401   9.367
  259    HD1  PHE  38           HD1      PHE  38  10.147  -7.915   7.096
  260    HD2  PHE  38           HD2      PHE  38   8.512 -10.294  10.206
  261    HE1  PHE  38           HE1      PHE  38  12.381  -9.009   7.434
  262    HE2  PHE  38           HE2      PHE  38  10.746 -11.387  10.544
  263    HZ   PHE  38           HZ       PHE  38  12.654 -10.731   9.154
  264    H    ASP  39           H        ASP  39   7.408 -11.358   6.274
  265    HA   ASP  39           HA       ASP  39   5.435 -12.675   7.854
  266   1HB   ASP  39          1HB       ASP  39   5.475 -13.690   5.798
  267   2HB   ASP  39          2HB       ASP  39   7.179 -13.304   5.519
  268    H    SER  40           H        SER  40   8.726 -13.926   7.018
  269    HA   SER  40           HA       SER  40  10.468 -14.395   8.294
  270   1HB   SER  40          1HB       SER  40   9.323 -12.625   9.969
  271   2HB   SER  40          2HB       SER  40   9.081 -14.090  10.937
  272    HG   SER  40           HG       SER  40  11.079 -13.297  11.548
  273    H    ARG  41           H        ARG  41   7.201 -15.562   8.792
  274    HA   ARG  41           HA       ARG  41   7.784 -17.772  10.357
  275   1HB   ARG  41          1HB       ARG  41   5.597 -17.676   8.246
  276   2HB   ARG  41          2HB       ARG  41   5.558 -18.518   9.806
  277   1HG   ARG  41          1HG       ARG  41   6.023 -15.896  10.558
  278   2HG   ARG  41          2HG       ARG  41   4.966 -15.687   9.152
  279   1HD   ARG  41          1HD       ARG  41   3.499 -15.865  11.020
  280   2HD   ARG  41          2HD       ARG  41   3.436 -17.461  10.258
  281    HE   ARG  41           HE       ARG  41   4.834 -16.761  12.797
  282   1HH1  ARG  41          1HH1      ARG  41   3.873 -19.203  10.453
  283   2HH1  ARG  41          2HH1      ARG  41   4.230 -20.534  11.501
  284   1HH2  ARG  41          1HH2      ARG  41   5.305 -18.516  14.181
  285   2HH2  ARG  41          2HH2      ARG  41   5.050 -20.141  13.637
  286    H    ILE  42           H        ILE  42   7.649 -17.246   6.784
  287    HA   ILE  42           HA       ILE  42   8.936 -19.869   6.471
  288    HB   ILE  42           HB       ILE  42   7.268 -18.628   4.320
  289   1HG1  ILE  42          1HG1      ILE  42   6.280 -19.981   6.807
  290   2HG1  ILE  42          2HG1      ILE  42   5.636 -18.559   5.968
  291   1HG2  ILE  42          1HG2      ILE  42   7.262 -20.720   3.371
  292   2HG2  ILE  42          2HG2      ILE  42   8.857 -20.712   4.162
  293   3HG2  ILE  42          3HG2      ILE  42   7.488 -21.553   4.928
  294   1HD1  ILE  42          1HD1      ILE  42   5.137 -21.450   5.499
  295   2HD1  ILE  42          2HD1      ILE  42   4.102 -20.046   5.149
  296   3HD1  ILE  42          3HD1      ILE  42   5.402 -20.496   4.020
  297    HA   PRO  43           HA       PRO  43  12.016 -17.107   4.979
  298   1HB   PRO  43          1HB       PRO  43  14.106 -18.854   5.181
  299   2HB   PRO  43          2HB       PRO  43  13.591 -17.812   6.504
  300   1HG   PRO  43          1HG       PRO  43  13.146 -20.697   6.078
  301   2HG   PRO  43          2HG       PRO  43  13.051 -19.761   7.613
  302   1HD   PRO  43          1HD       PRO  43  10.906 -20.771   6.007
  303   2HD   PRO  43          2HD       PRO  43  10.760 -19.720   7.422
  304    H    GLY  44           H        GLY  44  10.566 -19.716   3.634
  305   1HA   GLY  44          1HA       GLY  44  12.313 -19.820   1.299
  306   2HA   GLY  44          2HA       GLY  44  10.923 -20.830   1.640
  307    H    VAL  45           H        VAL  45   9.773 -17.854   2.453
  308    HA   VAL  45           HA       VAL  45   8.978 -17.246  -0.310
  309    HB   VAL  45           HB       VAL  45   6.789 -17.032   0.290
  310   1HG1  VAL  45          1HG1      VAL  45   7.670 -19.394   0.690
  311   2HG1  VAL  45          2HG1      VAL  45   7.583 -19.023   2.428
  312   3HG1  VAL  45          3HG1      VAL  45   6.105 -18.990   1.435
  313   1HG2  VAL  45          1HG2      VAL  45   7.146 -16.978   3.254
  314   2HG2  VAL  45          2HG2      VAL  45   7.606 -15.522   2.338
  315   3HG2  VAL  45          3HG2      VAL  45   5.947 -16.157   2.227
  316    HA   PRO  46           HA       PRO  46   9.819 -13.082   0.596
  317   1HB   PRO  46          1HB       PRO  46   7.585 -11.605   0.060
  318   2HB   PRO  46          2HB       PRO  46   8.656 -12.221  -1.196
  319   1HG   PRO  46          1HG       PRO  46   6.008 -13.186  -0.322
  320   2HG   PRO  46          2HG       PRO  46   6.859 -13.496  -1.878
  321   1HD   PRO  46          1HD       PRO  46   6.519 -15.264   0.349
  322   2HD   PRO  46          2HD       PRO  46   7.500 -15.560  -1.093
  323    H    TRP  47           H        TRP  47  10.465 -12.296   2.488
  324    HA   TRP  47           HA       TRP  47   8.522 -12.441   4.637
  325   1HB   TRP  47          1HB       TRP  47  11.140 -11.283   5.218
  326   2HB   TRP  47          2HB       TRP  47  10.265 -12.589   6.017
  327    HD1  TRP  47           HD1      TRP  47  10.567 -15.108   4.786
  328    HE1  TRP  47           HE1      TRP  47  12.599 -16.211   3.516
  329    HE3  TRP  47           HE3      TRP  47  12.999 -10.752   3.805
  330    HZ2  TRP  47           HZ2      TRP  47  14.943 -15.163   2.270
  331    HZ3  TRP  47           HZ3      TRP  47  15.153 -10.880   2.557
  332    HH2  TRP  47           HH2      TRP  47  16.129 -12.989   1.797
  333    H    CYS  48           H        CYS  48   8.160 -10.588   2.307
  334    HA   CYS  48           HA       CYS  48   7.509  -8.293   3.799
  335   1HB   CYS  48          1HB       CYS  48   9.964  -7.953   3.554
  336   2HB   CYS  48          2HB       CYS  48   9.745  -7.894   1.803
  337    H    PHE  49           H        PHE  49   5.490  -8.108   2.873
  338    HA   PHE  49           HA       PHE  49   5.394  -7.792  -0.012
  339   1HB   PHE  49          1HB       PHE  49   3.157  -9.310   0.418
  340   2HB   PHE  49          2HB       PHE  49   4.703 -10.041  -0.029
  341    HD1  PHE  49           HD1      PHE  49   6.260 -10.607   2.036
  342    HD2  PHE  49           HD2      PHE  49   2.050 -10.119   2.257
  343    HE1  PHE  49           HE1      PHE  49   6.215 -11.955   4.154
  344    HE2  PHE  49           HE2      PHE  49   2.005 -11.466   4.374
  345    HZ   PHE  49           HZ       PHE  49   4.088 -12.368   5.297
  346    H    LYS  50           H        LYS  50   2.649  -7.617  -0.367
  347    HA   LYS  50           HA       LYS  50   1.886  -5.547   1.574
  348   1HB   LYS  50          1HB       LYS  50   0.628  -4.922  -0.832
  349   2HB   LYS  50          2HB       LYS  50   1.986  -4.066  -0.082
  350   1HG   LYS  50          1HG       LYS  50   2.548  -6.535  -1.708
  351   2HG   LYS  50          2HG       LYS  50   2.150  -5.040  -2.572
  352   1HD   LYS  50          1HD       LYS  50   4.429  -5.521  -0.616
  353   2HD   LYS  50          2HD       LYS  50   4.563  -5.141  -2.341
  354   1HE   LYS  50          1HE       LYS  50   3.799  -3.347  -0.030
  355   2HE   LYS  50          2HE       LYS  50   5.003  -3.064  -1.296
  356   1HZ   LYS  50          1HZ       LYS  50   2.157  -2.653  -1.344
  357   2HZ   LYS  50          2HZ       LYS  50   3.343  -1.824  -2.100
  358   3HZ   LYS  50          3HZ       LYS  50   2.806  -3.234  -2.725
  359    HA   PRO  51           HA       PRO  51  -1.253  -8.809   1.407
  360   1HB   PRO  51          1HB       PRO  51  -1.320  -9.387   4.077
  361   2HB   PRO  51          2HB       PRO  51  -0.357 -10.299   2.917
  362   1HG   PRO  51          1HG       PRO  51   0.469  -8.267   4.889
  363   2HG   PRO  51          2HG       PRO  51   1.479  -9.513   4.071
  364   1HD   PRO  51          1HD       PRO  51   1.342  -6.702   3.537
  365   2HD   PRO  51          2HD       PRO  51   2.230  -7.912   2.602
  366    H    LEU  52           H        LEU  52  -1.765  -7.818   4.634
  367    HA   LEU  52           HA       LEU  52  -4.160  -6.451   3.728
  368   1HB   LEU  52          1HB       LEU  52  -5.034  -6.840   5.782
  369   2HB   LEU  52          2HB       LEU  52  -3.968  -8.243   5.589
  370    HG   LEU  52           HG       LEU  52  -2.596  -6.039   6.889
  371   1HD1  LEU  52          1HD1      LEU  52  -4.174  -5.216   8.216
  372   2HD1  LEU  52          2HD1      LEU  52  -5.359  -6.425   7.664
  373   3HD1  LEU  52          3HD1      LEU  52  -4.255  -6.809   9.007
  374   1HD2  LEU  52          1HD2      LEU  52  -2.935  -8.943   7.132
  375   2HD2  LEU  52          2HD2      LEU  52  -1.509  -7.918   7.424
  376   3HD2  LEU  52          3HD2      LEU  52  -2.746  -8.106   8.691
  377    H    GLN  53           H        GLN  53  -1.556  -5.249   3.139
  378    HA   GLN  53           HA       GLN  53  -0.789  -3.378   4.971
  379   1HB   GLN  53          1HB       GLN  53  -0.795  -3.253   1.932
  380   2HB   GLN  53          2HB       GLN  53   0.087  -2.109   2.961
  381   1HG   GLN  53          1HG       GLN  53   0.480  -5.130   2.846
  382   2HG   GLN  53          2HG       GLN  53   1.583  -3.916   2.182
  383   1HE2  GLN  53          1HE2      GLN  53   1.553  -2.014   4.156
  384   2HE2  GLN  53          2HE2      GLN  53   2.274  -2.625   5.608
  385    H    GLU  54           H        GLU  54  -3.732  -3.579   3.119
  386    HA   GLU  54           HA       GLU  54  -4.456  -1.080   2.597
  387   1HB   GLU  54          1HB       GLU  54  -6.765  -1.765   2.938
  388   2HB   GLU  54          2HB       GLU  54  -5.856  -3.128   2.261
  389   1HG   GLU  54          1HG       GLU  54  -5.924  -4.328   4.255
  390   2HG   GLU  54          2HG       GLU  54  -6.067  -2.878   5.261
  391    H    ALA  55           H        ALA  55  -3.872  -2.460   5.788
  392    HA   ALA  55           HA       ALA  55  -5.323  -1.019   7.504
  393   1HB   ALA  55          1HB       ALA  55  -2.376  -1.737   7.527
  394   2HB   ALA  55          2HB       ALA  55  -3.180  -0.991   8.929
  395   3HB   ALA  55          3HB       ALA  55  -3.727  -2.574   8.328
  396    H    GLU  56           H        GLU  56  -2.029   0.182   6.555
  397    HA   GLU  56           HA       GLU  56  -3.225   2.840   6.489
  398   1HB   GLU  56          1HB       GLU  56  -0.919   1.808   8.042
  399   2HB   GLU  56          2HB       GLU  56  -0.629   3.357   7.230
  400   1HG   GLU  56          1HG       GLU  56  -1.804   4.405   8.839
  401   2HG   GLU  56          2HG       GLU  56  -3.245   3.469   8.414
  402    H    CYS  57           H        CYS  57  -2.647   0.797   4.347
  403    HA   CYS  57           HA       CYS  57  -0.530   2.215   2.916
  404   1HB   CYS  57          1HB       CYS  57  -0.466  -0.320   3.311
  405   2HB   CYS  57          2HB       CYS  57  -1.736  -0.415   2.087
  406    H    THR  58           H        THR  58  -3.787   0.648   2.453
  407    HA   THR  58           HA       THR  58  -4.254   2.368   0.148
  408    HB   THR  58           HB       THR  58  -4.752  -0.263   0.546
  409    HG1  THR  58           HG1      THR  58  -6.619   0.285  -1.021
  410   1HG2  THR  58          1HG2      THR  58  -7.434   1.063   1.152
  411   2HG2  THR  58          2HG2      THR  58  -7.051  -0.675   1.138
  412   3HG2  THR  58          3HG2      THR  58  -6.423   0.363   2.440
  413    H    PHE  59           H        PHE  59  -5.186   1.996   3.550
  414    HA   PHE  59           HA       PHE  59  -7.509   3.204   3.817
  415   1HB   PHE  59          1HB       PHE  59  -5.214   2.751   5.343
  416   2HB   PHE  59          2HB       PHE  59  -5.310   4.515   5.385
  417    HD1  PHE  59           HD1      PHE  59  -6.223   5.258   7.356
  418    HD2  PHE  59           HD2      PHE  59  -7.815   1.743   5.590
  419    HE1  PHE  59           HE1      PHE  59  -7.926   5.106   9.194
  420    HE2  PHE  59           HE2      PHE  59  -9.519   1.592   7.428
  421    HZ   PHE  59           HZ       PHE  59  -9.553   3.275   9.208
  422   1H    GLU   1           H1       GLU   1 -20.499   5.095   0.569
  423    HA   GLU   1           HA       GLU   1 -18.303   4.936  -0.128
  424   1HB   GLU   1          1HB       GLU   1 -18.918   4.267   2.696
  425   2HB   GLU   1          2HB       GLU   1 -17.244   3.949   2.207
  426   1HG   GLU   1          1HG       GLU   1 -16.770   6.151   2.261
  427   2HG   GLU   1          2HG       GLU   1 -18.105   6.519   1.158
  428    H    GLU   2           H        GLU   2 -19.345   2.794  -1.506
  429    HA   GLU   2           HA       GLU   2 -18.234   0.353  -0.659
  430   1HB   GLU   2          1HB       GLU   2 -19.295   1.268  -3.359
  431   2HB   GLU   2          2HB       GLU   2 -18.874  -0.410  -2.978
  432   1HG   GLU   2          1HG       GLU   2 -20.563   0.545  -0.877
  433   2HG   GLU   2          2HG       GLU   2 -21.319   1.033  -2.402
  434    H    TYR   3           H        TYR   3 -17.522   0.682  -3.979
  435    HA   TYR   3           HA       TYR   3 -14.680   0.694  -3.373
  436   1HB   TYR   3          1HB       TYR   3 -14.940   0.342  -6.071
  437   2HB   TYR   3          2HB       TYR   3 -15.200  -0.995  -4.948
  438    HD1  TYR   3           HD1      TYR   3 -16.920   1.618  -6.961
  439    HD2  TYR   3           HD2      TYR   3 -17.341  -2.017  -4.743
  440    HE1  TYR   3           HE1      TYR   3 -19.285   1.340  -7.851
  441    HE2  TYR   3           HE2      TYR   3 -19.704  -2.283  -5.642
  442    HH   TYR   3           HH       TYR   3 -20.972  -0.052  -8.066
  443    H    VAL   4           H        VAL   4 -14.593   3.012  -2.774
  444    HA   VAL   4           HA       VAL   4 -14.345   4.631  -5.196
  445    HB   VAL   4           HB       VAL   4 -16.451   5.288  -4.381
  446   1HG1  VAL   4          1HG1      VAL   4 -15.472   5.864  -1.602
  447   2HG1  VAL   4          2HG1      VAL   4 -17.117   5.503  -2.180
  448   3HG1  VAL   4          3HG1      VAL   4 -15.913   4.198  -2.045
  449   1HG2  VAL   4          1HG2      VAL   4 -14.365   7.058  -4.560
  450   2HG2  VAL   4          2HG2      VAL   4 -16.078   7.510  -4.390
  451   3HG2  VAL   4          3HG2      VAL   4 -15.030   7.442  -2.954
  452    H    GLY   5           H        GLY   5 -13.875   4.710  -1.586
  453   1HA   GLY   5          1HA       GLY   5 -11.580   6.355  -1.719
  454   2HA   GLY   5          2HA       GLY   5 -12.129   5.410  -0.350
  455    H    LEU   6           H        LEU   6 -11.938   3.299  -2.986
  456    HA   LEU   6           HA       LEU   6  -9.101   2.839  -2.850
  457   1HB   LEU   6          1HB       LEU   6  -9.380   0.498  -2.091
  458   2HB   LEU   6          2HB       LEU   6  -9.646   1.729  -0.844
  459    HG   LEU   6           HG       LEU   6 -11.202  -0.276  -0.855
  460   1HD1  LEU   6          1HD1      LEU   6 -11.577   2.153   0.104
  461   2HD1  LEU   6          2HD1      LEU   6 -12.849   2.203  -1.140
  462   3HD1  LEU   6          3HD1      LEU   6 -12.880   0.941   0.114
  463   1HD2  LEU   6          1HD2      LEU   6 -13.028  -0.347  -2.422
  464   2HD2  LEU   6          2HD2      LEU   6 -12.451   1.132  -3.229
  465   3HD2  LEU   6          3HD2      LEU   6 -11.491  -0.365  -3.322
  466    H    SER   7           H        SER   7 -11.350   3.548  -4.765
  467    HA   SER   7           HA       SER   7 -11.158   1.183  -6.454
  468   1HB   SER   7          1HB       SER   7 -13.440   1.677  -6.182
  469   2HB   SER   7          2HB       SER   7 -13.180   3.428  -6.253
  470    HG   SER   7           HG       SER   7 -13.869   3.121  -8.278
  471    H    ALA   8           H        ALA   8 -10.582   1.474  -8.732
  472    HA   ALA   8           HA       ALA   8  -8.491   3.254  -9.140
  473   1HB   ALA   8          1HB       ALA   8  -8.525   2.428 -11.404
  474   2HB   ALA   8          2HB       ALA   8  -8.982   1.077 -10.340
  475   3HB   ALA   8          3HB       ALA   8 -10.232   1.945 -11.264
  476    H    ASN   9           H        ASN   9  -9.198   5.370  -8.491
  477    HA   ASN   9           HA       ASN   9  -9.923   7.004 -10.504
  478   1HB   ASN   9          1HB       ASN   9 -12.210   5.573  -9.728
  479   2HB   ASN   9          2HB       ASN   9 -12.388   7.110  -8.869
  480   1HD2  ASN   9          1HD2      ASN   9 -11.877   9.079 -10.221
  481   2HD2  ASN   9          2HD2      ASN   9 -12.514   9.131 -11.832
  482    H    GLN  10           H        GLN  10 -10.072   6.106  -7.064
  483    HA   GLN  10           HA       GLN  10 -10.462   8.622  -5.986
  484   1HB   GLN  10          1HB       GLN  10 -10.240   6.088  -5.005
  485   2HB   GLN  10          2HB       GLN  10  -8.687   6.761  -4.481
  486   1HG   GLN  10          1HG       GLN  10 -10.580   8.774  -3.924
  487   2HG   GLN  10          2HG       GLN  10 -11.386   7.269  -3.458
  488   1HE2  GLN  10          1HE2      GLN  10  -9.024   5.810  -2.834
  489   2HE2  GLN  10          2HE2      GLN  10  -8.361   6.429  -1.359
  490    H    CYS  11           H        CYS  11  -7.626   7.065  -7.415
  491    HA   CYS  11           HA       CYS  11  -5.739   8.816  -6.224
  492   1HB   CYS  11          1HB       CYS  11  -5.090   6.618  -6.959
  493   2HB   CYS  11          2HB       CYS  11  -5.551   6.986  -8.623
  494    H    ALA  12           H        ALA  12  -8.261   9.330  -8.364
  495    HA   ALA  12           HA       ALA  12  -6.781  11.450  -9.768
  496   1HB   ALA  12          1HB       ALA  12  -8.329  11.165 -11.611
  497   2HB   ALA  12          2HB       ALA  12  -7.651   9.571 -11.201
  498   3HB   ALA  12          3HB       ALA  12  -9.298   9.999 -10.677
  499    H    VAL  13           H        VAL  13  -8.438  11.066  -7.062
  500    HA   VAL  13           HA       VAL  13 -10.772  12.431  -7.126
  501    HB   VAL  13           HB       VAL  13  -8.988  11.514  -5.225
  502   1HG1  VAL  13          1HG1      VAL  13  -8.752  13.369  -3.605
  503   2HG1  VAL  13          2HG1      VAL  13  -7.847  13.667  -5.109
  504   3HG1  VAL  13          3HG1      VAL  13  -9.394  14.498  -4.823
  505   1HG2  VAL  13          1HG2      VAL  13 -10.981  11.163  -4.292
  506   2HG2  VAL  13          2HG2      VAL  13 -11.081  12.890  -3.871
  507   3HG2  VAL  13          3HG2      VAL  13 -11.737  12.312  -5.422
  508    HA   PRO  14           HA       PRO  14  -9.937  16.569  -8.058
  509   1HB   PRO  14          1HB       PRO  14 -11.534  17.997  -6.363
  510   2HB   PRO  14          2HB       PRO  14 -12.138  17.202  -7.815
  511   1HG   PRO  14          1HG       PRO  14 -12.368  16.408  -4.984
  512   2HG   PRO  14          2HG       PRO  14 -13.369  15.878  -6.383
  513   1HD   PRO  14          1HD       PRO  14 -11.313  14.428  -5.016
  514   2HD   PRO  14          2HD       PRO  14 -12.158  13.928  -6.487
  515    H    ALA  15           H        ALA  15  -8.154  15.287  -6.092
  516    HA   ALA  15           HA       ALA  15  -6.579  15.849  -4.626
  517   1HB   ALA  15          1HB       ALA  15  -6.629  17.905  -6.760
  518   2HB   ALA  15          2HB       ALA  15  -5.733  18.371  -5.294
  519   3HB   ALA  15          3HB       ALA  15  -5.286  16.892  -6.178
  520    H    LYS  16           H        LYS  16  -8.648  15.889  -3.121
  521    HA   LYS  16           HA       LYS  16  -8.223  17.834  -1.214
  522   1HB   LYS  16          1HB       LYS  16 -10.485  19.039  -1.488
  523   2HB   LYS  16          2HB       LYS  16  -9.110  19.575  -2.471
  524   1HG   LYS  16          1HG       LYS  16 -10.350  19.223  -4.315
  525   2HG   LYS  16          2HG       LYS  16 -10.398  17.492  -3.938
  526   1HD   LYS  16          1HD       LYS  16 -12.673  18.228  -4.139
  527   2HD   LYS  16          2HD       LYS  16 -12.382  18.006  -2.405
  528   1HE   LYS  16          1HE       LYS  16 -11.926  20.466  -2.219
  529   2HE   LYS  16          2HE       LYS  16 -12.327  20.652  -3.933
  530   1HZ   LYS  16          1HZ       LYS  16 -14.365  20.943  -3.138
  531   2HZ   LYS  16          2HZ       LYS  16 -14.426  19.321  -2.969
  532   3HZ   LYS  16          3HZ       LYS  16 -14.046  20.262  -1.690
  533    H    ASP  17           H        ASP  17  -8.556  14.979  -1.545
  534    HA   ASP  17           HA       ASP  17 -10.533  14.641   0.482
  535   1HB   ASP  17          1HB       ASP  17 -11.692  14.419  -1.822
  536   2HB   ASP  17          2HB       ASP  17 -10.760  12.928  -2.024
  537    H    ARG  18           H        ARG  18  -7.522  14.281  -0.495
  538    HA   ARG  18           HA       ARG  18  -7.227  11.450  -0.206
  539   1HB   ARG  18          1HB       ARG  18  -5.088  13.620  -0.399
  540   2HB   ARG  18          2HB       ARG  18  -4.834  11.883  -0.642
  541   1HG   ARG  18          1HG       ARG  18  -5.695  11.931  -2.757
  542   2HG   ARG  18          2HG       ARG  18  -6.960  13.098  -2.339
  543   1HD   ARG  18          1HD       ARG  18  -5.412  14.944  -2.508
  544   2HD   ARG  18          2HD       ARG  18  -4.017  13.861  -2.605
  545    HE   ARG  18           HE       ARG  18  -6.002  13.458  -4.728
  546   1HH1  ARG  18          1HH1      ARG  18  -3.124  15.233  -3.756
  547   2HH1  ARG  18          2HH1      ARG  18  -2.642  15.594  -5.380
  548   1HH2  ARG  18          1HH2      ARG  18  -5.368  13.935  -6.872
  549   2HH2  ARG  18          2HH2      ARG  18  -3.928  14.852  -7.164
  550    H    VAL  19           H        VAL  19  -5.185  10.822   1.330
  551    HA   VAL  19           HA       VAL  19  -5.818  12.023   3.926
  552    HB   VAL  19           HB       VAL  19  -4.547   9.368   3.231
  553   1HG1  VAL  19          1HG1      VAL  19  -3.795   9.579   5.358
  554   2HG1  VAL  19          2HG1      VAL  19  -5.005  10.815   5.780
  555   3HG1  VAL  19          3HG1      VAL  19  -5.457   9.094   5.771
  556   1HG2  VAL  19          1HG2      VAL  19  -6.812   8.550   4.229
  557   2HG2  VAL  19          2HG2      VAL  19  -7.389  10.182   3.811
  558   3HG2  VAL  19          3HG2      VAL  19  -6.755   9.109   2.540
  559    H    ASP  20           H        ASP  20  -3.937  13.008   1.674
  560    HA   ASP  20           HA       ASP  20  -1.802  13.537   1.386
  561   1HB   ASP  20          1HB       ASP  20  -2.358  15.506   2.472
  562   2HB   ASP  20          2HB       ASP  20  -2.781  14.687   3.983
  563    H    CYS  21           H        CYS  21  -0.749  11.394   1.420
  564    HA   CYS  21           HA       CYS  21  -0.115   9.919   3.598
  565   1HB   CYS  21          1HB       CYS  21   0.432   9.809   0.928
  566   2HB   CYS  21          2HB       CYS  21   2.046  10.054   1.605
  567    H    GLY  22           H        GLY  22   1.384  12.916   2.347
  568   1HA   GLY  22          1HA       GLY  22   3.056  14.216   3.117
  569   2HA   GLY  22          2HA       GLY  22   2.410  13.829   4.700
  570    H    TYR  23           H        TYR  23   4.331  12.101   2.129
  571    HA   TYR  23           HA       TYR  23   5.880  10.825   4.231
  572   1HB   TYR  23          1HB       TYR  23   5.066  10.464   1.412
  573   2HB   TYR  23          2HB       TYR  23   6.809  10.228   1.580
  574    HD1  TYR  23           HD1      TYR  23   7.674   8.409   3.045
  575    HD2  TYR  23           HD2      TYR  23   3.494   8.870   2.262
  576    HE1  TYR  23           HE1      TYR  23   7.253   6.039   3.864
  577    HE2  TYR  23           HE2      TYR  23   3.086   6.499   3.084
  578    HH   TYR  23           HH       TYR  23   5.266   4.814   4.880
  579    HA   PRO  24           HA       PRO  24   9.234  13.523   3.744
  580   1HB   PRO  24          1HB       PRO  24  11.204  12.037   4.914
  581   2HB   PRO  24          2HB       PRO  24  10.046  12.995   5.832
  582   1HG   PRO  24          1HG       PRO  24  10.160  10.081   5.380
  583   2HG   PRO  24          2HG       PRO  24   9.296  10.984   6.677
  584   1HD   PRO  24          1HD       PRO  24   8.202   9.743   4.339
  585   2HD   PRO  24          2HD       PRO  24   7.334  10.754   5.500
  586    H    HIS  25           H        HIS  25   8.837  10.755   2.026
  587    HA   HIS  25           HA       HIS  25  11.197  11.445   0.432
  588   1HB   HIS  25          1HB       HIS  25  10.399   8.898   1.611
  589   2HB   HIS  25          2HB       HIS  25  10.652   8.782  -0.135
  590    HD1  HIS  25           HD1      HIS  25  12.913   7.708  -0.329
  591    HD2  HIS  25           HD2      HIS  25  12.870  10.847   2.453
  592    HE1  HIS  25           HE1      HIS  25  15.330   8.033   0.420
  593    HE2  HIS  25           HE2      HIS  25  15.249  10.010   2.087
  594    H    VAL  26           H        VAL  26   8.068  12.008   0.555
  595    HA   VAL  26           HA       VAL  26   6.684  10.884  -1.431
  596    HB   VAL  26           HB       VAL  26   5.670  12.555  -0.164
  597   1HG1  VAL  26          1HG1      VAL  26   8.158  13.840  -0.262
  598   2HG1  VAL  26          2HG1      VAL  26   7.027  14.968  -1.048
  599   3HG1  VAL  26          3HG1      VAL  26   6.700  14.385   0.601
  600   1HG2  VAL  26          1HG2      VAL  26   4.527  13.807  -1.745
  601   2HG2  VAL  26          2HG2      VAL  26   5.987  14.115  -2.716
  602   3HG2  VAL  26          3HG2      VAL  26   5.220  12.509  -2.746
  603    H    THR  27           H        THR  27   7.008  10.435  -3.545
  604    HA   THR  27           HA       THR  27   8.101  12.345  -5.325
  605    HB   THR  27           HB       THR  27   9.989  10.747  -3.857
  606    HG1  THR  27           HG1      THR  27  10.381  12.865  -4.710
  607   1HG2  THR  27          1HG2      THR  27  11.196   9.960  -6.064
  608   2HG2  THR  27          2HG2      THR  27   9.945   8.900  -5.370
  609   3HG2  THR  27          3HG2      THR  27   9.558   9.941  -6.762
  610    HA   PRO  28           HA       PRO  28   6.020   9.786  -8.066
  611   1HB   PRO  28          1HB       PRO  28   7.213  10.371 -10.453
  612   2HB   PRO  28          2HB       PRO  28   6.001  11.406  -9.702
  613   1HG   PRO  28          1HG       PRO  28   8.932  11.715  -9.850
  614   2HG   PRO  28          2HG       PRO  28   7.684  12.973  -9.525
  615   1HD   PRO  28          1HD       PRO  28   9.464  11.711  -7.670
  616   2HD   PRO  28          2HD       PRO  28   8.147  12.824  -7.278
  617    H    LYS  29           H        LYS  29   7.674   8.271  -6.567
  618    HA   LYS  29           HA       LYS  29   7.944   6.024  -8.142
  619   1HB   LYS  29          1HB       LYS  29   9.869   7.734  -8.947
  620   2HB   LYS  29          2HB       LYS  29  10.736   6.891  -7.652
  621   1HG   LYS  29          1HG       LYS  29  10.932   5.024  -8.906
  622   2HG   LYS  29          2HG       LYS  29   9.204   5.015  -9.299
  623   1HD   LYS  29          1HD       LYS  29  10.148   7.136 -10.810
  624   2HD   LYS  29          2HD       LYS  29  11.513   6.008 -10.874
  625   1HE   LYS  29          1HE       LYS  29  10.168   5.382 -12.713
  626   2HE   LYS  29          2HE       LYS  29   9.723   4.204 -11.468
  627   1HZ   LYS  29          1HZ       LYS  29   8.240   6.701 -11.792
  628   2HZ   LYS  29          2HZ       LYS  29   7.893   5.397 -12.712
  629   3HZ   LYS  29          3HZ       LYS  29   7.752   5.312 -11.087
  630    H    GLU  30           H        GLU  30   8.409   7.969  -5.325
  631    HA   GLU  30           HA       GLU  30   9.310   5.663  -3.816
  632   1HB   GLU  30          1HB       GLU  30   9.519   8.586  -3.534
  633   2HB   GLU  30          2HB       GLU  30   9.093   7.775  -2.018
  634   1HG   GLU  30          1HG       GLU  30  11.461   7.791  -2.039
  635   2HG   GLU  30          2HG       GLU  30  11.047   6.151  -2.559
  636    H    CYS  31           H        CYS  31   6.662   8.118  -3.987
  637    HA   CYS  31           HA       CYS  31   5.209   7.281  -1.816
  638   1HB   CYS  31          1HB       CYS  31   4.353   8.479  -4.444
  639   2HB   CYS  31          2HB       CYS  31   3.221   8.178  -3.123
  640    H    ASN  32           H        ASN  32   4.877   6.298  -5.312
  641    HA   ASN  32           HA       ASN  32   2.954   4.383  -4.850
  642   1HB   ASN  32          1HB       ASN  32   4.906   5.042  -7.017
  643   2HB   ASN  32          2HB       ASN  32   4.265   3.393  -7.058
  644   1HD2  ASN  32          1HD2      ASN  32   2.801   6.440  -5.973
  645   2HD2  ASN  32          2HD2      ASN  32   1.473   6.461  -7.083
  646    H    ASN  33           H        ASN  33   6.249   4.506  -3.909
  647    HA   ASN  33           HA       ASN  33   6.685   1.679  -4.132
  648   1HB   ASN  33          1HB       ASN  33   8.384   3.809  -4.224
  649   2HB   ASN  33          2HB       ASN  33   8.532   3.408  -2.507
  650   1HD2  ASN  33          1HD2      ASN  33  10.741   2.930  -3.056
  651   2HD2  ASN  33          2HD2      ASN  33  11.175   1.384  -3.704
  652    H    ARG  34           H        ARG  34   5.934   4.241  -1.733
  653    HA   ARG  34           HA       ARG  34   6.261   2.461   0.464
  654   1HB   ARG  34          1HB       ARG  34   4.832   5.140   0.547
  655   2HB   ARG  34          2HB       ARG  34   5.757   4.358   1.842
  656   1HG   ARG  34          1HG       ARG  34   7.448   4.717  -0.479
  657   2HG   ARG  34          2HG       ARG  34   6.675   6.264  -0.084
  658   1HD   ARG  34          1HD       ARG  34   7.977   6.522   1.750
  659   2HD   ARG  34          2HD       ARG  34   7.612   4.891   2.332
  660    HE   ARG  34           HE       ARG  34   9.407   4.658   0.135
  661   1HH1  ARG  34          1HH1      ARG  34   9.392   5.909   3.425
  662   2HH1  ARG  34          2HH1      ARG  34  11.087   5.649   3.668
  663   1HH2  ARG  34          1HH2      ARG  34  11.644   4.315   0.456
  664   2HH2  ARG  34          2HH2      ARG  34  12.376   4.737   1.968
  665    H    GLY  35           H        GLY  35   3.719   3.496  -1.745
  666   1HA   GLY  35          1HA       GLY  35   1.826   1.958  -1.862
  667   2HA   GLY  35          2HA       GLY  35   1.730   2.033  -0.113
  668    H    CYS  36           H        CYS  36   2.575   4.931  -1.993
  669    HA   CYS  36           HA       CYS  36  -0.115   5.951  -1.424
  670   1HB   CYS  36          1HB       CYS  36   2.462   7.526  -1.447
  671   2HB   CYS  36          2HB       CYS  36   0.849   8.152  -1.095
  672    H    CYS  37           H        CYS  37  -0.569   7.946  -2.975
  673    HA   CYS  37           HA       CYS  37   0.405   7.172  -5.627
  674   1HB   CYS  37          1HB       CYS  37  -2.116   6.984  -4.887
  675   2HB   CYS  37          2HB       CYS  37  -2.130   8.711  -5.259
  676    H    PHE  38           H        PHE  38   1.414   8.780  -6.851
  677    HA   PHE  38           HA       PHE  38   1.781  11.326  -5.493
  678   1HB   PHE  38          1HB       PHE  38   3.663   9.823  -6.405
  679   2HB   PHE  38          2HB       PHE  38   3.038  10.123  -8.031
  680    HD1  PHE  38           HD1      PHE  38   4.430  11.836  -5.040
  681    HD2  PHE  38           HD2      PHE  38   3.749  12.001  -9.225
  682    HE1  PHE  38           HE1      PHE  38   5.852  13.900  -5.190
  683    HE2  PHE  38           HE2      PHE  38   5.171  14.065  -9.375
  684    HZ   PHE  38           HZ       PHE  38   6.204  14.990  -7.356
  685    H    ASP  39           H        ASP  39   0.506  13.026  -6.038
  686    HA   ASP  39           HA       ASP  39  -1.097  12.878  -8.355
  687   1HB   ASP  39          1HB       ASP  39  -2.205  14.105  -6.766
  688   2HB   ASP  39          2HB       ASP  39  -0.711  14.717  -6.040
  689    H    SER  40           H        SER  40   0.802  15.778  -7.315
  690    HA   SER  40           HA       SER  40   2.470  16.848  -8.298
  691   1HB   SER  40          1HB       SER  40   2.834  14.481  -9.542
  692   2HB   SER  40          2HB       SER  40   2.315  15.441 -10.940
  693    HG   SER  40           HG       SER  40   4.256  16.623  -9.249
  694    H    ARG  41           H        ARG  41  -0.606  16.057  -9.788
  695    HA   ARG  41           HA       ARG  41  -0.583  17.970 -11.796
  696   1HB   ARG  41          1HB       ARG  41  -3.059  17.063 -10.276
  697   2HB   ARG  41          2HB       ARG  41  -2.952  17.532 -11.983
  698   1HG   ARG  41          1HG       ARG  41  -1.143  15.472 -11.880
  699   2HG   ARG  41          2HG       ARG  41  -2.314  14.939 -10.661
  700   1HD   ARG  41          1HD       ARG  41  -3.165  14.027 -12.659
  701   2HD   ARG  41          2HD       ARG  41  -4.111  15.515 -12.490
  702    HE   ARG  41           HE       ARG  41  -1.756  16.118 -13.976
  703   1HH1  ARG  41          1HH1      ARG  41  -4.719  14.253 -14.327
  704   2HH1  ARG  41          2HH1      ARG  41  -4.759  14.401 -16.052
  705   1HH2  ARG  41          1HH2      ARG  41  -1.808  16.314 -16.253
  706   2HH2  ARG  41          2HH2      ARG  41  -3.093  15.581 -17.155
  707    H    ILE  42           H        ILE  42  -1.591  18.020  -8.335
  708    HA   ILE  42           HA       ILE  42  -1.876  20.934  -8.581
  709    HB   ILE  42           HB       ILE  42  -3.348  19.277  -6.556
  710   1HG1  ILE  42          1HG1      ILE  42  -4.064  19.763  -9.433
  711   2HG1  ILE  42          2HG1      ILE  42  -4.147  18.258  -8.499
  712   1HG2  ILE  42          1HG2      ILE  42  -3.149  21.703  -6.186
  713   2HG2  ILE  42          2HG2      ILE  42  -3.907  21.999  -7.768
  714   3HG2  ILE  42          3HG2      ILE  42  -4.831  21.199  -6.474
  715   1HD1  ILE  42          1HD1      ILE  42  -5.882  19.672  -7.039
  716   2HD1  ILE  42          2HD1      ILE  42  -6.030  20.612  -8.543
  717   3HD1  ILE  42          3HD1      ILE  42  -6.397  18.871  -8.543
  718    HA   PRO  43           HA       PRO  43   1.501  20.530  -5.793
  719   1HB   PRO  43          1HB       PRO  43   2.455  23.070  -6.111
  720   2HB   PRO  43          2HB       PRO  43   2.939  21.721  -7.138
  721   1HG   PRO  43          1HG       PRO  43   1.075  23.942  -7.678
  722   2HG   PRO  43          2HG       PRO  43   1.920  22.874  -8.856
  723   1HD   PRO  43          1HD       PRO  43  -0.827  22.812  -8.048
  724   2HD   PRO  43          2HD       PRO  43  -0.006  21.641  -9.089
  725    H    GLY  44           H        GLY  44  -1.336  22.188  -5.599
  726   1HA   GLY  44          1HA       GLY  44  -0.670  23.520  -3.087
  727   2HA   GLY  44          2HA       GLY  44  -2.168  23.630  -3.992
  728    H    VAL  45           H        VAL  45  -1.553  20.393  -4.119
  729    HA   VAL  45           HA       VAL  45  -2.880  19.902  -1.542
  730    HB   VAL  45           HB       VAL  45  -4.368  18.459  -2.517
  731   1HG1  VAL  45          1HG1      VAL  45  -5.545  19.904  -3.756
  732   2HG1  VAL  45          2HG1      VAL  45  -4.131  20.982  -3.673
  733   3HG1  VAL  45          3HG1      VAL  45  -4.336  19.889  -5.062
  734   1HG2  VAL  45          1HG2      VAL  45  -2.649  17.082  -3.666
  735   2HG2  VAL  45          2HG2      VAL  45  -4.111  17.333  -4.651
  736   3HG2  VAL  45          3HG2      VAL  45  -2.632  18.260  -5.001
  737    HA   PRO  46           HA       PRO  46  -0.017  16.700  -0.907
  738   1HB   PRO  46          1HB       PRO  46  -1.398  14.398  -0.406
  739   2HB   PRO  46          2HB       PRO  46  -1.200  15.681   0.785
  740   1HG   PRO  46          1HG       PRO  46  -3.539  14.974  -0.868
  741   2HG   PRO  46          2HG       PRO  46  -3.487  15.939   0.652
  742   1HD   PRO  46          1HD       PRO  46  -3.812  16.869  -2.037
  743   2HD   PRO  46          2HD       PRO  46  -3.608  17.868  -0.592
  744    H    TRP  47           H        TRP  47   1.506  16.018  -2.261
  745    HA   TRP  47           HA       TRP  47   0.531  14.760  -4.695
  746   1HB   TRP  47          1HB       TRP  47   3.413  15.094  -4.388
  747   2HB   TRP  47          2HB       TRP  47   2.338  15.591  -5.696
  748    HD1  TRP  47           HD1      TRP  47   1.012  18.044  -5.221
  749    HE1  TRP  47           HE1      TRP  47   1.792  20.247  -3.995
  750    HE3  TRP  47           HE3      TRP  47   4.786  15.872  -2.597
  751    HZ2  TRP  47           HZ2      TRP  47   3.856  20.821  -2.109
  752    HZ3  TRP  47           HZ3      TRP  47   6.135  17.325  -1.085
  753    HH2  TRP  47           HH2      TRP  47   5.720  19.719  -0.819
  754    H    CYS  48           H        CYS  48   0.348  13.443  -2.000
  755    HA   CYS  48           HA       CYS  48   1.390  10.943  -2.789
  756   1HB   CYS  48          1HB       CYS  48   3.439  12.114  -1.891
  757   2HB   CYS  48          2HB       CYS  48   2.668  12.082  -0.303
  758    H    PHE  49           H        PHE  49  -0.450   9.800  -2.275
  759    HA   PHE  49           HA       PHE  49  -1.383   9.934   0.459
  760   1HB   PHE  49          1HB       PHE  49  -3.783  10.019  -0.822
  761   2HB   PHE  49          2HB       PHE  49  -2.953  11.503  -0.342
  762    HD1  PHE  49           HD1      PHE  49  -1.329  12.499  -2.136
  763    HD2  PHE  49           HD2      PHE  49  -4.437   9.747  -3.015
  764    HE1  PHE  49           HE1      PHE  49  -1.316  13.248  -4.531
  765    HE2  PHE  49           HE2      PHE  49  -4.424  10.497  -5.409
  766    HZ   PHE  49           HZ       PHE  49  -2.863  12.239  -6.139
  767    H    LYS  50           H        LYS  50  -3.687   8.415   0.263
  768    HA   LYS  50           HA       LYS  50  -2.759   6.010  -1.145
  769   1HB   LYS  50          1HB       LYS  50  -4.159   4.983   0.924
  770   2HB   LYS  50          2HB       LYS  50  -2.400   5.206   0.927
  771   1HG   LYS  50          1HG       LYS  50  -4.107   7.531   1.751
  772   2HG   LYS  50          2HG       LYS  50  -3.992   6.173   2.884
  773   1HD   LYS  50          1HD       LYS  50  -1.712   7.830   1.729
  774   2HD   LYS  50          2HD       LYS  50  -2.239   7.782   3.420
  775   1HE   LYS  50          1HE       LYS  50  -0.725   5.722   1.814
  776   2HE   LYS  50          2HE       LYS  50  -0.364   6.353   3.428
  777   1HZ   LYS  50          1HZ       LYS  50  -2.383   4.394   2.644
  778   2HZ   LYS  50          2HZ       LYS  50  -1.224   4.263   3.787
  779   3HZ   LYS  50          3HZ       LYS  50  -2.526   5.214   4.049
  780    HA   PRO  51           HA       PRO  51  -6.900   7.147  -2.559
  781   1HB   PRO  51          1HB       PRO  51  -6.376   7.127  -5.239
  782   2HB   PRO  51          2HB       PRO  51  -6.332   8.591  -4.259
  783   1HG   PRO  51          1HG       PRO  51  -4.121   6.950  -5.319
  784   2HG   PRO  51          2HG       PRO  51  -4.080   8.659  -4.754
  785   1HD   PRO  51          1HD       PRO  51  -3.119   6.317  -3.415
  786   2HD   PRO  51          2HD       PRO  51  -3.200   7.953  -2.749
  787    H    LEU  52           H        LEU  52  -5.811   5.453  -5.334
  788    HA   LEU  52           HA       LEU  52  -7.413   3.184  -4.410
  789   1HB   LEU  52          1HB       LEU  52  -8.022   2.800  -6.543
  790   2HB   LEU  52          2HB       LEU  52  -7.819   4.560  -6.594
  791    HG   LEU  52           HG       LEU  52  -5.317   3.464  -7.288
  792   1HD1  LEU  52          1HD1      LEU  52  -6.385   2.222  -9.439
  793   2HD1  LEU  52          2HD1      LEU  52  -5.832   1.379  -7.972
  794   3HD1  LEU  52          3HD1      LEU  52  -7.559   1.754  -8.186
  795   1HD2  LEU  52          1HD2      LEU  52  -6.887   4.272  -9.585
  796   2HD2  LEU  52          2HD2      LEU  52  -7.125   5.381  -8.214
  797   3HD2  LEU  52          3HD2      LEU  52  -5.484   5.060  -8.823
  798    H    GLN  53           H        GLN  53  -4.844   3.537  -3.247
  799    HA   GLN  53           HA       GLN  53  -2.777   2.354  -4.550
  800   1HB   GLN  53          1HB       GLN  53  -3.505   2.151  -1.603
  801   2HB   GLN  53          2HB       GLN  53  -1.899   1.809  -2.274
  802   1HG   GLN  53          1HG       GLN  53  -3.381   4.469  -2.442
  803   2HG   GLN  53          2HG       GLN  53  -2.050   4.114  -1.329
  804   1HE2  GLN  53          1HE2      GLN  53  -3.030   4.776  -4.590
  805   2HE2  GLN  53          2HE2      GLN  53  -1.462   5.018  -5.288
  806    H    GLU  54           H        GLU  54  -5.776   0.937  -3.530
  807    HA   GLU  54           HA       GLU  54  -5.220  -1.561  -2.811
  808   1HB   GLU  54          1HB       GLU  54  -7.355  -2.197  -3.666
  809   2HB   GLU  54          2HB       GLU  54  -7.498  -0.482  -3.241
  810   1HG   GLU  54          1HG       GLU  54  -8.123  -0.030  -5.356
  811   2HG   GLU  54          2HG       GLU  54  -6.564  -0.623  -5.951
  812    H    ALA  55           H        ALA  55  -4.446  -0.070  -5.886
  813    HA   ALA  55           HA       ALA  55  -4.411  -1.924  -7.754
  814   1HB   ALA  55          1HB       ALA  55  -2.860   0.379  -7.095
  815   2HB   ALA  55          2HB       ALA  55  -1.729  -0.881  -7.645
  816   3HB   ALA  55          3HB       ALA  55  -3.080  -0.378  -8.691
  817    H    GLU  56           H        GLU  56  -1.625  -1.699  -5.420
  818    HA   GLU  56           HA       GLU  56  -1.638  -4.584  -5.317
  819   1HB   GLU  56          1HB       GLU  56   0.439  -2.922  -6.631
  820   2HB   GLU  56          2HB       GLU  56   1.066  -4.156  -5.525
  821   1HG   GLU  56          1HG       GLU  56  -0.072  -5.912  -6.735
  822   2HG   GLU  56          2HG       GLU  56  -0.981  -4.745  -7.708
  823    H    CYS  57           H        CYS  57  -2.209  -2.129  -3.562
  824    HA   CYS  57           HA       CYS  57  -0.113  -2.486  -1.570
  825   1HB   CYS  57          1HB       CYS  57  -1.392  -0.231  -2.488
  826   2HB   CYS  57          2HB       CYS  57  -2.231  -0.557  -0.970
  827    H    THR  58           H        THR  58  -3.738  -2.353  -1.908
  828    HA   THR  58           HA       THR  58  -4.213  -3.482   0.643
  829    HB   THR  58           HB       THR  58  -5.718  -2.018  -0.945
  830    HG1  THR  58           HG1      THR  58  -7.555  -3.221   0.071
  831   1HG2  THR  58          1HG2      THR  58  -6.261  -4.867  -1.932
  832   2HG2  THR  58          2HG2      THR  58  -7.393  -3.510  -2.153
  833   3HG2  THR  58          3HG2      THR  58  -5.791  -3.468  -2.929
  834    H    PHE  59           H        PHE  59  -4.006  -4.865  -2.678
  835    HA   PHE  59           HA       PHE  59  -4.822  -7.426  -1.970
  836   1HB   PHE  59          1HB       PHE  59  -3.201  -6.033  -4.106
  837   2HB   PHE  59          2HB       PHE  59  -3.063  -7.793  -4.052
  838    HD1  PHE  59           HD1      PHE  59  -5.769  -5.212  -3.907
  839    HD2  PHE  59           HD2      PHE  59  -4.468  -8.942  -5.458
  840    HE1  PHE  59           HE1      PHE  59  -7.895  -5.404  -5.227
  841    HE2  PHE  59           HE2      PHE  59  -6.593  -9.134  -6.779
  842    HZ   PHE  59           HZ       PHE  59  -8.282  -7.363  -6.647
  Start of MODEL   27
    1   1H    GLU   1           H1       GLU   1 -14.833 -14.534  -4.555
    2    HA   GLU   1           HA       GLU   1 -13.666 -12.381  -6.112
    3   1HB   GLU   1          1HB       GLU   1 -16.474 -13.486  -5.849
    4   2HB   GLU   1          2HB       GLU   1 -16.165 -11.928  -6.637
    5   1HG   GLU   1          1HG       GLU   1 -14.880 -12.941  -8.361
    6   2HG   GLU   1          2HG       GLU   1 -14.666 -14.444  -7.451
    7    H    GLU   2           H        GLU   2 -14.875 -13.145  -2.971
    8    HA   GLU   2           HA       GLU   2 -15.686 -10.423  -2.467
    9   1HB   GLU   2          1HB       GLU   2 -16.275 -13.021  -1.348
   10   2HB   GLU   2          2HB       GLU   2 -15.705 -11.950  -0.057
   11   1HG   GLU   2          1HG       GLU   2 -17.791 -11.051  -2.065
   12   2HG   GLU   2          2HG       GLU   2 -18.254 -11.964  -0.622
   13    H    TYR   3           H        TYR   3 -13.750  -9.211  -2.544
   14    HA   TYR   3           HA       TYR   3 -11.283  -9.677  -1.860
   15   1HB   TYR   3          1HB       TYR   3 -12.890  -7.412  -0.551
   16   2HB   TYR   3          2HB       TYR   3 -11.223  -7.313  -1.125
   17    HD1  TYR   3           HD1      TYR   3 -11.215  -8.236  -3.812
   18    HD2  TYR   3           HD2      TYR   3 -14.296  -6.068  -1.785
   19    HE1  TYR   3           HE1      TYR   3 -12.057  -7.340  -6.037
   20    HE2  TYR   3           HE2      TYR   3 -15.129  -5.178  -4.018
   21    HH   TYR   3           HH       TYR   3 -14.175  -6.500  -6.952
   22    H    VAL   4           H        VAL   4 -11.109 -11.492  -0.391
   23    HA   VAL   4           HA       VAL   4 -11.180 -10.596   2.389
   24    HB   VAL   4           HB       VAL   4 -12.386 -13.144   1.299
   25   1HG1  VAL   4          1HG1      VAL   4 -12.870 -13.726   3.656
   26   2HG1  VAL   4          2HG1      VAL   4 -11.123 -13.664   3.317
   27   3HG1  VAL   4          3HG1      VAL   4 -11.909 -12.323   4.184
   28   1HG2  VAL   4          1HG2      VAL   4 -14.054 -11.665   3.125
   29   2HG2  VAL   4          2HG2      VAL   4 -13.497 -10.592   1.818
   30   3HG2  VAL   4          3HG2      VAL   4 -14.353 -12.103   1.426
   31    H    GLY   5           H        GLY   5 -10.185 -13.128  -0.002
   32   1HA   GLY   5          1HA       GLY   5  -8.130 -14.231   1.572
   33   2HA   GLY   5          2HA       GLY   5  -8.305 -14.351  -0.168
   34    H    LEU   6           H        LEU   6  -8.416 -11.108   0.161
   35    HA   LEU   6           HA       LEU   6  -5.488 -10.851   0.155
   36   1HB   LEU   6          1HB       LEU   6  -6.522  -8.755  -1.337
   37   2HB   LEU   6          2HB       LEU   6  -5.641 -10.173  -1.933
   38    HG   LEU   6           HG       LEU   6  -8.638 -10.170  -1.572
   39   1HD1  LEU   6          1HD1      LEU   6  -8.134  -8.283  -3.014
   40   2HD1  LEU   6          2HD1      LEU   6  -7.099  -9.309  -4.037
   41   3HD1  LEU   6          3HD1      LEU   6  -8.852  -9.610  -3.959
   42   1HD2  LEU   6          1HD2      LEU   6  -6.653 -11.904  -3.033
   43   2HD2  LEU   6          2HD2      LEU   6  -7.881 -12.364  -1.829
   44   3HD2  LEU   6          3HD2      LEU   6  -8.379 -11.886  -3.469
   45    H    SER   7           H        SER   7  -8.012 -10.460   2.109
   46    HA   SER   7           HA       SER   7  -7.280  -7.741   2.851
   47   1HB   SER   7          1HB       SER   7  -9.635  -9.201   4.033
   48   2HB   SER   7          2HB       SER   7  -9.422  -7.462   3.768
   49    HG   SER   7           HG       SER   7 -10.590  -7.788   2.006
   50    H    ALA   8           H        ALA   8  -8.489  -8.149   5.581
   51    HA   ALA   8           HA       ALA   8  -6.200  -8.807   6.975
   52   1HB   ALA   8          1HB       ALA   8  -8.787  -9.320   8.334
   53   2HB   ALA   8          2HB       ALA   8  -7.461  -8.217   8.774
   54   3HB   ALA   8          3HB       ALA   8  -8.653  -7.730   7.545
   55    H    ASN   9           H        ASN   9  -5.372 -10.769   5.967
   56    HA   ASN   9           HA       ASN   9  -5.683 -12.987   7.403
   57   1HB   ASN   9          1HB       ASN   9  -8.038 -12.663   5.837
   58   2HB   ASN   9          2HB       ASN   9  -7.121 -13.953   5.043
   59   1HD2  ASN   9          1HD2      ASN   9  -6.028 -15.460   6.754
   60   2HD2  ASN   9          2HD2      ASN   9  -7.085 -16.091   7.973
   61    H    GLN  10           H        GLN  10  -5.368 -11.495   4.180
   62    HA   GLN  10           HA       GLN  10  -3.982 -13.573   2.953
   63   1HB   GLN  10          1HB       GLN  10  -5.111 -11.564   1.867
   64   2HB   GLN  10          2HB       GLN  10  -3.693 -10.607   2.331
   65   1HG   GLN  10          1HG       GLN  10  -2.693 -12.972   1.115
   66   2HG   GLN  10          2HG       GLN  10  -4.035 -12.437   0.090
   67   1HE2  GLN  10          1HE2      GLN  10  -3.954  -9.728   0.412
   68   2HE2  GLN  10          2HE2      GLN  10  -2.496  -9.066  -0.247
   69    H    CYS  11           H        CYS  11  -3.052 -11.090   5.276
   70    HA   CYS  11           HA       CYS  11  -0.281 -11.175   4.686
   71   1HB   CYS  11          1HB       CYS  11  -1.255  -9.235   5.719
   72   2HB   CYS  11          2HB       CYS  11  -1.800 -10.183   7.105
   73    H    ALA  12           H        ALA  12  -2.407 -13.490   5.830
   74    HA   ALA  12           HA       ALA  12  -0.362 -14.692   7.567
   75   1HB   ALA  12          1HB       ALA  12  -2.679 -14.033   8.515
   76   2HB   ALA  12          2HB       ALA  12  -3.310 -15.390   7.552
   77   3HB   ALA  12          3HB       ALA  12  -2.100 -15.688   8.822
   78    H    VAL  13           H        VAL  13  -1.158 -14.637   4.451
   79    HA   VAL  13           HA       VAL  13  -2.020 -17.059   3.620
   80    HB   VAL  13           HB       VAL  13  -0.823 -14.825   2.519
   81   1HG1  VAL  13          1HG1      VAL  13   1.404 -15.797   2.702
   82   2HG1  VAL  13          2HG1      VAL  13   0.860 -17.266   1.856
   83   3HG1  VAL  13          3HG1      VAL  13   0.914 -15.710   0.993
   84   1HG2  VAL  13          1HG2      VAL  13  -2.302 -15.466   0.981
   85   2HG2  VAL  13          2HG2      VAL  13  -1.166 -16.723   0.437
   86   3HG2  VAL  13          3HG2      VAL  13  -2.377 -17.098   1.688
   87    HA   PRO  14           HA       PRO  14   0.984 -20.015   4.585
   88   1HB   PRO  14          1HB       PRO  14   1.124 -21.608   2.370
   89   2HB   PRO  14          2HB       PRO  14  -0.175 -21.717   3.556
   90   1HG   PRO  14          1HG       PRO  14  -0.160 -20.507   0.866
   91   2HG   PRO  14          2HG       PRO  14  -1.571 -21.040   1.850
   92   1HD   PRO  14          1HD       PRO  14  -0.644 -18.375   1.363
   93   2HD   PRO  14          2HD       PRO  14  -1.939 -18.856   2.467
   94    H    ALA  15           H        ALA  15   1.961 -17.483   3.429
   95    HA   ALA  15           HA       ALA  15   3.836 -16.625   2.605
   96   1HB   ALA  15          1HB       ALA  15   5.871 -18.337   3.359
   97   2HB   ALA  15          2HB       ALA  15   5.123 -17.106   4.405
   98   3HB   ALA  15          3HB       ALA  15   4.559 -18.793   4.472
   99    H    LYS  16           H        LYS  16   2.737 -17.353   0.445
  100    HA   LYS  16           HA       LYS  16   4.710 -18.127  -1.301
  101   1HB   LYS  16          1HB       LYS  16   3.762 -20.413  -1.951
  102   2HB   LYS  16          2HB       LYS  16   4.814 -20.328  -0.528
  103   1HG   LYS  16          1HG       LYS  16   3.169 -21.188   0.744
  104   2HG   LYS  16          2HG       LYS  16   2.097 -19.844   0.314
  105   1HD   LYS  16          1HD       LYS  16   0.995 -21.887  -0.331
  106   2HD   LYS  16          2HD       LYS  16   1.542 -21.109  -1.827
  107   1HE   LYS  16          1HE       LYS  16   2.931 -22.832  -2.323
  108   2HE   LYS  16          2HE       LYS  16   3.574 -22.910  -0.676
  109   1HZ   LYS  16          1HZ       LYS  16   2.181 -24.543  -0.203
  110   2HZ   LYS  16          2HZ       LYS  16   0.889 -23.807  -0.877
  111   3HZ   LYS  16          3HZ       LYS  16   1.904 -24.687  -1.805
  112    H    ASP  17           H        ASP  17   2.629 -16.168  -0.942
  113    HA   ASP  17           HA       ASP  17   1.443 -16.455  -3.513
  114   1HB   ASP  17          1HB       ASP  17  -0.129 -17.598  -1.816
  115   2HB   ASP  17          2HB       ASP  17  -0.412 -15.985  -1.141
  116    H    ARG  18           H        ARG  18   3.233 -14.751  -1.546
  117    HA   ARG  18           HA       ARG  18   1.734 -12.306  -1.482
  118   1HB   ARG  18          1HB       ARG  18   4.621 -12.849  -0.654
  119   2HB   ARG  18          2HB       ARG  18   3.672 -11.413  -0.231
  120   1HG   ARG  18          1HG       ARG  18   2.558 -12.500   1.433
  121   2HG   ARG  18          2HG       ARG  18   2.393 -13.996   0.495
  122   1HD   ARG  18          1HD       ARG  18   4.679 -14.643   1.033
  123   2HD   ARG  18          2HD       ARG  18   4.999 -13.080   1.800
  124    HE   ARG  18           HE       ARG  18   2.735 -14.516   2.972
  125   1HH1  ARG  18          1HH1      ARG  18   6.231 -14.122   3.036
  126   2HH1  ARG  18          2HH1      ARG  18   6.394 -14.705   4.660
  127   1HH2  ARG  18          1HH2      ARG  18   2.950 -15.285   5.113
  128   2HH2  ARG  18          2HH2      ARG  18   4.515 -15.371   5.849
  129    H    VAL  19           H        VAL  19   3.182 -10.230  -2.135
  130    HA   VAL  19           HA       VAL  19   4.127 -10.796  -4.848
  131    HB   VAL  19           HB       VAL  19   3.419  -8.115  -3.669
  132   1HG1  VAL  19          1HG1      VAL  19   3.576  -7.294  -5.776
  133   2HG1  VAL  19          2HG1      VAL  19   4.637  -8.703  -6.015
  134   3HG1  VAL  19          3HG1      VAL  19   2.932  -8.777  -6.521
  135   1HG2  VAL  19          1HG2      VAL  19   1.345  -8.983  -3.364
  136   2HG2  VAL  19          2HG2      VAL  19   1.217  -8.721  -5.120
  137   3HG2  VAL  19          3HG2      VAL  19   1.624 -10.335  -4.488
  138    H    ASP  20           H        ASP  20   5.565 -11.099  -2.107
  139    HA   ASP  20           HA       ASP  20   7.415 -10.412  -1.108
  140   1HB   ASP  20          1HB       ASP  20   8.525 -11.917  -2.467
  141   2HB   ASP  20          2HB       ASP  20   8.041 -11.099  -3.960
  142    H    CYS  21           H        CYS  21   6.947  -8.170  -0.522
  143    HA   CYS  21           HA       CYS  21   6.951  -6.015  -2.169
  144   1HB   CYS  21          1HB       CYS  21   6.680  -6.409   0.492
  145   2HB   CYS  21          2HB       CYS  21   8.236  -5.576   0.456
  146    H    GLY  22           H        GLY  22   9.695  -7.829  -0.732
  147   1HA   GLY  22          1HA       GLY  22  11.928  -7.656  -0.992
  148   2HA   GLY  22          2HA       GLY  22  11.542  -7.318  -2.667
  149    H    TYR  23           H        TYR  23  11.444  -5.590   0.538
  150    HA   TYR  23           HA       TYR  23  12.157  -3.127  -0.835
  151   1HB   TYR  23          1HB       TYR  23  10.804  -4.096   1.599
  152   2HB   TYR  23          2HB       TYR  23  12.020  -2.889   2.031
  153    HD1  TYR  23           HD1      TYR  23  11.815  -0.566   1.188
  154    HD2  TYR  23           HD2      TYR  23   8.792  -3.497   0.429
  155    HE1  TYR  23           HE1      TYR  23  10.179   1.274   0.553
  156    HE2  TYR  23           HE2      TYR  23   7.168  -1.647  -0.204
  157    HH   TYR  23           HH       TYR  23   6.864   0.471  -0.455
  158    HA   PRO  24           HA       PRO  24  16.310  -3.381   0.374
  159   1HB   PRO  24          1HB       PRO  24  17.051  -0.769   0.070
  160   2HB   PRO  24          2HB       PRO  24  16.948  -1.905  -1.274
  161   1HG   PRO  24          1HG       PRO  24  15.107   0.255  -0.469
  162   2HG   PRO  24          2HG       PRO  24  15.252  -0.557  -2.069
  163   1HD   PRO  24          1HD       PRO  24  13.235  -0.917  -0.066
  164   2HD   PRO  24          2HD       PRO  24  13.426  -1.854  -1.554
  165    H    HIS  25           H        HIS  25  13.966  -1.851   2.153
  166    HA   HIS  25           HA       HIS  25  15.887  -1.600   4.351
  167   1HB   HIS  25          1HB       HIS  25  14.650   0.513   3.197
  168   2HB   HIS  25          2HB       HIS  25  13.461   0.098   4.439
  169    HD1  HIS  25           HD1      HIS  25  15.000   2.761   4.617
  170    HD2  HIS  25           HD2      HIS  25  16.264  -0.794   6.452
  171    HE1  HIS  25           HE1      HIS  25  16.534   3.452   6.537
  172    HE2  HIS  25           HE2      HIS  25  17.235   1.230   7.659
  173    H    VAL  26           H        VAL  26  13.924  -3.751   3.226
  174    HA   VAL  26           HA       VAL  26  11.697  -4.114   4.653
  175    HB   VAL  26           HB       VAL  26  12.338  -5.708   3.057
  176   1HG1  VAL  26          1HG1      VAL  26  14.330  -7.209   3.372
  177   2HG1  VAL  26          2HG1      VAL  26  14.729  -5.499   3.082
  178   3HG1  VAL  26          3HG1      VAL  26  14.828  -6.168   4.728
  179   1HG2  VAL  26          1HG2      VAL  26  11.658  -7.632   4.087
  180   2HG2  VAL  26          2HG2      VAL  26  12.788  -7.439   5.448
  181   3HG2  VAL  26          3HG2      VAL  26  11.290  -6.478   5.393
  182    H    THR  27           H        THR  27  11.080  -4.273   6.757
  183    HA   THR  27           HA       THR  27  12.736  -5.428   8.741
  184    HB   THR  27           HB       THR  27  13.204  -2.642   8.112
  185    HG1  THR  27           HG1      THR  27  14.904  -3.195   9.540
  186   1HG2  THR  27          1HG2      THR  27  12.893  -2.649  11.007
  187   2HG2  THR  27          2HG2      THR  27  12.256  -1.474   9.831
  188   3HG2  THR  27          3HG2      THR  27  11.308  -2.923  10.244
  189    HA   PRO  28           HA       PRO  28   8.869  -5.704  10.576
  190   1HB   PRO  28          1HB       PRO  28   9.531  -6.252  13.169
  191   2HB   PRO  28          2HB       PRO  28   9.540  -7.469  11.894
  192   1HG   PRO  28          1HG       PRO  28  11.785  -6.047  13.176
  193   2HG   PRO  28          2HG       PRO  28  11.815  -7.593  12.253
  194   1HD   PRO  28          1HD       PRO  28  12.680  -4.998  11.409
  195   2HD   PRO  28          2HD       PRO  28  12.582  -6.453  10.410
  196    H    LYS  29           H        LYS  29   9.307  -3.135  10.009
  197    HA   LYS  29           HA       LYS  29   7.676  -1.858  11.835
  198   1HB   LYS  29          1HB       LYS  29   9.807  -2.195  13.245
  199   2HB   LYS  29          2HB       LYS  29  10.505  -0.904  12.251
  200   1HG   LYS  29          1HG       LYS  29   9.506   0.574  13.626
  201   2HG   LYS  29          2HG       LYS  29   7.941   0.036  12.994
  202   1HD   LYS  29          1HD       LYS  29   7.455  -1.132  14.887
  203   2HD   LYS  29          2HD       LYS  29   9.103  -1.762  15.050
  204   1HE   LYS  29          1HE       LYS  29   9.279  -0.337  16.806
  205   2HE   LYS  29          2HE       LYS  29   9.431   0.948  15.598
  206   1HZ   LYS  29          1HZ       LYS  29   7.540   1.741  16.350
  207   2HZ   LYS  29          2HZ       LYS  29   6.748   0.379  15.922
  208   3HZ   LYS  29          3HZ       LYS  29   7.380   0.518  17.421
  209    H    GLU  30           H        GLU  30  10.018  -1.967   9.239
  210    HA   GLU  30           HA       GLU  30   9.272   0.701   8.408
  211   1HB   GLU  30          1HB       GLU  30  11.561  -1.077   7.998
  212   2HB   GLU  30          2HB       GLU  30  10.998  -0.372   6.472
  213   1HG   GLU  30          1HG       GLU  30  12.323   1.376   7.107
  214   2HG   GLU  30          2HG       GLU  30  10.927   1.833   8.093
  215    H    CYS  31           H        CYS  31   9.163  -2.743   7.327
  216    HA   CYS  31           HA       CYS  31   8.041  -2.329   4.850
  217   1HB   CYS  31          1HB       CYS  31   7.946  -4.591   6.813
  218   2HB   CYS  31          2HB       CYS  31   7.000  -4.668   5.323
  219    H    ASN  32           H        ASN  32   6.478  -2.887   8.086
  220    HA   ASN  32           HA       ASN  32   3.886  -2.639   7.089
  221   1HB   ASN  32          1HB       ASN  32   5.231  -2.830   9.722
  222   2HB   ASN  32          2HB       ASN  32   3.729  -1.895   9.781
  223   1HD2  ASN  32          1HD2      ASN  32   4.997  -4.816   8.172
  224   2HD2  ASN  32          2HD2      ASN  32   3.650  -5.853   8.507
  225    H    ASN  33           H        ASN  33   6.347  -0.386   7.197
  226    HA   ASN  33           HA       ASN  33   4.582   1.798   7.946
  227   1HB   ASN  33          1HB       ASN  33   6.957   1.488   8.959
  228   2HB   ASN  33          2HB       ASN  33   7.576   1.993   7.380
  229   1HD2  ASN  33          1HD2      ASN  33   8.533   3.764   8.493
  230   2HD2  ASN  33          2HD2      ASN  33   7.618   5.179   8.889
  231    H    ARG  34           H        ARG  34   6.467   0.261   5.351
  232    HA   ARG  34           HA       ARG  34   6.244   2.515   3.625
  233   1HB   ARG  34          1HB       ARG  34   6.968  -0.305   2.765
  234   2HB   ARG  34          2HB       ARG  34   7.530   1.225   2.069
  235   1HG   ARG  34          1HG       ARG  34   8.304   1.316   4.779
  236   2HG   ARG  34          2HG       ARG  34   8.647  -0.348   4.273
  237   1HD   ARG  34          1HD       ARG  34  10.348   0.306   2.901
  238   2HD   ARG  34          2HD       ARG  34   9.463   1.717   2.299
  239    HE   ARG  34           HE       ARG  34  10.159   2.251   4.992
  240   1HH1  ARG  34          1HH1      ARG  34  11.803   1.692   1.931
  241   2HH1  ARG  34          2HH1      ARG  34  13.183   2.651   2.351
  242   1HH2  ARG  34          1HH2      ARG  34  11.980   3.516   5.546
  243   2HH2  ARG  34          2HH2      ARG  34  13.284   3.696   4.421
  244    H    GLY  35           H        GLY  35   4.409  -0.367   4.451
  245   1HA   GLY  35          1HA       GLY  35   2.055  -0.232   3.774
  246   2HA   GLY  35          2HA       GLY  35   2.610   0.127   2.151
  247    H    CYS  36           H        CYS  36   4.396  -2.175   4.187
  248    HA   CYS  36           HA       CYS  36   3.299  -4.330   2.527
  249   1HB   CYS  36          1HB       CYS  36   6.095  -4.238   3.649
  250   2HB   CYS  36          2HB       CYS  36   5.429  -5.395   2.492
  251    H    CYS  37           H        CYS  37   4.153  -6.554   3.830
  252    HA   CYS  37           HA       CYS  37   3.413  -6.118   6.629
  253   1HB   CYS  37          1HB       CYS  37   1.604  -7.095   5.045
  254   2HB   CYS  37          2HB       CYS  37   2.550  -8.583   5.150
  255    H    PHE  38           H        PHE  38   4.952  -6.958   8.007
  256    HA   PHE  38           HA       PHE  38   7.081  -8.513   6.816
  257   1HB   PHE  38          1HB       PHE  38   7.413  -6.533   8.372
  258   2HB   PHE  38          2HB       PHE  38   6.557  -7.412   9.643
  259    HD1  PHE  38           HD1      PHE  38   7.662  -9.125  10.901
  260    HD2  PHE  38           HD2      PHE  38   9.643  -7.259   7.646
  261    HE1  PHE  38           HE1      PHE  38   9.837 -10.130  11.649
  262    HE2  PHE  38           HE2      PHE  38  11.818  -8.264   8.393
  263    HZ   PHE  38           HZ       PHE  38  11.890  -9.687  10.385
  264    H    ASP  39           H        ASP  39   7.100 -10.706   6.847
  265    HA   ASP  39           HA       ASP  39   5.221 -12.022   8.568
  266   1HB   ASP  39          1HB       ASP  39   5.385 -12.819   6.292
  267   2HB   ASP  39          2HB       ASP  39   7.144 -12.982   6.407
  268    H    SER  40           H        SER  40   8.539 -13.107   7.599
  269    HA   SER  40           HA       SER  40  10.372 -13.396   8.804
  270   1HB   SER  40          1HB       SER  40   9.119 -11.693  10.506
  271   2HB   SER  40          2HB       SER  40   9.134 -13.151  11.513
  272    HG   SER  40           HG       SER  40  11.083 -12.277  11.989
  273    H    ARG  41           H        ARG  41   7.276 -14.858   9.249
  274    HA   ARG  41           HA       ARG  41   7.928 -16.910  10.974
  275   1HB   ARG  41          1HB       ARG  41   5.928 -16.828   8.669
  276   2HB   ARG  41          2HB       ARG  41   5.941 -18.078   9.923
  277   1HG   ARG  41          1HG       ARG  41   5.959 -15.773  11.431
  278   2HG   ARG  41          2HG       ARG  41   4.992 -15.262  10.037
  279   1HD   ARG  41          1HD       ARG  41   3.507 -16.179  11.737
  280   2HD   ARG  41          2HD       ARG  41   3.545 -17.309  10.375
  281    HE   ARG  41           HE       ARG  41   5.582 -18.094  12.185
  282   1HH1  ARG  41          1HH1      ARG  41   2.072 -17.853  12.135
  283   2HH1  ARG  41          2HH1      ARG  41   1.840 -19.138  13.273
  284   1HH2  ARG  41          1HH2      ARG  41   5.277 -19.789  13.686
  285   2HH2  ARG  41          2HH2      ARG  41   3.676 -20.247  14.161
  286    H    ILE  42           H        ILE  42   8.166 -16.576   7.387
  287    HA   ILE  42           HA       ILE  42   9.750 -19.051   7.383
  288    HB   ILE  42           HB       ILE  42   8.182 -18.129   5.003
  289   1HG1  ILE  42          1HG1      ILE  42   7.131 -19.553   7.431
  290   2HG1  ILE  42          2HG1      ILE  42   6.415 -18.205   6.530
  291   1HG2  ILE  42          1HG2      ILE  42   9.960 -19.877   4.820
  292   2HG2  ILE  42          2HG2      ILE  42   8.993 -20.901   5.908
  293   3HG2  ILE  42          3HG2      ILE  42   8.337 -20.418   4.326
  294   1HD1  ILE  42          1HD1      ILE  42   5.138 -20.124   5.908
  295   2HD1  ILE  42          2HD1      ILE  42   6.250 -19.862   4.543
  296   3HD1  ILE  42          3HD1      ILE  42   6.592 -21.136   5.738
  297    HA   PRO  43           HA       PRO  43  12.671 -16.071   6.023
  298   1HB   PRO  43          1HB       PRO  43  14.888 -17.612   6.432
  299   2HB   PRO  43          2HB       PRO  43  14.174 -16.599   7.685
  300   1HG   PRO  43          1HG       PRO  43  14.034 -19.521   7.299
  301   2HG   PRO  43          2HG       PRO  43  13.729 -18.570   8.796
  302   1HD   PRO  43          1HD       PRO  43  11.822 -19.805   7.053
  303   2HD   PRO  43          2HD       PRO  43  11.467 -18.746   8.424
  304    H    GLY  44           H        GLY  44  11.633 -18.886   4.659
  305   1HA   GLY  44          1HA       GLY  44  13.534 -18.787   2.443
  306   2HA   GLY  44          2HA       GLY  44  12.298 -19.994   2.736
  307    H    VAL  45           H        VAL  45  10.656 -17.212   3.382
  308    HA   VAL  45           HA       VAL  45   9.949 -16.803   0.558
  309    HB   VAL  45           HB       VAL  45   7.716 -16.898   1.032
  310   1HG1  VAL  45          1HG1      VAL  45   8.936 -19.096   1.522
  311   2HG1  VAL  45          2HG1      VAL  45   8.655 -18.735   3.243
  312   3HG1  VAL  45          3HG1      VAL  45   7.274 -18.937   2.139
  313   1HG2  VAL  45          1HG2      VAL  45   7.778 -15.197   2.834
  314   2HG2  VAL  45          2HG2      VAL  45   6.674 -16.544   3.201
  315   3HG2  VAL  45          3HG2      VAL  45   8.271 -16.462   3.985
  316    HA   PRO  46           HA       PRO  46  10.098 -12.540   1.368
  317   1HB   PRO  46          1HB       PRO  46   7.714 -11.439   0.614
  318   2HB   PRO  46          2HB       PRO  46   8.962 -11.916  -0.536
  319   1HG   PRO  46          1HG       PRO  46   6.428 -13.251   0.175
  320   2HG   PRO  46          2HG       PRO  46   7.436 -13.468  -1.300
  321   1HD   PRO  46          1HD       PRO  46   7.193 -15.206   0.962
  322   2HD   PRO  46          2HD       PRO  46   8.317 -15.388  -0.390
  323    H    TRP  47           H        TRP  47  10.483 -11.664   3.292
  324    HA   TRP  47           HA       TRP  47   8.365 -11.985   5.258
  325   1HB   TRP  47          1HB       TRP  47  10.750 -10.591   6.136
  326   2HB   TRP  47          2HB       TRP  47   9.981 -12.048   6.772
  327    HD1  TRP  47           HD1      TRP  47  10.806 -14.431   5.564
  328    HE1  TRP  47           HE1      TRP  47  13.083 -15.174   4.458
  329    HE3  TRP  47           HE3      TRP  47  12.602  -9.727   4.852
  330    HZ2  TRP  47           HZ2      TRP  47  15.330 -13.745   3.432
  331    HZ3  TRP  47           HZ3      TRP  47  14.846  -9.490   3.792
  332    HH2  TRP  47           HH2      TRP  47  16.197 -11.401   3.090
  333    H    CYS  48           H        CYS  48   8.108 -10.192   2.856
  334    HA   CYS  48           HA       CYS  48   7.107  -7.946   4.228
  335   1HB   CYS  48          1HB       CYS  48   9.456  -7.307   4.302
  336   2HB   CYS  48          2HB       CYS  48   9.578  -7.467   2.547
  337    H    PHE  49           H        PHE  49   5.191  -7.926   3.091
  338    HA   PHE  49           HA       PHE  49   5.365  -7.625   0.214
  339   1HB   PHE  49          1HB       PHE  49   3.297  -9.380   0.353
  340   2HB   PHE  49          2HB       PHE  49   4.958  -9.951   0.163
  341    HD1  PHE  49           HD1      PHE  49   6.232 -10.414   2.406
  342    HD2  PHE  49           HD2      PHE  49   2.007 -10.219   2.066
  343    HE1  PHE  49           HE1      PHE  49   6.001 -11.748   4.520
  344    HE2  PHE  49           HE2      PHE  49   1.775 -11.553   4.179
  345    HZ   PHE  49           HZ       PHE  49   3.774 -12.301   5.382
  346    H    LYS  50           H        LYS  50   2.678  -7.732  -0.441
  347    HA   LYS  50           HA       LYS  50   1.515  -5.744   1.385
  348   1HB   LYS  50          1HB       LYS  50   0.344  -5.197  -1.000
  349   2HB   LYS  50          2HB       LYS  50   1.765  -4.353  -0.362
  350   1HG   LYS  50          1HG       LYS  50   2.159  -6.902  -1.915
  351   2HG   LYS  50          2HG       LYS  50   1.768  -5.424  -2.812
  352   1HD   LYS  50          1HD       LYS  50   4.109  -5.868  -0.915
  353   2HD   LYS  50          2HD       LYS  50   4.202  -5.669  -2.674
  354   1HE   LYS  50          1HE       LYS  50   3.651  -3.625  -0.528
  355   2HE   LYS  50          2HE       LYS  50   4.741  -3.511  -1.918
  356   1HZ   LYS  50          1HZ       LYS  50   1.863  -3.137  -1.804
  357   2HZ   LYS  50          2HZ       LYS  50   2.994  -2.234  -2.561
  358   3HZ   LYS  50          3HZ       LYS  50   2.525  -3.662  -3.201
  359    HA   PRO  51           HA       PRO  51  -1.221  -9.339   1.146
  360   1HB   PRO  51          1HB       PRO  51  -1.477  -9.773   3.831
  361   2HB   PRO  51          2HB       PRO  51  -0.309 -10.625   2.824
  362   1HG   PRO  51          1HG       PRO  51   0.088  -8.401   4.722
  363   2HG   PRO  51          2HG       PRO  51   1.307  -9.562   4.081
  364   1HD   PRO  51          1HD       PRO  51   0.902  -6.822   3.352
  365   2HD   PRO  51          2HD       PRO  51   2.008  -7.967   2.580
  366    H    LEU  52           H        LEU  52  -2.121  -8.194   4.245
  367    HA   LEU  52           HA       LEU  52  -4.558  -7.168   3.032
  368   1HB   LEU  52          1HB       LEU  52  -5.592  -7.532   5.032
  369   2HB   LEU  52          2HB       LEU  52  -4.421  -8.860   4.963
  370    HG   LEU  52           HG       LEU  52  -3.058  -6.851   6.308
  371   1HD1  LEU  52          1HD1      LEU  52  -5.117  -6.703   8.165
  372   2HD1  LEU  52          2HD1      LEU  52  -4.538  -5.393   7.108
  373   3HD1  LEU  52          3HD1      LEU  52  -5.919  -6.397   6.605
  374   1HD2  LEU  52          1HD2      LEU  52  -4.531  -8.732   8.032
  375   2HD2  LEU  52          2HD2      LEU  52  -3.658  -9.486   6.676
  376   3HD2  LEU  52          3HD2      LEU  52  -2.781  -8.465   7.841
  377    H    GLN  53           H        GLN  53  -2.059  -5.708   2.639
  378    HA   GLN  53           HA       GLN  53  -1.638  -3.710   4.429
  379   1HB   GLN  53          1HB       GLN  53  -1.482  -3.653   1.393
  380   2HB   GLN  53          2HB       GLN  53  -0.788  -2.400   2.438
  381   1HG   GLN  53          1HG       GLN  53  -0.069  -5.362   2.429
  382   2HG   GLN  53          2HG       GLN  53   0.932  -4.052   1.785
  383   1HE2  GLN  53          1HE2      GLN  53   0.598  -2.117   3.696
  384   2HE2  GLN  53          2HE2      GLN  53   1.299  -2.610   5.201
  385    H    GLU  54           H        GLU  54  -4.371  -4.227   2.281
  386    HA   GLU  54           HA       GLU  54  -5.350  -1.868   1.687
  387   1HB   GLU  54          1HB       GLU  54  -7.533  -2.804   1.766
  388   2HB   GLU  54          2HB       GLU  54  -6.453  -4.178   1.480
  389   1HG   GLU  54          1HG       GLU  54  -7.576  -5.117   3.224
  390   2HG   GLU  54          2HG       GLU  54  -6.518  -4.118   4.232
  391    H    ALA  55           H        ALA  55  -4.844  -3.080   4.965
  392    HA   ALA  55           HA       ALA  55  -6.507  -1.786   6.562
  393   1HB   ALA  55          1HB       ALA  55  -3.480  -1.678   6.871
  394   2HB   ALA  55          2HB       ALA  55  -4.694  -1.636   8.172
  395   3HB   ALA  55          3HB       ALA  55  -4.475  -3.115   7.207
  396    H    GLU  56           H        GLU  56  -3.479  -0.159   5.359
  397    HA   GLU  56           HA       GLU  56  -5.031   2.311   5.414
  398   1HB   GLU  56          1HB       GLU  56  -2.737   1.647   6.960
  399   2HB   GLU  56          2HB       GLU  56  -2.202   2.834   5.757
  400   1HG   GLU  56          1HG       GLU  56  -4.333   4.164   6.445
  401   2HG   GLU  56          2HG       GLU  56  -4.376   3.107   7.864
  402    H    CYS  57           H        CYS  57  -4.112   0.137   3.327
  403    HA   CYS  57           HA       CYS  57  -2.521   1.829   1.589
  404   1HB   CYS  57          1HB       CYS  57  -2.914  -1.013   1.934
  405   2HB   CYS  57          2HB       CYS  57  -3.154  -0.545   0.248
  406    H    THR  58           H        THR  58  -5.070  -0.508   0.602
  407    HA   THR  58           HA       THR  58  -6.120   0.904  -1.441
  408    HB   THR  58           HB       THR  58  -6.620  -1.489  -0.428
  409    HG1  THR  58           HG1      THR  58  -8.772   0.219  -1.449
  410   1HG2  THR  58          1HG2      THR  58  -8.896   0.217   0.713
  411   2HG2  THR  58          2HG2      THR  58  -8.884  -1.562   0.634
  412   3HG2  THR  58          3HG2      THR  58  -7.720  -0.710   1.678
  413    H    PHE  59           H        PHE  59  -6.984   1.279   2.036
  414    HA   PHE  59           HA       PHE  59  -9.128   2.832   1.968
  415   1HB   PHE  59          1HB       PHE  59  -7.535   2.170   3.898
  416   2HB   PHE  59          2HB       PHE  59  -6.527   3.549   3.443
  417    HD1  PHE  59           HD1      PHE  59  -6.816   5.457   4.690
  418    HD2  PHE  59           HD2      PHE  59 -10.126   2.848   4.190
  419    HE1  PHE  59           HE1      PHE  59  -8.208   6.938   6.164
  420    HE2  PHE  59           HE2      PHE  59 -11.517   4.329   5.663
  421    HZ   PHE  59           HZ       PHE  59 -10.541   6.357   6.633
  422   1H    GLU   1           H1       GLU   1 -22.639   5.982   0.734
  423    HA   GLU   1           HA       GLU   1 -21.667   5.501  -1.292
  424   1HB   GLU   1          1HB       GLU   1 -19.553   5.916   0.843
  425   2HB   GLU   1          2HB       GLU   1 -19.182   5.999  -0.887
  426   1HG   GLU   1          1HG       GLU   1 -20.174   8.036  -1.115
  427   2HG   GLU   1          2HG       GLU   1 -21.544   7.601  -0.080
  428    H    GLU   2           H        GLU   2 -20.993   3.885  -2.672
  429    HA   GLU   2           HA       GLU   2 -20.317   1.388  -1.409
  430   1HB   GLU   2          1HB       GLU   2 -20.601   0.465  -3.721
  431   2HB   GLU   2          2HB       GLU   2 -22.036   1.318  -3.128
  432   1HG   GLU   2          1HG       GLU   2 -20.117   3.060  -4.545
  433   2HG   GLU   2          2HG       GLU   2 -20.762   1.765  -5.565
  434    H    TYR   3           H        TYR   3 -19.048   1.098  -4.443
  435    HA   TYR   3           HA       TYR   3 -16.349   1.471  -3.431
  436   1HB   TYR   3          1HB       TYR   3 -15.983   0.325  -5.780
  437   2HB   TYR   3          2HB       TYR   3 -16.790  -0.639  -4.539
  438    HD1  TYR   3           HD1      TYR   3 -19.203  -1.100  -4.694
  439    HD2  TYR   3           HD2      TYR   3 -17.168   1.117  -7.735
  440    HE1  TYR   3           HE1      TYR   3 -21.169  -1.443  -6.268
  441    HE2  TYR   3           HE2      TYR   3 -19.141   0.767  -9.300
  442    HH   TYR   3           HH       TYR   3 -22.077  -0.848  -8.165
  443    H    VAL   4           H        VAL   4 -16.819   3.938  -3.491
  444    HA   VAL   4           HA       VAL   4 -16.114   4.885  -6.181
  445    HB   VAL   4           HB       VAL   4 -17.333   6.979  -5.549
  446   1HG1  VAL   4          1HG1      VAL   4 -18.843   6.088  -6.927
  447   2HG1  VAL   4          2HG1      VAL   4 -18.380   4.442  -6.432
  448   3HG1  VAL   4          3HG1      VAL   4 -19.630   5.327  -5.524
  449   1HG2  VAL   4          1HG2      VAL   4 -18.216   5.241  -3.232
  450   2HG2  VAL   4          2HG2      VAL   4 -17.489   6.866  -3.187
  451   3HG2  VAL   4          3HG2      VAL   4 -19.151   6.651  -3.788
  452    H    GLY   5           H        GLY   5 -16.066   5.665  -2.633
  453   1HA   GLY   5          1HA       GLY   5 -13.920   7.515  -2.872
  454   2HA   GLY   5          2HA       GLY   5 -14.560   6.805  -1.403
  455    H    LEU   6           H        LEU   6 -13.915   4.233  -3.488
  456    HA   LEU   6           HA       LEU   6 -11.114   4.051  -2.665
  457   1HB   LEU   6          1HB       LEU   6 -11.469   1.712  -2.013
  458   2HB   LEU   6          2HB       LEU   6 -12.279   2.879  -0.953
  459    HG   LEU   6           HG       LEU   6 -13.564   0.786  -1.458
  460   1HD1  LEU   6          1HD1      LEU   6 -15.186   3.042  -2.546
  461   2HD1  LEU   6          2HD1      LEU   6 -15.570   1.855  -1.276
  462   3HD1  LEU   6          3HD1      LEU   6 -14.479   3.218  -0.923
  463   1HD2  LEU   6          1HD2      LEU   6 -13.966   1.970  -4.213
  464   2HD2  LEU   6          2HD2      LEU   6 -12.816   0.659  -3.858
  465   3HD2  LEU   6          3HD2      LEU   6 -14.558   0.413  -3.587
  466    H    SER   7           H        SER   7 -12.846   4.609  -5.183
  467    HA   SER   7           HA       SER   7 -12.225   2.293  -6.758
  468   1HB   SER   7          1HB       SER   7 -13.243   3.696  -8.614
  469   2HB   SER   7          2HB       SER   7 -14.325   3.352  -7.254
  470    HG   SER   7           HG       SER   7 -12.828   5.705  -6.964
  471    H    ALA   8           H        ALA   8 -11.373   3.147  -9.184
  472    HA   ALA   8           HA       ALA   8  -8.680   3.880  -8.674
  473   1HB   ALA   8          1HB       ALA   8  -9.692   4.043 -11.450
  474   2HB   ALA   8          2HB       ALA   8  -8.359   3.076 -10.773
  475   3HB   ALA   8          3HB       ALA   8 -10.038   2.502 -10.630
  476    H    ASN   9           H        ASN   9 -11.555   5.674  -8.819
  477    HA   ASN   9           HA       ASN   9 -10.299   7.946 -10.068
  478   1HB   ASN   9          1HB       ASN   9 -12.881   7.046 -10.098
  479   2HB   ASN   9          2HB       ASN   9 -12.992   8.203  -8.763
  480   1HD2  ASN   9          1HD2      ASN   9 -11.816  10.331  -9.233
  481   2HD2  ASN   9          2HD2      ASN   9 -12.124  11.067 -10.769
  482    H    GLN  10           H        GLN  10 -10.508   6.462  -7.012
  483    HA   GLN  10           HA       GLN  10 -10.989   8.658  -5.367
  484   1HB   GLN  10          1HB       GLN  10 -10.773   7.145  -3.696
  485   2HB   GLN  10          2HB       GLN  10 -10.698   5.947  -5.000
  486   1HG   GLN  10          1HG       GLN  10  -8.235   6.088  -4.997
  487   2HG   GLN  10          2HG       GLN  10  -8.284   7.335  -3.742
  488   1HE2  GLN  10          1HE2      GLN  10  -8.313   6.755  -1.687
  489   2HE2  GLN  10          2HE2      GLN  10  -8.511   5.148  -1.073
  490    H    CYS  11           H        CYS  11  -8.030   7.298  -6.871
  491    HA   CYS  11           HA       CYS  11  -6.210   8.817  -5.388
  492   1HB   CYS  11          1HB       CYS  11  -5.433   6.905  -6.526
  493   2HB   CYS  11          2HB       CYS  11  -6.048   7.471  -8.082
  494    H    ALA  12           H        ALA  12  -8.673   9.748  -7.513
  495    HA   ALA  12           HA       ALA  12  -7.178  12.098  -8.441
  496   1HB   ALA  12          1HB       ALA  12  -9.425  10.444  -9.511
  497   2HB   ALA  12          2HB       ALA  12  -9.496  12.196  -9.821
  498   3HB   ALA  12          3HB       ALA  12  -8.090  11.252 -10.368
  499    H    VAL  13           H        VAL  13  -8.509  11.360  -5.695
  500    HA   VAL  13           HA       VAL  13 -10.789  12.716  -5.217
  501    HB   VAL  13           HB       VAL  13  -8.747  11.567  -3.748
  502   1HG1  VAL  13          1HG1      VAL  13  -8.250  13.184  -1.947
  503   2HG1  VAL  13          2HG1      VAL  13  -7.588  13.704  -3.516
  504   3HG1  VAL  13          3HG1      VAL  13  -9.068  14.461  -2.880
  505   1HG2  VAL  13          1HG2      VAL  13 -11.487  12.330  -3.431
  506   2HG2  VAL  13          2HG2      VAL  13 -10.571  11.072  -2.568
  507   3HG2  VAL  13          3HG2      VAL  13 -10.614  12.734  -1.934
  508    HA   PRO  14           HA       PRO  14 -10.052  16.946  -5.706
  509   1HB   PRO  14          1HB       PRO  14 -11.382  18.121  -3.628
  510   2HB   PRO  14          2HB       PRO  14 -12.191  17.522  -5.074
  511   1HG   PRO  14          1HG       PRO  14 -12.030  16.353  -2.370
  512   2HG   PRO  14          2HG       PRO  14 -13.222  16.007  -3.674
  513   1HD   PRO  14          1HD       PRO  14 -11.008  14.407  -2.815
  514   2HD   PRO  14          2HD       PRO  14 -12.055  14.098  -4.207
  515    H    ALA  15           H        ALA  15  -8.024  15.429  -4.196
  516    HA   ALA  15           HA       ALA  15  -6.229  15.813  -2.950
  517   1HB   ALA  15          1HB       ALA  15  -5.193  18.125  -3.326
  518   2HB   ALA  15          2HB       ALA  15  -5.553  17.177  -4.789
  519   3HB   ALA  15          3HB       ALA  15  -6.635  18.503  -4.300
  520    H    LYS  16           H        LYS  16  -7.745  15.438  -1.052
  521    HA   LYS  16           HA       LYS  16  -7.144  16.982   1.054
  522   1HB   LYS  16          1HB       LYS  16  -9.412  18.251   1.321
  523   2HB   LYS  16          2HB       LYS  16  -8.083  18.978   0.400
  524   1HG   LYS  16          1HG       LYS  16  -9.349  19.021  -1.462
  525   2HG   LYS  16          2HG       LYS  16  -9.678  17.284  -1.342
  526   1HD   LYS  16          1HD       LYS  16 -11.138  19.234   0.446
  527   2HD   LYS  16          2HD       LYS  16 -11.670  19.023  -1.230
  528   1HE   LYS  16          1HE       LYS  16 -12.812  17.194  -0.572
  529   2HE   LYS  16          2HE       LYS  16 -11.276  16.401  -0.189
  530   1HZ   LYS  16          1HZ       LYS  16 -12.913  18.047   1.609
  531   2HZ   LYS  16          2HZ       LYS  16 -12.634  16.442   1.727
  532   3HZ   LYS  16          3HZ       LYS  16 -11.420  17.503   1.987
  533    H    ASP  17           H        ASP  17  -7.557  14.280   0.378
  534    HA   ASP  17           HA       ASP  17  -9.348  13.608   2.477
  535   1HB   ASP  17          1HB       ASP  17 -10.747  13.804   0.309
  536   2HB   ASP  17          2HB       ASP  17  -9.881  12.364  -0.250
  537    H    ARG  18           H        ARG  18  -6.471  13.393   1.096
  538    HA   ARG  18           HA       ARG  18  -6.244  10.534   0.953
  539   1HB   ARG  18          1HB       ARG  18  -4.061  12.647   0.684
  540   2HB   ARG  18          2HB       ARG  18  -3.963  10.961   0.151
  541   1HG   ARG  18          1HG       ARG  18  -5.103  11.385  -1.770
  542   2HG   ARG  18          2HG       ARG  18  -6.274  12.447  -0.967
  543   1HD   ARG  18          1HD       ARG  18  -4.754  14.318  -1.069
  544   2HD   ARG  18          2HD       ARG  18  -3.403  13.289  -1.566
  545    HE   ARG  18           HE       ARG  18  -5.735  13.266  -3.369
  546   1HH1  ARG  18          1HH1      ARG  18  -2.607  14.705  -2.642
  547   2HH1  ARG  18          2HH1      ARG  18  -2.361  15.294  -4.252
  548   1HH2  ARG  18          1HH2      ARG  18  -5.411  14.042  -5.493
  549   2HH2  ARG  18          2HH2      ARG  18  -3.966  14.915  -5.885
  550    H    VAL  19           H        VAL  19  -3.929   9.762   2.027
  551    HA   VAL  19           HA       VAL  19  -4.115  10.638   4.820
  552    HB   VAL  19           HB       VAL  19  -3.014   8.063   3.683
  553   1HG1  VAL  19          1HG1      VAL  19  -3.729   7.560   6.274
  554   2HG1  VAL  19          2HG1      VAL  19  -2.085   7.983   5.737
  555   3HG1  VAL  19          3HG1      VAL  19  -3.162   9.243   6.386
  556   1HG2  VAL  19          1HG2      VAL  19  -5.100   7.009   4.449
  557   2HG2  VAL  19          2HG2      VAL  19  -5.736   8.603   4.919
  558   3HG2  VAL  19          3HG2      VAL  19  -5.413   8.243   3.206
  559    H    ASP  20           H        ASP  20  -2.606  11.874   2.437
  560    HA   ASP  20           HA       ASP  20  -0.531  12.395   1.846
  561   1HB   ASP  20          1HB       ASP  20  -0.793  14.218   3.241
  562   2HB   ASP  20          2HB       ASP  20  -1.027  13.222   4.686
  563    H    CYS  21           H        CYS  21   0.470  10.287   1.407
  564    HA   CYS  21           HA       CYS  21   1.392   8.507   3.234
  565   1HB   CYS  21          1HB       CYS  21   1.425   8.664   0.558
  566   2HB   CYS  21          2HB       CYS  21   3.134   8.974   0.877
  567    H    GLY  22           H        GLY  22   2.796  11.613   2.123
  568   1HA   GLY  22          1HA       GLY  22   4.573  12.806   2.811
  569   2HA   GLY  22          2HA       GLY  22   4.242  12.145   4.400
  570    H    TYR  23           H        TYR  23   5.581  10.903   1.245
  571    HA   TYR  23           HA       TYR  23   7.490   9.313   2.753
  572   1HB   TYR  23          1HB       TYR  23   6.103   9.393   0.153
  573   2HB   TYR  23          2HB       TYR  23   7.840   9.199  -0.104
  574    HD1  TYR  23           HD1      TYR  23   9.015   7.230   0.984
  575    HD2  TYR  23           HD2      TYR  23   4.753   7.588   0.865
  576    HE1  TYR  23           HE1      TYR  23   8.785   4.743   1.460
  577    HE2  TYR  23           HE2      TYR  23   4.537   5.101   1.342
  578    HH   TYR  23           HH       TYR  23   5.726   3.136   1.211
  579    HA   PRO  24           HA       PRO  24  10.703  12.143   2.069
  580   1HB   PRO  24          1HB       PRO  24  12.833  10.556   2.709
  581   2HB   PRO  24          2HB       PRO  24  11.851  11.384   3.916
  582   1HG   PRO  24          1HG       PRO  24  11.871   8.545   3.109
  583   2HG   PRO  24          2HG       PRO  24  11.241   9.276   4.630
  584   1HD   PRO  24          1HD       PRO  24   9.765   8.302   2.377
  585   2HD   PRO  24          2HD       PRO  24   9.109   9.158   3.778
  586    H    HIS  25           H        HIS  25  10.031   9.565   0.139
  587    HA   HIS  25           HA       HIS  25  12.080  10.487  -1.741
  588   1HB   HIS  25          1HB       HIS  25  11.864   7.944  -0.609
  589   2HB   HIS  25          2HB       HIS  25  11.185   7.765  -2.231
  590    HD1  HIS  25           HD1      HIS  25  13.768   6.305  -1.687
  591    HD2  HIS  25           HD2      HIS  25  13.665  10.270  -3.052
  592    HE1  HIS  25           HE1      HIS  25  16.026   6.739  -2.791
  593    HE2  HIS  25           HE2      HIS  25  15.884   9.173  -3.659
  594    H    VAL  26           H        VAL  26   9.038  11.012  -1.046
  595    HA   VAL  26           HA       VAL  26   7.315  10.080  -2.854
  596    HB   VAL  26           HB       VAL  26   6.560  11.633  -1.295
  597   1HG1  VAL  26          1HG1      VAL  26   7.770  13.350  -0.539
  598   2HG1  VAL  26          2HG1      VAL  26   9.025  12.922  -1.726
  599   3HG1  VAL  26          3HG1      VAL  26   7.776  14.120  -2.144
  600   1HG2  VAL  26          1HG2      VAL  26   5.193  13.027  -2.540
  601   2HG2  VAL  26          2HG2      VAL  26   6.479  13.432  -3.702
  602   3HG2  VAL  26          3HG2      VAL  26   5.694  11.835  -3.765
  603    H    THR  27           H        THR  27   7.157   9.906  -5.033
  604    HA   THR  27           HA       THR  27   8.094  11.950  -6.768
  605    HB   THR  27           HB       THR  27   9.993   9.929  -5.913
  606    HG1  THR  27           HG1      THR  27  11.238  11.540  -6.886
  607   1HG2  THR  27          1HG2      THR  27  10.206   8.547  -7.719
  608   2HG2  THR  27          2HG2      THR  27   8.722   9.251  -8.409
  609   3HG2  THR  27          3HG2      THR  27  10.308   9.963  -8.793
  610    HA   PRO  28           HA       PRO  28   5.227   9.982  -9.278
  611   1HB   PRO  28          1HB       PRO  28   5.926  10.890 -11.756
  612   2HB   PRO  28          2HB       PRO  28   4.994  11.847 -10.608
  613   1HG   PRO  28          1HG       PRO  28   7.841  12.032 -11.361
  614   2HG   PRO  28          2HG       PRO  28   6.801  13.279 -10.582
  615   1HD   PRO  28          1HD       PRO  28   8.823  11.644  -9.383
  616   2HD   PRO  28          2HD       PRO  28   7.720  12.741  -8.544
  617    H    LYS  29           H        LYS  29   7.083   8.187  -8.435
  618    HA   LYS  29           HA       LYS  29   6.801   6.204 -10.338
  619   1HB   LYS  29          1HB       LYS  29   8.558   7.878 -11.397
  620   2HB   LYS  29          2HB       LYS  29   9.687   6.983 -10.366
  621   1HG   LYS  29          1HG       LYS  29   9.645   5.216 -11.765
  622   2HG   LYS  29          2HG       LYS  29   7.875   5.144 -11.721
  623   1HD   LYS  29          1HD       LYS  29   7.655   6.583 -13.574
  624   2HD   LYS  29          2HD       LYS  29   9.290   7.244 -13.390
  625   1HE   LYS  29          1HE       LYS  29  10.228   5.029 -14.052
  626   2HE   LYS  29          2HE       LYS  29   8.586   4.403 -14.275
  627   1HZ   LYS  29          1HZ       LYS  29   8.254   5.892 -16.028
  628   2HZ   LYS  29          2HZ       LYS  29   9.590   6.769 -15.687
  629   3HZ   LYS  29          3HZ       LYS  29   9.737   5.259 -16.292
  630    H    GLU  30           H        GLU  30   8.157   7.667  -7.484
  631    HA   GLU  30           HA       GLU  30   9.153   5.113  -6.569
  632   1HB   GLU  30          1HB       GLU  30   9.658   7.929  -5.957
  633   2HB   GLU  30          2HB       GLU  30   9.430   6.973  -4.482
  634   1HG   GLU  30          1HG       GLU  30  11.645   6.500  -4.757
  635   2HG   GLU  30          2HG       GLU  30  11.062   5.304  -5.924
  636    H    CYS  31           H        CYS  31   6.682   7.627  -5.775
  637    HA   CYS  31           HA       CYS  31   5.700   6.508  -3.473
  638   1HB   CYS  31          1HB       CYS  31   4.400   8.139  -5.639
  639   2HB   CYS  31          2HB       CYS  31   3.507   7.618  -4.209
  640    H    ASN  32           H        ASN  32   4.552   6.065  -6.904
  641    HA   ASN  32           HA       ASN  32   2.660   4.168  -6.316
  642   1HB   ASN  32          1HB       ASN  32   4.186   5.048  -8.731
  643   2HB   ASN  32          2HB       ASN  32   3.456   3.441  -8.851
  644   1HD2  ASN  32          1HD2      ASN  32   2.452   6.415  -7.179
  645   2HD2  ASN  32          2HD2      ASN  32   0.920   6.606  -7.966
  646    H    ASN  33           H        ASN  33   6.106   4.039  -6.150
  647    HA   ASN  33           HA       ASN  33   6.262   1.235  -6.744
  648   1HB   ASN  33          1HB       ASN  33   8.048   3.218  -7.107
  649   2HB   ASN  33          2HB       ASN  33   8.538   2.762  -5.469
  650   1HD2  ASN  33          1HD2      ASN  33  10.542   2.246  -6.621
  651   2HD2  ASN  33          2HD2      ASN  33  10.741   0.675  -7.325
  652    H    ARG  34           H        ARG  34   6.176   3.533  -4.008
  653    HA   ARG  34           HA       ARG  34   6.944   1.540  -2.124
  654   1HB   ARG  34          1HB       ARG  34   5.670   4.227  -1.491
  655   2HB   ARG  34          2HB       ARG  34   6.792   3.297  -0.482
  656   1HG   ARG  34          1HG       ARG  34   8.069   3.779  -3.002
  657   2HG   ARG  34          2HG       ARG  34   7.382   5.320  -2.458
  658   1HD   ARG  34          1HD       ARG  34   8.910   5.512  -0.789
  659   2HD   ARG  34          2HD       ARG  34   8.704   3.830  -0.281
  660    HE   ARG  34           HE       ARG  34  10.115   3.588  -2.630
  661   1HH1  ARG  34          1HH1      ARG  34  10.616   5.523   0.266
  662   2HH1  ARG  34          2HH1      ARG  34  12.341   5.539   0.111
  663   1HH2  ARG  34          1HH2      ARG  34  12.392   3.609  -2.834
  664   2HH2  ARG  34          2HH2      ARG  34  13.358   4.443  -1.664
  665    H    GLY  35           H        GLY  35   4.007   2.800  -3.596
  666   1HA   GLY  35          1HA       GLY  35   2.088   1.306  -3.420
  667   2HA   GLY  35          2HA       GLY  35   2.390   1.206  -1.697
  668    H    CYS  36           H        CYS  36   2.928   4.289  -3.352
  669    HA   CYS  36           HA       CYS  36   0.438   5.259  -2.148
  670   1HB   CYS  36          1HB       CYS  36   3.038   6.757  -2.483
  671   2HB   CYS  36          2HB       CYS  36   1.543   7.414  -1.811
  672    H    CYS  37           H        CYS  37  -0.122   7.528  -3.327
  673    HA   CYS  37           HA       CYS  37   0.233   7.037  -6.195
  674   1HB   CYS  37          1HB       CYS  37  -2.090   6.735  -5.098
  675   2HB   CYS  37          2HB       CYS  37  -2.126   8.501  -5.046
  676    H    PHE  38           H        PHE  38   1.118   8.740  -7.365
  677    HA   PHE  38           HA       PHE  38   1.809  11.106  -5.821
  678   1HB   PHE  38          1HB       PHE  38   3.433   9.679  -7.228
  679   2HB   PHE  38          2HB       PHE  38   2.547  10.197  -8.666
  680    HD1  PHE  38           HD1      PHE  38   4.694  11.349  -5.892
  681    HD2  PHE  38           HD2      PHE  38   2.947  12.328  -9.633
  682    HE1  PHE  38           HE1      PHE  38   6.159  13.382  -6.044
  683    HE2  PHE  38           HE2      PHE  38   4.412  14.360  -9.785
  684    HZ   PHE  38           HZ       PHE  38   6.000  14.863  -7.989
  685    H    ASP  39           H        ASP  39   0.618  12.940  -5.974
  686    HA   ASP  39           HA       ASP  39  -1.383  13.087  -7.988
  687   1HB   ASP  39          1HB       ASP  39  -2.221  14.096  -6.114
  688   2HB   ASP  39          2HB       ASP  39  -0.620  14.556  -5.515
  689    H    SER  40           H        SER  40   0.746  15.788  -6.851
  690    HA   SER  40           HA       SER  40   2.277  16.971  -7.921
  691   1HB   SER  40          1HB       SER  40   2.393  14.820  -9.522
  692   2HB   SER  40          2HB       SER  40   1.649  15.944 -10.673
  693    HG   SER  40           HG       SER  40   3.832  16.234 -10.957
  694    H    ARG  41           H        ARG  41  -1.015  16.440  -9.022
  695    HA   ARG  41           HA       ARG  41  -1.245  18.620 -10.711
  696   1HB   ARG  41          1HB       ARG  41  -3.482  17.575  -8.933
  697   2HB   ARG  41          2HB       ARG  41  -3.623  18.247 -10.566
  698   1HG   ARG  41          1HG       ARG  41  -1.939  16.168 -11.054
  699   2HG   ARG  41          2HG       ARG  41  -2.832  15.501  -9.677
  700   1HD   ARG  41          1HD       ARG  41  -3.943  14.877 -11.769
  701   2HD   ARG  41          2HD       ARG  41  -4.980  16.002 -10.880
  702    HE   ARG  41           HE       ARG  41  -3.190  17.338 -12.763
  703   1HH1  ARG  41          1HH1      ARG  41  -6.279  15.681 -12.441
  704   2HH1  ARG  41          2HH1      ARG  41  -6.978  16.445 -13.830
  705   1HH2  ARG  41          1HH2      ARG  41  -4.113  18.346 -14.594
  706   2HH2  ARG  41          2HH2      ARG  41  -5.738  17.971 -15.062
  707    H    ILE  42           H        ILE  42  -1.755  18.203  -7.156
  708    HA   ILE  42           HA       ILE  42  -1.889  21.132  -6.957
  709    HB   ILE  42           HB       ILE  42  -3.155  19.312  -4.944
  710   1HG1  ILE  42          1HG1      ILE  42  -4.263  20.074  -7.637
  711   2HG1  ILE  42          2HG1      ILE  42  -4.197  18.473  -6.879
  712   1HG2  ILE  42          1HG2      ILE  42  -4.178  21.993  -5.810
  713   2HG2  ILE  42          2HG2      ILE  42  -4.281  21.183  -4.227
  714   3HG2  ILE  42          3HG2      ILE  42  -2.741  21.896  -4.763
  715   1HD1  ILE  42          1HD1      ILE  42  -6.218  20.594  -6.636
  716   2HD1  ILE  42          2HD1      ILE  42  -6.333  18.867  -6.216
  717   3HD1  ILE  42          3HD1      ILE  42  -5.647  20.024  -5.049
  718    HA   PRO  43           HA       PRO  43   1.799  20.188  -4.754
  719   1HB   PRO  43          1HB       PRO  43   2.862  22.701  -4.862
  720   2HB   PRO  43          2HB       PRO  43   3.118  21.493  -6.118
  721   1HG   PRO  43          1HG       PRO  43   1.342  23.847  -6.089
  722   2HG   PRO  43          2HG       PRO  43   1.954  22.920  -7.505
  723   1HD   PRO  43          1HD       PRO  43  -0.659  22.867  -6.334
  724   2HD   PRO  43          2HD       PRO  43  -0.060  21.818  -7.627
  725    H    GLY  44           H        GLY  44  -0.893  21.856  -3.925
  726   1HA   GLY  44          1HA       GLY  44   0.174  22.861  -1.403
  727   2HA   GLY  44          2HA       GLY  44  -1.444  23.075  -2.041
  728    H    VAL  45           H        VAL  45  -0.950  19.888  -2.663
  729    HA   VAL  45           HA       VAL  45  -1.822  19.075   0.024
  730    HB   VAL  45           HB       VAL  45  -3.520  17.808  -0.838
  731   1HG1  VAL  45          1HG1      VAL  45  -4.855  19.371  -1.753
  732   2HG1  VAL  45          2HG1      VAL  45  -3.437  20.439  -1.635
  733   3HG1  VAL  45          3HG1      VAL  45  -3.791  19.595  -3.161
  734   1HG2  VAL  45          1HG2      VAL  45  -3.675  16.890  -3.051
  735   2HG2  VAL  45          2HG2      VAL  45  -2.322  17.893  -3.623
  736   3HG2  VAL  45          3HG2      VAL  45  -2.027  16.588  -2.450
  737    HA   PRO  46           HA       PRO  46   0.987  15.779  -0.295
  738   1HB   PRO  46          1HB       PRO  46  -0.369  13.448   0.144
  739   2HB   PRO  46          2HB       PRO  46   0.088  14.555   1.437
  740   1HG   PRO  46          1HG       PRO  46  -2.533  14.109   0.158
  741   2HG   PRO  46          2HG       PRO  46  -2.177  14.859   1.756
  742   1HD   PRO  46          1HD       PRO  46  -2.941  16.148  -0.684
  743   2HD   PRO  46          2HD       PRO  46  -2.446  16.940   0.817
  744    H    TRP  47           H        TRP  47   2.208  15.306  -1.998
  745    HA   TRP  47           HA       TRP  47   0.770  14.378  -4.347
  746   1HB   TRP  47          1HB       TRP  47   3.662  14.647  -4.559
  747   2HB   TRP  47          2HB       TRP  47   2.375  15.347  -5.543
  748    HD1  TRP  47           HD1      TRP  47   1.241  17.701  -4.420
  749    HE1  TRP  47           HE1      TRP  47   2.345  19.691  -3.085
  750    HE3  TRP  47           HE3      TRP  47   5.422  15.154  -3.044
  751    HZ2  TRP  47           HZ2      TRP  47   4.787  19.971  -1.634
  752    HZ3  TRP  47           HZ3      TRP  47   7.115  16.359  -1.669
  753    HH2  TRP  47           HH2      TRP  47   6.850  18.685  -0.966
  754    H    CYS  48           H        CYS  48   1.046  12.715  -1.861
  755    HA   CYS  48           HA       CYS  48   1.854  10.337  -3.149
  756   1HB   CYS  48          1HB       CYS  48   4.067  11.347  -2.518
  757   2HB   CYS  48          2HB       CYS  48   3.602  11.155  -0.826
  758    H    PHE  49           H        PHE  49  -0.013   9.287  -2.495
  759    HA   PHE  49           HA       PHE  49  -0.402   9.033   0.377
  760   1HB   PHE  49          1HB       PHE  49  -2.984   9.247  -0.497
  761   2HB   PHE  49          2HB       PHE  49  -2.074  10.658   0.056
  762    HD1  PHE  49           HD1      PHE  49  -0.633  11.806  -1.868
  763    HD2  PHE  49           HD2      PHE  49  -4.055   9.381  -2.519
  764    HE1  PHE  49           HE1      PHE  49  -0.969  12.882  -4.110
  765    HE2  PHE  49           HE2      PHE  49  -4.390  10.458  -4.762
  766    HZ   PHE  49           HZ       PHE  49  -2.843  12.196  -5.530
  767    H    LYS  50           H        LYS  50  -2.764   7.560   0.370
  768    HA   LYS  50           HA       LYS  50  -2.107   5.316  -1.409
  769   1HB   LYS  50          1HB       LYS  50  -3.292   4.235   0.871
  770   2HB   LYS  50          2HB       LYS  50  -1.588   4.123   0.395
  771   1HG   LYS  50          1HG       LYS  50  -2.537   6.607   1.801
  772   2HG   LYS  50          2HG       LYS  50  -2.322   5.136   2.766
  773   1HD   LYS  50          1HD       LYS  50  -0.248   6.589   1.078
  774   2HD   LYS  50          2HD       LYS  50  -0.239   6.382   2.839
  775   1HE   LYS  50          1HE       LYS  50   0.331   4.363   0.662
  776   2HE   LYS  50          2HE       LYS  50   1.291   4.739   2.100
  777   1HZ   LYS  50          1HZ       LYS  50  -0.998   3.016   1.814
  778   2HZ   LYS  50          2HZ       LYS  50   0.299   2.871   2.795
  779   3HZ   LYS  50          3HZ       LYS  50  -0.924   3.874   3.202
  780    HA   PRO  51           HA       PRO  51  -6.400   6.635  -2.000
  781   1HB   PRO  51          1HB       PRO  51  -6.296   7.024  -4.702
  782   2HB   PRO  51          2HB       PRO  51  -6.088   8.325  -3.532
  783   1HG   PRO  51          1HG       PRO  51  -4.081   6.893  -5.152
  784   2HG   PRO  51          2HG       PRO  51  -3.938   8.499  -4.349
  785   1HD   PRO  51          1HD       PRO  51  -2.804   5.997  -3.538
  786   2HD   PRO  51          2HD       PRO  51  -2.768   7.515  -2.632
  787    H    LEU  52           H        LEU  52  -5.841   5.420  -5.142
  788    HA   LEU  52           HA       LEU  52  -7.368   3.064  -4.384
  789   1HB   LEU  52          1HB       LEU  52  -8.044   2.922  -6.547
  790   2HB   LEU  52          2HB       LEU  52  -7.882   4.674  -6.336
  791    HG   LEU  52           HG       LEU  52  -5.392   3.720  -7.298
  792   1HD1  LEU  52          1HD1      LEU  52  -7.654   2.151  -8.315
  793   2HD1  LEU  52          2HD1      LEU  52  -6.683   2.926  -9.590
  794   3HD1  LEU  52          3HD1      LEU  52  -5.902   1.847  -8.409
  795   1HD2  LEU  52          1HD2      LEU  52  -7.237   5.776  -7.797
  796   2HD2  LEU  52          2HD2      LEU  52  -5.601   5.589  -8.474
  797   3HD2  LEU  52          3HD2      LEU  52  -7.008   4.944  -9.354
  798    H    GLN  53           H        GLN  53  -4.645   3.289  -3.409
  799    HA   GLN  53           HA       GLN  53  -2.762   2.122  -4.965
  800   1HB   GLN  53          1HB       GLN  53  -3.266   1.808  -1.983
  801   2HB   GLN  53          2HB       GLN  53  -1.764   1.311  -2.783
  802   1HG   GLN  53          1HG       GLN  53  -2.935   4.125  -2.707
  803   2HG   GLN  53          2HG       GLN  53  -1.532   3.565  -1.787
  804   1HE2  GLN  53          1HE2      GLN  53  -0.293   1.985  -3.697
  805   2HE2  GLN  53          2HE2      GLN  53   0.320   2.970  -4.982
  806    H    GLU  54           H        GLU  54  -5.718   0.740  -3.780
  807    HA   GLU  54           HA       GLU  54  -5.244  -1.812  -3.280
  808   1HB   GLU  54          1HB       GLU  54  -7.454  -2.233  -3.845
  809   2HB   GLU  54          2HB       GLU  54  -7.482  -0.468  -3.688
  810   1HG   GLU  54          1HG       GLU  54  -8.461  -0.585  -5.751
  811   2HG   GLU  54          2HG       GLU  54  -6.789  -0.704  -6.321
  812    H    ALA  55           H        ALA  55  -4.636  -0.167  -6.333
  813    HA   ALA  55           HA       ALA  55  -4.755  -1.942  -8.276
  814   1HB   ALA  55          1HB       ALA  55  -3.749   0.158  -8.710
  815   2HB   ALA  55          2HB       ALA  55  -2.486  -0.096  -7.482
  816   3HB   ALA  55          3HB       ALA  55  -2.451  -1.024  -9.000
  817    H    GLU  56           H        GLU  56  -1.916  -1.865  -5.997
  818    HA   GLU  56           HA       GLU  56  -1.880  -4.749  -6.165
  819   1HB   GLU  56          1HB       GLU  56  -0.191  -3.303  -7.776
  820   2HB   GLU  56          2HB       GLU  56   0.825  -3.535  -6.344
  821   1HG   GLU  56          1HG       GLU  56   0.261  -6.004  -6.458
  822   2HG   GLU  56          2HG       GLU  56  -0.554  -5.698  -7.999
  823    H    CYS  57           H        CYS  57  -2.450  -2.397  -4.212
  824    HA   CYS  57           HA       CYS  57  -0.387  -2.923  -2.236
  825   1HB   CYS  57          1HB       CYS  57  -1.627  -0.621  -2.940
  826   2HB   CYS  57          2HB       CYS  57  -2.623  -1.113  -1.567
  827    H    THR  58           H        THR  58  -3.996  -2.974  -2.676
  828    HA   THR  58           HA       THR  58  -4.479  -4.296  -0.214
  829    HB   THR  58           HB       THR  58  -6.024  -2.811  -1.736
  830    HG1  THR  58           HG1      THR  58  -7.715  -3.919  -0.643
  831   1HG2  THR  58          1HG2      THR  58  -6.569  -5.602  -2.875
  832   2HG2  THR  58          2HG2      THR  58  -7.493  -4.122  -3.224
  833   3HG2  THR  58          3HG2      THR  58  -5.814  -4.278  -3.794
  834    H    PHE  59           H        PHE  59  -4.149  -5.427  -3.625
  835    HA   PHE  59           HA       PHE  59  -4.907  -7.942  -3.546
  836   1HB   PHE  59          1HB       PHE  59  -2.788  -6.340  -4.779
  837   2HB   PHE  59          2HB       PHE  59  -2.189  -7.983  -4.527
  838    HD1  PHE  59           HD1      PHE  59  -4.401  -9.697  -5.084
  839    HD2  PHE  59           HD2      PHE  59  -3.361  -6.044  -6.977
  840    HE1  PHE  59           HE1      PHE  59  -5.595 -10.435  -7.164
  841    HE2  PHE  59           HE2      PHE  59  -4.556  -6.783  -9.057
  842    HZ   PHE  59           HZ       PHE  59  -5.658  -8.969  -9.126
  Start of MODEL   28
    1   1H    GLU   1           H1       GLU   1 -11.970 -13.408  -2.578
    2    HA   GLU   1           HA       GLU   1 -13.250 -12.422  -4.997
    3   1HB   GLU   1          1HB       GLU   1 -14.216 -14.568  -3.108
    4   2HB   GLU   1          2HB       GLU   1 -15.393 -13.574  -3.985
    5   1HG   GLU   1          1HG       GLU   1 -13.244 -14.539  -5.730
    6   2HG   GLU   1          2HG       GLU   1 -14.087 -15.879  -4.939
    7    H    GLU   2           H        GLU   2 -14.238 -12.993  -1.544
    8    HA   GLU   2           HA       GLU   2 -15.247 -10.307  -1.487
    9   1HB   GLU   2          1HB       GLU   2 -15.292 -12.531   0.589
   10   2HB   GLU   2          2HB       GLU   2 -16.132 -10.979   0.758
   11   1HG   GLU   2          1HG       GLU   2 -17.864 -12.189  -0.139
   12   2HG   GLU   2          2HG       GLU   2 -17.094 -11.732  -1.665
   13    H    TYR   3           H        TYR   3 -14.418 -11.081   1.671
   14    HA   TYR   3           HA       TYR   3 -12.174  -9.235   1.574
   15   1HB   TYR   3          1HB       TYR   3 -12.576  -9.716   4.180
   16   2HB   TYR   3          2HB       TYR   3 -13.759  -8.739   3.304
   17    HD1  TYR   3           HD1      TYR   3 -15.977  -9.625   2.800
   18    HD2  TYR   3           HD2      TYR   3 -13.083 -12.002   4.870
   19    HE1  TYR   3           HE1      TYR   3 -17.797 -11.265   3.479
   20    HE2  TYR   3           HE2      TYR   3 -14.913 -13.633   5.542
   21    HH   TYR   3           HH       TYR   3 -17.890 -13.699   4.085
   22    H    VAL   4           H        VAL   4 -10.831 -10.965   0.427
   23    HA   VAL   4           HA       VAL   4  -9.605 -12.656   2.489
   24    HB   VAL   4           HB       VAL   4 -10.218 -13.359  -0.388
   25   1HG1  VAL   4          1HG1      VAL   4  -8.679 -14.924   1.711
   26   2HG1  VAL   4          2HG1      VAL   4  -9.193 -15.553   0.128
   27   3HG1  VAL   4          3HG1      VAL   4  -8.020 -14.217   0.216
   28   1HG2  VAL   4          1HG2      VAL   4 -11.225 -15.353   1.246
   29   2HG2  VAL   4          2HG2      VAL   4 -11.566 -13.868   2.166
   30   3HG2  VAL   4          3HG2      VAL   4 -12.164 -14.039   0.499
   31    H    GLY   5           H        GLY   5  -9.131 -11.421  -0.903
   32   1HA   GLY   5          1HA       GLY   5  -6.311 -11.372  -0.701
   33   2HA   GLY   5          2HA       GLY   5  -7.301 -10.595  -1.919
   34    H    LEU   6           H        LEU   6  -8.481  -9.610   1.098
   35    HA   LEU   6           HA       LEU   6  -6.528  -7.520   1.507
   36   1HB   LEU   6          1HB       LEU   6  -8.433  -5.815   1.419
   37   2HB   LEU   6          2HB       LEU   6  -7.664  -6.330  -0.093
   38    HG   LEU   6           HG       LEU   6 -10.092  -6.105  -0.311
   39   1HD1  LEU   6          1HD1      LEU   6 -10.296  -7.870  -1.710
   40   2HD1  LEU   6          2HD1      LEU   6  -8.566  -8.067  -1.339
   41   3HD1  LEU   6          3HD1      LEU   6  -9.777  -9.051  -0.483
   42   1HD2  LEU   6          1HD2      LEU   6 -11.664  -7.430   0.885
   43   2HD2  LEU   6          2HD2      LEU   6 -10.376  -8.389   1.653
   44   3HD2  LEU   6          3HD2      LEU   6 -10.591  -6.676   2.089
   45    H    SER   7           H        SER   7  -7.540  -9.928   2.922
   46    HA   SER   7           HA       SER   7  -8.993  -8.642   5.083
   47   1HB   SER   7          1HB       SER   7  -9.448 -11.034   3.826
   48   2HB   SER   7          2HB       SER   7  -8.492 -11.572   5.219
   49    HG   SER   7           HG       SER   7 -11.001 -11.299   5.333
   50    H    ALA   8           H        ALA   8  -8.313  -9.418   7.377
   51    HA   ALA   8           HA       ALA   8  -5.578  -8.819   7.718
   52   1HB   ALA   8          1HB       ALA   8  -6.111  -8.756   9.971
   53   2HB   ALA   8          2HB       ALA   8  -7.728  -8.538   9.258
   54   3HB   ALA   8          3HB       ALA   8  -7.228 -10.138   9.857
   55    H    ASN   9           H        ASN   9  -7.080 -11.609   6.582
   56    HA   ASN   9           HA       ASN   9  -5.243 -13.383   7.925
   57   1HB   ASN   9          1HB       ASN   9  -7.865 -13.645   6.903
   58   2HB   ASN   9          2HB       ASN   9  -6.867 -14.585   5.784
   59   1HD2  ASN   9          1HD2      ASN   9  -5.146 -15.942   6.935
   60   2HD2  ASN   9          2HD2      ASN   9  -5.672 -16.877   8.294
   61    H    GLN  10           H        GLN  10  -5.362 -11.336   5.217
   62    HA   GLN  10           HA       GLN  10  -4.290 -12.956   3.229
   63   1HB   GLN  10          1HB       GLN  10  -5.115 -10.280   3.516
   64   2HB   GLN  10          2HB       GLN  10  -3.413 -10.177   3.030
   65   1HG   GLN  10          1HG       GLN  10  -5.074 -12.169   1.559
   66   2HG   GLN  10          2HG       GLN  10  -5.499 -10.474   1.277
   67   1HE2  GLN  10          1HE2      GLN  10  -3.582  -9.009   0.902
   68   2HE2  GLN  10          2HE2      GLN  10  -2.335  -9.576  -0.158
   69    H    CYS  11           H        CYS  11  -2.805 -10.914   5.800
   70    HA   CYS  11           HA       CYS  11  -0.166 -11.349   4.852
   71   1HB   CYS  11          1HB       CYS  11  -0.774  -9.359   6.106
   72   2HB   CYS  11          2HB       CYS  11  -1.173 -10.338   7.521
   73    H    ALA  12           H        ALA  12  -2.432 -13.449   6.045
   74    HA   ALA  12           HA       ALA  12  -0.480 -14.958   7.638
   75   1HB   ALA  12          1HB       ALA  12  -2.486 -14.438   8.880
   76   2HB   ALA  12          2HB       ALA  12  -3.520 -14.990   7.541
   77   3HB   ALA  12          3HB       ALA  12  -2.542 -16.165   8.454
   78    H    VAL  13           H        VAL  13  -1.258 -14.603   4.517
   79    HA   VAL  13           HA       VAL  13  -2.245 -16.862   3.462
   80    HB   VAL  13           HB       VAL  13  -0.839 -14.672   2.581
   81   1HG1  VAL  13          1HG1      VAL  13   1.287 -15.965   2.885
   82   2HG1  VAL  13          2HG1      VAL  13   0.705 -17.118   1.661
   83   3HG1  VAL  13          3HG1      VAL  13   0.999 -15.420   1.215
   84   1HG2  VAL  13          1HG2      VAL  13  -2.510 -16.726   1.521
   85   2HG2  VAL  13          2HG2      VAL  13  -2.198 -15.100   0.868
   86   3HG2  VAL  13          3HG2      VAL  13  -1.170 -16.467   0.377
   87    HA   PRO  14           HA       PRO  14   0.398 -20.153   4.385
   88   1HB   PRO  14          1HB       PRO  14   0.274 -21.713   2.146
   89   2HB   PRO  14          2HB       PRO  14  -0.990 -21.688   3.374
   90   1HG   PRO  14          1HG       PRO  14  -0.919 -20.440   0.701
   91   2HG   PRO  14          2HG       PRO  14  -2.349 -20.819   1.726
   92   1HD   PRO  14          1HD       PRO  14  -1.127 -18.273   1.245
   93   2HD   PRO  14          2HD       PRO  14  -2.433 -18.618   2.386
   94    H    ALA  15           H        ALA  15   1.640 -17.739   3.256
   95    HA   ALA  15           HA       ALA  15   3.578 -17.093   2.382
   96   1HB   ALA  15          1HB       ALA  15   4.229 -18.301   4.507
   97   2HB   ALA  15          2HB       ALA  15   4.610 -19.724   3.509
   98   3HB   ALA  15          3HB       ALA  15   5.518 -18.210   3.284
   99    H    LYS  16           H        LYS  16   2.602 -17.380   0.189
  100    HA   LYS  16           HA       LYS  16   4.272 -18.328  -1.646
  101   1HB   LYS  16          1HB       LYS  16   3.103 -20.567  -2.282
  102   2HB   LYS  16          2HB       LYS  16   4.378 -20.551  -1.049
  103   1HG   LYS  16          1HG       LYS  16   2.942 -21.329   0.500
  104   2HG   LYS  16          2HG       LYS  16   1.802 -20.009   0.186
  105   1HD   LYS  16          1HD       LYS  16   1.961 -22.278  -1.783
  106   2HD   LYS  16          2HD       LYS  16   1.138 -22.572  -0.241
  107   1HE   LYS  16          1HE       LYS  16  -0.692 -21.669  -1.222
  108   2HE   LYS  16          2HE       LYS  16   0.112 -20.101  -1.057
  109   1HZ   LYS  16          1HZ       LYS  16   0.049 -20.051  -3.249
  110   2HZ   LYS  16          2HZ       LYS  16   1.180 -21.228  -3.281
  111   3HZ   LYS  16          3HZ       LYS  16  -0.403 -21.616  -3.382
  112    H    ASP  17           H        ASP  17   2.576 -16.208  -1.423
  113    HA   ASP  17           HA       ASP  17   1.044 -16.545  -3.784
  114   1HB   ASP  17          1HB       ASP  17  -0.471 -17.340  -1.876
  115   2HB   ASP  17          2HB       ASP  17  -0.437 -15.679  -1.263
  116    H    ARG  18           H        ARG  18   2.313 -14.740  -1.011
  117    HA   ARG  18           HA       ARG  18   1.432 -12.244  -1.428
  118   1HB   ARG  18          1HB       ARG  18   4.291 -13.076  -0.751
  119   2HB   ARG  18          2HB       ARG  18   3.597 -11.479  -0.420
  120   1HG   ARG  18          1HG       ARG  18   2.417 -12.233   1.385
  121   2HG   ARG  18          2HG       ARG  18   2.018 -13.781   0.620
  122   1HD   ARG  18          1HD       ARG  18   4.327 -14.581   1.069
  123   2HD   ARG  18          2HD       ARG  18   4.725 -13.034   1.830
  124    HE   ARG  18           HE       ARG  18   2.392 -14.470   2.943
  125   1HH1  ARG  18          1HH1      ARG  18   5.832 -13.773   3.204
  126   2HH1  ARG  18          2HH1      ARG  18   5.930 -14.240   4.870
  127   1HH2  ARG  18          1HH2      ARG  18   2.521 -15.085   5.140
  128   2HH2  ARG  18          2HH2      ARG  18   4.033 -14.991   5.978
  129    H    VAL  19           H        VAL  19   3.154 -10.351  -2.201
  130    HA   VAL  19           HA       VAL  19   3.862 -11.098  -4.953
  131    HB   VAL  19           HB       VAL  19   3.309  -8.307  -3.982
  132   1HG1  VAL  19          1HG1      VAL  19   2.396  -8.873  -6.636
  133   2HG1  VAL  19          2HG1      VAL  19   3.701  -7.783  -6.112
  134   3HG1  VAL  19          3HG1      VAL  19   4.057  -9.491  -6.465
  135   1HG2  VAL  19          1HG2      VAL  19   0.956  -8.661  -4.878
  136   2HG2  VAL  19          2HG2      VAL  19   1.287 -10.409  -4.800
  137   3HG2  VAL  19          3HG2      VAL  19   1.324  -9.429  -3.314
  138    H    ASP  20           H        ASP  20   5.421 -11.350  -2.324
  139    HA   ASP  20           HA       ASP  20   7.312 -10.637  -1.408
  140   1HB   ASP  20          1HB       ASP  20   8.334 -12.229  -2.737
  141   2HB   ASP  20          2HB       ASP  20   7.805 -11.472  -4.247
  142    H    CYS  21           H        CYS  21   6.848  -8.350  -0.941
  143    HA   CYS  21           HA       CYS  21   6.847  -6.277  -2.663
  144   1HB   CYS  21          1HB       CYS  21   6.579  -6.466  -0.047
  145   2HB   CYS  21          2HB       CYS  21   8.252  -5.901  -0.054
  146    H    GLY  22           H        GLY  22   9.624  -8.106  -1.320
  147   1HA   GLY  22          1HA       GLY  22  11.819  -8.092  -1.798
  148   2HA   GLY  22          2HA       GLY  22  11.356  -7.581  -3.409
  149    H    TYR  23           H        TYR  23  11.469  -6.117  -0.074
  150    HA   TYR  23           HA       TYR  23  12.298  -3.601  -1.272
  151   1HB   TYR  23          1HB       TYR  23  10.943  -4.674   1.108
  152   2HB   TYR  23          2HB       TYR  23  12.261  -3.614   1.615
  153    HD1  TYR  23           HD1      TYR  23  12.296  -1.223   0.701
  154    HD2  TYR  23           HD2      TYR  23   8.895  -3.795   0.356
  155    HE1  TYR  23           HE1      TYR  23  10.804   0.793   0.287
  156    HE2  TYR  23           HE2      TYR  23   7.415  -1.770  -0.058
  157    HH   TYR  23           HH       TYR  23   8.824   1.477  -0.276
  158    HA   PRO  24           HA       PRO  24  16.464  -4.290  -0.271
  159   1HB   PRO  24          1HB       PRO  24  17.423  -1.763  -0.671
  160   2HB   PRO  24          2HB       PRO  24  17.167  -2.916  -1.980
  161   1HG   PRO  24          1HG       PRO  24  15.557  -0.581  -1.169
  162   2HG   PRO  24          2HG       PRO  24  15.570  -1.441  -2.750
  163   1HD   PRO  24          1HD       PRO  24  13.607  -1.570  -0.668
  164   2HD   PRO  24          2HD       PRO  24  13.657  -2.556  -2.136
  165    H    HIS  25           H        HIS  25  14.324  -2.581   1.570
  166    HA   HIS  25           HA       HIS  25  16.361  -2.371   3.666
  167   1HB   HIS  25          1HB       HIS  25  14.628  -0.347   2.565
  168   2HB   HIS  25          2HB       HIS  25  14.266  -0.586   4.279
  169    HD1  HIS  25           HD1      HIS  25  16.309  -0.201   5.973
  170    HD2  HIS  25           HD2      HIS  25  16.972   1.008   2.012
  171    HE1  HIS  25           HE1      HIS  25  18.357   1.321   6.024
  172    HE2  HIS  25           HE2      HIS  25  18.748   1.988   3.554
  173    H    VAL  26           H        VAL  26  14.244  -4.459   2.674
  174    HA   VAL  26           HA       VAL  26  12.100  -4.724   4.239
  175    HB   VAL  26           HB       VAL  26  12.567  -6.364   2.637
  176   1HG1  VAL  26          1HG1      VAL  26  14.530  -7.913   2.801
  177   2HG1  VAL  26          2HG1      VAL  26  14.967  -6.213   2.497
  178   3HG1  VAL  26          3HG1      VAL  26  15.155  -6.904   4.127
  179   1HG2  VAL  26          1HG2      VAL  26  11.960  -8.287   3.742
  180   2HG2  VAL  26          2HG2      VAL  26  13.136  -8.039   5.056
  181   3HG2  VAL  26          3HG2      VAL  26  11.635  -7.081   5.011
  182    H    THR  27           H        THR  27  11.592  -4.898   6.377
  183    HA   THR  27           HA       THR  27  13.328  -6.071   8.270
  184    HB   THR  27           HB       THR  27  13.774  -3.260   7.614
  185    HG1  THR  27           HG1      THR  27  15.658  -4.127   8.385
  186   1HG2  THR  27          1HG2      THR  27  12.424  -2.468   9.400
  187   2HG2  THR  27          2HG2      THR  27  12.672  -3.947  10.360
  188   3HG2  THR  27          3HG2      THR  27  13.983  -2.752  10.211
  189    HA   PRO  28           HA       PRO  28   9.557  -6.213  10.310
  190   1HB   PRO  28          1HB       PRO  28  10.346  -6.832  12.850
  191   2HB   PRO  28          2HB       PRO  28  10.223  -8.028  11.561
  192   1HG   PRO  28          1HG       PRO  28  12.605  -6.733  12.724
  193   2HG   PRO  28          2HG       PRO  28  12.507  -8.261  11.779
  194   1HD   PRO  28          1HD       PRO  28  13.439  -5.694  10.920
  195   2HD   PRO  28          2HD       PRO  28  13.214  -7.128   9.909
  196    H    LYS  29           H        LYS  29  10.003  -3.672   9.746
  197    HA   LYS  29           HA       LYS  29   8.563  -2.345  11.667
  198   1HB   LYS  29          1HB       LYS  29  10.914  -2.838  12.833
  199   2HB   LYS  29          2HB       LYS  29  11.343  -1.330  12.005
  200   1HG   LYS  29          1HG       LYS  29  10.301  -0.191  13.642
  201   2HG   LYS  29          2HG       LYS  29   8.761  -0.921  13.149
  202   1HD   LYS  29          1HD       LYS  29   9.111  -2.791  14.666
  203   2HD   LYS  29          2HD       LYS  29  10.749  -2.241  15.055
  204   1HE   LYS  29          1HE       LYS  29   9.991  -0.537  16.426
  205   2HE   LYS  29          2HE       LYS  29   8.492  -0.308  15.514
  206   1HZ   LYS  29          1HZ       LYS  29   8.773  -1.673  17.830
  207   2HZ   LYS  29          2HZ       LYS  29   7.476  -1.729  16.840
  208   3HZ   LYS  29          3HZ       LYS  29   8.646  -2.862  16.718
  209    H    GLU  30           H        GLU  30  10.667  -2.579   8.920
  210    HA   GLU  30           HA       GLU  30  10.063   0.163   8.187
  211   1HB   GLU  30          1HB       GLU  30  12.230  -1.735   7.613
  212   2HB   GLU  30          2HB       GLU  30  11.649  -0.910   6.157
  213   1HG   GLU  30          1HG       GLU  30  12.949   0.830   6.773
  214   2HG   GLU  30          2HG       GLU  30  11.800   1.130   8.085
  215    H    CYS  31           H        CYS  31   9.755  -3.255   7.055
  216    HA   CYS  31           HA       CYS  31   8.543  -2.749   4.641
  217   1HB   CYS  31          1HB       CYS  31   8.389  -5.040   6.573
  218   2HB   CYS  31          2HB       CYS  31   7.436  -5.043   5.086
  219    H    ASN  32           H        ASN  32   7.077  -3.346   7.918
  220    HA   ASN  32           HA       ASN  32   4.466  -2.949   7.047
  221   1HB   ASN  32          1HB       ASN  32   5.916  -3.232   9.620
  222   2HB   ASN  32          2HB       ASN  32   4.450  -2.250   9.753
  223   1HD2  ASN  32          1HD2      ASN  32   5.544  -5.177   8.034
  224   2HD2  ASN  32          2HD2      ASN  32   4.181  -6.177   8.415
  225    H    ASN  33           H        ASN  33   7.058  -0.803   7.187
  226    HA   ASN  33           HA       ASN  33   5.391   1.439   7.983
  227   1HB   ASN  33          1HB       ASN  33   7.763   1.001   8.960
  228   2HB   ASN  33          2HB       ASN  33   8.384   1.523   7.386
  229   1HD2  ASN  33          1HD2      ASN  33   9.392   3.106   8.913
  230   2HD2  ASN  33          2HD2      ASN  33   8.551   4.588   9.226
  231    H    ARG  34           H        ARG  34   7.054  -0.178   5.318
  232    HA   ARG  34           HA       ARG  34   6.972   2.136   3.644
  233   1HB   ARG  34          1HB       ARG  34   7.546  -0.739   2.814
  234   2HB   ARG  34          2HB       ARG  34   8.072   0.739   1.988
  235   1HG   ARG  34          1HG       ARG  34   9.043   0.983   4.622
  236   2HG   ARG  34          2HG       ARG  34   9.328  -0.714   4.200
  237   1HD   ARG  34          1HD       ARG  34  10.897  -0.180   2.616
  238   2HD   ARG  34          2HD       ARG  34  10.024   1.263   2.076
  239    HE   ARG  34           HE       ARG  34  10.953   1.865   4.652
  240   1HH1  ARG  34          1HH1      ARG  34  12.409   0.942   1.585
  241   2HH1  ARG  34          2HH1      ARG  34  13.892   1.784   1.890
  242   1HH2  ARG  34          1HH2      ARG  34  12.910   2.975   5.055
  243   2HH2  ARG  34          2HH2      ARG  34  14.179   2.948   3.877
  244    H    GLY  35           H        GLY  35   4.984  -0.646   4.457
  245   1HA   GLY  35          1HA       GLY  35   2.628  -0.358   3.835
  246   2HA   GLY  35          2HA       GLY  35   3.170   0.000   2.208
  247    H    CYS  36           H        CYS  36   4.923  -2.431   4.090
  248    HA   CYS  36           HA       CYS  36   3.604  -4.496   2.479
  249   1HB   CYS  36          1HB       CYS  36   6.500  -4.415   3.331
  250   2HB   CYS  36          2HB       CYS  36   5.722  -5.697   2.400
  251    H    CYS  37           H        CYS  37   4.515  -6.777   3.691
  252    HA   CYS  37           HA       CYS  37   3.926  -6.361   6.531
  253   1HB   CYS  37          1HB       CYS  37   2.041  -7.329   5.058
  254   2HB   CYS  37          2HB       CYS  37   3.008  -8.807   5.041
  255    H    PHE  38           H        PHE  38   5.469  -7.279   7.868
  256    HA   PHE  38           HA       PHE  38   7.664  -8.630   6.606
  257   1HB   PHE  38          1HB       PHE  38   7.689  -6.865   8.504
  258   2HB   PHE  38          2HB       PHE  38   7.020  -8.107   9.567
  259    HD1  PHE  38           HD1      PHE  38   8.406  -9.897  10.388
  260    HD2  PHE  38           HD2      PHE  38   9.981  -7.029   7.685
  261    HE1  PHE  38           HE1      PHE  38  10.732 -10.688  10.902
  262    HE2  PHE  38           HE2      PHE  38  12.307  -7.821   8.198
  263    HZ   PHE  38           HZ       PHE  38  12.654  -9.641   9.801
  264    H    ASP  39           H        ASP  39   8.044 -10.806   6.546
  265    HA   ASP  39           HA       ASP  39   6.007 -12.526   7.396
  266   1HB   ASP  39          1HB       ASP  39   7.285 -13.194   5.504
  267   2HB   ASP  39          2HB       ASP  39   8.825 -12.907   6.328
  268    H    SER  40           H        SER  40   9.347 -13.529   8.062
  269    HA   SER  40           HA       SER  40  10.505 -13.629   9.967
  270   1HB   SER  40          1HB       SER  40   8.813 -11.821  10.874
  271   2HB   SER  40          2HB       SER  40   8.085 -13.195  11.725
  272    HG   SER  40           HG       SER  40   9.852 -13.387  12.998
  273    H    ARG  41           H        ARG  41   7.689 -15.233   8.939
  274    HA   ARG  41           HA       ARG  41   7.851 -17.283  10.942
  275   1HB   ARG  41          1HB       ARG  41   6.150 -17.297   8.415
  276   2HB   ARG  41          2HB       ARG  41   5.854 -18.195   9.915
  277   1HG   ARG  41          1HG       ARG  41   5.850 -15.718  10.943
  278   2HG   ARG  41          2HG       ARG  41   5.393 -15.285   9.285
  279   1HD   ARG  41          1HD       ARG  41   3.272 -15.816   9.865
  280   2HD   ARG  41          2HD       ARG  41   3.779 -17.512   9.887
  281    HE   ARG  41           HE       ARG  41   4.443 -16.184  12.373
  282   1HH1  ARG  41          1HH1      ARG  41   1.752 -17.599  10.602
  283   2HH1  ARG  41          2HH1      ARG  41   0.843 -17.972  12.028
  284   1HH2  ARG  41          1HH2      ARG  41   3.245 -16.677  14.255
  285   2HH2  ARG  41          2HH2      ARG  41   1.698 -17.444  14.120
  286    H    ILE  42           H        ILE  42   8.070 -17.017   7.313
  287    HA   ILE  42           HA       ILE  42   9.807 -19.387   7.387
  288    HB   ILE  42           HB       ILE  42   8.341 -18.647   4.912
  289   1HG1  ILE  42          1HG1      ILE  42   7.018 -19.962   7.291
  290   2HG1  ILE  42          2HG1      ILE  42   6.582 -18.404   6.569
  291   1HG2  ILE  42          1HG2      ILE  42   9.879 -20.475   4.794
  292   2HG2  ILE  42          2HG2      ILE  42   9.174 -21.237   6.239
  293   3HG2  ILE  42          3HG2      ILE  42   8.228 -21.139   4.734
  294   1HD1  ILE  42          1HD1      ILE  42   6.124 -21.199   5.549
  295   2HD1  ILE  42          2HD1      ILE  42   5.035 -19.791   5.523
  296   3HD1  ILE  42          3HD1      ILE  42   6.375 -19.902   4.356
  297    HA   PRO  43           HA       PRO  43  12.717 -16.506   5.899
  298   1HB   PRO  43          1HB       PRO  43  14.871 -18.187   5.852
  299   2HB   PRO  43          2HB       PRO  43  14.359 -17.316   7.296
  300   1HG   PRO  43          1HG       PRO  43  14.002 -20.152   6.565
  301   2HG   PRO  43          2HG       PRO  43  13.919 -19.394   8.196
  302   1HD   PRO  43          1HD       PRO  43  11.763 -20.300   6.542
  303   2HD   PRO  43          2HD       PRO  43  11.624 -19.416   8.067
  304    H    GLY  44           H        GLY  44  11.531 -19.231   4.357
  305   1HA   GLY  44          1HA       GLY  44  13.115 -18.813   1.946
  306   2HA   GLY  44          2HA       GLY  44  11.925 -20.064   2.243
  307    H    VAL  45           H        VAL  45  10.304 -17.485   3.412
  308    HA   VAL  45           HA       VAL  45   9.111 -16.924   0.793
  309    HB   VAL  45           HB       VAL  45   8.010 -17.844   3.152
  310   1HG1  VAL  45          1HG1      VAL  45   6.506 -16.036   3.921
  311   2HG1  VAL  45          2HG1      VAL  45   8.220 -15.663   4.224
  312   3HG1  VAL  45          3HG1      VAL  45   7.368 -14.889   2.866
  313   1HG2  VAL  45          1HG2      VAL  45   6.498 -18.308   1.579
  314   2HG2  VAL  45          2HG2      VAL  45   5.914 -16.631   1.708
  315   3HG2  VAL  45          3HG2      VAL  45   7.158 -17.051   0.506
  316    HA   PRO  46           HA       PRO  46  10.065 -12.722   1.171
  317   1HB   PRO  46          1HB       PRO  46   7.815 -11.400   0.366
  318   2HB   PRO  46          2HB       PRO  46   8.946 -12.149  -0.758
  319   1HG   PRO  46          1HG       PRO  46   6.292 -13.061   0.155
  320   2HG   PRO  46          2HG       PRO  46   7.206 -13.556  -1.316
  321   1HD   PRO  46          1HD       PRO  46   6.829 -15.011   1.121
  322   2HD   PRO  46          2HD       PRO  46   7.867 -15.473  -0.233
  323    H    TRP  47           H        TRP  47  10.642 -11.765   3.009
  324    HA   TRP  47           HA       TRP  47   8.615 -11.634   5.069
  325   1HB   TRP  47          1HB       TRP  47  11.169 -10.348   5.619
  326   2HB   TRP  47          2HB       TRP  47  10.309 -11.607   6.508
  327    HD1  TRP  47           HD1      TRP  47  10.739 -14.218   5.496
  328    HE1  TRP  47           HE1      TRP  47  12.875 -15.353   4.444
  329    HE3  TRP  47           HE3      TRP  47  13.103  -9.877   4.307
  330    HZ2  TRP  47           HZ2      TRP  47  15.262 -14.330   3.259
  331    HZ3  TRP  47           HZ3      TRP  47  15.333 -10.033   3.205
  332    HH2  TRP  47           HH2      TRP  47  16.413 -12.162   2.680
  333    H    CYS  48           H        CYS  48   8.286 -10.111   2.520
  334    HA   CYS  48           HA       CYS  48   7.614  -7.630   3.697
  335   1HB   CYS  48          1HB       CYS  48  10.140  -7.477   3.207
  336   2HB   CYS  48          2HB       CYS  48   9.662  -7.369   1.510
  337    H    PHE  49           H        PHE  49   5.528  -8.100   2.877
  338    HA   PHE  49           HA       PHE  49   5.335  -7.927  -0.032
  339   1HB   PHE  49          1HB       PHE  49   3.310  -9.641   0.532
  340   2HB   PHE  49          2HB       PHE  49   4.939 -10.246   0.206
  341    HD1  PHE  49           HD1      PHE  49   6.470 -10.283   2.424
  342    HD2  PHE  49           HD2      PHE  49   2.233 -10.498   2.357
  343    HE1  PHE  49           HE1      PHE  49   6.490 -11.393   4.676
  344    HE2  PHE  49           HE2      PHE  49   2.252 -11.607   4.608
  345    HZ   PHE  49           HZ       PHE  49   4.382 -12.041   5.741
  346    H    LYS  50           H        LYS  50   2.674  -7.925  -0.449
  347    HA   LYS  50           HA       LYS  50   1.671  -5.891   1.420
  348   1HB   LYS  50          1HB       LYS  50   0.454  -5.587  -1.126
  349   2HB   LYS  50          2HB       LYS  50   1.516  -4.456  -0.268
  350   1HG   LYS  50          1HG       LYS  50   2.684  -6.805  -1.772
  351   2HG   LYS  50          2HG       LYS  50   2.196  -5.351  -2.662
  352   1HD   LYS  50          1HD       LYS  50   4.246  -5.583  -0.426
  353   2HD   LYS  50          2HD       LYS  50   4.545  -5.120  -2.110
  354   1HE   LYS  50          1HE       LYS  50   3.169  -3.545   0.087
  355   2HE   LYS  50          2HE       LYS  50   4.558  -3.062  -0.900
  356   1HZ   LYS  50          1HZ       LYS  50   2.778  -1.953  -1.809
  357   2HZ   LYS  50          2HZ       LYS  50   2.906  -3.245  -2.800
  358   3HZ   LYS  50          3HZ       LYS  50   1.741  -3.206  -1.655
  359    HA   PRO  51           HA       PRO  51  -1.156  -9.421   1.364
  360   1HB   PRO  51          1HB       PRO  51  -1.262  -9.837   4.061
  361   2HB   PRO  51          2HB       PRO  51  -0.176 -10.722   2.990
  362   1HG   PRO  51          1HG       PRO  51   0.387  -8.504   4.849
  363   2HG   PRO  51          2HG       PRO  51   1.537  -9.695   4.143
  364   1HD   PRO  51          1HD       PRO  51   1.153  -6.948   3.426
  365   2HD   PRO  51          2HD       PRO  51   2.184  -8.122   2.596
  366    H    LEU  52           H        LEU  52  -1.841  -8.242   4.505
  367    HA   LEU  52           HA       LEU  52  -4.318  -7.154   3.429
  368   1HB   LEU  52          1HB       LEU  52  -5.270  -7.590   5.423
  369   2HB   LEU  52          2HB       LEU  52  -4.026  -8.853   5.396
  370    HG   LEU  52           HG       LEU  52  -2.898  -6.554   6.635
  371   1HD1  LEU  52          1HD1      LEU  52  -5.766  -6.870   7.192
  372   2HD1  LEU  52          2HD1      LEU  52  -4.735  -6.849   8.643
  373   3HD1  LEU  52          3HD1      LEU  52  -4.675  -5.495   7.490
  374   1HD2  LEU  52          1HD2      LEU  52  -3.412  -9.384   7.214
  375   2HD2  LEU  52          2HD2      LEU  52  -1.981  -8.379   7.545
  376   3HD2  LEU  52          3HD2      LEU  52  -3.368  -8.347   8.660
  377    H    GLN  53           H        GLN  53  -1.749  -5.783   2.959
  378    HA   GLN  53           HA       GLN  53  -1.234  -3.790   4.732
  379   1HB   GLN  53          1HB       GLN  53  -1.127  -3.745   1.693
  380   2HB   GLN  53          2HB       GLN  53  -0.368  -2.522   2.725
  381   1HG   GLN  53          1HG       GLN  53   0.239  -5.507   2.685
  382   2HG   GLN  53          2HG       GLN  53   1.284  -4.226   2.054
  383   1HE2  GLN  53          1HE2      GLN  53   1.099  -2.309   3.967
  384   2HE2  GLN  53          2HE2      GLN  53   1.768  -2.852   5.470
  385    H    GLU  54           H        GLU  54  -4.062  -4.273   2.745
  386    HA   GLU  54           HA       GLU  54  -4.964  -1.867   2.117
  387   1HB   GLU  54          1HB       GLU  54  -7.106  -2.779   2.092
  388   2HB   GLU  54          2HB       GLU  54  -6.102  -4.238   2.062
  389   1HG   GLU  54          1HG       GLU  54  -7.464  -4.852   3.797
  390   2HG   GLU  54          2HG       GLU  54  -6.332  -3.887   4.756
  391    H    ALA  55           H        ALA  55  -4.397  -3.077   5.378
  392    HA   ALA  55           HA       ALA  55  -6.007  -1.725   7.003
  393   1HB   ALA  55          1HB       ALA  55  -4.258  -3.061   7.910
  394   2HB   ALA  55          2HB       ALA  55  -2.997  -2.094   7.110
  395   3HB   ALA  55          3HB       ALA  55  -3.919  -1.404   8.467
  396    H    GLU  56           H        GLU  56  -2.885  -0.220   5.891
  397    HA   GLU  56           HA       GLU  56  -4.362   2.278   5.693
  398   1HB   GLU  56          1HB       GLU  56  -2.844   1.856   7.848
  399   2HB   GLU  56          2HB       GLU  56  -1.549   2.365   6.752
  400   1HG   GLU  56          1HG       GLU  56  -2.245   4.526   6.768
  401   2HG   GLU  56          2HG       GLU  56  -3.952   4.083   6.611
  402    H    CYS  57           H        CYS  57  -3.355   0.182   3.750
  403    HA   CYS  57           HA       CYS  57  -1.342   1.783   2.362
  404   1HB   CYS  57          1HB       CYS  57  -1.059  -0.736   2.960
  405   2HB   CYS  57          2HB       CYS  57  -2.102  -1.006   1.562
  406    H    THR  58           H        THR  58  -4.426  -0.089   1.951
  407    HA   THR  58           HA       THR  58  -4.875   1.103  -0.645
  408    HB   THR  58           HB       THR  58  -5.433  -1.331   0.279
  409    HG1  THR  58           HG1      THR  58  -6.039  -0.103  -1.794
  410   1HG2  THR  58          1HG2      THR  58  -6.893  -0.696   2.160
  411   2HG2  THR  58          2HG2      THR  58  -7.862   0.348   1.093
  412   3HG2  THR  58          3HG2      THR  58  -7.897  -1.420   0.881
  413    H    PHE  59           H        PHE  59  -6.263   1.323   2.679
  414    HA   PHE  59           HA       PHE  59  -8.409   2.812   2.379
  415   1HB   PHE  59          1HB       PHE  59  -7.393   2.284   4.553
  416   2HB   PHE  59          2HB       PHE  59  -5.954   3.239   4.176
  417    HD1  PHE  59           HD1      PHE  59  -9.643   3.626   4.600
  418    HD2  PHE  59           HD2      PHE  59  -5.803   5.383   5.027
  419    HE1  PHE  59           HE1      PHE  59 -10.677   5.609   5.740
  420    HE2  PHE  59           HE2      PHE  59  -6.838   7.365   6.167
  421    HZ   PHE  59           HZ       PHE  59  -9.262   7.455   6.509
  422   1H    GLU   1           H1       GLU   1 -23.035   7.358  -1.501
  423    HA   GLU   1           HA       GLU   1 -21.869   6.350  -3.217
  424   1HB   GLU   1          1HB       GLU   1 -20.127   7.665  -1.140
  425   2HB   GLU   1          2HB       GLU   1 -19.386   7.037  -2.622
  426   1HG   GLU   1          1HG       GLU   1 -20.418   8.614  -3.959
  427   2HG   GLU   1          2HG       GLU   1 -21.853   8.722  -2.928
  428    H    GLU   2           H        GLU   2 -21.262   4.345  -3.911
  429    HA   GLU   2           HA       GLU   2 -20.391   2.485  -1.894
  430   1HB   GLU   2          1HB       GLU   2 -22.190   2.079  -3.730
  431   2HB   GLU   2          2HB       GLU   2 -20.818   1.834  -4.825
  432   1HG   GLU   2          1HG       GLU   2 -21.136  -0.338  -4.094
  433   2HG   GLU   2          2HG       GLU   2 -19.997   0.213  -2.856
  434    H    TYR   3           H        TYR   3 -19.140   1.038  -4.485
  435    HA   TYR   3           HA       TYR   3 -16.472   1.653  -3.805
  436   1HB   TYR   3          1HB       TYR   3 -16.216   0.261  -6.045
  437   2HB   TYR   3          2HB       TYR   3 -16.998  -0.539  -4.678
  438    HD1  TYR   3           HD1      TYR   3 -17.530   1.038  -7.975
  439    HD2  TYR   3           HD2      TYR   3 -19.356  -1.092  -4.745
  440    HE1  TYR   3           HE1      TYR   3 -19.574   0.587  -9.418
  441    HE2  TYR   3           HE2      TYR   3 -21.394  -1.536  -6.199
  442    HH   TYR   3           HH       TYR   3 -22.095   0.133  -8.873
  443    H    VAL   4           H        VAL   4 -17.014   4.142  -4.157
  444    HA   VAL   4           HA       VAL   4 -16.256   4.759  -6.930
  445    HB   VAL   4           HB       VAL   4 -17.427   6.894  -6.618
  446   1HG1  VAL   4          1HG1      VAL   4 -18.596   4.306  -6.929
  447   2HG1  VAL   4          2HG1      VAL   4 -19.733   5.320  -6.009
  448   3HG1  VAL   4          3HG1      VAL   4 -19.143   5.863  -7.598
  449   1HG2  VAL   4          1HG2      VAL   4 -18.143   5.714  -3.923
  450   2HG2  VAL   4          2HG2      VAL   4 -17.349   7.268  -4.276
  451   3HG2  VAL   4          3HG2      VAL   4 -19.068   7.036  -4.677
  452    H    GLY   5           H        GLY   5 -16.124   5.942  -3.495
  453   1HA   GLY   5          1HA       GLY   5 -13.887   7.641  -3.988
  454   2HA   GLY   5          2HA       GLY   5 -14.562   7.183  -2.436
  455    H    LEU   6           H        LEU   6 -14.032   4.336  -4.202
  456    HA   LEU   6           HA       LEU   6 -11.296   4.088  -3.175
  457   1HB   LEU   6          1HB       LEU   6 -11.926   1.706  -2.623
  458   2HB   LEU   6          2HB       LEU   6 -12.508   2.980  -1.536
  459    HG   LEU   6           HG       LEU   6 -14.712   2.844  -2.816
  460   1HD1  LEU   6          1HD1      LEU   6 -13.164   0.820  -4.250
  461   2HD1  LEU   6          2HD1      LEU   6 -14.731   0.217  -3.659
  462   3HD1  LEU   6          3HD1      LEU   6 -14.668   1.656  -4.703
  463   1HD2  LEU   6          1HD2      LEU   6 -15.449   0.818  -1.561
  464   2HD2  LEU   6          2HD2      LEU   6 -13.745   0.508  -1.150
  465   3HD2  LEU   6          3HD2      LEU   6 -14.542   1.994  -0.581
  466    H    SER   7           H        SER   7 -13.146   4.357  -5.847
  467    HA   SER   7           HA       SER   7 -12.324   2.059  -7.270
  468   1HB   SER   7          1HB       SER   7 -13.393   3.065  -9.158
  469   2HB   SER   7          2HB       SER   7 -14.379   3.490  -7.749
  470    HG   SER   7           HG       SER   7 -13.210   5.569  -7.726
  471    H    ALA   8           H        ALA   8 -11.295   2.819  -9.684
  472    HA   ALA   8           HA       ALA   8  -8.618   3.508  -8.997
  473   1HB   ALA   8          1HB       ALA   8  -9.564   1.882 -10.817
  474   2HB   ALA   8          2HB       ALA   8  -9.717   3.353 -11.807
  475   3HB   ALA   8          3HB       ALA   8  -8.122   2.855 -11.192
  476    H    ASN   9           H        ASN   9 -11.394   5.357  -9.337
  477    HA   ASN   9           HA       ASN   9  -9.987   7.527 -10.642
  478   1HB   ASN   9          1HB       ASN   9 -12.495   6.706 -11.072
  479   2HB   ASN   9          2HB       ASN   9 -12.851   7.726  -9.670
  480   1HD2  ASN   9          1HD2      ASN   9 -11.759   9.928  -9.750
  481   2HD2  ASN   9          2HD2      ASN   9 -11.846  10.799 -11.245
  482    H    GLN  10           H        GLN  10 -10.472   6.209  -7.573
  483    HA   GLN  10           HA       GLN  10 -11.179   8.448  -6.079
  484   1HB   GLN  10          1HB       GLN  10 -11.149   6.966  -4.387
  485   2HB   GLN  10          2HB       GLN  10 -10.715   5.738  -5.590
  486   1HG   GLN  10          1HG       GLN  10  -8.327   6.152  -5.174
  487   2HG   GLN  10          2HG       GLN  10  -8.718   7.453  -4.040
  488   1HE2  GLN  10          1HE2      GLN  10  -9.251   6.999  -1.990
  489   2HE2  GLN  10          2HE2      GLN  10  -9.314   5.414  -1.295
  490    H    CYS  11           H        CYS  11  -8.035   7.129  -7.210
  491    HA   CYS  11           HA       CYS  11  -6.419   8.779  -5.649
  492   1HB   CYS  11          1HB       CYS  11  -5.524   6.828  -6.684
  493   2HB   CYS  11          2HB       CYS  11  -5.935   7.413  -8.299
  494    H    ALA  12           H        ALA  12  -8.690   9.518  -8.065
  495    HA   ALA  12           HA       ALA  12  -7.203  11.860  -8.994
  496   1HB   ALA  12          1HB       ALA  12  -9.922  11.147 -10.025
  497   2HB   ALA  12          2HB       ALA  12  -8.500  11.771 -10.893
  498   3HB   ALA  12          3HB       ALA  12  -8.577  10.054 -10.430
  499    H    VAL  13           H        VAL  13  -8.629  11.238  -6.251
  500    HA   VAL  13           HA       VAL  13 -10.901  12.639  -5.898
  501    HB   VAL  13           HB       VAL  13  -8.923  11.530  -4.321
  502   1HG1  VAL  13          1HG1      VAL  13  -8.408  13.196  -2.595
  503   2HG1  VAL  13          2HG1      VAL  13  -7.755  13.689  -4.176
  504   3HG1  VAL  13          3HG1      VAL  13  -9.235  14.452  -3.548
  505   1HG2  VAL  13          1HG2      VAL  13 -10.794  11.113  -3.184
  506   2HG2  VAL  13          2HG2      VAL  13 -10.810  12.795  -2.605
  507   3HG2  VAL  13          3HG2      VAL  13 -11.656  12.365  -4.110
  508    HA   PRO  14           HA       PRO  14 -10.105  16.836  -6.557
  509   1HB   PRO  14          1HB       PRO  14 -11.515  18.110  -4.596
  510   2HB   PRO  14          2HB       PRO  14 -12.264  17.451  -6.049
  511   1HG   PRO  14          1HG       PRO  14 -12.233  16.405  -3.291
  512   2HG   PRO  14          2HG       PRO  14 -13.369  16.008  -4.629
  513   1HD   PRO  14          1HD       PRO  14 -11.208  14.433  -3.602
  514   2HD   PRO  14          2HD       PRO  14 -12.195  14.070  -5.024
  515    H    ALA  15           H        ALA  15  -8.173  15.364  -4.864
  516    HA   ALA  15           HA       ALA  15  -6.457  15.790  -3.517
  517   1HB   ALA  15          1HB       ALA  15  -5.705  18.404  -4.059
  518   2HB   ALA  15          2HB       ALA  15  -5.251  16.975  -5.019
  519   3HB   ALA  15          3HB       ALA  15  -6.654  17.960  -5.498
  520    H    LYS  16           H        LYS  16  -8.288  15.683  -1.781
  521    HA   LYS  16           HA       LYS  16  -7.691  17.465   0.217
  522   1HB   LYS  16          1HB       LYS  16 -10.002  18.660   0.251
  523   2HB   LYS  16          2HB       LYS  16  -8.683  19.319  -0.732
  524   1HG   LYS  16          1HG       LYS  16  -9.955  19.118  -2.575
  525   2HG   LYS  16          2HG       LYS  16 -10.099  17.372  -2.315
  526   1HD   LYS  16          1HD       LYS  16 -12.332  18.164  -2.329
  527   2HD   LYS  16          2HD       LYS  16 -11.961  17.969  -0.608
  528   1HE   LYS  16          1HE       LYS  16 -11.321  20.440  -0.590
  529   2HE   LYS  16          2HE       LYS  16 -11.987  20.556  -2.227
  530   1HZ   LYS  16          1HZ       LYS  16 -13.944  19.346  -0.907
  531   2HZ   LYS  16          2HZ       LYS  16 -13.337  20.289   0.282
  532   3HZ   LYS  16          3HZ       LYS  16 -13.852  20.964  -1.113
  533    H    ASP  17           H        ASP  17  -8.042  14.658  -0.270
  534    HA   ASP  17           HA       ASP  17  -9.796  14.139   1.902
  535   1HB   ASP  17          1HB       ASP  17 -11.258  14.156  -0.215
  536   2HB   ASP  17          2HB       ASP  17 -10.366  12.719  -0.734
  537    H    ARG  18           H        ARG  18  -6.929  13.856   0.587
  538    HA   ARG  18           HA       ARG  18  -6.675  10.995   0.581
  539   1HB   ARG  18          1HB       ARG  18  -4.535  13.143   0.225
  540   2HB   ARG  18          2HB       ARG  18  -4.357  11.423  -0.163
  541   1HG   ARG  18          1HG       ARG  18  -5.544  11.614  -2.114
  542   2HG   ARG  18          2HG       ARG  18  -6.666  12.816  -1.450
  543   1HD   ARG  18          1HD       ARG  18  -5.093  14.596  -1.786
  544   2HD   ARG  18          2HD       ARG  18  -3.756  13.473  -2.076
  545    HE   ARG  18           HE       ARG  18  -5.985  13.201  -3.965
  546   1HH1  ARG  18          1HH1      ARG  18  -2.957  14.860  -3.283
  547   2HH1  ARG  18          2HH1      ARG  18  -2.656  15.262  -4.940
  548   1HH2  ARG  18          1HH2      ARG  18  -5.587  13.731  -6.153
  549   2HH2  ARG  18          2HH2      ARG  18  -4.162  14.615  -6.584
  550    H    VAL  19           H        VAL  19  -4.497  10.190   1.776
  551    HA   VAL  19           HA       VAL  19  -4.736  11.180   4.514
  552    HB   VAL  19           HB       VAL  19  -3.266   8.706   3.666
  553   1HG1  VAL  19          1HG1      VAL  19  -4.159   9.924   6.150
  554   2HG1  VAL  19          2HG1      VAL  19  -4.783   8.265   5.981
  555   3HG1  VAL  19          3HG1      VAL  19  -3.032   8.571   5.884
  556   1HG2  VAL  19          1HG2      VAL  19  -5.554   7.543   4.130
  557   2HG2  VAL  19          2HG2      VAL  19  -6.249   9.126   3.708
  558   3HG2  VAL  19          3HG2      VAL  19  -5.244   8.251   2.527
  559    H    ASP  20           H        ASP  20  -3.182  12.369   2.081
  560    HA   ASP  20           HA       ASP  20  -1.125  13.006   1.573
  561   1HB   ASP  20          1HB       ASP  20  -1.579  14.863   2.884
  562   2HB   ASP  20          2HB       ASP  20  -1.762  13.912   4.366
  563    H    CYS  21           H        CYS  21  -0.053  10.882   1.298
  564    HA   CYS  21           HA       CYS  21   0.915   9.286   3.266
  565   1HB   CYS  21          1HB       CYS  21   1.000   9.269   0.576
  566   2HB   CYS  21          2HB       CYS  21   2.691   9.637   0.922
  567    H    GLY  22           H        GLY  22   2.204  12.359   1.944
  568   1HA   GLY  22          1HA       GLY  22   4.112  13.510   2.424
  569   2HA   GLY  22          2HA       GLY  22   3.474  13.354   4.049
  570    H    TYR  23           H        TYR  23   5.203  11.210   1.662
  571    HA   TYR  23           HA       TYR  23   6.685  10.042   3.869
  572   1HB   TYR  23          1HB       TYR  23   5.902   9.519   1.035
  573   2HB   TYR  23          2HB       TYR  23   7.565   9.033   1.377
  574    HD1  TYR  23           HD1      TYR  23   4.087   8.663   2.732
  575    HD2  TYR  23           HD2      TYR  23   7.958   6.908   2.247
  576    HE1  TYR  23           HE1      TYR  23   3.236   6.490   3.741
  577    HE2  TYR  23           HE2      TYR  23   7.094   4.740   3.259
  578    HH   TYR  23           HH       TYR  23   4.392   3.749   3.350
  579    HA   PRO  24           HA       PRO  24  10.344  12.201   3.066
  580   1HB   PRO  24          1HB       PRO  24  12.266  10.389   3.759
  581   2HB   PRO  24          2HB       PRO  24  11.370  11.342   4.939
  582   1HG   PRO  24          1HG       PRO  24  11.072   8.510   4.172
  583   2HG   PRO  24          2HG       PRO  24  10.511   9.331   5.671
  584   1HD   PRO  24          1HD       PRO  24   8.964   8.501   3.409
  585   2HD   PRO  24          2HD       PRO  24   8.391   9.448   4.789
  586    H    HIS  25           H        HIS  25   9.525   9.522   1.245
  587    HA   HIS  25           HA       HIS  25  11.660  10.217  -0.639
  588   1HB   HIS  25          1HB       HIS  25  10.864   7.689   0.466
  589   2HB   HIS  25          2HB       HIS  25  10.592   7.671  -1.281
  590    HD1  HIS  25           HD1      HIS  25  13.047   6.619   0.946
  591    HD2  HIS  25           HD2      HIS  25  13.203   9.032  -2.482
  592    HE1  HIS  25           HE1      HIS  25  15.464   6.550   0.133
  593    HE2  HIS  25           HE2      HIS  25  15.486   8.005  -2.007
  594    H    VAL  26           H        VAL  26   8.572  10.934   0.027
  595    HA   VAL  26           HA       VAL  26   6.909  10.217  -1.939
  596    HB   VAL  26           HB       VAL  26   6.186  11.676  -0.243
  597   1HG1  VAL  26          1HG1      VAL  26   8.612  12.841  -0.309
  598   2HG1  VAL  26          2HG1      VAL  26   7.674  14.083  -1.171
  599   3HG1  VAL  26          3HG1      VAL  26   7.197  13.587   0.470
  600   1HG2  VAL  26          1HG2      VAL  26   4.720  12.853  -1.485
  601   2HG2  VAL  26          2HG2      VAL  26   6.003  13.744  -2.337
  602   3HG2  VAL  26          3HG2      VAL  26   5.546  12.110  -2.875
  603    H    THR  27           H        THR  27   7.216   9.953  -4.086
  604    HA   THR  27           HA       THR  27   7.982  12.151  -5.702
  605    HB   THR  27           HB       THR  27  10.133  10.703  -4.568
  606    HG1  THR  27           HG1      THR  27  11.198  12.007  -6.353
  607   1HG2  THR  27          1HG2      THR  27  11.189   9.911  -6.800
  608   2HG2  THR  27          2HG2      THR  27   9.975   8.824  -6.084
  609   3HG2  THR  27          3HG2      THR  27   9.532   9.879  -7.448
  610    HA   PRO  28           HA       PRO  28   5.945   9.749  -8.615
  611   1HB   PRO  28          1HB       PRO  28   7.045  10.534 -10.989
  612   2HB   PRO  28          2HB       PRO  28   5.836  11.483 -10.127
  613   1HG   PRO  28          1HG       PRO  28   8.753  11.874 -10.343
  614   2HG   PRO  28          2HG       PRO  28   7.488  13.073  -9.888
  615   1HD   PRO  28          1HD       PRO  28   9.356  11.723  -8.189
  616   2HD   PRO  28          2HD       PRO  28   8.029  12.771  -7.674
  617    H    LYS  29           H        LYS  29   7.652   8.155  -7.289
  618    HA   LYS  29           HA       LYS  29   7.937   6.051  -9.051
  619   1HB   LYS  29          1HB       LYS  29   9.799   7.832  -9.773
  620   2HB   LYS  29          2HB       LYS  29  10.712   6.983  -8.514
  621   1HG   LYS  29          1HG       LYS  29  11.066   5.260  -9.916
  622   2HG   LYS  29          2HG       LYS  29   9.320   5.029 -10.126
  623   1HD   LYS  29          1HD       LYS  29   9.657   7.182 -11.718
  624   2HD   LYS  29          2HD       LYS  29  11.291   6.506 -11.847
  625   1HE   LYS  29          1HE       LYS  29  10.510   4.502 -12.816
  626   2HE   LYS  29          2HE       LYS  29   8.862   4.724 -12.207
  627   1HZ   LYS  29          1HZ       LYS  29   9.463   5.240 -14.651
  628   2HZ   LYS  29          2HZ       LYS  29   8.407   6.198 -13.854
  629   3HZ   LYS  29          3HZ       LYS  29   9.955   6.679 -14.056
  630    H    GLU  30           H        GLU  30   8.486   7.778  -6.088
  631    HA   GLU  30           HA       GLU  30   9.390   5.347  -4.793
  632   1HB   GLU  30          1HB       GLU  30   9.664   8.229  -4.297
  633   2HB   GLU  30          2HB       GLU  30   9.227   7.330  -2.833
  634   1HG   GLU  30          1HG       GLU  30  11.675   7.478  -3.093
  635   2HG   GLU  30          2HG       GLU  30  11.144   5.793  -3.217
  636    H    CYS  31           H        CYS  31   6.755   7.816  -4.729
  637    HA   CYS  31           HA       CYS  31   5.348   6.854  -2.583
  638   1HB   CYS  31          1HB       CYS  31   4.378   8.156  -5.126
  639   2HB   CYS  31          2HB       CYS  31   3.344   7.850  -3.728
  640    H    ASN  32           H        ASN  32   4.927   6.076  -6.121
  641    HA   ASN  32           HA       ASN  32   3.030   4.114  -5.693
  642   1HB   ASN  32          1HB       ASN  32   4.786   5.031  -7.907
  643   2HB   ASN  32          2HB       ASN  32   4.323   3.327  -8.034
  644   1HD2  ASN  32          1HD2      ASN  32   2.477   5.906  -6.500
  645   2HD2  ASN  32          2HD2      ASN  32   1.138   5.923  -7.598
  646    H    ASN  33           H        ASN  33   6.341   4.223  -4.870
  647    HA   ASN  33           HA       ASN  33   6.860   1.452  -5.375
  648   1HB   ASN  33          1HB       ASN  33   8.486   3.628  -5.260
  649   2HB   ASN  33          2HB       ASN  33   8.655   3.078  -3.586
  650   1HD2  ASN  33          1HD2      ASN  33  10.888   2.774  -4.252
  651   2HD2  ASN  33          2HD2      ASN  33  11.371   1.293  -5.010
  652    H    ARG  34           H        ARG  34   6.098   3.720  -2.689
  653    HA   ARG  34           HA       ARG  34   6.459   1.688  -0.725
  654   1HB   ARG  34          1HB       ARG  34   5.009   4.289  -0.204
  655   2HB   ARG  34          2HB       ARG  34   6.109   3.405   0.866
  656   1HG   ARG  34          1HG       ARG  34   7.578   4.095  -1.485
  657   2HG   ARG  34          2HG       ARG  34   6.701   5.552  -0.984
  658   1HD   ARG  34          1HD       ARG  34   8.320   5.875   0.560
  659   2HD   ARG  34          2HD       ARG  34   7.713   4.450   1.416
  660    HE   ARG  34           HE       ARG  34   9.355   3.434  -0.602
  661   1HH1  ARG  34          1HH1      ARG  34   9.777   5.674   2.079
  662   2HH1  ARG  34          2HH1      ARG  34  11.453   5.296   2.297
  663   1HH2  ARG  34          1HH2      ARG  34  11.566   2.935  -0.315
  664   2HH2  ARG  34          2HH2      ARG  34  12.478   3.727   0.927
  665    H    GLY  35           H        GLY  35   3.866   3.085  -2.690
  666   1HA   GLY  35          1HA       GLY  35   1.958   1.569  -2.984
  667   2HA   GLY  35          2HA       GLY  35   1.900   1.413  -1.239
  668    H    CYS  36           H        CYS  36   2.736   4.519  -2.763
  669    HA   CYS  36           HA       CYS  36   0.132   5.518  -1.864
  670   1HB   CYS  36          1HB       CYS  36   2.758   6.989  -2.111
  671   2HB   CYS  36          2HB       CYS  36   1.222   7.708  -1.620
  672    H    CYS  37           H        CYS  37  -0.388   7.690  -3.209
  673    HA   CYS  37           HA       CYS  37   0.166   7.047  -6.015
  674   1HB   CYS  37          1HB       CYS  37  -2.212   6.740  -5.086
  675   2HB   CYS  37          2HB       CYS  37  -2.295   8.504  -5.081
  676    H    PHE  38           H        PHE  38   1.272   8.645  -7.110
  677    HA   PHE  38           HA       PHE  38   1.688  11.150  -5.704
  678   1HB   PHE  38          1HB       PHE  38   3.555   9.751  -6.696
  679   2HB   PHE  38          2HB       PHE  38   2.820   9.928  -8.292
  680    HD1  PHE  38           HD1      PHE  38   4.305  11.885  -5.500
  681    HD2  PHE  38           HD2      PHE  38   3.410  11.735  -9.646
  682    HE1  PHE  38           HE1      PHE  38   5.635  13.982  -5.864
  683    HE2  PHE  38           HE2      PHE  38   4.740  13.832 -10.009
  684    HZ   PHE  38           HZ       PHE  38   5.837  14.930  -8.114
  685    H    ASP  39           H        ASP  39   0.475  12.921  -6.154
  686    HA   ASP  39           HA       ASP  39  -1.152  12.860  -8.507
  687   1HB   ASP  39          1HB       ASP  39  -2.156  13.656  -6.451
  688   2HB   ASP  39          2HB       ASP  39  -0.853  14.830  -6.198
  689    H    SER  40           H        SER  40   0.514  15.713  -7.022
  690    HA   SER  40           HA       SER  40   2.168  16.973  -7.795
  691   1HB   SER  40          1HB       SER  40   2.712  14.862  -9.332
  692   2HB   SER  40          2HB       SER  40   2.072  15.909 -10.610
  693    HG   SER  40           HG       SER  40   4.123  16.754  -8.757
  694    H    ARG  41           H        ARG  41  -0.933  16.384  -9.188
  695    HA   ARG  41           HA       ARG  41  -1.022  18.432 -11.050
  696   1HB   ARG  41          1HB       ARG  41  -3.238  17.191  -9.357
  697   2HB   ARG  41          2HB       ARG  41  -3.529  18.220 -10.769
  698   1HG   ARG  41          1HG       ARG  41  -1.787  16.378 -11.809
  699   2HG   ARG  41          2HG       ARG  41  -2.634  15.380 -10.614
  700   1HD   ARG  41          1HD       ARG  41  -4.343  15.185 -12.074
  701   2HD   ARG  41          2HD       ARG  41  -4.636  16.924 -11.936
  702    HE   ARG  41           HE       ARG  41  -2.454  16.464 -13.740
  703   1HH1  ARG  41          1HH1      ARG  41  -5.947  16.075 -13.551
  704   2HH1  ARG  41          2HH1      ARG  41  -6.181  16.205 -15.262
  705   1HH2  ARG  41          1HH2      ARG  41  -2.763  16.637 -15.997
  706   2HH2  ARG  41          2HH2      ARG  41  -4.359  16.528 -16.663
  707    H    ILE  42           H        ILE  42  -1.702  18.280  -7.514
  708    HA   ILE  42           HA       ILE  42  -1.902  21.211  -7.544
  709    HB   ILE  42           HB       ILE  42  -3.248  19.568  -5.445
  710   1HG1  ILE  42          1HG1      ILE  42  -4.232  19.981  -8.263
  711   2HG1  ILE  42          2HG1      ILE  42  -4.124  18.471  -7.342
  712   1HG2  ILE  42          1HG2      ILE  42  -2.980  22.077  -5.332
  713   2HG2  ILE  42          2HG2      ILE  42  -4.077  22.177  -6.729
  714   3HG2  ILE  42          3HG2      ILE  42  -4.648  21.467  -5.200
  715   1HD1  ILE  42          1HD1      ILE  42  -6.123  20.726  -7.111
  716   2HD1  ILE  42          2HD1      ILE  42  -6.408  18.970  -7.178
  717   3HD1  ILE  42          3HD1      ILE  42  -5.781  19.715  -5.687
  718    HA   PRO  43           HA       PRO  43   1.658  20.537  -5.066
  719   1HB   PRO  43          1HB       PRO  43   2.611  23.092  -5.203
  720   2HB   PRO  43          2HB       PRO  43   2.995  21.855  -6.399
  721   1HG   PRO  43          1HG       PRO  43   1.115  24.124  -6.554
  722   2HG   PRO  43          2HG       PRO  43   1.850  23.180  -7.900
  723   1HD   PRO  43          1HD       PRO  43  -0.822  23.042  -6.881
  724   2HD   PRO  43          2HD       PRO  43  -0.102  21.981  -8.097
  725    H    GLY  44           H        GLY  44  -1.134  22.183  -4.475
  726   1HA   GLY  44          1HA       GLY  44  -0.245  23.225  -1.893
  727   2HA   GLY  44          2HA       GLY  44  -1.798  23.471  -2.665
  728    H    VAL  45           H        VAL  45  -1.325  20.261  -3.206
  729    HA   VAL  45           HA       VAL  45  -2.452  19.509  -0.597
  730    HB   VAL  45           HB       VAL  45  -4.055  18.200  -1.611
  731   1HG1  VAL  45          1HG1      VAL  45  -3.857  20.876  -2.408
  732   2HG1  VAL  45          2HG1      VAL  45  -4.284  19.989  -3.891
  733   3HG1  VAL  45          3HG1      VAL  45  -5.310  19.850  -2.444
  734   1HG2  VAL  45          1HG2      VAL  45  -2.083  17.975  -3.789
  735   2HG2  VAL  45          2HG2      VAL  45  -3.267  16.794  -3.183
  736   3HG2  VAL  45          3HG2      VAL  45  -3.775  18.051  -4.336
  737    HA   PRO  46           HA       PRO  46   0.330  16.178  -0.588
  738   1HB   PRO  46          1HB       PRO  46  -1.098  13.888  -0.169
  739   2HB   PRO  46          2HB       PRO  46  -0.717  15.036   1.114
  740   1HG   PRO  46          1HG       PRO  46  -3.245  14.584  -0.337
  741   2HG   PRO  46          2HG       PRO  46  -2.992  15.387   1.254
  742   1HD   PRO  46          1HD       PRO  46  -3.550  16.596  -1.282
  743   2HD   PRO  46          2HD       PRO  46  -3.152  17.436   0.223
  744    H    TRP  47           H        TRP  47   1.639  15.729  -2.235
  745    HA   TRP  47           HA       TRP  47   0.356  14.664  -4.612
  746   1HB   TRP  47          1HB       TRP  47   3.224  14.954  -4.761
  747   2HB   TRP  47          2HB       TRP  47   1.956  15.700  -5.733
  748    HD1  TRP  47           HD1      TRP  47   1.078  18.159  -4.871
  749    HE1  TRP  47           HE1      TRP  47   2.138  20.059  -3.377
  750    HE3  TRP  47           HE3      TRP  47   4.696  15.243  -2.807
  751    HZ2  TRP  47           HZ2      TRP  47   4.322  20.127  -1.541
  752    HZ3  TRP  47           HZ3      TRP  47   6.251  16.304  -1.173
  753    HH2  TRP  47           HH2      TRP  47   6.107  18.658  -0.532
  754    H    CYS  48           H        CYS  48   0.497  13.091  -2.074
  755    HA   CYS  48           HA       CYS  48   1.409  10.686  -3.205
  756   1HB   CYS  48          1HB       CYS  48   3.598  11.689  -2.602
  757   2HB   CYS  48          2HB       CYS  48   3.094  11.706  -0.910
  758    H    PHE  49           H        PHE  49  -0.317   9.474  -2.501
  759    HA   PHE  49           HA       PHE  49  -0.827   9.395   0.346
  760   1HB   PHE  49          1HB       PHE  49  -3.394   9.529  -0.570
  761   2HB   PHE  49          2HB       PHE  49  -2.515  10.982  -0.082
  762    HD1  PHE  49           HD1      PHE  49  -1.124  12.113  -2.018
  763    HD2  PHE  49           HD2      PHE  49  -4.392   9.479  -2.638
  764    HE1  PHE  49           HE1      PHE  49  -1.454  13.064  -4.316
  765    HE2  PHE  49           HE2      PHE  49  -4.723  10.431  -4.937
  766    HZ   PHE  49           HZ       PHE  49  -3.250  12.213  -5.749
  767    H    LYS  50           H        LYS  50  -3.194   7.891   0.305
  768    HA   LYS  50           HA       LYS  50  -2.436   5.588  -1.352
  769   1HB   LYS  50          1HB       LYS  50  -3.465   4.306   0.703
  770   2HB   LYS  50          2HB       LYS  50  -1.760   4.789   0.682
  771   1HG   LYS  50          1HG       LYS  50  -3.107   7.031   1.697
  772   2HG   LYS  50          2HG       LYS  50  -3.941   5.661   2.450
  773   1HD   LYS  50          1HD       LYS  50  -2.158   6.182   3.925
  774   2HD   LYS  50          2HD       LYS  50  -1.578   4.770   3.027
  775   1HE   LYS  50          1HE       LYS  50   0.225   6.366   3.099
  776   2HE   LYS  50          2HE       LYS  50  -0.403   6.391   1.445
  777   1HZ   LYS  50          1HZ       LYS  50  -0.688   8.374   3.549
  778   2HZ   LYS  50          2HZ       LYS  50  -0.322   8.585   1.971
  779   3HZ   LYS  50          3HZ       LYS  50  -1.860   8.266   2.416
  780    HA   PRO  51           HA       PRO  51  -6.724   6.804  -2.145
  781   1HB   PRO  51          1HB       PRO  51  -6.534   7.047  -4.858
  782   2HB   PRO  51          2HB       PRO  51  -6.380   8.413  -3.755
  783   1HG   PRO  51          1HG       PRO  51  -4.305   6.921  -5.229
  784   2HG   PRO  51          2HG       PRO  51  -4.207   8.569  -4.511
  785   1HD   PRO  51          1HD       PRO  51  -3.073   6.129  -3.530
  786   2HD   PRO  51          2HD       PRO  51  -3.083   7.694  -2.707
  787    H    LEU  52           H        LEU  52  -5.993   5.407  -5.185
  788    HA   LEU  52           HA       LEU  52  -7.531   3.078  -4.349
  789   1HB   LEU  52          1HB       LEU  52  -8.167   2.827  -6.507
  790   2HB   LEU  52          2HB       LEU  52  -7.996   4.587  -6.407
  791    HG   LEU  52           HG       LEU  52  -5.491   3.624  -7.248
  792   1HD1  LEU  52          1HD1      LEU  52  -6.678   2.536  -9.470
  793   2HD1  LEU  52          2HD1      LEU  52  -5.893   1.622  -8.160
  794   3HD1  LEU  52          3HD1      LEU  52  -7.657   1.860  -8.146
  795   1HD2  LEU  52          1HD2      LEU  52  -7.539   5.443  -8.094
  796   2HD2  LEU  52          2HD2      LEU  52  -5.800   5.446  -8.471
  797   3HD2  LEU  52          3HD2      LEU  52  -6.932   4.543  -9.505
  798    H    GLN  53           H        GLN  53  -4.877   3.355  -3.279
  799    HA   GLN  53           HA       GLN  53  -2.911   2.169  -4.725
  800   1HB   GLN  53          1HB       GLN  53  -3.516   1.948  -1.753
  801   2HB   GLN  53          2HB       GLN  53  -1.972   1.476  -2.485
  802   1HG   GLN  53          1HG       GLN  53  -3.232   4.251  -2.579
  803   2HG   GLN  53          2HG       GLN  53  -1.882   3.777  -1.535
  804   1HE2  GLN  53          1HE2      GLN  53  -0.565   2.089  -3.386
  805   2HE2  GLN  53          2HE2      GLN  53   0.147   3.060  -4.631
  806    H    GLU  54           H        GLU  54  -5.886   0.785  -3.582
  807    HA   GLU  54           HA       GLU  54  -5.360  -1.745  -2.981
  808   1HB   GLU  54          1HB       GLU  54  -7.545  -2.317  -3.814
  809   2HB   GLU  54          2HB       GLU  54  -7.630  -0.652  -3.214
  810   1HG   GLU  54          1HG       GLU  54  -7.500   0.230  -5.467
  811   2HG   GLU  54          2HG       GLU  54  -7.148  -1.369  -6.140
  812    H    ALA  55           H        ALA  55  -4.689  -0.170  -6.036
  813    HA   ALA  55           HA       ALA  55  -4.800  -1.961  -7.965
  814   1HB   ALA  55          1HB       ALA  55  -3.579   0.348  -7.775
  815   2HB   ALA  55          2HB       ALA  55  -2.137  -0.637  -7.433
  816   3HB   ALA  55          3HB       ALA  55  -3.008  -0.838  -8.973
  817    H    GLU  56           H        GLU  56  -2.004  -1.911  -5.632
  818    HA   GLU  56           HA       GLU  56  -2.043  -4.791  -5.706
  819   1HB   GLU  56          1HB       GLU  56  -0.142  -3.215  -7.199
  820   2HB   GLU  56          2HB       GLU  56   0.717  -4.083  -5.916
  821   1HG   GLU  56          1HG       GLU  56  -0.156  -6.207  -6.682
  822   2HG   GLU  56          2HG       GLU  56  -1.266  -5.417  -7.814
  823    H    CYS  57           H        CYS  57  -2.475  -2.334  -3.851
  824    HA   CYS  57           HA       CYS  57  -0.378  -2.842  -1.907
  825   1HB   CYS  57          1HB       CYS  57  -1.693  -0.546  -2.683
  826   2HB   CYS  57          2HB       CYS  57  -2.464  -0.944  -1.146
  827    H    THR  58           H        THR  58  -3.997  -2.783  -2.249
  828    HA   THR  58           HA       THR  58  -4.422  -4.018   0.283
  829    HB   THR  58           HB       THR  58  -5.943  -2.458  -1.244
  830    HG1  THR  58           HG1      THR  58  -7.769  -3.715  -0.176
  831   1HG2  THR  58          1HG2      THR  58  -6.736  -5.285  -2.121
  832   2HG2  THR  58          2HG2      THR  58  -7.664  -3.802  -2.445
  833   3HG2  THR  58          3HG2      THR  58  -6.066  -4.034  -3.194
  834    H    PHE  59           H        PHE  59  -3.937  -5.177  -3.048
  835    HA   PHE  59           HA       PHE  59  -4.958  -7.588  -3.154
  836   1HB   PHE  59          1HB       PHE  59  -2.570  -6.208  -4.050
  837   2HB   PHE  59          2HB       PHE  59  -2.091  -7.858  -3.638
  838    HD1  PHE  59           HD1      PHE  59  -5.258  -6.590  -5.138
  839    HD2  PHE  59           HD2      PHE  59  -1.748  -8.913  -5.677
  840    HE1  PHE  59           HE1      PHE  59  -6.120  -7.377  -7.360
  841    HE2  PHE  59           HE2      PHE  59  -2.609  -9.700  -7.900
  842    HZ   PHE  59           HZ       PHE  59  -4.786  -8.923  -8.714
  Start of MODEL   29
    1   1H    GLU   1           H1       GLU   1 -17.597  -7.067  -4.400
    2    HA   GLU   1           HA       GLU   1 -15.255  -8.255  -5.366
    3   1HB   GLU   1          1HB       GLU   1 -16.004  -5.877  -4.029
    4   2HB   GLU   1          2HB       GLU   1 -14.800  -6.648  -2.981
    5   1HG   GLU   1          1HG       GLU   1 -13.703  -5.161  -4.596
    6   2HG   GLU   1          2HG       GLU   1 -13.260  -6.842  -4.941
    7    H    GLU   2           H        GLU   2 -14.076  -9.963  -4.593
    8    HA   GLU   2           HA       GLU   2 -15.036 -11.182  -2.174
    9   1HB   GLU   2          1HB       GLU   2 -14.040 -12.138  -4.606
   10   2HB   GLU   2          2HB       GLU   2 -12.743 -12.492  -3.452
   11   1HG   GLU   2          1HG       GLU   2 -14.079 -13.926  -2.194
   12   2HG   GLU   2          2HG       GLU   2 -15.585 -13.124  -2.666
   13    H    TYR   3           H        TYR   3 -14.236  -9.368  -0.781
   14    HA   TYR   3           HA       TYR   3 -11.508  -8.740  -0.622
   15   1HB   TYR   3          1HB       TYR   3 -12.401  -8.043   1.771
   16   2HB   TYR   3          2HB       TYR   3 -13.147  -7.264   0.370
   17    HD1  TYR   3           HD1      TYR   3 -15.099  -6.725   1.821
   18    HD2  TYR   3           HD2      TYR   3 -13.954 -10.764   0.998
   19    HE1  TYR   3           HE1      TYR   3 -17.378  -7.538   2.605
   20    HE2  TYR   3           HE2      TYR   3 -16.236 -11.563   1.784
   21    HH   TYR   3           HH       TYR   3 -18.016 -10.511   3.504
   22    H    VAL   4           H        VAL   4 -10.742 -11.107  -0.827
   23    HA   VAL   4           HA       VAL   4 -10.566 -12.234   1.883
   24    HB   VAL   4           HB       VAL   4 -10.593 -13.674  -0.777
   25   1HG1  VAL   4          1HG1      VAL   4 -10.988 -15.547   1.220
   26   2HG1  VAL   4          2HG1      VAL   4  -9.468 -15.262   0.341
   27   3HG1  VAL   4          3HG1      VAL   4  -9.748 -14.477   1.914
   28   1HG2  VAL   4          1HG2      VAL   4 -12.726 -14.680   0.228
   29   2HG2  VAL   4          2HG2      VAL   4 -12.683 -13.323   1.380
   30   3HG2  VAL   4          3HG2      VAL   4 -12.817 -13.005  -0.366
   31    H    GLY   5           H        GLY   5  -8.916 -12.325  -1.361
   32   1HA   GLY   5          1HA       GLY   5  -6.358 -12.802  -0.187
   33   2HA   GLY   5          2HA       GLY   5  -6.716 -12.439  -1.863
   34    H    LEU   6           H        LEU   6  -8.178 -10.154   0.269
   35    HA   LEU   6           HA       LEU   6  -5.840  -8.432   0.308
   36   1HB   LEU   6          1HB       LEU   6  -8.048  -6.875  -0.593
   37   2HB   LEU   6          2HB       LEU   6  -6.447  -7.088  -1.323
   38    HG   LEU   6           HG       LEU   6  -7.425  -9.251  -2.331
   39   1HD1  LEU   6          1HD1      LEU   6 -10.017  -7.843  -1.637
   40   2HD1  LEU   6          2HD1      LEU   6  -9.842  -9.293  -2.654
   41   3HD1  LEU   6          3HD1      LEU   6  -9.429  -9.364  -0.925
   42   1HD2  LEU   6          1HD2      LEU   6  -7.879  -8.143  -4.288
   43   2HD2  LEU   6          2HD2      LEU   6  -8.769  -6.833  -3.475
   44   3HD2  LEU   6          3HD2      LEU   6  -6.992  -6.885  -3.393
   45    H    SER   7           H        SER   7  -7.921 -10.014   2.066
   46    HA   SER   7           HA       SER   7  -8.746  -7.705   3.639
   47   1HB   SER   7          1HB       SER   7 -10.280  -9.410   4.768
   48   2HB   SER   7          2HB       SER   7 -10.664  -9.017   3.084
   49    HG   SER   7           HG       SER   7 -10.048 -11.438   4.211
   50    H    ALA   8           H        ALA   8  -8.913  -8.446   6.157
   51    HA   ALA   8           HA       ALA   8  -6.265  -8.860   6.979
   52   1HB   ALA   8          1HB       ALA   8  -8.848  -8.216   8.117
   53   2HB   ALA   8          2HB       ALA   8  -8.026  -9.429   9.127
   54   3HB   ALA   8          3HB       ALA   8  -7.222  -7.884   8.761
   55    H    ASN   9           H        ASN   9  -5.574 -10.818   5.897
   56    HA   ASN   9           HA       ASN   9  -5.613 -13.019   7.466
   57   1HB   ASN   9          1HB       ASN   9  -8.109 -12.821   6.192
   58   2HB   ASN   9          2HB       ASN   9  -7.229 -13.982   5.186
   59   1HD2  ASN   9          1HD2      ASN   9  -5.734 -15.414   6.771
   60   2HD2  ASN   9          2HD2      ASN   9  -6.623 -16.244   8.004
   61    H    GLN  10           H        GLN  10  -5.577 -11.525   4.237
   62    HA   GLN  10           HA       GLN  10  -4.315 -13.522   2.825
   63   1HB   GLN  10          1HB       GLN  10  -5.374 -11.329   2.004
   64   2HB   GLN  10          2HB       GLN  10  -3.826 -10.553   2.389
   65   1HG   GLN  10          1HG       GLN  10  -3.327 -12.979   0.903
   66   2HG   GLN  10          2HG       GLN  10  -4.543 -12.030   0.035
   67   1HE2  GLN  10          1HE2      GLN  10  -4.032  -9.602   0.028
   68   2HE2  GLN  10          2HE2      GLN  10  -2.416  -9.151  -0.403
   69    H    CYS  11           H        CYS  11  -3.068 -11.100   5.123
   70    HA   CYS  11           HA       CYS  11  -0.376 -11.295   4.427
   71   1HB   CYS  11          1HB       CYS  11  -1.242  -9.488   5.770
   72   2HB   CYS  11          2HB       CYS  11  -1.679 -10.603   7.067
   73    H    ALA  12           H        ALA  12  -2.539 -13.641   5.561
   74    HA   ALA  12           HA       ALA  12  -0.434 -15.095   6.995
   75   1HB   ALA  12          1HB       ALA  12  -2.065 -15.671   8.428
   76   2HB   ALA  12          2HB       ALA  12  -3.182 -14.616   7.531
   77   3HB   ALA  12          3HB       ALA  12  -3.042 -16.337   7.098
   78    H    VAL  13           H        VAL  13  -0.823 -14.655   3.973
   79    HA   VAL  13           HA       VAL  13  -1.859 -16.761   2.654
   80    HB   VAL  13           HB       VAL  13   0.382 -16.396   1.228
   81   1HG1  VAL  13          1HG1      VAL  13  -1.732 -15.868   0.309
   82   2HG1  VAL  13          2HG1      VAL  13  -2.030 -14.590   1.513
   83   3HG1  VAL  13          3HG1      VAL  13  -0.802 -14.351   0.246
   84   1HG2  VAL  13          1HG2      VAL  13   1.464 -14.356   1.584
   85   2HG2  VAL  13          2HG2      VAL  13   0.168 -13.739   2.639
   86   3HG2  VAL  13          3HG2      VAL  13   1.269 -15.005   3.230
   87    HA   PRO  14           HA       PRO  14   0.445 -20.298   3.580
   88   1HB   PRO  14          1HB       PRO  14   0.706 -21.596   1.191
   89   2HB   PRO  14          2HB       PRO  14  -0.774 -21.623   2.145
   90   1HG   PRO  14          1HG       PRO  14  -0.120 -20.100  -0.295
   91   2HG   PRO  14          2HG       PRO  14  -1.741 -20.497   0.381
   92   1HD   PRO  14          1HD       PRO  14  -0.346 -17.997   0.451
   93   2HD   PRO  14          2HD       PRO  14  -1.865 -18.380   1.269
   94    H    ALA  15           H        ALA  15   1.869 -17.808   2.149
   95    HA   ALA  15           HA       ALA  15   4.035 -17.237   2.211
   96   1HB   ALA  15          1HB       ALA  15   5.205 -19.943   2.439
   97   2HB   ALA  15          2HB       ALA  15   5.504 -18.482   3.409
   98   3HB   ALA  15          3HB       ALA  15   4.096 -19.512   3.763
   99    H    LYS  16           H        LYS  16   2.647 -17.460  -0.119
  100    HA   LYS  16           HA       LYS  16   4.581 -17.641  -2.034
  101   1HB   LYS  16          1HB       LYS  16   3.541 -19.867  -3.108
  102   2HB   LYS  16          2HB       LYS  16   4.993 -19.865  -2.091
  103   1HG   LYS  16          1HG       LYS  16   3.920 -20.881  -0.343
  104   2HG   LYS  16          2HG       LYS  16   2.393 -20.030  -0.632
  105   1HD   LYS  16          1HD       LYS  16   1.678 -22.055  -1.385
  106   2HD   LYS  16          2HD       LYS  16   2.547 -21.629  -2.870
  107   1HE   LYS  16          1HE       LYS  16   4.301 -23.068  -2.407
  108   2HE   LYS  16          2HE       LYS  16   4.130 -22.903  -0.653
  109   1HZ   LYS  16          1HZ       LYS  16   3.426 -25.058  -1.607
  110   2HZ   LYS  16          2HZ       LYS  16   2.276 -24.324  -0.710
  111   3HZ   LYS  16          3HZ       LYS  16   2.178 -24.302  -2.339
  112    H    ASP  17           H        ASP  17   2.522 -15.905  -1.351
  113    HA   ASP  17           HA       ASP  17   1.053 -15.983  -3.813
  114   1HB   ASP  17          1HB       ASP  17  -0.419 -17.164  -2.196
  115   2HB   ASP  17          2HB       ASP  17  -0.335 -15.776  -1.099
  116    H    ARG  18           H        ARG  18   3.111 -14.452  -1.884
  117    HA   ARG  18           HA       ARG  18   1.730 -11.939  -1.680
  118   1HB   ARG  18          1HB       ARG  18   4.631 -12.541  -0.973
  119   2HB   ARG  18          2HB       ARG  18   3.641 -11.201  -0.369
  120   1HG   ARG  18          1HG       ARG  18   2.627 -12.506   1.203
  121   2HG   ARG  18          2HG       ARG  18   2.515 -13.910   0.126
  122   1HD   ARG  18          1HD       ARG  18   4.902 -14.403   0.508
  123   2HD   ARG  18          2HD       ARG  18   5.063 -12.965   1.528
  124    HE   ARG  18           HE       ARG  18   3.031 -14.986   2.310
  125   1HH1  ARG  18          1HH1      ARG  18   6.197 -13.555   2.865
  126   2HH1  ARG  18          2HH1      ARG  18   6.358 -14.216   4.458
  127   1HH2  ARG  18          1HH2      ARG  18   3.243 -15.859   4.412
  128   2HH2  ARG  18          2HH2      ARG  18   4.666 -15.535   5.344
  129    H    VAL  19           H        VAL  19   3.297  -9.925  -2.290
  130    HA   VAL  19           HA       VAL  19   4.224 -10.480  -5.019
  131    HB   VAL  19           HB       VAL  19   3.520  -7.777  -3.908
  132   1HG1  VAL  19          1HG1      VAL  19   2.720  -7.940  -6.553
  133   2HG1  VAL  19          2HG1      VAL  19   4.243  -7.233  -5.961
  134   3HG1  VAL  19          3HG1      VAL  19   4.203  -8.923  -6.518
  135   1HG2  VAL  19          1HG2      VAL  19   1.553  -9.704  -5.189
  136   2HG2  VAL  19          2HG2      VAL  19   1.613  -9.306  -3.455
  137   3HG2  VAL  19          3HG2      VAL  19   1.224  -8.041  -4.645
  138    H    ASP  20           H        ASP  20   5.644 -10.818  -2.306
  139    HA   ASP  20           HA       ASP  20   7.467 -10.123  -1.263
  140   1HB   ASP  20          1HB       ASP  20   8.618 -11.565  -2.659
  141   2HB   ASP  20          2HB       ASP  20   8.134 -10.706  -4.130
  142    H    CYS  21           H        CYS  21   6.922  -7.908  -0.624
  143    HA   CYS  21           HA       CYS  21   6.886  -5.701  -2.175
  144   1HB   CYS  21          1HB       CYS  21   6.662  -6.189   0.468
  145   2HB   CYS  21          2HB       CYS  21   8.215  -5.346   0.445
  146    H    GLY  22           H        GLY  22   9.679  -7.565  -0.947
  147   1HA   GLY  22          1HA       GLY  22  11.899  -7.371  -1.271
  148   2HA   GLY  22          2HA       GLY  22  11.462  -6.859  -2.889
  149    H    TYR  23           H        TYR  23  11.389  -5.452   0.471
  150    HA   TYR  23           HA       TYR  23  12.122  -2.874  -0.660
  151   1HB   TYR  23          1HB       TYR  23  10.751  -4.061   1.665
  152   2HB   TYR  23          2HB       TYR  23  11.973  -2.910   2.215
  153    HD1  TYR  23           HD1      TYR  23   8.717  -3.340   0.657
  154    HD2  TYR  23           HD2      TYR  23  11.819  -0.514   1.488
  155    HE1  TYR  23           HE1      TYR  23   7.106  -1.427   0.196
  156    HE2  TYR  23           HE2      TYR  23  10.199   1.390   1.026
  157    HH   TYR  23           HH       TYR  23   6.795   0.783   0.548
  158    HA   PRO  24           HA       PRO  24  16.270  -3.284   0.525
  159   1HB   PRO  24          1HB       PRO  24  17.044  -0.668   0.404
  160   2HB   PRO  24          2HB       PRO  24  16.932  -1.706  -1.015
  161   1HG   PRO  24          1HG       PRO  24  15.115   0.416  -0.068
  162   2HG   PRO  24          2HG       PRO  24  15.258  -0.286  -1.721
  163   1HD   PRO  24          1HD       PRO  24  13.230  -0.757   0.245
  164   2HD   PRO  24          2HD       PRO  24  13.412  -1.592  -1.303
  165    H    HIS  25           H        HIS  25  13.937  -1.859   2.400
  166    HA   HIS  25           HA       HIS  25  15.859  -1.743   4.609
  167   1HB   HIS  25          1HB       HIS  25  14.005   0.260   3.623
  168   2HB   HIS  25          2HB       HIS  25  13.690  -0.128   5.318
  169    HD1  HIS  25           HD1      HIS  25  15.018   1.242   6.922
  170    HD2  HIS  25           HD2      HIS  25  16.969   0.816   3.234
  171    HE1  HIS  25           HE1      HIS  25  17.161   2.617   7.084
  172    HE2  HIS  25           HE2      HIS  25  18.344   2.272   4.809
  173    H    VAL  26           H        VAL  26  13.903  -3.835   3.327
  174    HA   VAL  26           HA       VAL  26  11.713  -4.339   4.777
  175    HB   VAL  26           HB       VAL  26  12.267  -5.791   3.041
  176   1HG1  VAL  26          1HG1      VAL  26  14.587  -7.206   4.054
  177   2HG1  VAL  26          2HG1      VAL  26  14.350  -6.379   2.495
  178   3HG1  VAL  26          3HG1      VAL  26  14.917  -5.463   3.913
  179   1HG2  VAL  26          1HG2      VAL  26  11.707  -7.812   3.941
  180   2HG2  VAL  26          2HG2      VAL  26  12.950  -7.721   5.212
  181   3HG2  VAL  26          3HG2      VAL  26  11.434  -6.802   5.380
  182    H    THR  27           H        THR  27  11.175  -4.627   6.883
  183    HA   THR  27           HA       THR  27  12.852  -5.997   8.701
  184    HB   THR  27           HB       THR  27  13.407  -3.184   8.290
  185    HG1  THR  27           HG1      THR  27  15.187  -4.061   9.297
  186   1HG2  THR  27          1HG2      THR  27  12.086  -3.955  10.922
  187   2HG2  THR  27          2HG2      THR  27  13.398  -2.754  10.891
  188   3HG2  THR  27          3HG2      THR  27  11.895  -2.453   9.986
  189    HA   PRO  28           HA       PRO  28   9.056  -6.268  10.678
  190   1HB   PRO  28          1HB       PRO  28   9.788  -6.973  13.213
  191   2HB   PRO  28          2HB       PRO  28   9.724  -8.119  11.876
  192   1HG   PRO  28          1HG       PRO  28  12.046  -6.825  13.155
  193   2HG   PRO  28          2HG       PRO  28  12.005  -8.317  12.149
  194   1HD   PRO  28          1HD       PRO  28  12.910  -5.700  11.417
  195   2HD   PRO  28          2HD       PRO  28  12.740  -7.096  10.344
  196    H    LYS  29           H        LYS  29   9.450  -3.702  10.224
  197    HA   LYS  29           HA       LYS  29   7.938  -2.481  12.157
  198   1HB   LYS  29          1HB       LYS  29  10.319  -2.964  13.325
  199   2HB   LYS  29          2HB       LYS  29  10.648  -1.371  12.621
  200   1HG   LYS  29          1HG       LYS  29   9.543  -0.458  14.357
  201   2HG   LYS  29          2HG       LYS  29   8.049  -1.185  13.742
  202   1HD   LYS  29          1HD       LYS  29   7.973  -2.543  15.534
  203   2HD   LYS  29          2HD       LYS  29   9.547  -3.233  15.105
  204   1HE   LYS  29          1HE       LYS  29   9.713  -0.546  16.330
  205   2HE   LYS  29          2HE       LYS  29   8.996  -1.760  17.400
  206   1HZ   LYS  29          1HZ       LYS  29  11.311  -2.654  15.996
  207   2HZ   LYS  29          2HZ       LYS  29  11.611  -1.405  17.003
  208   3HZ   LYS  29          3HZ       LYS  29  10.944  -2.778  17.582
  209    H    GLU  30           H        GLU  30  10.146  -2.548   9.474
  210    HA   GLU  30           HA       GLU  30   9.491   0.201   8.828
  211   1HB   GLU  30          1HB       GLU  30  11.728  -1.607   8.273
  212   2HB   GLU  30          2HB       GLU  30  11.158  -0.794   6.804
  213   1HG   GLU  30          1HG       GLU  30  12.832   0.624   7.776
  214   2HG   GLU  30          2HG       GLU  30  11.279   1.401   8.114
  215    H    CYS  31           H        CYS  31   9.280  -3.176   7.563
  216    HA   CYS  31           HA       CYS  31   8.139  -2.612   5.131
  217   1HB   CYS  31          1HB       CYS  31   7.886  -4.965   6.988
  218   2HB   CYS  31          2HB       CYS  31   7.070  -4.925   5.422
  219    H    ASN  32           H        ASN  32   6.574  -3.306   8.342
  220    HA   ASN  32           HA       ASN  32   3.990  -2.902   7.385
  221   1HB   ASN  32          1HB       ASN  32   5.345  -3.254  10.008
  222   2HB   ASN  32          2HB       ASN  32   3.843  -2.323  10.104
  223   1HD2  ASN  32          1HD2      ASN  32   5.099  -5.141   8.312
  224   2HD2  ASN  32          2HD2      ASN  32   3.759  -6.199   8.602
  225    H    ASN  33           H        ASN  33   6.543  -0.748   7.645
  226    HA   ASN  33           HA       ASN  33   4.892   1.448   8.568
  227   1HB   ASN  33          1HB       ASN  33   7.417   0.887   9.260
  228   2HB   ASN  33          2HB       ASN  33   7.797   1.767   7.771
  229   1HD2  ASN  33          1HD2      ASN  33   8.869   3.160   9.385
  230   2HD2  ASN  33          2HD2      ASN  33   7.966   4.444  10.117
  231    H    ARG  34           H        ARG  34   6.641   0.058   5.779
  232    HA   ARG  34           HA       ARG  34   6.325   2.408   4.209
  233   1HB   ARG  34          1HB       ARG  34   6.995  -0.363   3.158
  234   2HB   ARG  34          2HB       ARG  34   7.503   1.202   2.498
  235   1HG   ARG  34          1HG       ARG  34   8.395   1.040   5.223
  236   2HG   ARG  34          2HG       ARG  34   8.855  -0.469   4.418
  237   1HD   ARG  34          1HD       ARG  34  10.464   0.577   3.216
  238   2HD   ARG  34          2HD       ARG  34   9.361   1.867   2.712
  239    HE   ARG  34           HE       ARG  34   9.918   2.431   5.381
  240   1HH1  ARG  34          1HH1      ARG  34  11.867   1.947   2.491
  241   2HH1  ARG  34          2HH1      ARG  34  13.144   2.990   3.024
  242   1HH2  ARG  34          1HH2      ARG  34  11.601   3.806   6.083
  243   2HH2  ARG  34          2HH2      ARG  34  12.991   4.055   5.080
  244    H    GLY  35           H        GLY  35   4.514  -0.506   4.957
  245   1HA   GLY  35          1HA       GLY  35   2.131  -0.331   4.419
  246   2HA   GLY  35          2HA       GLY  35   2.597   0.136   2.795
  247    H    CYS  36           H        CYS  36   4.511  -2.291   4.536
  248    HA   CYS  36           HA       CYS  36   3.331  -4.320   2.780
  249   1HB   CYS  36          1HB       CYS  36   6.161  -4.232   3.828
  250   2HB   CYS  36          2HB       CYS  36   5.480  -5.424   2.718
  251    H    CYS  37           H        CYS  37   4.087  -6.648   3.869
  252    HA   CYS  37           HA       CYS  37   3.417  -6.413   6.713
  253   1HB   CYS  37          1HB       CYS  37   1.597  -7.275   5.093
  254   2HB   CYS  37          2HB       CYS  37   2.557  -8.757   5.040
  255    H    PHE  38           H        PHE  38   4.952  -7.358   8.029
  256    HA   PHE  38           HA       PHE  38   7.086  -8.813   6.720
  257   1HB   PHE  38          1HB       PHE  38   7.366  -6.917   8.421
  258   2HB   PHE  38          2HB       PHE  38   6.610  -7.952   9.636
  259    HD1  PHE  38           HD1      PHE  38   7.857  -9.678  10.712
  260    HD2  PHE  38           HD2      PHE  38   9.587  -7.494   7.511
  261    HE1  PHE  38           HE1      PHE  38  10.108 -10.636  11.274
  262    HE2  PHE  38           HE2      PHE  38  11.837  -8.453   8.073
  263    HZ   PHE  38           HZ       PHE  38  12.071 -10.013   9.948
  264    H    ASP  39           H        ASP  39   7.178 -11.006   6.662
  265    HA   ASP  39           HA       ASP  39   5.280 -12.438   8.268
  266   1HB   ASP  39          1HB       ASP  39   5.471 -13.139   5.977
  267   2HB   ASP  39          2HB       ASP  39   7.237 -13.221   6.070
  268    H    SER  40           H        SER  40   8.635 -13.415   7.306
  269    HA   SER  40           HA       SER  40  10.455 -13.687   8.554
  270   1HB   SER  40          1HB       SER  40   9.200 -12.159  10.323
  271   2HB   SER  40          2HB       SER  40   8.972 -13.694  11.182
  272    HG   SER  40           HG       SER  40  11.529 -12.694  10.261
  273    H    ARG  41           H        ARG  41   7.386 -15.309   8.863
  274    HA   ARG  41           HA       ARG  41   7.974 -17.463  10.381
  275   1HB   ARG  41          1HB       ARG  41   6.296 -17.213   7.853
  276   2HB   ARG  41          2HB       ARG  41   6.301 -18.689   8.834
  277   1HG   ARG  41          1HG       ARG  41   5.890 -16.759  10.750
  278   2HG   ARG  41          2HG       ARG  41   5.052 -16.039   9.364
  279   1HD   ARG  41          1HD       ARG  41   3.303 -17.356   9.970
  280   2HD   ARG  41          2HD       ARG  41   4.221 -18.699   9.272
  281    HE   ARG  41           HE       ARG  41   5.090 -18.233  11.970
  282   1HH1  ARG  41          1HH1      ARG  41   2.346 -19.511  10.174
  283   2HH1  ARG  41          2HH1      ARG  41   1.845 -20.574  11.447
  284   1HH2  ARG  41          1HH2      ARG  41   4.429 -19.635  13.649
  285   2HH2  ARG  41          2HH2      ARG  41   3.037 -20.644  13.437
  286    H    ILE  42           H        ILE  42   8.367 -17.150   6.771
  287    HA   ILE  42           HA       ILE  42  10.317 -19.344   6.935
  288    HB   ILE  42           HB       ILE  42   9.095 -18.763   4.327
  289   1HG1  ILE  42          1HG1      ILE  42   7.429 -19.837   6.609
  290   2HG1  ILE  42          2HG1      ILE  42   7.113 -18.386   5.642
  291   1HG2  ILE  42          1HG2      ILE  42   9.695 -20.874   3.920
  292   2HG2  ILE  42          2HG2      ILE  42  10.587 -20.785   5.458
  293   3HG2  ILE  42          3HG2      ILE  42   8.946 -21.474   5.420
  294   1HD1  ILE  42          1HD1      ILE  42   7.111 -21.277   4.663
  295   2HD1  ILE  42          2HD1      ILE  42   5.694 -20.216   4.849
  296   3HD1  ILE  42          3HD1      ILE  42   6.916 -19.857   3.606
  297    HA   PRO  43           HA       PRO  43  13.083 -16.242   5.663
  298   1HB   PRO  43          1HB       PRO  43  15.333 -17.785   5.554
  299   2HB   PRO  43          2HB       PRO  43  14.740 -17.050   7.041
  300   1HG   PRO  43          1HG       PRO  43  14.572 -19.844   6.105
  301   2HG   PRO  43          2HG       PRO  43  14.408 -19.209   7.782
  302   1HD   PRO  43          1HD       PRO  43  12.347 -20.123   6.015
  303   2HD   PRO  43          2HD       PRO  43  12.121 -19.359   7.594
  304    H    GLY  44           H        GLY  44  12.108 -18.924   3.906
  305   1HA   GLY  44          1HA       GLY  44  13.693 -18.190   1.564
  306   2HA   GLY  44          2HA       GLY  44  12.647 -19.583   1.751
  307    H    VAL  45           H        VAL  45  10.761 -17.249   3.066
  308    HA   VAL  45           HA       VAL  45   9.543 -16.636   0.467
  309    HB   VAL  45           HB       VAL  45   8.514 -17.861   2.726
  310   1HG1  VAL  45          1HG1      VAL  45   7.652 -14.956   2.652
  311   2HG1  VAL  45          2HG1      VAL  45   6.714 -16.240   3.452
  312   3HG1  VAL  45          3HG1      VAL  45   8.359 -15.856   4.015
  313   1HG2  VAL  45          1HG2      VAL  45   6.324 -16.807   1.288
  314   2HG2  VAL  45          2HG2      VAL  45   7.642 -17.007   0.109
  315   3HG2  VAL  45          3HG2      VAL  45   7.102 -18.395   1.085
  316    HA   PRO  46           HA       PRO  46  10.012 -12.403   1.212
  317   1HB   PRO  46          1HB       PRO  46   7.653 -11.277   0.417
  318   2HB   PRO  46          2HB       PRO  46   8.901 -11.801  -0.713
  319   1HG   PRO  46          1HG       PRO  46   6.340 -13.074   0.009
  320   2HG   PRO  46          2HG       PRO  46   7.353 -13.343  -1.454
  321   1HD   PRO  46          1HD       PRO  46   7.062 -15.027   0.844
  322   2HD   PRO  46          2HD       PRO  46   8.193 -15.256  -0.497
  323    H    TRP  47           H        TRP  47  10.446 -11.724   3.217
  324    HA   TRP  47           HA       TRP  47   8.273 -11.867   5.121
  325   1HB   TRP  47          1HB       TRP  47  10.644 -10.586   6.111
  326   2HB   TRP  47          2HB       TRP  47   9.879 -12.094   6.616
  327    HD1  TRP  47           HD1      TRP  47  10.831 -14.382   5.397
  328    HE1  TRP  47           HE1      TRP  47  13.128 -15.014   4.262
  329    HE3  TRP  47           HE3      TRP  47  12.438  -9.599   4.769
  330    HZ2  TRP  47           HZ2      TRP  47  15.310 -13.477   3.251
  331    HZ3  TRP  47           HZ3      TRP  47  14.663  -9.252   3.699
  332    HH2  TRP  47           HH2      TRP  47  16.083 -11.095   2.951
  333    H    CYS  48           H        CYS  48   8.060 -10.083   2.744
  334    HA   CYS  48           HA       CYS  48   7.221  -7.771   4.116
  335   1HB   CYS  48          1HB       CYS  48   9.700  -7.390   4.001
  336   2HB   CYS  48          2HB       CYS  48   9.548  -7.321   2.243
  337    H    PHE  49           H        PHE  49   5.240  -7.899   3.057
  338    HA   PHE  49           HA       PHE  49   5.321  -7.512   0.179
  339   1HB   PHE  49          1HB       PHE  49   3.270  -9.276   0.348
  340   2HB   PHE  49          2HB       PHE  49   4.928  -9.844   0.123
  341    HD1  PHE  49           HD1      PHE  49   6.239 -10.237   2.396
  342    HD2  PHE  49           HD2      PHE  49   2.013 -10.215   2.021
  343    HE1  PHE  49           HE1      PHE  49   6.046 -11.586   4.504
  344    HE2  PHE  49           HE2      PHE  49   1.818 -11.564   4.129
  345    HZ   PHE  49           HZ       PHE  49   3.837 -12.234   5.344
  346    H    LYS  50           H        LYS  50   2.632  -7.585  -0.409
  347    HA   LYS  50           HA       LYS  50   1.487  -5.690   1.523
  348   1HB   LYS  50          1HB       LYS  50   0.333  -4.962  -0.814
  349   2HB   LYS  50          2HB       LYS  50   1.771  -4.187  -0.126
  350   1HG   LYS  50          1HG       LYS  50   2.190  -6.634  -1.802
  351   2HG   LYS  50          2HG       LYS  50   1.691  -5.162  -2.653
  352   1HD   LYS  50          1HD       LYS  50   4.133  -5.561  -0.882
  353   2HD   LYS  50          2HD       LYS  50   4.119  -5.219  -2.620
  354   1HE   LYS  50          1HE       LYS  50   3.543  -3.388  -0.292
  355   2HE   LYS  50          2HE       LYS  50   4.589  -3.105  -1.691
  356   1HZ   LYS  50          1HZ       LYS  50   2.809  -1.918  -2.313
  357   2HZ   LYS  50          2HZ       LYS  50   2.259  -3.354  -2.865
  358   3HZ   LYS  50          3HZ       LYS  50   1.739  -2.779  -1.428
  359    HA   PRO  51           HA       PRO  51  -1.267  -9.243   1.026
  360   1HB   PRO  51          1HB       PRO  51  -1.552  -9.845   3.675
  361   2HB   PRO  51          2HB       PRO  51  -0.377 -10.637   2.628
  362   1HG   PRO  51          1HG       PRO  51   0.011  -8.540   4.666
  363   2HG   PRO  51          2HG       PRO  51   1.230  -9.665   3.966
  364   1HD   PRO  51          1HD       PRO  51   0.847  -6.882   3.409
  365   2HD   PRO  51          2HD       PRO  51   1.954  -7.982   2.577
  366    H    LEU  52           H        LEU  52  -2.209  -8.318   4.179
  367    HA   LEU  52           HA       LEU  52  -4.608  -7.166   2.999
  368   1HB   LEU  52          1HB       LEU  52  -5.696  -7.673   4.949
  369   2HB   LEU  52          2HB       LEU  52  -4.575  -9.030   4.749
  370    HG   LEU  52           HG       LEU  52  -3.182  -7.187   6.318
  371   1HD1  LEU  52          1HD1      LEU  52  -6.034  -6.760   6.643
  372   2HD1  LEU  52          2HD1      LEU  52  -5.274  -7.300   8.159
  373   3HD1  LEU  52          3HD1      LEU  52  -4.657  -5.858   7.319
  374   1HD2  LEU  52          1HD2      LEU  52  -3.945  -9.873   6.386
  375   2HD2  LEU  52          2HD2      LEU  52  -2.825  -9.041   7.491
  376   3HD2  LEU  52          3HD2      LEU  52  -4.547  -9.187   7.913
  377    H    GLN  53           H        GLN  53  -2.070  -5.717   2.824
  378    HA   GLN  53           HA       GLN  53  -1.677  -3.900   4.798
  379   1HB   GLN  53          1HB       GLN  53  -1.457  -3.524   1.788
  380   2HB   GLN  53          2HB       GLN  53  -0.738  -2.430   2.984
  381   1HG   GLN  53          1HG       GLN  53  -0.119  -5.392   2.611
  382   2HG   GLN  53          2HG       GLN  53   0.944  -4.044   2.178
  383   1HE2  GLN  53          1HE2      GLN  53  -0.332  -6.059   4.671
  384   2HE2  GLN  53          2HE2      GLN  53   0.635  -5.495   5.993
  385    H    GLU  54           H        GLU  54  -4.435  -4.256   2.711
  386    HA   GLU  54           HA       GLU  54  -5.368  -1.825   2.244
  387   1HB   GLU  54          1HB       GLU  54  -6.970  -3.266   1.581
  388   2HB   GLU  54          2HB       GLU  54  -6.569  -4.445   2.841
  389   1HG   GLU  54          1HG       GLU  54  -8.048  -1.879   3.491
  390   2HG   GLU  54          2HG       GLU  54  -8.922  -3.299   2.895
  391    H    ALA  55           H        ALA  55  -4.863  -3.272   5.422
  392    HA   ALA  55           HA       ALA  55  -6.523  -2.066   7.104
  393   1HB   ALA  55          1HB       ALA  55  -3.988  -1.609   8.251
  394   2HB   ALA  55          2HB       ALA  55  -5.003  -3.060   8.430
  395   3HB   ALA  55          3HB       ALA  55  -3.765  -2.992   7.152
  396    H    GLU  56           H        GLU  56  -3.362  -0.423   6.415
  397    HA   GLU  56           HA       GLU  56  -4.886   2.058   6.281
  398   1HB   GLU  56          1HB       GLU  56  -3.375   1.438   8.429
  399   2HB   GLU  56          2HB       GLU  56  -2.114   2.156   7.414
  400   1HG   GLU  56          1HG       GLU  56  -3.904   4.068   7.060
  401   2HG   GLU  56          2HG       GLU  56  -4.622   3.422   8.544
  402    H    CYS  57           H        CYS  57  -3.779   0.145   4.206
  403    HA   CYS  57           HA       CYS  57  -1.747   1.882   3.027
  404   1HB   CYS  57          1HB       CYS  57  -1.398  -0.644   3.413
  405   2HB   CYS  57          2HB       CYS  57  -2.461  -0.860   2.021
  406    H    THR  58           H        THR  58  -4.728  -0.060   2.262
  407    HA   THR  58           HA       THR  58  -5.132   1.444  -0.175
  408    HB   THR  58           HB       THR  58  -5.570  -1.126   0.398
  409    HG1  THR  58           HG1      THR  58  -7.422  -0.829  -1.203
  410   1HG2  THR  58          1HG2      THR  58  -7.837  -1.612   1.058
  411   2HG2  THR  58          2HG2      THR  58  -7.246  -0.453   2.273
  412   3HG2  THR  58          3HG2      THR  58  -8.309   0.101   0.957
  413    H    PHE  59           H        PHE  59  -6.347   1.377   3.169
  414    HA   PHE  59           HA       PHE  59  -8.688   2.569   3.124
  415   1HB   PHE  59          1HB       PHE  59  -7.220   2.153   5.121
  416   2HB   PHE  59          2HB       PHE  59  -6.173   3.493   4.640
  417    HD1  PHE  59           HD1      PHE  59  -6.436   5.412   5.871
  418    HD2  PHE  59           HD2      PHE  59  -9.824   2.934   5.245
  419    HE1  PHE  59           HE1      PHE  59  -7.836   6.978   7.246
  420    HE2  PHE  59           HE2      PHE  59 -11.224   4.501   6.620
  421    HZ   PHE  59           HZ       PHE  59 -10.212   6.503   7.603
  422   1H    GLU   1           H1       GLU   1 -19.637   5.431   3.997
  423    HA   GLU   1           HA       GLU   1 -19.321   6.631   1.821
  424   1HB   GLU   1          1HB       GLU   1 -16.524   6.523   2.957
  425   2HB   GLU   1          2HB       GLU   1 -16.771   6.545   1.203
  426   1HG   GLU   1          1HG       GLU   1 -18.456   8.567   2.088
  427   2HG   GLU   1          2HG       GLU   1 -17.087   8.711   3.199
  428    H    GLU   2           H        GLU   2 -19.138   5.227  -0.011
  429    HA   GLU   2           HA       GLU   2 -18.975   2.466   0.771
  430   1HB   GLU   2          1HB       GLU   2 -19.716   3.736  -1.893
  431   2HB   GLU   2          2HB       GLU   2 -19.906   2.022  -1.485
  432   1HG   GLU   2          1HG       GLU   2 -21.167   4.169   0.235
  433   2HG   GLU   2          2HG       GLU   2 -21.967   3.648  -1.255
  434    H    TYR   3           H        TYR   3 -18.284   2.435  -2.470
  435    HA   TYR   3           HA       TYR   3 -15.481   1.900  -1.935
  436   1HB   TYR   3          1HB       TYR   3 -15.826   1.269  -4.510
  437   2HB   TYR   3          2HB       TYR   3 -16.566   0.236  -3.283
  438    HD1  TYR   3           HD1      TYR   3 -17.172   2.728  -5.917
  439    HD2  TYR   3           HD2      TYR   3 -18.990   0.244  -2.946
  440    HE1  TYR   3           HE1      TYR   3 -19.450   3.110  -6.980
  441    HE2  TYR   3           HE2      TYR   3 -21.262   0.635  -4.020
  442    HH   TYR   3           HH       TYR   3 -21.566   2.719  -6.885
  443    H    VAL   4           H        VAL   4 -14.951   4.230  -1.545
  444    HA   VAL   4           HA       VAL   4 -14.471   5.536  -4.125
  445    HB   VAL   4           HB       VAL   4 -14.903   7.708  -2.955
  446   1HG1  VAL   4          1HG1      VAL   4 -17.229   7.693  -3.405
  447   2HG1  VAL   4          2HG1      VAL   4 -16.523   6.476  -4.497
  448   3HG1  VAL   4          3HG1      VAL   4 -17.374   5.960  -3.021
  449   1HG2  VAL   4          1HG2      VAL   4 -16.601   7.376  -0.975
  450   2HG2  VAL   4          2HG2      VAL   4 -15.761   5.819  -0.782
  451   3HG2  VAL   4          3HG2      VAL   4 -14.848   7.342  -0.671
  452    H    GLY   5           H        GLY   5 -13.736   5.654  -0.564
  453   1HA   GLY   5          1HA       GLY   5 -11.164   6.793  -0.938
  454   2HA   GLY   5          2HA       GLY   5 -11.804   6.063   0.521
  455    H    LEU   6           H        LEU   6 -12.209   3.865  -2.049
  456    HA   LEU   6           HA       LEU   6  -9.542   2.794  -1.981
  457   1HB   LEU   6          1HB       LEU   6 -10.576   0.537  -1.219
  458   2HB   LEU   6          2HB       LEU   6 -10.015   1.730  -0.033
  459    HG   LEU   6           HG       LEU   6 -12.168   0.614   0.537
  460   1HD1  LEU   6          1HD1      LEU   6 -11.405   3.072   1.128
  461   2HD1  LEU   6          2HD1      LEU   6 -12.827   3.504   0.148
  462   3HD1  LEU   6          3HD1      LEU   6 -13.016   2.465   1.581
  463   1HD2  LEU   6          1HD2      LEU   6 -13.420   2.240  -1.680
  464   2HD2  LEU   6          2HD2      LEU   6 -12.956   0.534  -1.877
  465   3HD2  LEU   6          3HD2      LEU   6 -14.168   0.991  -0.656
  466    H    SER   7           H        SER   7 -11.731   3.905  -3.819
  467    HA   SER   7           HA       SER   7 -12.055   1.513  -5.448
  468   1HB   SER   7          1HB       SER   7 -14.203   2.327  -5.203
  469   2HB   SER   7          2HB       SER   7 -13.678   4.016  -5.077
  470    HG   SER   7           HG       SER   7 -13.775   4.231  -7.228
  471    H    ALA   8           H        ALA   8 -11.564   1.659  -7.760
  472    HA   ALA   8           HA       ALA   8  -9.225   3.076  -8.309
  473   1HB   ALA   8          1HB       ALA   8 -10.811   1.056  -9.482
  474   2HB   ALA   8          2HB       ALA   8 -10.717   2.355 -10.695
  475   3HB   ALA   8          3HB       ALA   8  -9.225   1.641 -10.038
  476    H    ASN   9           H        ASN   9  -9.587   5.299  -7.747
  477    HA   ASN   9           HA       ASN   9 -10.149   6.932  -9.810
  478   1HB   ASN   9          1HB       ASN   9 -12.593   5.895  -8.799
  479   2HB   ASN   9          2HB       ASN   9 -12.499   7.546  -8.166
  480   1HD2  ASN   9          1HD2      ASN   9 -11.610   9.148  -9.869
  481   2HD2  ASN   9          2HD2      ASN   9 -12.359   9.095 -11.429
  482    H    GLN  10           H        GLN  10 -10.184   6.186  -6.351
  483    HA   GLN  10           HA       GLN  10 -10.259   8.738  -5.317
  484   1HB   GLN  10          1HB       GLN  10 -10.218   6.264  -4.259
  485   2HB   GLN  10          2HB       GLN  10  -8.524   6.696  -3.971
  486   1HG   GLN  10          1HG       GLN  10  -9.857   8.990  -3.186
  487   2HG   GLN  10          2HG       GLN  10 -11.000   7.729  -2.702
  488   1HE2  GLN  10          1HE2      GLN  10  -9.090   5.679  -2.257
  489   2HE2  GLN  10          2HE2      GLN  10  -8.196   6.046  -0.820
  490    H    CYS  11           H        CYS  11  -7.665   6.908  -6.898
  491    HA   CYS  11           HA       CYS  11  -5.514   8.398  -5.921
  492   1HB   CYS  11          1HB       CYS  11  -5.992   6.548  -8.195
  493   2HB   CYS  11          2HB       CYS  11  -4.572   7.593  -8.289
  494    H    ALA  12           H        ALA  12  -8.194   9.279  -7.829
  495    HA   ALA  12           HA       ALA  12  -6.680  11.497  -9.029
  496   1HB   ALA  12          1HB       ALA  12  -8.200  11.458 -10.872
  497   2HB   ALA  12          2HB       ALA  12  -7.725   9.766 -10.595
  498   3HB   ALA  12          3HB       ALA  12  -9.308  10.350 -10.030
  499    H    VAL  13           H        VAL  13  -8.063  10.998  -6.285
  500    HA   VAL  13           HA       VAL  13 -10.418  12.294  -6.017
  501    HB   VAL  13           HB       VAL  13  -8.407  11.357  -4.377
  502   1HG1  VAL  13          1HG1      VAL  13  -7.955  13.127  -2.745
  503   2HG1  VAL  13          2HG1      VAL  13  -7.330  13.572  -4.352
  504   3HG1  VAL  13          3HG1      VAL  13  -8.841  14.298  -3.752
  505   1HG2  VAL  13          1HG2      VAL  13 -11.172  12.100  -4.215
  506   2HG2  VAL  13          2HG2      VAL  13 -10.267  10.925  -3.230
  507   3HG2  VAL  13          3HG2      VAL  13 -10.346  12.632  -2.731
  508    HA   PRO  14           HA       PRO  14  -9.810  16.486  -6.876
  509   1HB   PRO  14          1HB       PRO  14 -11.252  17.798  -4.962
  510   2HB   PRO  14          2HB       PRO  14 -11.987  17.037  -6.369
  511   1HG   PRO  14          1HG       PRO  14 -11.881  16.131  -3.564
  512   2HG   PRO  14          2HG       PRO  14 -13.014  15.622  -4.866
  513   1HD   PRO  14          1HD       PRO  14 -10.779  14.192  -3.791
  514   2HD   PRO  14          2HD       PRO  14 -11.766  13.717  -5.180
  515    H    ALA  15           H        ALA  15  -7.797  15.185  -5.144
  516    HA   ALA  15           HA       ALA  15  -6.116  15.747  -3.793
  517   1HB   ALA  15          1HB       ALA  15  -5.348  18.275  -4.560
  518   2HB   ALA  15          2HB       ALA  15  -4.952  16.782  -5.444
  519   3HB   ALA  15          3HB       ALA  15  -6.348  17.767  -5.942
  520    H    LYS  16           H        LYS  16  -8.036  15.801  -2.107
  521    HA   LYS  16           HA       LYS  16  -7.445  17.722  -0.241
  522   1HB   LYS  16          1HB       LYS  16  -9.635  19.038  -0.329
  523   2HB   LYS  16          2HB       LYS  16  -8.356  19.487  -1.471
  524   1HG   LYS  16          1HG       LYS  16  -9.841  19.197  -3.139
  525   2HG   LYS  16          2HG       LYS  16  -9.872  17.465  -2.767
  526   1HD   LYS  16          1HD       LYS  16 -12.114  17.952  -2.509
  527   2HD   LYS  16          2HD       LYS  16 -11.572  18.291  -0.856
  528   1HE   LYS  16          1HE       LYS  16 -12.006  20.512  -1.064
  529   2HE   LYS  16          2HE       LYS  16 -11.283  20.603  -2.677
  530   1HZ   LYS  16          1HZ       LYS  16 -13.363  20.767  -3.359
  531   2HZ   LYS  16          2HZ       LYS  16 -13.542  19.178  -3.031
  532   3HZ   LYS  16          3HZ       LYS  16 -13.999  20.295  -1.931
  533    H    ASP  17           H        ASP  17  -7.870  14.892  -0.525
  534    HA   ASP  17           HA       ASP  17  -9.693  14.596   1.634
  535   1HB   ASP  17          1HB       ASP  17 -11.083  14.481  -0.539
  536   2HB   ASP  17          2HB       ASP  17 -10.233  12.968  -0.885
  537    H    ARG  18           H        ARG  18  -6.799  14.137   0.448
  538    HA   ARG  18           HA       ARG  18  -6.616  11.282   0.626
  539   1HB   ARG  18          1HB       ARG  18  -4.406  13.361   0.296
  540   2HB   ARG  18          2HB       ARG  18  -4.247  11.620   0.004
  541   1HG   ARG  18          1HG       ARG  18  -5.316  11.738  -2.021
  542   2HG   ARG  18          2HG       ARG  18  -6.440  13.000  -1.487
  543   1HD   ARG  18          1HD       ARG  18  -4.769  14.717  -1.784
  544   2HD   ARG  18          2HD       ARG  18  -3.479  13.526  -2.007
  545    HE   ARG  18           HE       ARG  18  -5.619  13.228  -3.960
  546   1HH1  ARG  18          1HH1      ARG  18  -2.704  15.047  -3.203
  547   2HH1  ARG  18          2HH1      ARG  18  -2.377  15.454  -4.855
  548   1HH2  ARG  18          1HH2      ARG  18  -5.187  13.764  -6.139
  549   2HH2  ARG  18          2HH2      ARG  18  -3.799  14.719  -6.536
  550    H    VAL  19           H        VAL  19  -4.321  10.663   1.918
  551    HA   VAL  19           HA       VAL  19  -4.701  11.817   4.594
  552    HB   VAL  19           HB       VAL  19  -3.567   9.100   3.945
  553   1HG1  VAL  19          1HG1      VAL  19  -3.186   9.063   6.143
  554   2HG1  VAL  19          2HG1      VAL  19  -3.988  10.638   6.354
  555   3HG1  VAL  19          3HG1      VAL  19  -4.945   9.138   6.410
  556   1HG2  VAL  19          1HG2      VAL  19  -5.670   8.807   3.027
  557   2HG2  VAL  19          2HG2      VAL  19  -5.965   8.363   4.725
  558   3HG2  VAL  19          3HG2      VAL  19  -6.437   9.974   4.131
  559    H    ASP  20           H        ASP  20  -2.970  12.660   2.176
  560    HA   ASP  20           HA       ASP  20  -0.854  13.059   1.685
  561   1HB   ASP  20          1HB       ASP  20  -1.087  15.003   2.916
  562   2HB   ASP  20          2HB       ASP  20  -1.435  14.143   4.422
  563    H    CYS  21           H        CYS  21   0.164  10.962   1.435
  564    HA   CYS  21           HA       CYS  21   0.856   9.261   3.463
  565   1HB   CYS  21          1HB       CYS  21   1.009   9.169   0.798
  566   2HB   CYS  21          2HB       CYS  21   2.714   9.462   1.152
  567    H    GLY  22           H        GLY  22   2.407  12.235   2.237
  568   1HA   GLY  22          1HA       GLY  22   4.159  13.441   2.962
  569   2HA   GLY  22          2HA       GLY  22   3.827  12.779   4.551
  570    H    TYR  23           H        TYR  23   4.996  11.285   1.445
  571    HA   TYR  23           HA       TYR  23   6.953   9.780   2.937
  572   1HB   TYR  23          1HB       TYR  23   5.393   9.493   0.635
  573   2HB   TYR  23          2HB       TYR  23   6.950   9.941  -0.068
  574    HD1  TYR  23           HD1      TYR  23   6.260   7.856   2.960
  575    HD2  TYR  23           HD2      TYR  23   7.699   7.953  -1.069
  576    HE1  TYR  23           HE1      TYR  23   7.037   5.444   3.170
  577    HE2  TYR  23           HE2      TYR  23   8.471   5.541  -0.843
  578    HH   TYR  23           HH       TYR  23   7.663   3.648   1.993
  579    HA   PRO  24           HA       PRO  24  10.188  12.576   2.196
  580   1HB   PRO  24          1HB       PRO  24  12.290  11.002   2.951
  581   2HB   PRO  24          2HB       PRO  24  11.295  11.898   4.097
  582   1HG   PRO  24          1HG       PRO  24  11.300   9.024   3.431
  583   2HG   PRO  24          2HG       PRO  24  10.652   9.834   4.902
  584   1HD   PRO  24          1HD       PRO  24   9.206   8.764   2.675
  585   2HD   PRO  24          2HD       PRO  24   8.534   9.694   4.020
  586    H    HIS  25           H        HIS  25   9.571   9.855   0.416
  587    HA   HIS  25           HA       HIS  25  11.644  10.684  -1.482
  588   1HB   HIS  25          1HB       HIS  25  11.462   8.238  -0.214
  589   2HB   HIS  25          2HB       HIS  25  10.690   7.930  -1.773
  590    HD1  HIS  25           HD1      HIS  25  13.456   6.681  -0.953
  591    HD2  HIS  25           HD2      HIS  25  12.964  10.154  -3.254
  592    HE1  HIS  25           HE1      HIS  25  15.603   6.953  -2.304
  593    HE2  HIS  25           HE2      HIS  25  15.220   9.072  -3.738
  594    H    VAL  26           H        VAL  26   8.698  11.454  -0.957
  595    HA   VAL  26           HA       VAL  26   6.901  10.430  -2.638
  596    HB   VAL  26           HB       VAL  26   6.263  12.232  -1.322
  597   1HG1  VAL  26          1HG1      VAL  26   8.277  13.351  -0.832
  598   2HG1  VAL  26          2HG1      VAL  26   8.595  13.717  -2.545
  599   3HG1  VAL  26          3HG1      VAL  26   7.287  14.562  -1.683
  600   1HG2  VAL  26          1HG2      VAL  26   4.965  13.427  -2.763
  601   2HG2  VAL  26          2HG2      VAL  26   6.327  13.830  -3.835
  602   3HG2  VAL  26          3HG2      VAL  26   5.573  12.220  -3.921
  603    H    THR  27           H        THR  27   6.901   9.815  -4.732
  604    HA   THR  27           HA       THR  27   7.798  11.555  -6.781
  605    HB   THR  27           HB       THR  27   9.760   9.775  -5.551
  606    HG1  THR  27           HG1      THR  27   9.500  11.681  -7.757
  607   1HG2  THR  27          1HG2      THR  27  10.589   9.202  -8.044
  608   2HG2  THR  27          2HG2      THR  27   9.546   8.067  -7.154
  609   3HG2  THR  27          3HG2      THR  27   8.839   9.161  -8.367
  610    HA   PRO  28           HA       PRO  28   5.076   9.012  -8.909
  611   1HB   PRO  28          1HB       PRO  28   5.679   9.639 -11.498
  612   2HB   PRO  28          2HB       PRO  28   4.662  10.649 -10.474
  613   1HG   PRO  28          1HG       PRO  28   7.474  11.001 -11.291
  614   2HG   PRO  28          2HG       PRO  28   6.323  12.238 -10.669
  615   1HD   PRO  28          1HD       PRO  28   8.496  10.978  -9.294
  616   2HD   PRO  28          2HD       PRO  28   7.294  12.070  -8.592
  617    H    LYS  29           H        LYS  29   7.013   7.485  -7.850
  618    HA   LYS  29           HA       LYS  29   6.984   5.309  -9.591
  619   1HB   LYS  29          1HB       LYS  29   8.580   6.607 -10.903
  620   2HB   LYS  29          2HB       LYS  29   9.649   6.754  -9.497
  621   1HG   LYS  29          1HG       LYS  29  10.487   4.678  -9.816
  622   2HG   LYS  29          2HG       LYS  29   8.878   3.964 -10.017
  623   1HD   LYS  29          1HD       LYS  29   8.896   4.996 -12.376
  624   2HD   LYS  29          2HD       LYS  29  10.623   5.301 -12.125
  625   1HE   LYS  29          1HE       LYS  29  11.126   2.990 -12.012
  626   2HE   LYS  29          2HE       LYS  29   9.447   2.535 -11.682
  627   1HZ   LYS  29          1HZ       LYS  29   8.946   2.662 -13.850
  628   2HZ   LYS  29          2HZ       LYS  29   9.960   3.902 -14.167
  629   3HZ   LYS  29          3HZ       LYS  29  10.541   2.381 -14.055
  630    H    GLU  30           H        GLU  30   8.040   7.093  -6.768
  631    HA   GLU  30           HA       GLU  30   8.952   4.639  -5.531
  632   1HB   GLU  30          1HB       GLU  30   9.582   7.445  -5.261
  633   2HB   GLU  30          2HB       GLU  30   9.074   6.811  -3.686
  634   1HG   GLU  30          1HG       GLU  30  11.351   6.322  -3.661
  635   2HG   GLU  30          2HG       GLU  30  10.701   4.807  -4.308
  636    H    CYS  31           H        CYS  31   6.468   7.235  -5.224
  637    HA   CYS  31           HA       CYS  31   5.320   6.297  -2.873
  638   1HB   CYS  31          1HB       CYS  31   4.311   7.973  -5.149
  639   2HB   CYS  31          2HB       CYS  31   3.250   7.521  -3.813
  640    H    ASN  32           H        ASN  32   4.365   5.833  -6.360
  641    HA   ASN  32           HA       ASN  32   2.338   4.038  -5.791
  642   1HB   ASN  32          1HB       ASN  32   3.918   4.877  -8.191
  643   2HB   ASN  32          2HB       ASN  32   3.108   3.309  -8.329
  644   1HD2  ASN  32          1HD2      ASN  32   2.445   6.542  -6.974
  645   2HD2  ASN  32          2HD2      ASN  32   0.861   6.740  -7.645
  646    H    ASN  33           H        ASN  33   5.667   3.754  -5.307
  647    HA   ASN  33           HA       ASN  33   5.715   0.932  -5.980
  648   1HB   ASN  33          1HB       ASN  33   7.645   2.115  -6.810
  649   2HB   ASN  33          2HB       ASN  33   7.887   2.960  -5.275
  650   1HD2  ASN  33          1HD2      ASN  33   9.718   2.293  -4.449
  651   2HD2  ASN  33          2HD2      ASN  33  10.246   0.654  -4.262
  652    H    ARG  34           H        ARG  34   5.746   3.324  -3.348
  653    HA   ARG  34           HA       ARG  34   6.501   1.362  -1.407
  654   1HB   ARG  34          1HB       ARG  34   6.655   3.154   0.116
  655   2HB   ARG  34          2HB       ARG  34   7.059   3.939  -1.420
  656   1HG   ARG  34          1HG       ARG  34   5.492   5.418  -0.532
  657   2HG   ARG  34          2HG       ARG  34   4.452   4.393  -1.536
  658   1HD   ARG  34          1HD       ARG  34   3.229   4.003   0.327
  659   2HD   ARG  34          2HD       ARG  34   4.590   3.056   0.947
  660    HE   ARG  34           HE       ARG  34   4.962   5.899   1.398
  661   1HH1  ARG  34          1HH1      ARG  34   3.290   3.056   2.625
  662   2HH1  ARG  34          2HH1      ARG  34   3.164   3.670   4.240
  663   1HH2  ARG  34          1HH2      ARG  34   4.796   6.710   3.528
  664   2HH2  ARG  34          2HH2      ARG  34   4.026   5.762   4.757
  665    H    GLY  35           H        GLY  35   3.600   2.998  -2.676
  666   1HA   GLY  35          1HA       GLY  35   1.603   1.496  -2.377
  667   2HA   GLY  35          2HA       GLY  35   1.943   1.606  -0.661
  668    H    CYS  36           H        CYS  36   2.659   4.413  -2.680
  669    HA   CYS  36           HA       CYS  36   0.208   5.667  -1.677
  670   1HB   CYS  36          1HB       CYS  36   2.932   6.942  -1.951
  671   2HB   CYS  36          2HB       CYS  36   1.450   7.766  -1.457
  672    H    CYS  37           H        CYS  37  -0.459   7.587  -3.098
  673    HA   CYS  37           HA       CYS  37   0.217   6.951  -5.874
  674   1HB   CYS  37          1HB       CYS  37  -2.267   7.194  -4.569
  675   2HB   CYS  37          2HB       CYS  37  -2.122   8.605  -5.619
  676    H    PHE  38           H        PHE  38   1.342   8.513  -7.005
  677    HA   PHE  38           HA       PHE  38   1.848  11.013  -5.639
  678   1HB   PHE  38          1HB       PHE  38   3.547   9.438  -6.829
  679   2HB   PHE  38          2HB       PHE  38   2.818   9.950  -8.354
  680    HD1  PHE  38           HD1      PHE  38   4.917  10.952  -5.530
  681    HD2  PHE  38           HD2      PHE  38   3.203  12.187  -9.210
  682    HE1  PHE  38           HE1      PHE  38   6.464  12.929  -5.588
  683    HE2  PHE  38           HE2      PHE  38   4.749  14.164  -9.268
  684    HZ   PHE  38           HZ       PHE  38   6.361  14.511  -7.456
  685    H    ASP  39           H        ASP  39   0.702  12.841  -6.042
  686    HA   ASP  39           HA       ASP  39  -1.158  12.828  -8.182
  687   1HB   ASP  39          1HB       ASP  39  -2.054  14.033  -6.448
  688   2HB   ASP  39          2HB       ASP  39  -0.472  14.560  -5.852
  689    H    SER  40           H        SER  40   0.957  15.604  -7.224
  690    HA   SER  40           HA       SER  40   2.571  16.644  -8.321
  691   1HB   SER  40          1HB       SER  40   2.793  14.334  -9.633
  692   2HB   SER  40          2HB       SER  40   2.077  15.271 -10.957
  693    HG   SER  40           HG       SER  40   3.840  16.652 -10.965
  694    H    ARG  41           H        ARG  41  -0.666  16.046  -9.515
  695    HA   ARG  41           HA       ARG  41  -0.734  18.038 -11.457
  696   1HB   ARG  41          1HB       ARG  41  -3.114  17.157  -9.781
  697   2HB   ARG  41          2HB       ARG  41  -3.116  17.677 -11.475
  698   1HG   ARG  41          1HG       ARG  41  -1.393  15.553 -11.592
  699   2HG   ARG  41          2HG       ARG  41  -2.461  15.021 -10.283
  700   1HD   ARG  41          1HD       ARG  41  -3.763  14.260 -12.000
  701   2HD   ARG  41          2HD       ARG  41  -4.299  15.943 -12.109
  702    HE   ARG  41           HE       ARG  41  -1.868  15.443 -13.636
  703   1HH1  ARG  41          1HH1      ARG  41  -5.376  15.179 -13.719
  704   2HH1  ARG  41          2HH1      ARG  41  -5.466  15.222 -15.448
  705   1HH2  ARG  41          1HH2      ARG  41  -1.986  15.498 -15.917
  706   2HH2  ARG  41          2HH2      ARG  41  -3.525  15.404 -16.707
  707    H    ILE  42           H        ILE  42  -1.429  17.958  -7.923
  708    HA   ILE  42           HA       ILE  42  -1.645  20.887  -8.016
  709    HB   ILE  42           HB       ILE  42  -2.970  19.205  -5.916
  710   1HG1  ILE  42          1HG1      ILE  42  -3.959  19.775  -8.700
  711   2HG1  ILE  42          2HG1      ILE  42  -3.928  18.234  -7.826
  712   1HG2  ILE  42          1HG2      ILE  42  -4.442  21.162  -5.739
  713   2HG2  ILE  42          2HG2      ILE  42  -2.733  21.589  -5.478
  714   3HG2  ILE  42          3HG2      ILE  42  -3.520  21.970  -7.029
  715   1HD1  ILE  42          1HD1      ILE  42  -5.821  20.567  -7.553
  716   2HD1  ILE  42          2HD1      ILE  42  -6.179  18.825  -7.622
  717   3HD1  ILE  42          3HD1      ILE  42  -5.516  19.540  -6.133
  718    HA   PRO  43           HA       PRO  43   1.957  20.261  -5.571
  719   1HB   PRO  43          1HB       PRO  43   2.962  22.784  -5.873
  720   2HB   PRO  43          2HB       PRO  43   3.306  21.469  -6.993
  721   1HG   PRO  43          1HG       PRO  43   1.474  23.764  -7.268
  722   2HG   PRO  43          2HG       PRO  43   2.174  22.725  -8.561
  723   1HD   PRO  43          1HD       PRO  43  -0.490  22.707  -7.507
  724   2HD   PRO  43          2HD       PRO  43   0.195  21.559  -8.666
  725    H    GLY  44           H        GLY  44  -0.797  21.985  -5.047
  726   1HA   GLY  44          1HA       GLY  44   0.136  23.196  -2.560
  727   2HA   GLY  44          2HA       GLY  44  -1.437  23.372  -3.312
  728    H    VAL  45           H        VAL  45  -0.947  20.137  -3.631
  729    HA   VAL  45           HA       VAL  45  -2.011  19.566  -0.950
  730    HB   VAL  45           HB       VAL  45  -3.644  18.218  -1.823
  731   1HG1  VAL  45          1HG1      VAL  45  -4.918  19.658  -3.015
  732   2HG1  VAL  45          2HG1      VAL  45  -3.552  20.771  -2.761
  733   3HG1  VAL  45          3HG1      VAL  45  -3.687  19.862  -4.285
  734   1HG2  VAL  45          1HG2      VAL  45  -3.649  17.159  -3.995
  735   2HG2  VAL  45          2HG2      VAL  45  -2.210  18.081  -4.495
  736   3HG2  VAL  45          3HG2      VAL  45  -2.080  16.855  -3.211
  737    HA   PRO  46           HA       PRO  46   0.780  16.243  -0.768
  738   1HB   PRO  46          1HB       PRO  46  -0.624  13.955  -0.267
  739   2HB   PRO  46          2HB       PRO  46  -0.272  15.160   0.970
  740   1HG   PRO  46          1HG       PRO  46  -2.779  14.617  -0.489
  741   2HG   PRO  46          2HG       PRO  46  -2.552  15.489   1.070
  742   1HD   PRO  46          1HD       PRO  46  -3.099  16.582  -1.519
  743   2HD   PRO  46          2HD       PRO  46  -2.726  17.490  -0.049
  744    H    TRP  47           H        TRP  47   2.151  15.574  -2.283
  745    HA   TRP  47           HA       TRP  47   0.913  14.501  -4.686
  746   1HB   TRP  47          1HB       TRP  47   3.824  14.727  -4.617
  747   2HB   TRP  47          2HB       TRP  47   2.658  15.319  -5.802
  748    HD1  TRP  47           HD1      TRP  47   1.446  17.778  -5.081
  749    HE1  TRP  47           HE1      TRP  47   2.406  19.894  -3.829
  750    HE3  TRP  47           HE3      TRP  47   5.385  15.378  -2.941
  751    HZ2  TRP  47           HZ2      TRP  47   4.653  20.317  -2.123
  752    HZ3  TRP  47           HZ3      TRP  47   6.914  16.716  -1.496
  753    HH2  TRP  47           HH2      TRP  47   6.598  19.103  -1.074
  754    H    CYS  48           H        CYS  48   0.967  13.056  -2.029
  755    HA   CYS  48           HA       CYS  48   1.752  10.553  -3.043
  756   1HB   CYS  48          1HB       CYS  48   3.987  11.506  -2.474
  757   2HB   CYS  48          2HB       CYS  48   3.481  11.572  -0.783
  758    H    PHE  49           H        PHE  49  -0.244   9.746  -2.375
  759    HA   PHE  49           HA       PHE  49  -0.706   9.789   0.510
  760   1HB   PHE  49          1HB       PHE  49  -3.245   9.891  -0.533
  761   2HB   PHE  49          2HB       PHE  49  -2.359  11.349  -0.075
  762    HD1  PHE  49           HD1      PHE  49  -0.691  12.150  -2.069
  763    HD2  PHE  49           HD2      PHE  49  -4.285   9.949  -2.565
  764    HE1  PHE  49           HE1      PHE  49  -0.877  12.984  -4.429
  765    HE2  PHE  49           HE2      PHE  49  -4.471  10.784  -4.925
  766    HZ   PHE  49           HZ       PHE  49  -2.765  12.291  -5.829
  767    H    LYS  50           H        LYS  50  -3.104   8.349   0.559
  768    HA   LYS  50           HA       LYS  50  -2.407   5.895  -0.893
  769   1HB   LYS  50          1HB       LYS  50  -3.191   4.654   1.137
  770   2HB   LYS  50          2HB       LYS  50  -1.658   5.521   1.332
  771   1HG   LYS  50          1HG       LYS  50  -3.877   7.260   2.008
  772   2HG   LYS  50          2HG       LYS  50  -4.018   5.747   2.920
  773   1HD   LYS  50          1HD       LYS  50  -1.628   7.632   2.815
  774   2HD   LYS  50          2HD       LYS  50  -2.679   7.335   4.211
  775   1HE   LYS  50          1HE       LYS  50  -1.727   4.791   3.361
  776   2HE   LYS  50          2HE       LYS  50  -0.321   5.869   3.337
  777   1HZ   LYS  50          1HZ       LYS  50  -0.343   5.296   5.494
  778   2HZ   LYS  50          2HZ       LYS  50  -1.386   6.545   5.621
  779   3HZ   LYS  50          3HZ       LYS  50  -1.950   5.015   5.561
  780    HA   PRO  51           HA       PRO  51  -6.692   7.172  -1.674
  781   1HB   PRO  51          1HB       PRO  51  -6.546   7.338  -4.397
  782   2HB   PRO  51          2HB       PRO  51  -6.363   8.732  -3.336
  783   1HG   PRO  51          1HG       PRO  51  -4.324   7.183  -4.801
  784   2HG   PRO  51          2HG       PRO  51  -4.202   8.851  -4.131
  785   1HD   PRO  51          1HD       PRO  51  -3.068   6.430  -3.101
  786   2HD   PRO  51          2HD       PRO  51  -3.054   8.017  -2.322
  787    H    LEU  52           H        LEU  52  -6.036   5.691  -4.689
  788    HA   LEU  52           HA       LEU  52  -7.560   3.389  -3.752
  789   1HB   LEU  52          1HB       LEU  52  -8.420   3.255  -5.785
  790   2HB   LEU  52          2HB       LEU  52  -7.879   4.936  -5.931
  791    HG   LEU  52           HG       LEU  52  -5.668   3.627  -6.798
  792   1HD1  LEU  52          1HD1      LEU  52  -7.497   1.554  -6.619
  793   2HD1  LEU  52          2HD1      LEU  52  -7.535   2.003  -8.342
  794   3HD1  LEU  52          3HD1      LEU  52  -5.992   1.563  -7.569
  795   1HD2  LEU  52          1HD2      LEU  52  -7.666   3.965  -8.930
  796   2HD2  LEU  52          2HD2      LEU  52  -7.503   5.364  -7.842
  797   3HD2  LEU  52          3HD2      LEU  52  -6.077   4.734  -8.703
  798    H    GLN  53           H        GLN  53  -4.866   3.691  -2.780
  799    HA   GLN  53           HA       GLN  53  -2.901   2.548  -4.183
  800   1HB   GLN  53          1HB       GLN  53  -3.620   2.146  -1.257
  801   2HB   GLN  53          2HB       GLN  53  -2.061   1.666  -1.951
  802   1HG   GLN  53          1HG       GLN  53  -3.241   4.475  -1.876
  803   2HG   GLN  53          2HG       GLN  53  -1.884   3.890  -0.901
  804   1HE2  GLN  53          1HE2      GLN  53  -0.652   2.316  -2.907
  805   2HE2  GLN  53          2HE2      GLN  53   0.060   3.363  -4.088
  806    H    GLU  54           H        GLU  54  -5.877   1.040  -3.125
  807    HA   GLU  54           HA       GLU  54  -5.380  -1.504  -2.725
  808   1HB   GLU  54          1HB       GLU  54  -7.528  -2.008  -3.575
  809   2HB   GLU  54          2HB       GLU  54  -7.634  -0.302  -3.107
  810   1HG   GLU  54          1HG       GLU  54  -8.463  -0.020  -5.209
  811   2HG   GLU  54          2HG       GLU  54  -6.768  -0.091  -5.715
  812    H    ALA  55           H        ALA  55  -4.673   0.247  -5.704
  813    HA   ALA  55           HA       ALA  55  -4.626  -1.444  -7.704
  814   1HB   ALA  55          1HB       ALA  55  -2.404   0.359  -6.697
  815   2HB   ALA  55          2HB       ALA  55  -2.303  -0.485  -8.261
  816   3HB   ALA  55          3HB       ALA  55  -3.610   0.688  -7.965
  817    H    GLU  56           H        GLU  56  -1.846  -1.420  -5.352
  818    HA   GLU  56           HA       GLU  56  -1.814  -4.306  -5.593
  819   1HB   GLU  56          1HB       GLU  56   0.277  -2.432  -6.544
  820   2HB   GLU  56          2HB       GLU  56   0.885  -3.775  -5.560
  821   1HG   GLU  56          1HG       GLU  56   0.420  -5.315  -7.173
  822   2HG   GLU  56          2HG       GLU  56  -1.129  -4.566  -7.595
  823    H    CYS  57           H        CYS  57  -2.413  -1.932  -3.602
  824    HA   CYS  57           HA       CYS  57  -0.466  -2.497  -1.549
  825   1HB   CYS  57          1HB       CYS  57  -2.078  -0.307  -2.210
  826   2HB   CYS  57          2HB       CYS  57  -2.726  -0.911  -0.683
  827    H    THR  58           H        THR  58  -4.081  -2.646  -2.001
  828    HA   THR  58           HA       THR  58  -4.456  -4.239   0.327
  829    HB   THR  58           HB       THR  58  -6.105  -2.614  -0.796
  830    HG1  THR  58           HG1      THR  58  -6.595  -5.444  -0.248
  831   1HG2  THR  58          1HG2      THR  58  -7.578  -3.720  -2.530
  832   2HG2  THR  58          2HG2      THR  58  -5.945  -3.374  -3.146
  833   3HG2  THR  58          3HG2      THR  58  -6.380  -5.030  -2.661
  834    H    PHE  59           H        PHE  59  -4.119  -4.930  -3.184
  835    HA   PHE  59           HA       PHE  59  -4.907  -7.392  -3.514
  836   1HB   PHE  59          1HB       PHE  59  -2.665  -5.719  -4.351
  837   2HB   PHE  59          2HB       PHE  59  -2.106  -7.392  -4.264
  838    HD1  PHE  59           HD1      PHE  59  -5.344  -5.870  -5.344
  839    HD2  PHE  59           HD2      PHE  59  -1.986  -8.238  -6.404
  840    HE1  PHE  59           HE1      PHE  59  -6.367  -6.314  -7.592
  841    HE2  PHE  59           HE2      PHE  59  -3.008  -8.682  -8.652
  842    HZ   PHE  59           HZ       PHE  59  -5.186  -7.715  -9.220
  Start of MODEL   30
    1   1H    GLU   1           H1       GLU   1 -12.270  -6.908  -7.717
    2    HA   GLU   1           HA       GLU   1 -14.269  -6.645  -6.792
    3   1HB   GLU   1          1HB       GLU   1 -14.183  -8.951  -8.594
    4   2HB   GLU   1          2HB       GLU   1 -15.578  -9.021  -7.502
    5   1HG   GLU   1          1HG       GLU   1 -16.475  -7.017  -8.323
    6   2HG   GLU   1          2HG       GLU   1 -14.913  -6.427  -8.913
    7    H    GLU   2           H        GLU   2 -13.148 -10.032  -6.125
    8    HA   GLU   2           HA       GLU   2 -14.739 -10.033  -3.728
    9   1HB   GLU   2          1HB       GLU   2 -14.078 -12.384  -3.541
   10   2HB   GLU   2          2HB       GLU   2 -14.666 -12.050  -5.179
   11   1HG   GLU   2          1HG       GLU   2 -12.000 -11.523  -5.481
   12   2HG   GLU   2          2HG       GLU   2 -11.928 -12.772  -4.228
   13    H    TYR   3           H        TYR   3 -13.575  -8.311  -2.591
   14    HA   TYR   3           HA       TYR   3 -10.809  -8.450  -2.113
   15   1HB   TYR   3          1HB       TYR   3 -13.000  -7.302  -0.302
   16   2HB   TYR   3          2HB       TYR   3 -11.382  -6.639  -0.560
   17    HD1  TYR   3           HD1      TYR   3 -11.518  -6.973  -3.667
   18    HD2  TYR   3           HD2      TYR   3 -14.160  -5.244  -0.781
   19    HE1  TYR   3           HE1      TYR   3 -12.458  -5.421  -5.448
   20    HE2  TYR   3           HE2      TYR   3 -15.090  -3.697  -2.571
   21    HH   TYR   3           HH       TYR   3 -13.776  -3.761  -5.871
   22    H    VAL   4           H        VAL   4 -10.953 -10.948  -1.669
   23    HA   VAL   4           HA       VAL   4 -11.179 -11.243   1.244
   24    HB   VAL   4           HB       VAL   4 -11.992 -13.228  -0.889
   25   1HG1  VAL   4          1HG1      VAL   4 -12.240 -13.502   2.123
   26   2HG1  VAL   4          2HG1      VAL   4 -12.613 -14.723   0.883
   27   3HG1  VAL   4          3HG1      VAL   4 -10.928 -14.224   1.162
   28   1HG2  VAL   4          1HG2      VAL   4 -13.802 -11.813  -0.838
   29   2HG2  VAL   4          2HG2      VAL   4 -14.231 -12.913   0.494
   30   3HG2  VAL   4          3HG2      VAL   4 -13.515 -11.321   0.848
   31    H    GLY   5           H        GLY   5  -9.869 -12.750  -1.796
   32   1HA   GLY   5          1HA       GLY   5  -7.738 -14.061  -0.448
   33   2HA   GLY   5          2HA       GLY   5  -7.926 -13.830  -2.175
   34    H    LEU   6           H        LEU   6  -8.284 -10.780  -0.795
   35    HA   LEU   6           HA       LEU   6  -5.409 -10.267  -0.725
   36   1HB   LEU   6          1HB       LEU   6  -6.134  -8.096  -2.032
   37   2HB   LEU   6          2HB       LEU   6  -5.610  -9.576  -2.854
   38    HG   LEU   6           HG       LEU   6  -8.392  -9.825  -2.530
   39   1HD1  LEU   6          1HD1      LEU   6  -9.200  -7.757  -3.706
   40   2HD1  LEU   6          2HD1      LEU   6  -8.688  -7.517  -2.018
   41   3HD1  LEU   6          3HD1      LEU   6  -7.620  -7.016  -3.351
   42   1HD2  LEU   6          1HD2      LEU   6  -7.341  -8.836  -5.126
   43   2HD2  LEU   6          2HD2      LEU   6  -6.591 -10.307  -4.460
   44   3HD2  LEU   6          3HD2      LEU   6  -8.346 -10.257  -4.752
   45    H    SER   7           H        SER   7  -7.954 -10.470   1.103
   46    HA   SER   7           HA       SER   7  -7.734  -7.775   2.185
   47   1HB   SER   7          1HB       SER   7 -10.014  -8.702   1.533
   48   2HB   SER   7          2HB       SER   7  -9.845  -9.864   2.862
   49    HG   SER   7           HG       SER   7  -9.490  -7.059   3.351
   50    H    ALA   8           H        ALA   8  -8.817  -8.575   4.816
   51    HA   ALA   8           HA       ALA   8  -6.432  -9.155   6.125
   52   1HB   ALA   8          1HB       ALA   8  -7.782  -9.190   8.106
   53   2HB   ALA   8          2HB       ALA   8  -8.525  -8.002   7.008
   54   3HB   ALA   8          3HB       ALA   8  -9.241  -9.622   7.183
   55    H    ASN   9           H        ASN   9  -5.548 -11.015   4.975
   56    HA   ASN   9           HA       ASN   9  -5.775 -13.334   6.297
   57   1HB   ASN   9          1HB       ASN   9  -8.136 -13.033   4.821
   58   2HB   ASN   9          2HB       ASN   9  -7.158 -14.085   3.787
   59   1HD2  ASN   9          1HD2      ASN   9  -5.922 -15.807   5.114
   60   2HD2  ASN   9          2HD2      ASN   9  -6.862 -16.711   6.254
   61    H    GLN  10           H        GLN  10  -5.437 -11.608   3.198
   62    HA   GLN  10           HA       GLN  10  -3.996 -13.511   1.809
   63   1HB   GLN  10          1HB       GLN  10  -5.029 -11.440   0.861
   64   2HB   GLN  10          2HB       GLN  10  -3.743 -10.478   1.610
   65   1HG   GLN  10          1HG       GLN  10  -2.417 -12.552   0.227
   66   2HG   GLN  10          2HG       GLN  10  -3.707 -12.037  -0.869
   67   1HE2  GLN  10          1HE2      GLN  10  -3.856  -9.348   0.112
   68   2HE2  GLN  10          2HE2      GLN  10  -2.461  -8.486  -0.444
   69    H    CYS  11           H        CYS  11  -3.066 -11.183   4.337
   70    HA   CYS  11           HA       CYS  11  -0.305 -11.283   3.879
   71   1HB   CYS  11          1HB       CYS  11  -1.272  -9.503   5.147
   72   2HB   CYS  11          2HB       CYS  11  -1.912 -10.624   6.351
   73    H    ALA  12           H        ALA  12  -2.499 -13.704   4.713
   74    HA   ALA  12           HA       ALA  12  -0.537 -15.130   6.363
   75   1HB   ALA  12          1HB       ALA  12  -3.155 -14.661   6.882
   76   2HB   ALA  12          2HB       ALA  12  -3.298 -16.184   5.973
   77   3HB   ALA  12          3HB       ALA  12  -2.296 -16.116   7.442
   78    H    VAL  13           H        VAL  13  -0.937 -14.621   3.232
   79    HA   VAL  13           HA       VAL  13  -1.607 -16.922   1.957
   80    HB   VAL  13           HB       VAL  13  -0.377 -14.501   1.355
   81   1HG1  VAL  13          1HG1      VAL  13   1.839 -15.475   1.548
   82   2HG1  VAL  13          2HG1      VAL  13   1.383 -16.809   0.462
   83   3HG1  VAL  13          3HG1      VAL  13   1.480 -15.146  -0.164
   84   1HG2  VAL  13          1HG2      VAL  13  -1.937 -16.489   0.097
   85   2HG2  VAL  13          2HG2      VAL  13  -1.600 -14.839  -0.479
   86   3HG2  VAL  13          3HG2      VAL  13  -0.554 -16.187  -0.982
   87    HA   PRO  14           HA       PRO  14   1.419 -19.874   2.852
   88   1HB   PRO  14          1HB       PRO  14   1.767 -21.199   0.490
   89   2HB   PRO  14          2HB       PRO  14   0.396 -21.484   1.561
   90   1HG   PRO  14          1HG       PRO  14   0.545 -19.975  -0.970
   91   2HG   PRO  14          2HG       PRO  14  -0.907 -20.657  -0.153
   92   1HD   PRO  14          1HD       PRO  14  -0.049 -17.928  -0.273
   93   2HD   PRO  14          2HD       PRO  14  -1.397 -18.570   0.675
   94    H    ALA  15           H        ALA  15   2.377 -17.201   2.067
   95    HA   ALA  15           HA       ALA  15   4.270 -16.199   1.480
   96   1HB   ALA  15          1HB       ALA  15   4.894 -18.472   3.203
   97   2HB   ALA  15          2HB       ALA  15   6.273 -18.043   2.163
   98   3HB   ALA  15          3HB       ALA  15   5.546 -16.817   3.230
   99    H    LYS  16           H        LYS  16   3.280 -16.787  -0.813
  100    HA   LYS  16           HA       LYS  16   5.431 -17.302  -2.488
  101   1HB   LYS  16          1HB       LYS  16   4.522 -19.481  -3.482
  102   2HB   LYS  16          2HB       LYS  16   5.470 -19.580  -1.988
  103   1HG   LYS  16          1HG       LYS  16   3.733 -20.529  -0.916
  104   2HG   LYS  16          2HG       LYS  16   2.676 -19.167  -1.329
  105   1HD   LYS  16          1HD       LYS  16   1.532 -20.743  -2.509
  106   2HD   LYS  16          2HD       LYS  16   2.784 -20.484  -3.737
  107   1HE   LYS  16          1HE       LYS  16   3.537 -22.596  -3.476
  108   2HE   LYS  16          2HE       LYS  16   3.727 -22.371  -1.730
  109   1HZ   LYS  16          1HZ       LYS  16   1.831 -23.863  -3.031
  110   2HZ   LYS  16          2HZ       LYS  16   1.918 -23.561  -1.429
  111   3HZ   LYS  16          3HZ       LYS  16   1.020 -22.597  -2.393
  112    H    ASP  17           H        ASP  17   3.293 -15.397  -2.028
  113    HA   ASP  17           HA       ASP  17   2.340 -15.324  -4.709
  114   1HB   ASP  17          1HB       ASP  17   0.641 -16.703  -3.360
  115   2HB   ASP  17          2HB       ASP  17   0.286 -15.221  -2.459
  116    H    ARG  18           H        ARG  18   3.923 -13.908  -2.372
  117    HA   ARG  18           HA       ARG  18   2.383 -11.498  -2.114
  118   1HB   ARG  18          1HB       ARG  18   5.178 -12.158  -1.078
  119   2HB   ARG  18          2HB       ARG  18   4.181 -10.784  -0.566
  120   1HG   ARG  18          1HG       ARG  18   2.859 -12.086   0.774
  121   2HG   ARG  18          2HG       ARG  18   2.903 -13.473  -0.329
  122   1HD   ARG  18          1HD       ARG  18   5.067 -14.148   0.477
  123   2HD   ARG  18          2HD       ARG  18   5.311 -12.621   1.339
  124    HE   ARG  18           HE       ARG  18   2.948 -14.138   2.202
  125   1HH1  ARG  18          1HH1      ARG  18   6.394 -13.614   2.687
  126   2HH1  ARG  18          2HH1      ARG  18   6.390 -14.234   4.304
  127   1HH2  ARG  18          1HH2      ARG  18   2.942 -14.956   4.335
  128   2HH2  ARG  18          2HH2      ARG  18   4.414 -15.002   5.248
  129    H    VAL  19           H        VAL  19   3.808  -9.344  -2.355
  130    HA   VAL  19           HA       VAL  19   5.040  -9.528  -5.001
  131    HB   VAL  19           HB       VAL  19   3.946  -7.183  -3.435
  132   1HG1  VAL  19          1HG1      VAL  19   5.539  -7.367  -5.926
  133   2HG1  VAL  19          2HG1      VAL  19   4.098  -6.324  -6.011
  134   3HG1  VAL  19          3HG1      VAL  19   5.345  -6.019  -4.779
  135   1HG2  VAL  19          1HG2      VAL  19   2.553  -7.624  -5.879
  136   2HG2  VAL  19          2HG2      VAL  19   2.652  -9.185  -5.028
  137   3HG2  VAL  19          3HG2      VAL  19   1.942  -7.770  -4.214
  138    H    ASP  20           H        ASP  20   6.222 -10.226  -2.214
  139    HA   ASP  20           HA       ASP  20   7.955  -9.676  -0.950
  140   1HB   ASP  20          1HB       ASP  20   9.182 -11.009  -2.396
  141   2HB   ASP  20          2HB       ASP  20   8.868  -9.974  -3.798
  142    H    CYS  21           H        CYS  21   7.434  -7.528  -0.120
  143    HA   CYS  21           HA       CYS  21   7.619  -5.181  -1.500
  144   1HB   CYS  21          1HB       CYS  21   7.070  -5.940   1.084
  145   2HB   CYS  21          2HB       CYS  21   8.531  -4.967   1.275
  146    H    GLY  22           H        GLY  22  10.140  -7.239  -0.018
  147   1HA   GLY  22          1HA       GLY  22  12.388  -6.996   0.148
  148   2HA   GLY  22          2HA       GLY  22  12.240  -6.576  -1.548
  149    H    TYR  23           H        TYR  23  11.589  -4.970   1.658
  150    HA   TYR  23           HA       TYR  23  12.540  -2.466   0.525
  151   1HB   TYR  23          1HB       TYR  23  10.831  -3.532   2.712
  152   2HB   TYR  23          2HB       TYR  23  11.891  -2.244   3.290
  153    HD1  TYR  23           HD1      TYR  23   9.266  -3.065   0.779
  154    HD2  TYR  23           HD2      TYR  23  11.401   0.030   2.819
  155    HE1  TYR  23           HE1      TYR  23   7.649  -1.333  -0.142
  156    HE2  TYR  23           HE2      TYR  23   9.777   1.752   1.892
  157    HH   TYR  23           HH       TYR  23   8.292   1.984  -0.005
  158    HA   PRO  24           HA       PRO  24  16.366  -2.612   2.535
  159   1HB   PRO  24          1HB       PRO  24  16.900   0.035   2.940
  160   2HB   PRO  24          2HB       PRO  24  17.133  -0.768   1.389
  161   1HG   PRO  24          1HG       PRO  24  14.985   1.049   2.277
  162   2HG   PRO  24          2HG       PRO  24  15.479   0.630   0.597
  163   1HD   PRO  24          1HD       PRO  24  13.194  -0.282   2.062
  164   2HD   PRO  24          2HD       PRO  24  13.722  -0.846   0.472
  165    H    HIS  25           H        HIS  25  13.672  -1.301   4.125
  166    HA   HIS  25           HA       HIS  25  15.152  -1.485   6.645
  167   1HB   HIS  25          1HB       HIS  25  13.117   0.363   5.613
  168   2HB   HIS  25          2HB       HIS  25  12.789  -0.219   7.248
  169    HD1  HIS  25           HD1      HIS  25  13.411   2.728   6.938
  170    HD2  HIS  25           HD2      HIS  25  16.387  -0.168   7.536
  171    HE1  HIS  25           HE1      HIS  25  15.425   3.961   7.903
  172    HE2  HIS  25           HE2      HIS  25  17.202   2.122   8.301
  173    H    VAL  26           H        VAL  26  13.566  -3.486   4.719
  174    HA   VAL  26           HA       VAL  26  11.305  -4.427   5.768
  175    HB   VAL  26           HB       VAL  26  12.248  -5.483   3.901
  176   1HG1  VAL  26          1HG1      VAL  26  14.530  -6.803   5.260
  177   2HG1  VAL  26          2HG1      VAL  26  14.404  -6.118   3.622
  178   3HG1  VAL  26          3HG1      VAL  26  14.683  -5.047   5.017
  179   1HG2  VAL  26          1HG2      VAL  26  11.194  -6.942   5.929
  180   2HG2  VAL  26          2HG2      VAL  26  11.648  -7.622   4.349
  181   3HG2  VAL  26          3HG2      VAL  26  12.762  -7.762   5.730
  182    H    THR  27           H        THR  27  10.622  -4.742   7.817
  183    HA   THR  27           HA       THR  27  12.027  -6.476   9.561
  184    HB   THR  27           HB       THR  27  12.894  -3.753   9.558
  185    HG1  THR  27           HG1      THR  27  14.266  -5.372  10.323
  186   1HG2  THR  27          1HG2      THR  27  12.191  -4.095  12.350
  187   2HG2  THR  27          2HG2      THR  27  11.837  -2.709  11.292
  188   3HG2  THR  27          3HG2      THR  27  10.692  -4.070  11.390
  189    HA   PRO  28           HA       PRO  28   8.054  -6.717  11.158
  190   1HB   PRO  28          1HB       PRO  28   8.502  -7.805  13.624
  191   2HB   PRO  28          2HB       PRO  28   8.488  -8.754  12.139
  192   1HG   PRO  28          1HG       PRO  28  10.760  -7.820  13.773
  193   2HG   PRO  28          2HG       PRO  28  10.718  -9.160  12.571
  194   1HD   PRO  28          1HD       PRO  28  11.850  -6.545  12.285
  195   2HD   PRO  28          2HD       PRO  28  11.693  -7.771  11.020
  196    H    LYS  29           H        LYS  29   8.609  -4.157  11.087
  197    HA   LYS  29           HA       LYS  29   7.046  -3.124  13.112
  198   1HB   LYS  29          1HB       LYS  29   9.071  -3.816  14.483
  199   2HB   LYS  29          2HB       LYS  29   9.950  -2.507  13.675
  200   1HG   LYS  29          1HG       LYS  29   9.043  -1.023  15.102
  201   2HG   LYS  29          2HG       LYS  29   7.416  -1.467  14.561
  202   1HD   LYS  29          1HD       LYS  29   8.697  -3.412  16.401
  203   2HD   LYS  29          2HD       LYS  29   8.381  -1.824  17.123
  204   1HE   LYS  29          1HE       LYS  29   6.017  -2.258  15.823
  205   2HE   LYS  29          2HE       LYS  29   6.471  -3.927  16.192
  206   1HZ   LYS  29          1HZ       LYS  29   6.014  -3.574  18.307
  207   2HZ   LYS  29          2HZ       LYS  29   6.883  -2.193  18.384
  208   3HZ   LYS  29          3HZ       LYS  29   5.328  -2.154  17.886
  209    H    GLU  30           H        GLU  30   9.451  -2.893  10.564
  210    HA   GLU  30           HA       GLU  30   8.802  -0.095  10.191
  211   1HB   GLU  30          1HB       GLU  30  11.106  -1.762   9.683
  212   2HB   GLU  30          2HB       GLU  30  10.598  -0.996   8.167
  213   1HG   GLU  30          1HG       GLU  30  10.925   1.168   9.010
  214   2HG   GLU  30          2HG       GLU  30  10.779   0.655  10.697
  215    H    CYS  31           H        CYS  31   8.560  -3.323   8.624
  216    HA   CYS  31           HA       CYS  31   7.576  -2.443   6.182
  217   1HB   CYS  31          1HB       CYS  31   7.305  -5.027   7.696
  218   2HB   CYS  31          2HB       CYS  31   6.552  -4.793   6.116
  219    H    ASN  32           H        ASN  32   5.878  -3.650   9.169
  220    HA   ASN  32           HA       ASN  32   3.341  -3.079   8.146
  221   1HB   ASN  32          1HB       ASN  32   4.537  -3.900  10.757
  222   2HB   ASN  32          2HB       ASN  32   2.973  -3.080  10.881
  223   1HD2  ASN  32          1HD2      ASN  32   4.626  -5.525   8.881
  224   2HD2  ASN  32          2HD2      ASN  32   3.317  -6.655   8.789
  225    H    ASN  33           H        ASN  33   5.792  -0.980   8.761
  226    HA   ASN  33           HA       ASN  33   4.104   0.976  10.095
  227   1HB   ASN  33          1HB       ASN  33   6.247   0.696  11.196
  228   2HB   ASN  33          2HB       ASN  33   7.127   0.803   9.664
  229   1HD2  ASN  33          1HD2      ASN  33   8.328   2.437  10.867
  230   2HD2  ASN  33          2HD2      ASN  33   7.762   4.074  10.892
  231    H    ARG  34           H        ARG  34   5.973   0.141   7.168
  232    HA   ARG  34           HA       ARG  34   5.590   2.757   6.063
  233   1HB   ARG  34          1HB       ARG  34   6.747   1.693   4.044
  234   2HB   ARG  34          2HB       ARG  34   7.703   1.702   5.536
  235   1HG   ARG  34          1HG       ARG  34   7.543  -0.588   5.804
  236   2HG   ARG  34          2HG       ARG  34   5.954  -0.689   5.025
  237   1HD   ARG  34          1HD       ARG  34   6.870  -1.024   2.966
  238   2HD   ARG  34          2HD       ARG  34   8.123   0.204   3.209
  239    HE   ARG  34           HE       ARG  34   8.489  -2.600   3.454
  240   1HH1  ARG  34          1HH1      ARG  34   9.223   0.319   5.278
  241   2HH1  ARG  34          2HH1      ARG  34  10.629  -0.354   6.034
  242   1HH2  ARG  34          1HH2      ARG  34  10.344  -3.488   4.451
  243   2HH2  ARG  34          2HH2      ARG  34  11.271  -2.533   5.560
  244    H    GLY  35           H        GLY  35   4.263  -0.549   5.866
  245   1HA   GLY  35          1HA       GLY  35   1.823  -0.379   5.198
  246   2HA   GLY  35          2HA       GLY  35   2.439   0.305   3.706
  247    H    CYS  36           H        CYS  36   4.356  -2.151   5.391
  248    HA   CYS  36           HA       CYS  36   3.551  -4.055   3.313
  249   1HB   CYS  36          1HB       CYS  36   6.234  -3.491   4.543
  250   2HB   CYS  36          2HB       CYS  36   5.886  -5.033   3.756
  251    H    CYS  37           H        CYS  37   3.978  -6.428   4.099
  252    HA   CYS  37           HA       CYS  37   3.210  -6.569   6.924
  253   1HB   CYS  37          1HB       CYS  37   1.573  -7.259   5.002
  254   2HB   CYS  37          2HB       CYS  37   2.539  -8.738   4.970
  255    H    PHE  38           H        PHE  38   4.708  -7.591   8.214
  256    HA   PHE  38           HA       PHE  38   6.901  -8.944   6.873
  257   1HB   PHE  38          1HB       PHE  38   7.062  -7.123   8.717
  258   2HB   PHE  38          2HB       PHE  38   6.396  -8.313   9.839
  259    HD1  PHE  38           HD1      PHE  38   7.743 -10.212  10.554
  260    HD2  PHE  38           HD2      PHE  38   9.324  -7.304   7.900
  261    HE1  PHE  38           HE1      PHE  38  10.060 -11.072  10.992
  262    HE2  PHE  38           HE2      PHE  38  11.640  -8.163   8.338
  263    HZ   PHE  38           HZ       PHE  38  11.981 -10.037   9.879
  264    H    ASP  39           H        ASP  39   6.976 -11.130   6.691
  265    HA   ASP  39           HA       ASP  39   5.026 -12.645   8.130
  266   1HB   ASP  39          1HB       ASP  39   5.378 -13.254   5.836
  267   2HB   ASP  39          2HB       ASP  39   7.137 -13.314   6.040
  268    H    SER  40           H        SER  40   8.448 -13.562   7.367
  269    HA   SER  40           HA       SER  40  10.177 -13.906   8.710
  270   1HB   SER  40          1HB       SER  40   8.750 -12.425  10.445
  271   2HB   SER  40          2HB       SER  40   8.625 -13.984  11.278
  272    HG   SER  40           HG       SER  40  11.120 -12.814  10.395
  273    H    ARG  41           H        ARG  41   7.114 -15.510   8.697
  274    HA   ARG  41           HA       ARG  41   7.710 -17.728  10.231
  275   1HB   ARG  41          1HB       ARG  41   5.892 -17.446   7.795
  276   2HB   ARG  41          2HB       ARG  41   5.853 -18.823   8.909
  277   1HG   ARG  41          1HG       ARG  41   5.628 -16.799  10.694
  278   2HG   ARG  41          2HG       ARG  41   4.891 -16.008   9.290
  279   1HD   ARG  41          1HD       ARG  41   3.155 -17.132  10.589
  280   2HD   ARG  41          2HD       ARG  41   3.352 -17.993   9.054
  281    HE   ARG  41           HE       ARG  41   5.092 -19.224  10.908
  282   1HH1  ARG  41          1HH1      ARG  41   1.627 -18.729  10.537
  283   2HH1  ARG  41          2HH1      ARG  41   1.200 -20.174  11.391
  284   1HH2  ARG  41          1HH2      ARG  41   4.529 -21.131  12.035
  285   2HH2  ARG  41          2HH2      ARG  41   2.862 -21.550  12.248
  286    H    ILE  42           H        ILE  42   8.203 -16.968   6.735
  287    HA   ILE  42           HA       ILE  42   9.880 -19.376   6.574
  288    HB   ILE  42           HB       ILE  42   8.551 -18.262   4.150
  289   1HG1  ILE  42          1HG1      ILE  42   7.171 -19.908   6.272
  290   2HG1  ILE  42          2HG1      ILE  42   6.663 -18.346   5.607
  291   1HG2  ILE  42          1HG2      ILE  42   9.072 -21.131   4.942
  292   2HG2  ILE  42          2HG2      ILE  42   8.762 -20.464   3.321
  293   3HG2  ILE  42          3HG2      ILE  42  10.293 -20.105   4.153
  294   1HD1  ILE  42          1HD1      ILE  42   5.292 -19.912   4.478
  295   2HD1  ILE  42          2HD1      ILE  42   6.601 -19.602   3.313
  296   3HD1  ILE  42          3HD1      ILE  42   6.621 -21.083   4.300
  297    HA   PRO  43           HA       PRO  43  12.794 -16.194   5.795
  298   1HB   PRO  43          1HB       PRO  43  15.026 -17.734   6.124
  299   2HB   PRO  43          2HB       PRO  43  14.211 -16.920   7.458
  300   1HG   PRO  43          1HG       PRO  43  14.174 -19.760   6.662
  301   2HG   PRO  43          2HG       PRO  43  13.755 -19.036   8.257
  302   1HD   PRO  43          1HD       PRO  43  11.988 -20.050   6.243
  303   2HD   PRO  43          2HD       PRO  43  11.525 -19.201   7.723
  304    H    GLY  44           H        GLY  44  11.894 -18.785   3.985
  305   1HA   GLY  44          1HA       GLY  44  13.925 -18.338   1.926
  306   2HA   GLY  44          2HA       GLY  44  12.717 -19.609   1.975
  307    H    VAL  45           H        VAL  45  10.947 -16.989   2.902
  308    HA   VAL  45           HA       VAL  45  10.363 -16.232   0.122
  309    HB   VAL  45           HB       VAL  45   8.095 -16.344   0.524
  310   1HG1  VAL  45          1HG1      VAL  45   8.120 -18.574   0.516
  311   2HG1  VAL  45          2HG1      VAL  45   9.683 -18.592   1.368
  312   3HG1  VAL  45          3HG1      VAL  45   8.164 -18.554   2.296
  313   1HG2  VAL  45          1HG2      VAL  45   7.366 -15.311   2.379
  314   2HG2  VAL  45          2HG2      VAL  45   7.529 -16.895   3.174
  315   3HG2  VAL  45          3HG2      VAL  45   8.846 -15.703   3.286
  316    HA   PRO  46           HA       PRO  46  10.430 -12.097   1.437
  317   1HB   PRO  46          1HB       PRO  46   8.090 -10.926   0.653
  318   2HB   PRO  46          2HB       PRO  46   9.420 -11.260  -0.456
  319   1HG   PRO  46          1HG       PRO  46   6.860 -12.680  -0.081
  320   2HG   PRO  46          2HG       PRO  46   7.969 -12.719  -1.498
  321   1HD   PRO  46          1HD       PRO  46   7.593 -14.711   0.525
  322   2HD   PRO  46          2HD       PRO  46   8.810 -14.728  -0.759
  323    H    TRP  47           H        TRP  47  10.683 -11.495   3.486
  324    HA   TRP  47           HA       TRP  47   8.440 -12.043   5.247
  325   1HB   TRP  47          1HB       TRP  47  10.737 -10.738   6.440
  326   2HB   TRP  47          2HB       TRP  47   9.955 -12.267   6.849
  327    HD1  TRP  47           HD1      TRP  47  10.921 -14.489   5.480
  328    HE1  TRP  47           HE1      TRP  47  13.272 -15.071   4.432
  329    HE3  TRP  47           HE3      TRP  47  12.625  -9.700   5.322
  330    HZ2  TRP  47           HZ2      TRP  47  15.528 -13.500   3.672
  331    HZ3  TRP  47           HZ3      TRP  47  14.912  -9.311   4.412
  332    HH2  TRP  47           HH2      TRP  47  16.349 -11.116   3.604
  333    H    CYS  48           H        CYS  48   8.283  -9.991   3.065
  334    HA   CYS  48           HA       CYS  48   7.140  -7.941   4.599
  335   1HB   CYS  48          1HB       CYS  48   9.498  -7.326   4.941
  336   2HB   CYS  48          2HB       CYS  48   9.708  -7.174   3.194
  337    H    PHE  49           H        PHE  49   5.342  -7.743   3.304
  338    HA   PHE  49           HA       PHE  49   5.778  -7.121   0.507
  339   1HB   PHE  49          1HB       PHE  49   3.692  -8.862   0.280
  340   2HB   PHE  49          2HB       PHE  49   5.365  -9.410   0.132
  341    HD1  PHE  49           HD1      PHE  49   6.489 -10.132   2.396
  342    HD2  PHE  49           HD2      PHE  49   2.297  -9.918   1.774
  343    HE1  PHE  49           HE1      PHE  49   6.123 -11.714   4.311
  344    HE2  PHE  49           HE2      PHE  49   1.931 -11.500   3.688
  345    HZ   PHE  49           HZ       PHE  49   3.849 -12.378   4.934
  346    H    LYS  50           H        LYS  50   3.129  -7.176  -0.371
  347    HA   LYS  50           HA       LYS  50   1.806  -5.393   1.552
  348   1HB   LYS  50          1HB       LYS  50   0.892  -4.243  -0.517
  349   2HB   LYS  50          2HB       LYS  50   2.599  -3.956  -0.132
  350   1HG   LYS  50          1HG       LYS  50   2.128  -6.307  -1.864
  351   2HG   LYS  50          2HG       LYS  50   1.617  -4.776  -2.597
  352   1HD   LYS  50          1HD       LYS  50   4.366  -5.479  -1.490
  353   2HD   LYS  50          2HD       LYS  50   3.949  -5.193  -3.188
  354   1HE   LYS  50          1HE       LYS  50   3.082  -2.898  -1.752
  355   2HE   LYS  50          2HE       LYS  50   4.693  -3.279  -1.123
  356   1HZ   LYS  50          1HZ       LYS  50   5.097  -1.995  -2.961
  357   2HZ   LYS  50          2HZ       LYS  50   5.265  -3.496  -3.583
  358   3HZ   LYS  50          3HZ       LYS  50   3.897  -2.647  -3.856
  359    HA   PRO  51           HA       PRO  51  -0.875  -8.908   0.577
  360   1HB   PRO  51          1HB       PRO  51  -1.364  -9.712   3.141
  361   2HB   PRO  51          2HB       PRO  51  -0.109 -10.425   2.131
  362   1HG   PRO  51          1HG       PRO  51   0.112  -8.493   4.350
  363   2HG   PRO  51          2HG       PRO  51   1.386  -9.564   3.662
  364   1HD   PRO  51          1HD       PRO  51   1.036  -6.745   3.294
  365   2HD   PRO  51          2HD       PRO  51   2.210  -7.780   2.468
  366    H    LEU  52           H        LEU  52  -2.118  -8.313   3.685
  367    HA   LEU  52           HA       LEU  52  -4.395  -7.023   2.418
  368   1HB   LEU  52          1HB       LEU  52  -5.656  -7.767   4.146
  369   2HB   LEU  52          2HB       LEU  52  -4.433  -9.047   4.040
  370    HG   LEU  52           HG       LEU  52  -3.385  -7.208   5.865
  371   1HD1  LEU  52          1HD1      LEU  52  -5.075  -6.022   6.695
  372   2HD1  LEU  52          2HD1      LEU  52  -6.286  -6.999   5.829
  373   3HD1  LEU  52          3HD1      LEU  52  -5.672  -7.538   7.410
  374   1HD2  LEU  52          1HD2      LEU  52  -3.993  -9.940   5.709
  375   2HD2  LEU  52          2HD2      LEU  52  -3.042  -9.106   6.961
  376   3HD2  LEU  52          3HD2      LEU  52  -4.789  -9.358   7.191
  377    H    GLN  53           H        GLN  53  -1.921  -5.532   2.530
  378    HA   GLN  53           HA       GLN  53  -1.701  -3.911   4.718
  379   1HB   GLN  53          1HB       GLN  53  -1.193  -3.256   1.790
  380   2HB   GLN  53          2HB       GLN  53  -0.576  -2.308   3.155
  381   1HG   GLN  53          1HG       GLN  53   0.052  -5.217   2.500
  382   2HG   GLN  53          2HG       GLN  53   1.165  -3.847   2.364
  383   1HE2  GLN  53          1HE2      GLN  53  -0.491  -6.067   4.461
  384   2HE2  GLN  53          2HE2      GLN  53   0.362  -5.720   5.928
  385    H    GLU  54           H        GLU  54  -4.130  -3.965   2.168
  386    HA   GLU  54           HA       GLU  54  -5.023  -1.492   1.954
  387   1HB   GLU  54          1HB       GLU  54  -7.169  -2.376   1.464
  388   2HB   GLU  54          2HB       GLU  54  -6.039  -3.681   1.063
  389   1HG   GLU  54          1HG       GLU  54  -7.504  -4.912   2.326
  390   2HG   GLU  54          2HG       GLU  54  -6.527  -4.294   3.666
  391    H    ALA  55           H        ALA  55  -5.059  -3.450   4.901
  392    HA   ALA  55           HA       ALA  55  -6.987  -2.428   6.438
  393   1HB   ALA  55          1HB       ALA  55  -5.363  -4.082   7.203
  394   2HB   ALA  55          2HB       ALA  55  -4.064  -2.865   7.174
  395   3HB   ALA  55          3HB       ALA  55  -5.396  -2.717   8.345
  396    H    GLU  56           H        GLU  56  -3.697  -0.886   6.176
  397    HA   GLU  56           HA       GLU  56  -5.076   1.649   6.600
  398   1HB   GLU  56          1HB       GLU  56  -3.295   0.430   8.382
  399   2HB   GLU  56          2HB       GLU  56  -2.301   1.644   7.558
  400   1HG   GLU  56          1HG       GLU  56  -4.448   3.175   8.013
  401   2HG   GLU  56          2HG       GLU  56  -4.726   2.007   9.314
  402    H    CYS  57           H        CYS  57  -3.939  -0.034   4.216
  403    HA   CYS  57           HA       CYS  57  -1.875   1.765   3.282
  404   1HB   CYS  57          1HB       CYS  57  -1.495  -0.571   2.937
  405   2HB   CYS  57          2HB       CYS  57  -3.051  -0.767   2.125
  406    H    THR  58           H        THR  58  -4.621   0.244   1.477
  407    HA   THR  58           HA       THR  58  -5.013   2.391  -0.226
  408    HB   THR  58           HB       THR  58  -5.870  -0.163  -0.117
  409    HG1  THR  58           HG1      THR  58  -7.641   0.815  -1.624
  410   1HG2  THR  58          1HG2      THR  58  -8.449   1.334   0.433
  411   2HG2  THR  58          2HG2      THR  58  -8.133  -0.416   0.514
  412   3HG2  THR  58          3HG2      THR  58  -7.537   0.657   1.804
  413    H    PHE  59           H        PHE  59  -6.264   1.808   3.059
  414    HA   PHE  59           HA       PHE  59  -8.381   3.330   3.325
  415   1HB   PHE  59          1HB       PHE  59  -7.033   2.300   5.164
  416   2HB   PHE  59          2HB       PHE  59  -5.757   3.498   4.924
  417    HD1  PHE  59           HD1      PHE  59  -5.669   5.100   6.564
  418    HD2  PHE  59           HD2      PHE  59  -9.460   3.546   5.465
  419    HE1  PHE  59           HE1      PHE  59  -6.769   6.587   8.260
  420    HE2  PHE  59           HE2      PHE  59 -10.561   5.034   7.160
  421    HZ   PHE  59           HZ       PHE  59  -9.203   6.538   8.538
  422   1H    GLU   1           H1       GLU   1 -22.546   6.025   1.726
  423    HA   GLU   1           HA       GLU   1 -21.487   4.278   0.252
  424   1HB   GLU   1          1HB       GLU   1 -19.510   5.807  -0.249
  425   2HB   GLU   1          2HB       GLU   1 -21.104   6.579  -0.293
  426   1HG   GLU   1          1HG       GLU   1 -19.349   6.574   2.189
  427   2HG   GLU   1          2HG       GLU   1 -19.222   7.837   0.954
  428    H    GLU   2           H        GLU   2 -20.179   2.496   0.320
  429    HA   GLU   2           HA       GLU   2 -18.609   2.152   2.710
  430   1HB   GLU   2          1HB       GLU   2 -20.201   0.405   1.651
  431   2HB   GLU   2          2HB       GLU   2 -18.911   0.128   0.469
  432   1HG   GLU   2          1HG       GLU   2 -17.965  -1.279   1.955
  433   2HG   GLU   2          2HG       GLU   2 -17.627   0.114   2.993
  434    H    TYR   3           H        TYR   3 -17.046   0.136   0.719
  435    HA   TYR   3           HA       TYR   3 -14.726   1.701   0.578
  436   1HB   TYR   3          1HB       TYR   3 -14.162  -0.305  -1.053
  437   2HB   TYR   3          2HB       TYR   3 -14.564  -0.715   0.618
  438    HD1  TYR   3           HD1      TYR   3 -17.295   0.406  -1.507
  439    HD2  TYR   3           HD2      TYR   3 -15.081  -3.019  -0.215
  440    HE1  TYR   3           HE1      TYR   3 -19.153  -1.118  -2.340
  441    HE2  TYR   3           HE2      TYR   3 -16.945  -4.531  -1.051
  442    HH   TYR   3           HH       TYR   3 -19.971  -3.462  -1.714
  443    H    VAL   4           H        VAL   4 -15.820   3.663  -0.480
  444    HA   VAL   4           HA       VAL   4 -15.574   3.349  -3.388
  445    HB   VAL   4           HB       VAL   4 -17.640   4.895  -1.818
  446   1HG1  VAL   4          1HG1      VAL   4 -18.438   5.309  -4.327
  447   2HG1  VAL   4          2HG1      VAL   4 -17.306   6.409  -3.503
  448   3HG1  VAL   4          3HG1      VAL   4 -16.690   5.182  -4.638
  449   1HG2  VAL   4          1HG2      VAL   4 -18.429   2.708  -1.994
  450   2HG2  VAL   4          2HG2      VAL   4 -19.151   3.502  -3.414
  451   3HG2  VAL   4          3HG2      VAL   4 -17.714   2.471  -3.608
  452    H    GLY   5           H        GLY   5 -15.649   5.698  -0.618
  453   1HA   GLY   5          1HA       GLY   5 -14.185   7.696  -2.010
  454   2HA   GLY   5          2HA       GLY   5 -14.517   7.619  -0.291
  455    H    LEU   6           H        LEU   6 -13.212   4.628  -1.020
  456    HA   LEU   6           HA       LEU   6 -10.455   5.579  -0.733
  457   1HB   LEU   6          1HB       LEU   6 -10.138   3.643   0.855
  458   2HB   LEU   6          2HB       LEU   6 -10.974   5.078   1.472
  459    HG   LEU   6           HG       LEU   6 -11.967   2.984   2.276
  460   1HD1  LEU   6          1HD1      LEU   6 -13.991   3.922   2.323
  461   2HD1  LEU   6          2HD1      LEU   6 -13.291   5.198   1.297
  462   3HD1  LEU   6          3HD1      LEU   6 -14.172   3.841   0.555
  463   1HD2  LEU   6          1HD2      LEU   6 -12.692   1.260   0.979
  464   2HD2  LEU   6          2HD2      LEU   6 -13.073   2.308  -0.408
  465   3HD2  LEU   6          3HD2      LEU   6 -11.384   1.863  -0.067
  466    H    SER   7           H        SER   7 -12.529   4.252  -2.782
  467    HA   SER   7           HA       SER   7 -10.796   2.012  -3.454
  468   1HB   SER   7          1HB       SER   7 -13.618   2.315  -3.389
  469   2HB   SER   7          2HB       SER   7 -13.182   2.187  -5.103
  470    HG   SER   7           HG       SER   7 -12.023   0.214  -4.576
  471    H    ALA   8           H        ALA   8 -11.562   1.834  -6.235
  472    HA   ALA   8           HA       ALA   8  -9.706   3.546  -7.385
  473   1HB   ALA   8          1HB       ALA   8 -10.977   2.814  -9.533
  474   2HB   ALA   8          2HB       ALA   8 -10.215   1.554  -8.535
  475   3HB   ALA   8          3HB       ALA   8 -11.970   1.831  -8.431
  476    H    ASN   9           H        ASN   9 -10.132   5.701  -6.622
  477    HA   ASN   9           HA       ASN   9 -11.397   7.313  -8.335
  478   1HB   ASN   9          1HB       ASN   9 -13.594   6.524  -7.894
  479   2HB   ASN   9          2HB       ASN   9 -13.286   6.332  -6.161
  480   1HD2  ASN   9          1HD2      ASN   9 -12.673   9.000  -8.432
  481   2HD2  ASN   9          2HD2      ASN   9 -13.601  10.210  -7.611
  482    H    GLN  10           H        GLN  10 -10.607   6.453  -4.973
  483    HA   GLN  10           HA       GLN  10 -10.641   9.019  -3.904
  484   1HB   GLN  10          1HB       GLN  10 -10.653   7.044  -2.493
  485   2HB   GLN  10          2HB       GLN  10  -9.071   6.531  -3.106
  486   1HG   GLN  10          1HG       GLN  10  -7.959   8.345  -2.022
  487   2HG   GLN  10          2HG       GLN  10  -9.472   9.215  -1.729
  488   1HE2  GLN  10          1HE2      GLN  10  -7.863   6.109  -1.077
  489   2HE2  GLN  10          2HE2      GLN  10  -8.422   5.906   0.550
  490    H    CYS  11           H        CYS  11  -8.258   7.212  -5.831
  491    HA   CYS  11           HA       CYS  11  -6.052   8.833  -5.224
  492   1HB   CYS  11          1HB       CYS  11  -5.796   6.625  -6.151
  493   2HB   CYS  11          2HB       CYS  11  -6.638   7.098  -7.630
  494    H    ALA  12           H        ALA  12  -8.993   9.626  -6.596
  495    HA   ALA  12           HA       ALA  12  -7.766  11.703  -8.279
  496   1HB   ALA  12          1HB       ALA  12 -10.604  10.907  -8.725
  497   2HB   ALA  12          2HB       ALA  12  -9.339  11.342  -9.899
  498   3HB   ALA  12          3HB       ALA  12  -9.369   9.712  -9.187
  499    H    VAL  13           H        VAL  13  -8.764  11.275  -5.265
  500    HA   VAL  13           HA       VAL  13 -10.942  12.727  -4.680
  501    HB   VAL  13           HB       VAL  13  -8.728  11.746  -3.346
  502   1HG1  VAL  13          1HG1      VAL  13  -7.560  13.883  -3.527
  503   2HG1  VAL  13          2HG1      VAL  13  -8.952  14.727  -2.808
  504   3HG1  VAL  13          3HG1      VAL  13  -8.016  13.566  -1.835
  505   1HG2  VAL  13          1HG2      VAL  13 -10.401  11.411  -1.912
  506   2HG2  VAL  13          2HG2      VAL  13 -10.346  13.131  -1.460
  507   3HG2  VAL  13          3HG2      VAL  13 -11.410  12.592  -2.782
  508    HA   PRO  14           HA       PRO  14 -10.285  16.853  -5.787
  509   1HB   PRO  14          1HB       PRO  14 -11.361  18.292  -3.733
  510   2HB   PRO  14          2HB       PRO  14 -12.335  17.526  -4.985
  511   1HG   PRO  14          1HG       PRO  14 -11.848  16.706  -2.194
  512   2HG   PRO  14          2HG       PRO  14 -13.186  16.211  -3.293
  513   1HD   PRO  14          1HD       PRO  14 -10.880  14.706  -2.507
  514   2HD   PRO  14          2HD       PRO  14 -12.084  14.238  -3.716
  515    H    ALA  15           H        ALA  15  -8.091  15.510  -4.333
  516    HA   ALA  15           HA       ALA  15  -6.171  16.027  -3.343
  517   1HB   ALA  15          1HB       ALA  15  -5.234  18.320  -4.155
  518   2HB   ALA  15          2HB       ALA  15  -5.591  17.070  -5.370
  519   3HB   ALA  15          3HB       ALA  15  -6.730  18.415  -5.114
  520    H    LYS  16           H        LYS  16  -7.507  15.984  -1.268
  521    HA   LYS  16           HA       LYS  16  -6.652  17.830   0.498
  522   1HB   LYS  16          1HB       LYS  16  -8.912  19.124   0.815
  523   2HB   LYS  16          2HB       LYS  16  -7.681  19.711  -0.318
  524   1HG   LYS  16          1HG       LYS  16  -9.127  19.512  -2.029
  525   2HG   LYS  16          2HG       LYS  16  -9.386  17.796  -1.669
  526   1HD   LYS  16          1HD       LYS  16 -10.758  19.994  -0.090
  527   2HD   LYS  16          2HD       LYS  16 -11.449  19.381  -1.602
  528   1HE   LYS  16          1HE       LYS  16 -12.381  17.704  -0.419
  529   2HE   LYS  16          2HE       LYS  16 -10.759  17.085  -0.070
  530   1HZ   LYS  16          1HZ       LYS  16 -12.326  18.986   1.525
  531   2HZ   LYS  16          2HZ       LYS  16 -11.844  17.485   1.957
  532   3HZ   LYS  16          3HZ       LYS  16 -10.745  18.684   1.804
  533    H    ASP  17           H        ASP  17  -7.112  15.057   0.297
  534    HA   ASP  17           HA       ASP  17  -8.588  14.716   2.687
  535   1HB   ASP  17          1HB       ASP  17 -10.318  14.676   0.768
  536   2HB   ASP  17          2HB       ASP  17  -9.564  13.158   0.259
  537    H    ARG  18           H        ARG  18  -5.961  14.234   0.946
  538    HA   ARG  18           HA       ARG  18  -5.798  11.372   1.129
  539   1HB   ARG  18          1HB       ARG  18  -3.669  13.382   0.267
  540   2HB   ARG  18          2HB       ARG  18  -3.638  11.634  -0.027
  541   1HG   ARG  18          1HG       ARG  18  -5.164  11.767  -1.741
  542   2HG   ARG  18          2HG       ARG  18  -6.050  13.115  -1.008
  543   1HD   ARG  18          1HD       ARG  18  -4.422  14.710  -1.761
  544   2HD   ARG  18          2HD       ARG  18  -3.256  13.446  -2.178
  545    HE   ARG  18           HE       ARG  18  -5.795  13.238  -3.626
  546   1HH1  ARG  18          1HH1      ARG  18  -2.594  14.699  -3.614
  547   2HH1  ARG  18          2HH1      ARG  18  -2.567  14.962  -5.326
  548   1HH2  ARG  18          1HH2      ARG  18  -5.761  13.584  -5.884
  549   2HH2  ARG  18          2HH2      ARG  18  -4.381  14.324  -6.626
  550    H    VAL  19           H        VAL  19  -3.547  10.516   2.056
  551    HA   VAL  19           HA       VAL  19  -3.284  11.726   4.695
  552    HB   VAL  19           HB       VAL  19  -2.143   9.114   3.715
  553   1HG1  VAL  19          1HG1      VAL  19  -2.866  10.159   6.473
  554   2HG1  VAL  19          2HG1      VAL  19  -2.291   8.512   6.118
  555   3HG1  VAL  19          3HG1      VAL  19  -1.228   9.909   5.822
  556   1HG2  VAL  19          1HG2      VAL  19  -4.427   8.834   3.228
  557   2HG2  VAL  19          2HG2      VAL  19  -4.227   8.120   4.846
  558   3HG2  VAL  19          3HG2      VAL  19  -4.940   9.742   4.672
  559    H    ASP  20           H        ASP  20  -2.094  12.629   1.929
  560    HA   ASP  20           HA       ASP  20  -0.137  13.174   1.069
  561   1HB   ASP  20          1HB       ASP  20  -0.344  15.122   2.323
  562   2HB   ASP  20          2HB       ASP  20  -0.245  14.270   3.872
  563    H    CYS  21           H        CYS  21   0.727  10.921   0.836
  564    HA   CYS  21           HA       CYS  21   1.965   9.425   2.685
  565   1HB   CYS  21          1HB       CYS  21   1.580   9.011   0.191
  566   2HB   CYS  21          2HB       CYS  21   3.156   9.765  -0.061
  567    H    GLY  22           H        GLY  22   3.221  12.320   0.953
  568   1HA   GLY  22          1HA       GLY  22   5.157  13.474   1.160
  569   2HA   GLY  22          2HA       GLY  22   4.814  13.337   2.872
  570    H    TYR  23           H        TYR  23   6.071  11.190   0.210
  571    HA   TYR  23           HA       TYR  23   7.876   9.962   2.128
  572   1HB   TYR  23          1HB       TYR  23   6.599   9.476  -0.526
  573   2HB   TYR  23          2HB       TYR  23   8.291   8.971  -0.494
  574    HD1  TYR  23           HD1      TYR  23   8.335   8.118   2.460
  575    HD2  TYR  23           HD2      TYR  23   5.586   7.334  -0.724
  576    HE1  TYR  23           HE1      TYR  23   7.641   5.945   3.584
  577    HE2  TYR  23           HE2      TYR  23   4.901   5.164   0.410
  578    HH   TYR  23           HH       TYR  23   4.886   4.207   2.599
  579    HA   PRO  24           HA       PRO  24  11.351  12.139   0.752
  580   1HB   PRO  24          1HB       PRO  24  13.357  10.379   1.338
  581   2HB   PRO  24          2HB       PRO  24  12.606  11.422   2.544
  582   1HG   PRO  24          1HG       PRO  24  12.238   8.540   2.033
  583   2HG   PRO  24          2HG       PRO  24  11.858   9.472   3.525
  584   1HD   PRO  24          1HD       PRO  24  10.051   8.477   1.537
  585   2HD   PRO  24          2HD       PRO  24   9.646   9.526   2.903
  586    H    HIS  25           H        HIS  25  10.217   9.474  -0.822
  587    HA   HIS  25           HA       HIS  25  12.111  10.006  -2.992
  588   1HB   HIS  25          1HB       HIS  25  11.758   7.595  -1.576
  589   2HB   HIS  25          2HB       HIS  25  10.990   7.351  -3.150
  590    HD1  HIS  25           HD1      HIS  25  12.760   8.491  -5.180
  591    HD2  HIS  25           HD2      HIS  25  14.334   6.782  -1.687
  592    HE1  HIS  25           HE1      HIS  25  15.182   7.886  -5.709
  593    HE2  HIS  25           HE2      HIS  25  16.112   6.890  -3.508
  594    H    VAL  26           H        VAL  26   9.156  10.747  -1.983
  595    HA   VAL  26           HA       VAL  26   7.222   9.812  -3.559
  596    HB   VAL  26           HB       VAL  26   6.713  11.480  -2.009
  597   1HG1  VAL  26          1HG1      VAL  26   9.151  12.580  -2.614
  598   2HG1  VAL  26          2HG1      VAL  26   8.030  13.788  -3.287
  599   3HG1  VAL  26          3HG1      VAL  26   7.921  13.331  -1.571
  600   1HG2  VAL  26          1HG2      VAL  26   5.664  11.594  -4.473
  601   2HG2  VAL  26          2HG2      VAL  26   5.190  12.715  -3.174
  602   3HG2  VAL  26          3HG2      VAL  26   6.374  13.226  -4.403
  603    H    THR  27           H        THR  27   7.068   9.342  -5.684
  604    HA   THR  27           HA       THR  27   7.635  11.280  -7.662
  605    HB   THR  27           HB       THR  27   9.897   9.833  -6.733
  606    HG1  THR  27           HG1      THR  27  10.713  11.309  -8.214
  607   1HG2  THR  27          1HG2      THR  27  10.537   8.779  -9.007
  608   2HG2  THR  27          2HG2      THR  27   9.397   7.837  -8.017
  609   3HG2  THR  27          3HG2      THR  27   8.800   8.798  -9.392
  610    HA   PRO  28           HA       PRO  28   5.030   8.673  -9.856
  611   1HB   PRO  28          1HB       PRO  28   5.677   9.177 -12.460
  612   2HB   PRO  28          2HB       PRO  28   4.667  10.249 -11.495
  613   1HG   PRO  28          1HG       PRO  28   7.495  10.512 -12.288
  614   2HG   PRO  28          2HG       PRO  28   6.360  11.797 -11.735
  615   1HD   PRO  28          1HD       PRO  28   8.491  10.557 -10.278
  616   2HD   PRO  28          2HD       PRO  28   7.303  11.700  -9.640
  617    H    LYS  29           H        LYS  29   6.941   7.167  -8.709
  618    HA   LYS  29           HA       LYS  29   6.855   4.888 -10.272
  619   1HB   LYS  29          1HB       LYS  29   8.591   6.526 -11.485
  620   2HB   LYS  29          2HB       LYS  29   9.698   5.764 -10.329
  621   1HG   LYS  29          1HG       LYS  29   9.596   3.751 -11.390
  622   2HG   LYS  29          2HG       LYS  29   7.853   3.876 -11.691
  623   1HD   LYS  29          1HD       LYS  29   9.315   5.854 -13.248
  624   2HD   LYS  29          2HD       LYS  29   9.962   4.233 -13.558
  625   1HE   LYS  29          1HE       LYS  29   7.535   3.483 -13.895
  626   2HE   LYS  29          2HE       LYS  29   7.085   5.196 -13.877
  627   1HZ   LYS  29          1HZ       LYS  29   9.204   4.268 -15.646
  628   2HZ   LYS  29          2HZ       LYS  29   7.645   4.043 -16.075
  629   3HZ   LYS  29          3HZ       LYS  29   8.209   5.552 -15.816
  630    H    GLU  30           H        GLU  30   7.919   6.864  -7.632
  631    HA   GLU  30           HA       GLU  30   9.012   4.542  -6.281
  632   1HB   GLU  30          1HB       GLU  30   9.436   7.438  -6.149
  633   2HB   GLU  30          2HB       GLU  30   9.212   6.730  -4.540
  634   1HG   GLU  30          1HG       GLU  30  11.612   6.810  -5.444
  635   2HG   GLU  30          2HG       GLU  30  11.066   5.241  -4.835
  636    H    CYS  31           H        CYS  31   6.472   7.095  -6.004
  637    HA   CYS  31           HA       CYS  31   5.452   6.350  -3.561
  638   1HB   CYS  31          1HB       CYS  31   4.093   7.540  -5.976
  639   2HB   CYS  31          2HB       CYS  31   3.311   7.369  -4.402
  640    H    ASN  32           H        ASN  32   4.356   5.389  -6.903
  641    HA   ASN  32           HA       ASN  32   2.482   3.573  -6.054
  642   1HB   ASN  32          1HB       ASN  32   4.007   4.122  -8.563
  643   2HB   ASN  32          2HB       ASN  32   3.305   2.501  -8.456
  644   1HD2  ASN  32          1HD2      ASN  32   2.190   5.603  -7.142
  645   2HD2  ASN  32          2HD2      ASN  32   0.677   5.674  -7.983
  646    H    ASN  33           H        ASN  33   5.917   3.520  -5.820
  647    HA   ASN  33           HA       ASN  33   6.135   0.667  -6.040
  648   1HB   ASN  33          1HB       ASN  33   7.897   2.622  -6.608
  649   2HB   ASN  33          2HB       ASN  33   8.349   2.390  -4.912
  650   1HD2  ASN  33          1HD2      ASN  33  10.390   1.786  -5.985
  651   2HD2  ASN  33          2HD2      ASN  33  10.635   0.139  -6.459
  652    H    ARG  34           H        ARG  34   5.991   3.302  -3.618
  653    HA   ARG  34           HA       ARG  34   6.690   1.546  -1.482
  654   1HB   ARG  34          1HB       ARG  34   5.480   4.330  -1.245
  655   2HB   ARG  34          2HB       ARG  34   6.519   3.503  -0.070
  656   1HG   ARG  34          1HG       ARG  34   7.906   3.615  -2.584
  657   2HG   ARG  34          2HG       ARG  34   7.282   5.238  -2.238
  658   1HD   ARG  34          1HD       ARG  34   8.775   5.544  -0.557
  659   2HD   ARG  34          2HD       ARG  34   8.452   3.950   0.141
  660    HE   ARG  34           HE       ARG  34   9.941   3.554  -2.242
  661   1HH1  ARG  34          1HH1      ARG  34  10.388   5.024   0.924
  662   2HH1  ARG  34          2HH1      ARG  34  12.099   4.747   0.952
  663   1HH2  ARG  34          1HH2      ARG  34  12.196   3.189  -2.206
  664   2HH2  ARG  34          2HH2      ARG  34  13.133   3.695  -0.841
  665    H    GLY  35           H        GLY  35   3.806   2.701  -3.149
  666   1HA   GLY  35          1HA       GLY  35   1.841   1.297  -2.847
  667   2HA   GLY  35          2HA       GLY  35   2.122   1.358  -1.118
  668    H    CYS  36           H        CYS  36   2.749   4.237  -3.092
  669    HA   CYS  36           HA       CYS  36   0.323   5.416  -1.945
  670   1HB   CYS  36          1HB       CYS  36   2.961   6.736  -2.589
  671   2HB   CYS  36          2HB       CYS  36   1.513   7.579  -2.031
  672    H    CYS  37           H        CYS  37  -0.369   7.436  -3.380
  673    HA   CYS  37           HA       CYS  37  -0.142   6.581  -6.173
  674   1HB   CYS  37          1HB       CYS  37  -2.400   6.470  -4.906
  675   2HB   CYS  37          2HB       CYS  37  -2.427   8.221  -5.124
  676    H    PHE  38           H        PHE  38   0.763   8.075  -7.575
  677    HA   PHE  38           HA       PHE  38   1.476  10.646  -6.422
  678   1HB   PHE  38          1HB       PHE  38   3.123   9.084  -7.576
  679   2HB   PHE  38          2HB       PHE  38   2.182   9.232  -9.064
  680    HD1  PHE  38           HD1      PHE  38   2.593  10.999 -10.549
  681    HD2  PHE  38           HD2      PHE  38   4.196  11.173  -6.623
  682    HE1  PHE  38           HE1      PHE  38   3.955  13.006 -11.194
  683    HE2  PHE  38           HE2      PHE  38   5.558  13.181  -7.268
  684    HZ   PHE  38           HZ       PHE  38   5.421  14.073  -9.546
  685    H    ASP  39           H        ASP  39   0.213  12.400  -6.796
  686    HA   ASP  39           HA       ASP  39  -1.737  12.244  -8.872
  687   1HB   ASP  39          1HB       ASP  39  -2.350  13.253  -6.747
  688   2HB   ASP  39          2HB       ASP  39  -1.003  14.397  -6.840
  689    H    SER  40           H        SER  40   0.266  15.112  -7.921
  690    HA   SER  40           HA       SER  40   1.815  16.220  -9.055
  691   1HB   SER  40          1HB       SER  40   2.142  14.023 -10.425
  692   2HB   SER  40          2HB       SER  40   1.158  14.823 -11.664
  693    HG   SER  40           HG       SER  40   3.425  15.182 -12.017
  694    H    ARG  41           H        ARG  41  -1.496  15.700  -9.860
  695    HA   ARG  41           HA       ARG  41  -1.818  17.588 -11.858
  696   1HB   ARG  41          1HB       ARG  41  -3.742  16.596  -9.706
  697   2HB   ARG  41          2HB       ARG  41  -4.249  17.566 -11.100
  698   1HG   ARG  41          1HG       ARG  41  -2.786  15.549 -12.296
  699   2HG   ARG  41          2HG       ARG  41  -3.529  14.691 -10.935
  700   1HD   ARG  41          1HD       ARG  41  -5.522  14.667 -12.000
  701   2HD   ARG  41          2HD       ARG  41  -5.497  16.426 -12.189
  702    HE   ARG  41           HE       ARG  41  -4.776  16.135 -14.397
  703   1HH1  ARG  41          1HH1      ARG  41  -4.283  13.139 -12.620
  704   2HH1  ARG  41          2HH1      ARG  41  -3.834  12.229 -14.025
  705   1HH2  ARG  41          1HH2      ARG  41  -4.184  14.937 -16.251
  706   2HH2  ARG  41          2HH2      ARG  41  -3.777  13.261 -16.103
  707    H    ILE  42           H        ILE  42  -1.940  17.775  -8.254
  708    HA   ILE  42           HA       ILE  42  -1.956  20.701  -8.528
  709    HB   ILE  42           HB       ILE  42  -3.065  19.360  -6.104
  710   1HG1  ILE  42          1HG1      ILE  42  -4.501  19.632  -8.747
  711   2HG1  ILE  42          2HG1      ILE  42  -4.225  18.151  -7.815
  712   1HG2  ILE  42          1HG2      ILE  42  -3.488  21.981  -7.544
  713   2HG2  ILE  42          2HG2      ILE  42  -4.570  21.407  -6.253
  714   3HG2  ILE  42          3HG2      ILE  42  -2.848  21.697  -5.908
  715   1HD1  ILE  42          1HD1      ILE  42  -5.507  19.691  -5.946
  716   2HD1  ILE  42          2HD1      ILE  42  -6.248  20.308  -7.442
  717   3HD1  ILE  42          3HD1      ILE  42  -6.347  18.575  -7.049
  718    HA   PRO  43           HA       PRO  43   1.884  19.987  -6.532
  719   1HB   PRO  43          1HB       PRO  43   2.933  22.467  -6.993
  720   2HB   PRO  43          2HB       PRO  43   3.071  21.134  -8.137
  721   1HG   PRO  43          1HG       PRO  43   1.306  23.496  -8.183
  722   2HG   PRO  43          2HG       PRO  43   1.784  22.425  -9.550
  723   1HD   PRO  43          1HD       PRO  43  -0.711  22.516  -8.144
  724   2HD   PRO  43          2HD       PRO  43  -0.233  21.336  -9.372
  725    H    GLY  44           H        GLY  44  -0.699  21.849  -5.670
  726   1HA   GLY  44          1HA       GLY  44   0.614  23.000  -3.328
  727   2HA   GLY  44          2HA       GLY  44  -1.026  23.278  -3.878
  728    H    VAL  45           H        VAL  45  -0.756  20.011  -4.234
  729    HA   VAL  45           HA       VAL  45  -1.525  19.505  -1.442
  730    HB   VAL  45           HB       VAL  45  -3.307  18.203  -2.115
  731   1HG1  VAL  45          1HG1      VAL  45  -3.088  20.807  -3.210
  732   2HG1  VAL  45          2HG1      VAL  45  -3.887  19.799  -4.441
  733   3HG1  VAL  45          3HG1      VAL  45  -4.568  19.909  -2.800
  734   1HG2  VAL  45          1HG2      VAL  45  -3.436  17.868  -4.837
  735   2HG2  VAL  45          2HG2      VAL  45  -1.687  17.744  -4.534
  736   3HG2  VAL  45          3HG2      VAL  45  -2.815  16.663  -3.684
  737    HA   PRO  46           HA       PRO  46   1.101  16.054  -1.570
  738   1HB   PRO  46          1HB       PRO  46  -0.335  13.879  -0.749
  739   2HB   PRO  46          2HB       PRO  46   0.282  15.102   0.361
  740   1HG   PRO  46          1HG       PRO  46  -2.454  14.671  -0.654
  741   2HG   PRO  46          2HG       PRO  46  -1.930  15.580   0.808
  742   1HD   PRO  46          1HD       PRO  46  -2.821  16.616  -1.709
  743   2HD   PRO  46          2HD       PRO  46  -2.165  17.548  -0.356
  744    H    TRP  47           H        TRP  47   2.142  15.355  -3.315
  745    HA   TRP  47           HA       TRP  47   0.463  14.188  -5.385
  746   1HB   TRP  47          1HB       TRP  47   3.288  14.337  -5.978
  747   2HB   TRP  47          2HB       TRP  47   1.909  15.042  -6.826
  748    HD1  TRP  47           HD1      TRP  47   1.123  17.564  -5.881
  749    HE1  TRP  47           HE1      TRP  47   2.482  19.563  -4.822
  750    HE3  TRP  47           HE3      TRP  47   5.189  14.801  -4.579
  751    HZ2  TRP  47           HZ2      TRP  47   5.046  19.759  -3.584
  752    HZ3  TRP  47           HZ3      TRP  47   7.076  15.973  -3.449
  753    HH2  TRP  47           HH2      TRP  47   7.050  18.366  -2.949
  754    H    CYS  48           H        CYS  48   0.941  12.824  -2.770
  755    HA   CYS  48           HA       CYS  48   1.592  10.296  -3.809
  756   1HB   CYS  48          1HB       CYS  48   3.877  11.254  -3.620
  757   2HB   CYS  48          2HB       CYS  48   3.633  11.414  -1.878
  758    H    PHE  49           H        PHE  49  -0.152   9.341  -2.792
  759    HA   PHE  49           HA       PHE  49  -0.187   9.441   0.105
  760   1HB   PHE  49          1HB       PHE  49  -2.845   9.722  -0.387
  761   2HB   PHE  49          2HB       PHE  49  -1.803  11.135  -0.191
  762    HD1  PHE  49           HD1      PHE  49  -0.690  11.980  -2.435
  763    HD2  PHE  49           HD2      PHE  49  -4.199   9.601  -2.238
  764    HE1  PHE  49           HE1      PHE  49  -1.352  12.768  -4.724
  765    HE2  PHE  49           HE2      PHE  49  -4.862  10.390  -4.528
  766    HZ   PHE  49           HZ       PHE  49  -3.431  11.964  -5.742
  767    H    LYS  50           H        LYS  50  -2.607   8.112   0.549
  768    HA   LYS  50           HA       LYS  50  -2.229   5.647  -1.006
  769   1HB   LYS  50          1HB       LYS  50  -3.319   5.257   1.662
  770   2HB   LYS  50          2HB       LYS  50  -1.963   4.447   0.858
  771   1HG   LYS  50          1HG       LYS  50  -1.706   7.269   1.931
  772   2HG   LYS  50          2HG       LYS  50  -1.482   5.873   2.998
  773   1HD   LYS  50          1HD       LYS  50   0.204   5.021   1.239
  774   2HD   LYS  50          2HD       LYS  50   0.133   6.646   0.535
  775   1HE   LYS  50          1HE       LYS  50   1.947   5.998   2.384
  776   2HE   LYS  50          2HE       LYS  50   1.226   7.614   2.352
  777   1HZ   LYS  50          1HZ       LYS  50   0.168   5.391   3.951
  778   2HZ   LYS  50          2HZ       LYS  50   1.216   6.500   4.534
  779   3HZ   LYS  50          3HZ       LYS  50  -0.269   6.962   4.036
  780    HA   PRO  51           HA       PRO  51  -6.480   7.133  -1.486
  781   1HB   PRO  51          1HB       PRO  51  -6.548   7.164  -4.216
  782   2HB   PRO  51          2HB       PRO  51  -6.191   8.591  -3.246
  783   1HG   PRO  51          1HG       PRO  51  -4.383   6.842  -4.786
  784   2HG   PRO  51          2HG       PRO  51  -4.098   8.525  -4.215
  785   1HD   PRO  51          1HD       PRO  51  -3.041   6.083  -3.156
  786   2HD   PRO  51          2HD       PRO  51  -2.862   7.700  -2.462
  787    H    LEU  52           H        LEU  52  -6.132   5.457  -4.457
  788    HA   LEU  52           HA       LEU  52  -7.659   3.273  -3.248
  789   1HB   LEU  52          1HB       LEU  52  -8.717   2.978  -5.221
  790   2HB   LEU  52          2HB       LEU  52  -8.441   4.729  -5.259
  791    HG   LEU  52           HG       LEU  52  -6.200   3.564  -6.504
  792   1HD1  LEU  52          1HD1      LEU  52  -7.836   2.464  -8.401
  793   2HD1  LEU  52          2HD1      LEU  52  -6.900   1.551  -7.191
  794   3HD1  LEU  52          3HD1      LEU  52  -8.612   1.930  -6.891
  795   1HD2  LEU  52          1HD2      LEU  52  -6.634   5.148  -8.018
  796   2HD2  LEU  52          2HD2      LEU  52  -8.281   4.544  -8.319
  797   3HD2  LEU  52          3HD2      LEU  52  -7.967   5.626  -6.941
  798    H    GLN  53           H        GLN  53  -4.926   3.356  -2.603
  799    HA   GLN  53           HA       GLN  53  -3.204   2.161  -4.303
  800   1HB   GLN  53          1HB       GLN  53  -3.498   1.765  -1.302
  801   2HB   GLN  53          2HB       GLN  53  -2.064   1.285  -2.228
  802   1HG   GLN  53          1HG       GLN  53  -3.199   4.107  -2.000
  803   2HG   GLN  53          2HG       GLN  53  -1.763   3.509  -1.154
  804   1HE2  GLN  53          1HE2      GLN  53  -0.865   1.865  -3.352
  805   2HE2  GLN  53          2HE2      GLN  53  -0.213   2.910  -4.570
  806    H    GLU  54           H        GLU  54  -6.110   0.832  -2.951
  807    HA   GLU  54           HA       GLU  54  -5.625  -1.762  -2.574
  808   1HB   GLU  54          1HB       GLU  54  -7.909  -0.163  -3.542
  809   2HB   GLU  54          2HB       GLU  54  -7.993  -1.869  -4.011
  810   1HG   GLU  54          1HG       GLU  54  -8.022  -2.606  -1.774
  811   2HG   GLU  54          2HG       GLU  54  -7.309  -1.107  -1.159
  812    H    ALA  55           H        ALA  55  -5.276   0.012  -5.575
  813    HA   ALA  55           HA       ALA  55  -5.704  -1.732  -7.554
  814   1HB   ALA  55          1HB       ALA  55  -4.087   0.576  -7.093
  815   2HB   ALA  55          2HB       ALA  55  -3.085  -0.613  -7.959
  816   3HB   ALA  55          3HB       ALA  55  -4.639  -0.087  -8.648
  817    H    GLU  56           H        GLU  56  -2.286  -1.489  -6.434
  818    HA   GLU  56           HA       GLU  56  -2.234  -4.404  -6.556
  819   1HB   GLU  56          1HB       GLU  56  -0.169  -2.315  -7.294
  820   2HB   GLU  56          2HB       GLU  56   0.296  -3.999  -6.991
  821   1HG   GLU  56          1HG       GLU  56  -1.467  -4.663  -8.716
  822   2HG   GLU  56          2HG       GLU  56  -1.622  -2.945  -9.117
  823    H    CYS  57           H        CYS  57  -2.733  -2.249  -4.308
  824    HA   CYS  57           HA       CYS  57  -0.504  -2.863  -2.567
  825   1HB   CYS  57          1HB       CYS  57  -1.581  -0.572  -2.791
  826   2HB   CYS  57          2HB       CYS  57  -2.944  -1.229  -1.883
  827    H    THR  58           H        THR  58  -4.132  -2.846  -2.211
  828    HA   THR  58           HA       THR  58  -4.227  -4.616  -0.089
  829    HB   THR  58           HB       THR  58  -6.056  -3.089  -1.008
  830    HG1  THR  58           HG1      THR  58  -7.640  -4.746  -0.409
  831   1HG2  THR  58          1HG2      THR  58  -6.829  -3.437  -3.129
  832   2HG2  THR  58          2HG2      THR  58  -5.730  -4.824  -3.319
  833   3HG2  THR  58          3HG2      THR  58  -7.355  -5.063  -2.635
  834    H    PHE  59           H        PHE  59  -3.799  -5.239  -3.556
  835    HA   PHE  59           HA       PHE  59  -4.593  -7.731  -3.936
  836   1HB   PHE  59          1HB       PHE  59  -2.515  -5.944  -4.840
  837   2HB   PHE  59          2HB       PHE  59  -1.756  -7.530  -4.655
  838    HD1  PHE  59           HD1      PHE  59  -4.916  -6.090  -6.051
  839    HD2  PHE  59           HD2      PHE  59  -1.733  -8.855  -6.533
  840    HE1  PHE  59           HE1      PHE  59  -5.848  -6.777  -8.278
  841    HE2  PHE  59           HE2      PHE  59  -2.664  -9.541  -8.759
  842    HZ   PHE  59           HZ       PHE  59  -4.711  -8.493  -9.605
  Start of MODEL   31
    1   1H    GLU   1           H1       GLU   1 -15.790  -5.503  -0.400
    2    HA   GLU   1           HA       GLU   1 -16.898  -5.477   2.299
    3   1HB   GLU   1          1HB       GLU   1 -18.346  -5.230   0.065
    4   2HB   GLU   1          2HB       GLU   1 -18.242  -6.998   0.081
    5   1HG   GLU   1          1HG       GLU   1 -18.880  -5.806   2.710
    6   2HG   GLU   1          2HG       GLU   1 -20.102  -5.471   1.474
    7    H    GLU   2           H        GLU   2 -16.536  -7.902  -0.392
    8    HA   GLU   2           HA       GLU   2 -16.143  -9.989   1.423
    9   1HB   GLU   2          1HB       GLU   2 -15.921  -9.633  -1.551
   10   2HB   GLU   2          2HB       GLU   2 -15.239 -11.103  -0.833
   11   1HG   GLU   2          1HG       GLU   2 -18.078 -10.132  -0.315
   12   2HG   GLU   2          2HG       GLU   2 -17.673 -11.270  -1.609
   13    H    TYR   3           H        TYR   3 -14.421  -8.743   2.722
   14    HA   TYR   3           HA       TYR   3 -11.832  -8.506   1.538
   15   1HB   TYR   3          1HB       TYR   3 -13.148  -8.368   4.298
   16   2HB   TYR   3          2HB       TYR   3 -11.391  -8.242   4.163
   17    HD1  TYR   3           HD1      TYR   3 -10.876  -6.532   1.932
   18    HD2  TYR   3           HD2      TYR   3 -14.083  -6.310   4.756
   19    HE1  TYR   3           HE1      TYR   3 -11.108  -4.040   1.484
   20    HE2  TYR   3           HE2      TYR   3 -14.304  -3.819   4.298
   21    HH   TYR   3           HH       TYR   3 -13.541  -2.115   3.222
   22    H    VAL   4           H        VAL   4 -11.202 -10.568   0.754
   23    HA   VAL   4           HA       VAL   4 -10.568 -12.451   2.912
   24    HB   VAL   4           HB       VAL   4 -11.016 -14.255   1.181
   25   1HG1  VAL   4          1HG1      VAL   4 -13.059 -14.620   2.115
   26   2HG1  VAL   4          2HG1      VAL   4 -12.553 -13.273   3.162
   27   3HG1  VAL   4          3HG1      VAL   4 -13.632 -12.968   1.780
   28   1HG2  VAL   4          1HG2      VAL   4 -12.050 -11.852  -0.259
   29   2HG2  VAL   4          2HG2      VAL   4 -11.287 -13.331  -0.893
   30   3HG2  VAL   4          3HG2      VAL   4 -12.992 -13.358  -0.381
   31    H    GLY   5           H        GLY   5 -10.030 -11.914  -0.649
   32   1HA   GLY   5          1HA       GLY   5  -7.410 -12.966  -0.613
   33   2HA   GLY   5          2HA       GLY   5  -8.145 -11.997  -1.875
   34    H    LEU   6           H        LEU   6  -8.525 -10.257   0.989
   35    HA   LEU   6           HA       LEU   6  -5.874  -9.147   1.085
   36   1HB   LEU   6          1HB       LEU   6  -7.150  -6.821   0.710
   37   2HB   LEU   6          2HB       LEU   6  -6.253  -7.687  -0.552
   38    HG   LEU   6           HG       LEU   6  -8.221  -8.451  -1.578
   39   1HD1  LEU   6          1HD1      LEU   6 -10.470  -7.699  -0.223
   40   2HD1  LEU   6          2HD1      LEU   6  -9.745  -9.325  -0.187
   41   3HD1  LEU   6          3HD1      LEU   6  -9.384  -8.160   1.109
   42   1HD2  LEU   6          1HD2      LEU   6  -8.230  -5.607  -0.732
   43   2HD2  LEU   6          2HD2      LEU   6  -8.194  -6.330  -2.358
   44   3HD2  LEU   6          3HD2      LEU   6  -9.729  -6.229  -1.461
   45    H    SER   7           H        SER   7  -7.648 -10.628   2.871
   46    HA   SER   7           HA       SER   7  -8.684  -8.612   4.633
   47   1HB   SER   7          1HB       SER   7  -9.551 -11.096   4.046
   48   2HB   SER   7          2HB       SER   7  -8.557 -11.492   5.460
   49    HG   SER   7           HG       SER   7 -10.300  -9.265   5.698
   50    H    ALA   8           H        ALA   8  -8.185  -9.363   7.173
   51    HA   ALA   8           HA       ALA   8  -5.481  -8.658   7.541
   52   1HB   ALA   8          1HB       ALA   8  -7.754  -9.554   9.329
   53   2HB   ALA   8          2HB       ALA   8  -6.123  -9.274   9.981
   54   3HB   ALA   8          3HB       ALA   8  -7.006  -7.945   9.194
   55    H    ASN   9           H        ASN   9  -6.947 -11.594   6.641
   56    HA   ASN   9           HA       ASN   9  -5.014 -13.194   8.062
   57   1HB   ASN   9          1HB       ASN   9  -7.643 -13.626   7.182
   58   2HB   ASN   9          2HB       ASN   9  -6.679 -14.567   6.034
   59   1HD2  ASN   9          1HD2      ASN   9  -5.006 -15.984   6.974
   60   2HD2  ASN   9          2HD2      ASN   9  -5.353 -16.833   8.444
   61    H    GLN  10           H        GLN  10  -5.215 -11.348   5.232
   62    HA   GLN  10           HA       GLN  10  -4.127 -13.098   3.350
   63   1HB   GLN  10          1HB       GLN  10  -5.196 -10.579   3.299
   64   2HB   GLN  10          2HB       GLN  10  -3.478 -10.209   3.069
   65   1HG   GLN  10          1HG       GLN  10  -4.309 -12.503   1.457
   66   2HG   GLN  10          2HG       GLN  10  -5.310 -11.086   1.105
   67   1HE2  GLN  10          1HE2      GLN  10  -3.845  -8.978   1.191
   68   2HE2  GLN  10          2HE2      GLN  10  -2.457  -9.024   0.156
   69    H    CYS  11           H        CYS  11  -2.737 -10.988   5.870
   70    HA   CYS  11           HA       CYS  11  -0.088 -11.172   4.873
   71   1HB   CYS  11          1HB       CYS  11  -0.759  -9.289   6.204
   72   2HB   CYS  11          2HB       CYS  11  -1.181 -10.333   7.564
   73    H    ALA  12           H        ALA  12  -2.181 -13.478   6.049
   74    HA   ALA  12           HA       ALA  12  -0.043 -14.934   7.445
   75   1HB   ALA  12          1HB       ALA  12  -1.596 -15.664   8.928
   76   2HB   ALA  12          2HB       ALA  12  -2.571 -14.297   8.336
   77   3HB   ALA  12          3HB       ALA  12  -2.819 -15.926   7.661
   78    H    VAL  13           H        VAL  13  -1.030 -14.514   4.423
   79    HA   VAL  13           HA       VAL  13  -2.069 -16.728   3.342
   80    HB   VAL  13           HB       VAL  13  -0.665 -14.519   2.474
   81   1HG1  VAL  13          1HG1      VAL  13   0.758 -16.986   1.422
   82   2HG1  VAL  13          2HG1      VAL  13   1.031 -15.302   0.918
   83   3HG1  VAL  13          3HG1      VAL  13   1.447 -15.815   2.571
   84   1HG2  VAL  13          1HG2      VAL  13  -1.198 -16.249   0.241
   85   2HG2  VAL  13          2HG2      VAL  13  -2.484 -16.445   1.457
   86   3HG2  VAL  13          3HG2      VAL  13  -2.111 -14.830   0.807
   87    HA   PRO  14           HA       PRO  14   0.589 -20.064   4.029
   88   1HB   PRO  14          1HB       PRO  14   0.315 -21.561   1.760
   89   2HB   PRO  14          2HB       PRO  14  -0.871 -21.559   3.063
   90   1HG   PRO  14          1HG       PRO  14  -0.949 -20.239   0.426
   91   2HG   PRO  14          2HG       PRO  14  -2.319 -20.634   1.523
   92   1HD   PRO  14          1HD       PRO  14  -1.103 -18.087   1.037
   93   2HD   PRO  14          2HD       PRO  14  -2.342 -18.452   2.245
   94    H    ALA  15           H        ALA  15   1.793 -17.634   2.909
   95    HA   ALA  15           HA       ALA  15   3.686 -16.979   1.949
   96   1HB   ALA  15          1HB       ALA  15   4.610 -19.666   3.046
   97   2HB   ALA  15          2HB       ALA  15   5.680 -18.328   2.565
   98   3HB   ALA  15          3HB       ALA  15   4.563 -18.125   3.935
   99    H    LYS  16           H        LYS  16   2.525 -17.187  -0.180
  100    HA   LYS  16           HA       LYS  16   4.080 -18.078  -2.159
  101   1HB   LYS  16          1HB       LYS  16   2.775 -20.255  -2.799
  102   2HB   LYS  16          2HB       LYS  16   4.165 -20.325  -1.700
  103   1HG   LYS  16          1HG       LYS  16   2.865 -21.146  -0.057
  104   2HG   LYS  16          2HG       LYS  16   1.748 -19.774  -0.186
  105   1HD   LYS  16          1HD       LYS  16   1.657 -22.032  -2.197
  106   2HD   LYS  16          2HD       LYS  16   0.865 -22.219  -0.623
  107   1HE   LYS  16          1HE       LYS  16  -0.916 -21.167  -1.535
  108   2HE   LYS  16          2HE       LYS  16   0.043 -19.679  -1.506
  109   1HZ   LYS  16          1HZ       LYS  16   0.123 -21.612  -3.712
  110   2HZ   LYS  16          2HZ       LYS  16  -0.875 -20.320  -3.694
  111   3HZ   LYS  16          3HZ       LYS  16   0.744 -20.101  -3.697
  112    H    ASP  17           H        ASP  17   2.494 -15.918  -1.783
  113    HA   ASP  17           HA       ASP  17   0.829 -16.090  -4.053
  114   1HB   ASP  17          1HB       ASP  17  -0.623 -17.003  -2.156
  115   2HB   ASP  17          2HB       ASP  17  -0.534 -15.398  -1.412
  116    H    ARG  18           H        ARG  18   2.279 -14.499  -1.252
  117    HA   ARG  18           HA       ARG  18   1.393 -11.965  -1.461
  118   1HB   ARG  18          1HB       ARG  18   4.274 -12.838  -0.948
  119   2HB   ARG  18          2HB       ARG  18   3.569 -11.291  -0.448
  120   1HG   ARG  18          1HG       ARG  18   2.446 -12.231   1.312
  121   2HG   ARG  18          2HG       ARG  18   2.081 -13.725   0.431
  122   1HD   ARG  18          1HD       ARG  18   4.337 -14.558   0.811
  123   2HD   ARG  18          2HD       ARG  18   4.850 -13.012   1.507
  124    HE   ARG  18           HE       ARG  18   2.579 -14.343   2.850
  125   1HH1  ARG  18          1HH1      ARG  18   6.053 -13.793   2.784
  126   2HH1  ARG  18          2HH1      ARG  18   6.284 -14.244   4.440
  127   1HH2  ARG  18          1HH2      ARG  18   2.883 -14.937   5.035
  128   2HH2  ARG  18          2HH2      ARG  18   4.470 -14.899   5.729
  129    H    VAL  19           H        VAL  19   3.032 -10.027  -2.195
  130    HA   VAL  19           HA       VAL  19   3.659 -10.608  -5.003
  131    HB   VAL  19           HB       VAL  19   3.217  -7.877  -3.830
  132   1HG1  VAL  19          1HG1      VAL  19   2.379  -8.726  -6.577
  133   2HG1  VAL  19          2HG1      VAL  19   2.992  -7.157  -6.000
  134   3HG1  VAL  19          3HG1      VAL  19   4.116  -8.516  -6.246
  135   1HG2  VAL  19          1HG2      VAL  19   0.802  -8.398  -4.939
  136   2HG2  VAL  19          2HG2      VAL  19   1.197 -10.005  -4.284
  137   3HG2  VAL  19          3HG2      VAL  19   1.156  -8.589  -3.206
  138    H    ASP  20           H        ASP  20   5.283 -10.984  -2.378
  139    HA   ASP  20           HA       ASP  20   7.236 -10.415  -1.529
  140   1HB   ASP  20          1HB       ASP  20   8.201 -11.897  -3.008
  141   2HB   ASP  20          2HB       ASP  20   7.598 -11.042  -4.436
  142    H    CYS  21           H        CYS  21   6.896  -8.182  -0.833
  143    HA   CYS  21           HA       CYS  21   6.846  -5.970  -2.401
  144   1HB   CYS  21          1HB       CYS  21   6.733  -6.429   0.241
  145   2HB   CYS  21          2HB       CYS  21   8.346  -5.715   0.145
  146    H    GLY  22           H        GLY  22   9.593  -8.008  -1.385
  147   1HA   GLY  22          1HA       GLY  22  11.809  -7.897  -1.803
  148   2HA   GLY  22          2HA       GLY  22  11.295  -7.427  -3.411
  149    H    TYR  23           H        TYR  23  11.438  -5.866  -0.120
  150    HA   TYR  23           HA       TYR  23  12.229  -3.381  -1.399
  151   1HB   TYR  23          1HB       TYR  23  10.813  -4.341   0.933
  152   2HB   TYR  23          2HB       TYR  23  12.231  -3.479   1.539
  153    HD1  TYR  23           HD1      TYR  23   8.976  -3.181  -0.089
  154    HD2  TYR  23           HD2      TYR  23  12.514  -1.058   1.046
  155    HE1  TYR  23           HE1      TYR  23   7.763  -0.971  -0.411
  156    HE2  TYR  23           HE2      TYR  23  11.288   1.145   0.719
  157    HH   TYR  23           HH       TYR  23   7.999   1.203  -0.572
  158    HA   PRO  24           HA       PRO  24  16.420  -3.923  -0.436
  159   1HB   PRO  24          1HB       PRO  24  17.292  -1.349  -0.709
  160   2HB   PRO  24          2HB       PRO  24  17.055  -2.436  -2.075
  161   1HG   PRO  24          1HG       PRO  24  15.384  -0.202  -1.114
  162   2HG   PRO  24          2HG       PRO  24  15.401  -0.973  -2.742
  163   1HD   PRO  24          1HD       PRO  24  13.473  -1.279  -0.647
  164   2HD   PRO  24          2HD       PRO  24  13.531  -2.181  -2.166
  165    H    HIS  25           H        HIS  25  14.269  -2.286   1.499
  166    HA   HIS  25           HA       HIS  25  16.322  -2.165   3.587
  167   1HB   HIS  25          1HB       HIS  25  14.117  -0.270   2.875
  168   2HB   HIS  25          2HB       HIS  25  14.626  -0.405   4.563
  169    HD1  HIS  25           HD1      HIS  25  15.024   2.200   2.835
  170    HD2  HIS  25           HD2      HIS  25  17.938  -0.750   3.476
  171    HE1  HIS  25           HE1      HIS  25  17.281   3.332   2.466
  172    HE2  HIS  25           HE2      HIS  25  19.033   1.485   2.927
  173    H    VAL  26           H        VAL  26  14.242  -4.253   2.519
  174    HA   VAL  26           HA       VAL  26  12.136  -4.624   4.142
  175    HB   VAL  26           HB       VAL  26  12.531  -6.129   2.392
  176   1HG1  VAL  26          1HG1      VAL  26  15.239  -5.952   3.162
  177   2HG1  VAL  26          2HG1      VAL  26  14.797  -7.670   3.312
  178   3HG1  VAL  26          3HG1      VAL  26  14.558  -6.820   1.765
  179   1HG2  VAL  26          1HG2      VAL  26  11.761  -7.028   4.802
  180   2HG2  VAL  26          2HG2      VAL  26  11.886  -8.080   3.373
  181   3HG2  VAL  26          3HG2      VAL  26  13.202  -8.047   4.570
  182    H    THR  27           H        THR  27  11.749  -4.873   6.289
  183    HA   THR  27           HA       THR  27  13.551  -6.228   8.002
  184    HB   THR  27           HB       THR  27  14.039  -3.402   7.513
  185    HG1  THR  27           HG1      THR  27  15.818  -4.682   7.957
  186   1HG2  THR  27          1HG2      THR  27  14.298  -2.991  10.107
  187   2HG2  THR  27          2HG2      THR  27  12.710  -2.692   9.360
  188   3HG2  THR  27          3HG2      THR  27  13.001  -4.200  10.260
  189    HA   PRO  28           HA       PRO  28   9.895  -6.467  10.234
  190   1HB   PRO  28          1HB       PRO  28  10.806  -7.206  12.701
  191   2HB   PRO  28          2HB       PRO  28  10.621  -8.338  11.362
  192   1HG   PRO  28          1HG       PRO  28  13.053  -7.094  12.473
  193   2HG   PRO  28          2HG       PRO  28  12.913  -8.576  11.460
  194   1HD   PRO  28          1HD       PRO  28  13.803  -5.968  10.682
  195   2HD   PRO  28          2HD       PRO  28  13.529  -7.350   9.615
  196    H    LYS  29           H        LYS  29  10.328  -3.897   9.773
  197    HA   LYS  29           HA       LYS  29   8.972  -2.666  11.812
  198   1HB   LYS  29          1HB       LYS  29  11.373  -3.221  12.853
  199   2HB   LYS  29          2HB       LYS  29  11.760  -1.666  12.101
  200   1HG   LYS  29          1HG       LYS  29  10.781  -0.637  13.848
  201   2HG   LYS  29          2HG       LYS  29   9.226  -1.338  13.368
  202   1HD   LYS  29          1HD       LYS  29   9.467  -2.096  15.569
  203   2HD   LYS  29          2HD       LYS  29  10.094  -3.473  14.646
  204   1HE   LYS  29          1HE       LYS  29  12.331  -2.965  15.184
  205   2HE   LYS  29          2HE       LYS  29  11.970  -1.275  15.569
  206   1HZ   LYS  29          1HZ       LYS  29  11.970  -3.500  17.259
  207   2HZ   LYS  29          2HZ       LYS  29  11.782  -1.926  17.648
  208   3HZ   LYS  29          3HZ       LYS  29  10.479  -2.834  17.268
  209    H    GLU  30           H        GLU  30  10.929  -2.784   8.964
  210    HA   GLU  30           HA       GLU  30  10.331   0.002   8.400
  211   1HB   GLU  30          1HB       GLU  30  12.467  -1.865   7.662
  212   2HB   GLU  30          2HB       GLU  30  11.822  -1.004   6.254
  213   1HG   GLU  30          1HG       GLU  30  12.920   0.864   6.866
  214   2HG   GLU  30          2HG       GLU  30  12.123   0.863   8.446
  215    H    CYS  31           H        CYS  31   9.947  -3.354   7.115
  216    HA   CYS  31           HA       CYS  31   8.643  -2.727   4.781
  217   1HB   CYS  31          1HB       CYS  31   8.544  -5.102   6.612
  218   2HB   CYS  31          2HB       CYS  31   7.524  -5.029   5.173
  219    H    ASN  32           H        ASN  32   7.323  -3.405   8.101
  220    HA   ASN  32           HA       ASN  32   4.676  -2.953   7.346
  221   1HB   ASN  32          1HB       ASN  32   6.221  -3.368   9.848
  222   2HB   ASN  32          2HB       ASN  32   4.760  -2.394  10.075
  223   1HD2  ASN  32          1HD2      ASN  32   5.804  -5.242   8.197
  224   2HD2  ASN  32          2HD2      ASN  32   4.451  -6.258   8.572
  225    H    ASN  33           H        ASN  33   7.282  -0.851   7.416
  226    HA   ASN  33           HA       ASN  33   5.718   1.371   8.442
  227   1HB   ASN  33          1HB       ASN  33   8.223   0.777   9.108
  228   2HB   ASN  33          2HB       ASN  33   8.622   1.585   7.584
  229   1HD2  ASN  33          1HD2      ASN  33   9.763   3.024   9.074
  230   2HD2  ASN  33          2HD2      ASN  33   8.919   4.357   9.789
  231    H    ARG  34           H        ARG  34   7.254  -0.092   5.591
  232    HA   ARG  34           HA       ARG  34   7.012   2.290   4.042
  233   1HB   ARG  34          1HB       ARG  34   7.513  -0.487   2.926
  234   2HB   ARG  34          2HB       ARG  34   8.108   1.064   2.307
  235   1HG   ARG  34          1HG       ARG  34   9.100   0.910   4.934
  236   2HG   ARG  34          2HG       ARG  34   9.287  -0.736   4.302
  237   1HD   ARG  34          1HD       ARG  34  10.911  -0.101   2.830
  238   2HD   ARG  34          2HD       ARG  34  10.086   1.404   2.400
  239    HE   ARG  34           HE       ARG  34  12.256   1.173   4.213
  240   1HH1  ARG  34          1HH1      ARG  34   9.073   2.669   4.104
  241   2HH1  ARG  34          2HH1      ARG  34   9.498   3.953   5.186
  242   1HH2  ARG  34          1HH2      ARG  34  12.817   2.865   5.642
  243   2HH2  ARG  34          2HH2      ARG  34  11.643   4.066   6.066
  244    H    GLY  35           H        GLY  35   5.116  -0.559   4.840
  245   1HA   GLY  35          1HA       GLY  35   2.721  -0.274   4.385
  246   2HA   GLY  35          2HA       GLY  35   3.153   0.166   2.744
  247    H    CYS  36           H        CYS  36   5.025  -2.331   4.428
  248    HA   CYS  36           HA       CYS  36   3.666  -4.327   2.764
  249   1HB   CYS  36          1HB       CYS  36   6.572  -4.327   3.583
  250   2HB   CYS  36          2HB       CYS  36   5.765  -5.503   2.542
  251    H    CYS  37           H        CYS  37   4.479  -6.668   3.824
  252    HA   CYS  37           HA       CYS  37   4.032  -6.388   6.707
  253   1HB   CYS  37          1HB       CYS  37   2.056  -7.200   5.255
  254   2HB   CYS  37          2HB       CYS  37   2.958  -8.714   5.134
  255    H    PHE  38           H        PHE  38   5.644  -7.368   7.898
  256    HA   PHE  38           HA       PHE  38   7.586  -8.944   6.427
  257   1HB   PHE  38          1HB       PHE  38   8.139  -7.000   7.990
  258   2HB   PHE  38          2HB       PHE  38   7.453  -7.926   9.328
  259    HD1  PHE  38           HD1      PHE  38   8.680  -9.746  10.315
  260    HD2  PHE  38           HD2      PHE  38  10.254  -7.669   6.967
  261    HE1  PHE  38           HE1      PHE  38  10.921 -10.804  10.713
  262    HE2  PHE  38           HE2      PHE  38  12.495  -8.726   7.364
  263    HZ   PHE  38           HZ       PHE  38  12.801 -10.281   9.233
  264    H    ASP  39           H        ASP  39   7.533 -11.137   6.429
  265    HA   ASP  39           HA       ASP  39   5.792 -12.413   8.315
  266   1HB   ASP  39          1HB       ASP  39   5.681 -13.184   6.030
  267   2HB   ASP  39          2HB       ASP  39   7.436 -13.394   5.945
  268    H    SER  40           H        SER  40   8.958 -13.583   6.992
  269    HA   SER  40           HA       SER  40  10.896 -13.935   8.010
  270   1HB   SER  40          1HB       SER  40   9.884 -12.267   9.869
  271   2HB   SER  40          2HB       SER  40   9.868 -13.761  10.822
  272    HG   SER  40           HG       SER  40  11.879 -12.853  11.175
  273    H    ARG  41           H        ARG  41   7.818 -15.356   8.706
  274    HA   ARG  41           HA       ARG  41   8.563 -17.486  10.273
  275   1HB   ARG  41          1HB       ARG  41   6.401 -17.260   8.133
  276   2HB   ARG  41          2HB       ARG  41   6.490 -18.594   9.295
  277   1HG   ARG  41          1HG       ARG  41   6.648 -16.421  10.964
  278   2HG   ARG  41          2HG       ARG  41   5.618 -15.770   9.678
  279   1HD   ARG  41          1HD       ARG  41   4.083 -16.741  11.188
  280   2HD   ARG  41          2HD       ARG  41   4.260 -17.992   9.949
  281    HE   ARG  41           HE       ARG  41   6.141 -18.230  12.194
  282   1HH1  ARG  41          1HH1      ARG  41   2.970 -19.122  10.955
  283   2HH1  ARG  41          2HH1      ARG  41   2.824 -20.517  11.972
  284   1HH2  ARG  41          1HH2      ARG  41   5.948 -20.070  13.535
  285   2HH2  ARG  41          2HH2      ARG  41   4.529 -21.060  13.449
  286    H    ILE  42           H        ILE  42   8.469 -17.071   6.678
  287    HA   ILE  42           HA       ILE  42  10.031 -19.552   6.477
  288    HB   ILE  42           HB       ILE  42   8.413 -18.565   4.183
  289   1HG1  ILE  42          1HG1      ILE  42   7.262 -19.911   6.629
  290   2HG1  ILE  42          2HG1      ILE  42   6.758 -18.380   5.893
  291   1HG2  ILE  42          1HG2      ILE  42   9.996 -20.809   4.754
  292   2HG2  ILE  42          2HG2      ILE  42   8.315 -21.394   4.762
  293   3HG2  ILE  42          3HG2      ILE  42   8.955 -20.544   3.335
  294   1HD1  ILE  42          1HD1      ILE  42   6.197 -21.202   5.051
  295   2HD1  ILE  42          2HD1      ILE  42   5.156 -19.761   4.964
  296   3HD1  ILE  42          3HD1      ILE  42   6.437 -20.009   3.753
  297    HA   PRO  43           HA       PRO  43  12.973 -16.708   4.962
  298   1HB   PRO  43          1HB       PRO  43  15.065 -18.457   4.790
  299   2HB   PRO  43          2HB       PRO  43  14.646 -17.597   6.270
  300   1HG   PRO  43          1HG       PRO  43  14.162 -20.405   5.504
  301   2HG   PRO  43          2HG       PRO  43  14.176 -19.677   7.151
  302   1HD   PRO  43          1HD       PRO  43  11.921 -20.480   5.580
  303   2HD   PRO  43          2HD       PRO  43  11.878 -19.621   7.125
  304    H    GLY  44           H        GLY  44  11.665 -19.395   3.431
  305   1HA   GLY  44          1HA       GLY  44  13.135 -18.939   0.953
  306   2HA   GLY  44          2HA       GLY  44  11.959 -20.195   1.286
  307    H    VAL  45           H        VAL  45  10.381 -17.661   2.581
  308    HA   VAL  45           HA       VAL  45   9.133 -16.974   0.013
  309    HB   VAL  45           HB       VAL  45   8.069 -18.107   2.315
  310   1HG1  VAL  45          1HG1      VAL  45   6.443 -15.738   2.373
  311   2HG1  VAL  45          2HG1      VAL  45   7.310 -16.538   3.705
  312   3HG1  VAL  45          3HG1      VAL  45   8.130 -15.298   2.727
  313   1HG2  VAL  45          1HG2      VAL  45   6.629 -18.577   0.675
  314   2HG2  VAL  45          2HG2      VAL  45   5.917 -16.963   0.919
  315   3HG2  VAL  45          3HG2      VAL  45   7.195 -17.199  -0.298
  316    HA   PRO  46           HA       PRO  46   9.896 -12.782   0.767
  317   1HB   PRO  46          1HB       PRO  46   7.565 -11.481   0.189
  318   2HB   PRO  46          2HB       PRO  46   8.672 -12.072  -1.049
  319   1HG   PRO  46          1HG       PRO  46   6.097 -13.177  -0.127
  320   2HG   PRO  46          2HG       PRO  46   6.963 -13.489  -1.673
  321   1HD   PRO  46          1HD       PRO  46   6.750 -15.189   0.622
  322   2HD   PRO  46          2HD       PRO  46   7.744 -15.473  -0.812
  323    H    TRP  47           H        TRP  47  10.524 -12.020   2.679
  324    HA   TRP  47           HA       TRP  47   8.551 -12.128   4.800
  325   1HB   TRP  47          1HB       TRP  47  11.067 -10.908   5.509
  326   2HB   TRP  47          2HB       TRP  47  10.287 -12.355   6.150
  327    HD1  TRP  47           HD1      TRP  47  10.946 -14.726   4.853
  328    HE1  TRP  47           HE1      TRP  47  13.089 -15.516   3.533
  329    HE3  TRP  47           HE3      TRP  47  12.810 -10.064   4.044
  330    HZ2  TRP  47           HZ2      TRP  47  15.275 -14.134   2.325
  331    HZ3  TRP  47           HZ3      TRP  47  14.953  -9.874   2.785
  332    HH2  TRP  47           HH2      TRP  47  16.177 -11.812   1.936
  333    H    CYS  48           H        CYS  48   8.178 -10.338   2.433
  334    HA   CYS  48           HA       CYS  48   7.498  -8.013   3.864
  335   1HB   CYS  48          1HB       CYS  48   9.950  -7.652   3.608
  336   2HB   CYS  48          2HB       CYS  48   9.726  -7.639   1.855
  337    H    PHE  49           H        PHE  49   5.461  -7.969   2.943
  338    HA   PHE  49           HA       PHE  49   5.347  -7.623   0.066
  339   1HB   PHE  49          1HB       PHE  49   3.247  -9.309   0.388
  340   2HB   PHE  49          2HB       PHE  49   4.862  -9.937   0.041
  341    HD1  PHE  49           HD1      PHE  49   6.322 -10.433   2.178
  342    HD2  PHE  49           HD2      PHE  49   2.087 -10.155   2.182
  343    HE1  PHE  49           HE1      PHE  49   6.236 -11.779   4.294
  344    HE2  PHE  49           HE2      PHE  49   2.001 -11.501   4.298
  345    HZ   PHE  49           HZ       PHE  49   4.075 -12.298   5.329
  346    H    LYS  50           H        LYS  50   2.601  -7.634  -0.301
  347    HA   LYS  50           HA       LYS  50   1.688  -5.665   1.680
  348   1HB   LYS  50          1HB       LYS  50   0.361  -5.032  -0.646
  349   2HB   LYS  50          2HB       LYS  50   1.765  -4.176   0.016
  350   1HG   LYS  50          1HG       LYS  50   2.236  -6.628  -1.659
  351   2HG   LYS  50          2HG       LYS  50   1.745  -5.140  -2.490
  352   1HD   LYS  50          1HD       LYS  50   4.168  -5.564  -0.695
  353   2HD   LYS  50          2HD       LYS  50   4.178  -5.218  -2.433
  354   1HE   LYS  50          1HE       LYS  50   3.549  -3.388  -0.111
  355   2HE   LYS  50          2HE       LYS  50   4.650  -3.111  -1.470
  356   1HZ   LYS  50          1HZ       LYS  50   1.723  -3.258  -1.684
  357   2HZ   LYS  50          2HZ       LYS  50   2.579  -1.870  -1.625
  358   3HZ   LYS  50          3HZ       LYS  50   2.761  -2.887  -2.889
  359    HA   PRO  51           HA       PRO  51  -1.205  -9.138   1.506
  360   1HB   PRO  51          1HB       PRO  51  -1.265  -9.684   4.182
  361   2HB   PRO  51          2HB       PRO  51  -0.216 -10.533   3.048
  362   1HG   PRO  51          1HG       PRO  51   0.423  -8.417   5.003
  363   2HG   PRO  51          2HG       PRO  51   1.537  -9.591   4.215
  364   1HD   PRO  51          1HD       PRO  51   1.189  -6.807   3.641
  365   2HD   PRO  51          2HD       PRO  51   2.182  -7.956   2.734
  366    H    LEU  52           H        LEU  52  -1.798  -8.088   4.715
  367    HA   LEU  52           HA       LEU  52  -4.284  -6.924   3.750
  368   1HB   LEU  52          1HB       LEU  52  -5.177  -7.372   5.785
  369   2HB   LEU  52          2HB       LEU  52  -4.021  -8.703   5.612
  370    HG   LEU  52           HG       LEU  52  -2.685  -6.559   6.924
  371   1HD1  LEU  52          1HD1      LEU  52  -5.526  -6.669   7.570
  372   2HD1  LEU  52          2HD1      LEU  52  -4.491  -6.949   8.991
  373   3HD1  LEU  52          3HD1      LEU  52  -4.288  -5.471   8.020
  374   1HD2  LEU  52          1HD2      LEU  52  -3.200  -8.481   8.845
  375   2HD2  LEU  52          2HD2      LEU  52  -3.298  -9.388   7.315
  376   3HD2  LEU  52          3HD2      LEU  52  -1.829  -8.461   7.709
  377    H    GLN  53           H        GLN  53  -1.757  -5.547   3.220
  378    HA   GLN  53           HA       GLN  53  -1.117  -3.646   5.048
  379   1HB   GLN  53          1HB       GLN  53  -1.198  -3.459   2.014
  380   2HB   GLN  53          2HB       GLN  53  -0.370  -2.284   3.052
  381   1HG   GLN  53          1HG       GLN  53   0.216  -5.270   2.859
  382   2HG   GLN  53          2HG       GLN  53   1.220  -3.974   2.194
  383   1HE2  GLN  53          1HE2      GLN  53   1.088  -2.116   4.223
  384   2HE2  GLN  53          2HE2      GLN  53   1.895  -2.704   5.638
  385    H    GLU  54           H        GLU  54  -4.079  -4.028   3.259
  386    HA   GLU  54           HA       GLU  54  -5.013  -1.611   2.765
  387   1HB   GLU  54          1HB       GLU  54  -6.460  -3.415   2.366
  388   2HB   GLU  54          2HB       GLU  54  -6.355  -4.012   4.031
  389   1HG   GLU  54          1HG       GLU  54  -7.444  -1.253   3.659
  390   2HG   GLU  54          2HG       GLU  54  -8.467  -2.576   3.079
  391    H    ALA  55           H        ALA  55  -4.204  -2.891   5.955
  392    HA   ALA  55           HA       ALA  55  -5.626  -1.572   7.744
  393   1HB   ALA  55          1HB       ALA  55  -3.406  -2.937   7.934
  394   2HB   ALA  55          2HB       ALA  55  -2.615  -1.344   7.870
  395   3HB   ALA  55          3HB       ALA  55  -3.769  -1.711   9.173
  396    H    GLU  56           H        GLU  56  -2.695   0.002   6.266
  397    HA   GLU  56           HA       GLU  56  -4.222   2.469   6.257
  398   1HB   GLU  56          1HB       GLU  56  -2.264   3.710   7.149
  399   2HB   GLU  56          2HB       GLU  56  -2.901   2.543   8.322
  400   1HG   GLU  56          1HG       GLU  56  -0.931   1.442   8.379
  401   2HG   GLU  56          2HG       GLU  56  -0.882   1.300   6.616
  402    H    CYS  57           H        CYS  57  -3.370   0.436   4.206
  403    HA   CYS  57           HA       CYS  57  -1.449   2.033   2.698
  404   1HB   CYS  57          1HB       CYS  57  -1.331  -0.571   3.190
  405   2HB   CYS  57          2HB       CYS  57  -2.358  -0.644   1.755
  406    H    THR  58           H        THR  58  -4.433   0.010   2.134
  407    HA   THR  58           HA       THR  58  -5.100   1.381  -0.253
  408    HB   THR  58           HB       THR  58  -5.755  -1.015   0.933
  409    HG1  THR  58           HG1      THR  58  -7.537  -0.813  -0.809
  410   1HG2  THR  58          1HG2      THR  58  -8.315   0.646   0.973
  411   2HG2  THR  58          2HG2      THR  58  -8.088  -1.030   1.526
  412   3HG2  THR  58          3HG2      THR  58  -7.397   0.318   2.462
  413    H    PHE  59           H        PHE  59  -6.136   1.709   3.176
  414    HA   PHE  59           HA       PHE  59  -8.256   3.241   3.116
  415   1HB   PHE  59          1HB       PHE  59  -6.306   2.697   4.913
  416   2HB   PHE  59          2HB       PHE  59  -5.802   4.349   4.536
  417    HD1  PHE  59           HD1      PHE  59  -6.711   6.082   5.767
  418    HD2  PHE  59           HD2      PHE  59  -8.832   2.413   5.537
  419    HE1  PHE  59           HE1      PHE  59  -8.397   6.954   7.409
  420    HE2  PHE  59           HE2      PHE  59 -10.518   3.286   7.181
  421    HZ   PHE  59           HZ       PHE  59 -10.280   5.545   8.097
  422   1H    GLU   1           H1       GLU   1 -23.193   6.366  -4.796
  423    HA   GLU   1           HA       GLU   1 -21.187   5.238  -5.513
  424   1HB   GLU   1          1HB       GLU   1 -21.155   7.516  -3.577
  425   2HB   GLU   1          2HB       GLU   1 -19.586   6.804  -3.997
  426   1HG   GLU   1          1HG       GLU   1 -19.627   8.065  -5.868
  427   2HG   GLU   1          2HG       GLU   1 -20.949   7.048  -6.458
  428    H    GLU   2           H        GLU   2 -20.996   3.033  -4.890
  429    HA   GLU   2           HA       GLU   2 -20.436   2.395  -2.186
  430   1HB   GLU   2          1HB       GLU   2 -20.346   0.759  -4.747
  431   2HB   GLU   2          2HB       GLU   2 -20.092   0.069  -3.135
  432   1HG   GLU   2          1HG       GLU   2 -22.429   1.476  -2.768
  433   2HG   GLU   2          2HG       GLU   2 -22.599   0.978  -4.459
  434    H    TYR   3           H        TYR   3 -18.453   0.414  -4.091
  435    HA   TYR   3           HA       TYR   3 -16.091   1.638  -2.972
  436   1HB   TYR   3          1HB       TYR   3 -15.195  -0.474  -4.354
  437   2HB   TYR   3          2HB       TYR   3 -16.135  -0.757  -2.887
  438    HD1  TYR   3           HD1      TYR   3 -17.178  -2.822  -3.322
  439    HD2  TYR   3           HD2      TYR   3 -17.370   0.285  -6.256
  440    HE1  TYR   3           HE1      TYR   3 -18.840  -4.191  -4.673
  441    HE2  TYR   3           HE2      TYR   3 -19.032  -1.095  -7.599
  442    HH   TYR   3           HH       TYR   3 -20.811  -3.079  -6.763
  443    H    VAL   4           H        VAL   4 -16.721   3.632  -4.480
  444    HA   VAL   4           HA       VAL   4 -15.295   3.207  -7.016
  445    HB   VAL   4           HB       VAL   4 -16.686   4.982  -7.953
  446   1HG1  VAL   4          1HG1      VAL   4 -17.808   2.426  -6.936
  447   2HG1  VAL   4          2HG1      VAL   4 -18.984   3.620  -7.535
  448   3HG1  VAL   4          3HG1      VAL   4 -17.678   3.045  -8.599
  449   1HG2  VAL   4          1HG2      VAL   4 -18.804   5.591  -6.637
  450   2HG2  VAL   4          2HG2      VAL   4 -17.942   4.984  -5.203
  451   3HG2  VAL   4          3HG2      VAL   4 -17.277   6.351  -6.129
  452    H    GLY   5           H        GLY   5 -16.203   5.654  -4.488
  453   1HA   GLY   5          1HA       GLY   5 -14.103   7.440  -5.201
  454   2HA   GLY   5          2HA       GLY   5 -15.108   7.491  -3.767
  455    H    LEU   6           H        LEU   6 -13.818   4.354  -4.051
  456    HA   LEU   6           HA       LEU   6 -11.429   5.079  -2.516
  457   1HB   LEU   6          1HB       LEU   6 -12.136   2.801  -1.304
  458   2HB   LEU   6          2HB       LEU   6 -12.541   4.418  -0.700
  459    HG   LEU   6           HG       LEU   6 -14.362   2.673  -2.380
  460   1HD1  LEU   6          1HD1      LEU   6 -14.162   1.541  -0.329
  461   2HD1  LEU   6          2HD1      LEU   6 -14.163   3.055   0.608
  462   3HD1  LEU   6          3HD1      LEU   6 -15.656   2.499  -0.189
  463   1HD2  LEU   6          1HD2      LEU   6 -15.348   4.649  -2.775
  464   2HD2  LEU   6          2HD2      LEU   6 -15.963   4.477  -1.114
  465   3HD2  LEU   6          3HD2      LEU   6 -14.512   5.458  -1.428
  466    H    SER   7           H        SER   7 -12.737   3.716  -5.255
  467    HA   SER   7           HA       SER   7 -10.699   1.638  -5.321
  468   1HB   SER   7          1HB       SER   7 -11.996   0.530  -6.995
  469   2HB   SER   7          2HB       SER   7 -13.141   1.020  -5.733
  470    HG   SER   7           HG       SER   7 -13.194   3.070  -7.315
  471    H    ALA   8           H        ALA   8 -10.728   1.418  -8.250
  472    HA   ALA   8           HA       ALA   8  -8.721   3.210  -8.887
  473   1HB   ALA   8          1HB       ALA   8  -8.718   2.127 -10.923
  474   2HB   ALA   8          2HB       ALA   8  -9.663   0.954  -9.975
  475   3HB   ALA   8          3HB       ALA   8 -10.494   2.112 -11.041
  476    H    ASN   9           H        ASN   9  -8.701   5.338  -9.431
  477    HA   ASN   9           HA       ASN   9  -9.600   6.988 -10.836
  478   1HB   ASN   9          1HB       ASN   9 -11.757   5.764 -11.232
  479   2HB   ASN   9          2HB       ASN   9 -12.294   6.201  -9.603
  480   1HD2  ASN   9          1HD2      ASN   9 -12.241   8.554  -9.090
  481   2HD2  ASN   9          2HD2      ASN   9 -12.762   9.673 -10.304
  482    H    GLN  10           H        GLN  10 -10.376   5.976  -7.512
  483    HA   GLN  10           HA       GLN  10 -11.082   8.400  -6.435
  484   1HB   GLN  10          1HB       GLN  10 -11.207   7.172  -4.558
  485   2HB   GLN  10          2HB       GLN  10 -10.627   5.793  -5.508
  486   1HG   GLN  10          1HG       GLN  10  -8.302   6.355  -4.928
  487   2HG   GLN  10          2HG       GLN  10  -8.837   7.796  -4.050
  488   1HE2  GLN  10          1HE2      GLN  10  -9.509   7.634  -2.008
  489   2HE2  GLN  10          2HE2      GLN  10  -9.626   6.168  -1.093
  490    H    CYS  11           H        CYS  11  -7.856   6.970  -7.106
  491    HA   CYS  11           HA       CYS  11  -6.363   8.836  -5.681
  492   1HB   CYS  11          1HB       CYS  11  -5.349   6.814  -6.350
  493   2HB   CYS  11          2HB       CYS  11  -5.717   7.091  -8.055
  494    H    ALA  12           H        ALA  12  -8.492   9.267  -8.269
  495    HA   ALA  12           HA       ALA  12  -6.932  11.435  -9.457
  496   1HB   ALA  12          1HB       ALA  12  -8.452   9.449 -10.591
  497   2HB   ALA  12          2HB       ALA  12  -9.621  10.788 -10.518
  498   3HB   ALA  12          3HB       ALA  12  -8.075  11.002 -11.372
  499    H    VAL  13           H        VAL  13  -8.465  11.205  -6.699
  500    HA   VAL  13           HA       VAL  13 -10.699  12.684  -6.586
  501    HB   VAL  13           HB       VAL  13  -8.772  11.787  -4.831
  502   1HG1  VAL  13          1HG1      VAL  13  -9.044  14.786  -4.436
  503   2HG1  VAL  13          2HG1      VAL  13  -8.180  13.642  -3.380
  504   3HG1  VAL  13          3HG1      VAL  13  -7.583  13.959  -5.027
  505   1HG2  VAL  13          1HG2      VAL  13 -11.484  12.600  -4.802
  506   2HG2  VAL  13          2HG2      VAL  13 -10.617  11.626  -3.591
  507   3HG2  VAL  13          3HG2      VAL  13 -10.698  13.395  -3.417
  508    HA   PRO  14           HA       PRO  14  -9.824  16.699  -7.919
  509   1HB   PRO  14          1HB       PRO  14 -11.451  18.240  -6.358
  510   2HB   PRO  14          2HB       PRO  14 -12.029  17.341  -7.758
  511   1HG   PRO  14          1HG       PRO  14 -12.304  16.752  -4.881
  512   2HG   PRO  14          2HG       PRO  14 -13.281  16.120  -6.255
  513   1HD   PRO  14          1HD       PRO  14 -11.244  14.780  -4.753
  514   2HD   PRO  14          2HD       PRO  14 -12.063  14.170  -6.197
  515    H    ALA  15           H        ALA  15  -8.047  15.577  -5.872
  516    HA   ALA  15           HA       ALA  15  -6.471  16.245  -4.458
  517   1HB   ALA  15          1HB       ALA  15  -6.525  18.862  -6.000
  518   2HB   ALA  15          2HB       ALA  15  -5.130  18.065  -5.234
  519   3HB   ALA  15          3HB       ALA  15  -5.875  17.354  -6.685
  520    H    LYS  16           H        LYS  16  -8.161  16.219  -2.721
  521    HA   LYS  16           HA       LYS  16  -7.911  18.179  -0.935
  522   1HB   LYS  16          1HB       LYS  16 -10.183  19.414  -1.252
  523   2HB   LYS  16          2HB       LYS  16  -8.743  19.967  -2.125
  524   1HG   LYS  16          1HG       LYS  16  -9.752  19.591  -4.100
  525   2HG   LYS  16          2HG       LYS  16 -10.085  17.904  -3.667
  526   1HD   LYS  16          1HD       LYS  16 -12.253  18.634  -3.868
  527   2HD   LYS  16          2HD       LYS  16 -12.001  19.111  -2.180
  528   1HE   LYS  16          1HE       LYS  16 -11.738  21.379  -2.734
  529   2HE   LYS  16          2HE       LYS  16 -11.283  21.032  -4.411
  530   1HZ   LYS  16          1HZ       LYS  16 -13.773  21.640  -3.446
  531   2HZ   LYS  16          2HZ       LYS  16 -13.394  21.176  -4.966
  532   3HZ   LYS  16          3HZ       LYS  16 -13.853  20.063  -3.863
  533    H    ASP  17           H        ASP  17  -8.110  15.474  -0.844
  534    HA   ASP  17           HA       ASP  17 -10.272  15.180   0.949
  535   1HB   ASP  17          1HB       ASP  17 -11.312  14.766  -1.346
  536   2HB   ASP  17          2HB       ASP  17 -10.251  13.357  -1.498
  537    H    ARG  18           H        ARG  18  -7.466  14.077  -0.901
  538    HA   ARG  18           HA       ARG  18  -7.066  11.576  -0.032
  539   1HB   ARG  18          1HB       ARG  18  -4.950  13.766  -0.248
  540   2HB   ARG  18          2HB       ARG  18  -4.624  12.026  -0.318
  541   1HG   ARG  18          1HG       ARG  18  -5.375  11.850  -2.470
  542   2HG   ARG  18          2HG       ARG  18  -6.689  13.014  -2.229
  543   1HD   ARG  18          1HD       ARG  18  -5.103  14.879  -2.394
  544   2HD   ARG  18          2HD       ARG  18  -3.737  13.759  -2.502
  545    HE   ARG  18           HE       ARG  18  -5.833  13.419  -4.553
  546   1HH1  ARG  18          1HH1      ARG  18  -2.743  14.882  -3.721
  547   2HH1  ARG  18          2HH1      ARG  18  -2.270  15.126  -5.370
  548   1HH2  ARG  18          1HH2      ARG  18  -5.211  13.741  -6.727
  549   2HH2  ARG  18          2HH2      ARG  18  -3.683  14.473  -7.091
  550    H    VAL  19           H        VAL  19  -4.967  11.076   1.568
  551    HA   VAL  19           HA       VAL  19  -5.647  12.407   4.100
  552    HB   VAL  19           HB       VAL  19  -4.656   9.583   3.675
  553   1HG1  VAL  19          1HG1      VAL  19  -4.951  11.279   6.009
  554   2HG1  VAL  19          2HG1      VAL  19  -5.979   9.832   6.140
  555   3HG1  VAL  19          3HG1      VAL  19  -4.230   9.658   5.865
  556   1HG2  VAL  19          1HG2      VAL  19  -7.451  10.201   4.569
  557   2HG2  VAL  19          2HG2      VAL  19  -7.061  10.291   2.834
  558   3HG2  VAL  19          3HG2      VAL  19  -6.810   8.770   3.726
  559    H    ASP  20           H        ASP  20  -3.621  13.045   1.878
  560    HA   ASP  20           HA       ASP  20  -1.450  13.349   1.615
  561   1HB   ASP  20          1HB       ASP  20  -1.691  15.352   2.724
  562   2HB   ASP  20          2HB       ASP  20  -2.307  14.592   4.199
  563    H    CYS  21           H        CYS  21  -0.452  11.242   1.550
  564    HA   CYS  21           HA       CYS  21  -0.079   9.577   3.692
  565   1HB   CYS  21          1HB       CYS  21   0.432   9.439   1.057
  566   2HB   CYS  21          2HB       CYS  21   2.080   9.635   1.662
  567    H    GLY  22           H        GLY  22   1.733  12.453   2.581
  568   1HA   GLY  22          1HA       GLY  22   3.411  13.632   3.497
  569   2HA   GLY  22          2HA       GLY  22   2.856  13.034   5.048
  570    H    TYR  23           H        TYR  23   4.475  11.564   2.132
  571    HA   TYR  23           HA       TYR  23   6.145  10.004   3.922
  572   1HB   TYR  23          1HB       TYR  23   4.869   9.674   1.446
  573   2HB   TYR  23          2HB       TYR  23   6.527  10.020   0.945
  574    HD1  TYR  23           HD1      TYR  23   5.400   8.140   3.968
  575    HD2  TYR  23           HD2      TYR  23   7.237   7.931   0.109
  576    HE1  TYR  23           HE1      TYR  23   6.021   5.710   4.387
  577    HE2  TYR  23           HE2      TYR  23   7.851   5.502   0.541
  578    HH   TYR  23           HH       TYR  23   7.808   4.142   3.558
  579    HA   PRO  24           HA       PRO  24   9.540  12.659   3.456
  580   1HB   PRO  24          1HB       PRO  24  11.517  11.023   4.391
  581   2HB   PRO  24          2HB       PRO  24  10.452  11.949   5.447
  582   1HG   PRO  24          1HG       PRO  24  10.429   9.076   4.775
  583   2HG   PRO  24          2HG       PRO  24   9.677   9.905   6.185
  584   1HD   PRO  24          1HD       PRO  24   8.404   8.879   3.834
  585   2HD   PRO  24          2HD       PRO  24   7.642   9.830   5.117
  586    H    HIS  25           H        HIS  25   9.091   9.857   1.690
  587    HA   HIS  25           HA       HIS  25  11.249  10.727  -0.090
  588   1HB   HIS  25          1HB       HIS  25  10.841   8.178   1.182
  589   2HB   HIS  25          2HB       HIS  25  10.722   7.991  -0.572
  590    HD1  HIS  25           HD1      HIS  25  13.101   9.768   1.876
  591    HD2  HIS  25           HD2      HIS  25  13.166   7.542  -1.680
  592    HE1  HIS  25           HE1      HIS  25  15.558   9.507   1.240
  593    HE2  HIS  25           HE2      HIS  25  15.537   8.084  -0.922
  594    H    VAL  26           H        VAL  26   8.451  11.631   0.012
  595    HA   VAL  26           HA       VAL  26   6.766  10.308  -1.696
  596    HB   VAL  26           HB       VAL  26   5.878  12.080  -0.512
  597   1HG1  VAL  26          1HG1      VAL  26   7.147  14.463  -1.327
  598   2HG1  VAL  26          2HG1      VAL  26   7.228  13.675   0.267
  599   3HG1  VAL  26          3HG1      VAL  26   8.454  13.308  -0.971
  600   1HG2  VAL  26          1HG2      VAL  26   4.774  13.373  -2.092
  601   2HG2  VAL  26          2HG2      VAL  26   6.219  13.547  -3.116
  602   3HG2  VAL  26          3HG2      VAL  26   5.342  12.000  -3.072
  603    H    THR  27           H        THR  27   6.938   9.684  -3.781
  604    HA   THR  27           HA       THR  27   7.899  11.423  -5.788
  605    HB   THR  27           HB       THR  27   9.906   9.967  -4.335
  606    HG1  THR  27           HG1      THR  27  10.566  11.833  -5.366
  607   1HG2  THR  27          1HG2      THR  27   9.752   7.986  -5.662
  608   2HG2  THR  27          2HG2      THR  27   9.265   8.895  -7.113
  609   3HG2  THR  27          3HG2      THR  27  10.948   8.971  -6.538
  610    HA   PRO  28           HA       PRO  28   5.588   8.645  -8.097
  611   1HB   PRO  28          1HB       PRO  28   6.468   9.155 -10.632
  612   2HB   PRO  28          2HB       PRO  28   5.301  10.176  -9.793
  613   1HG   PRO  28          1HG       PRO  28   8.176  10.605 -10.298
  614   2HG   PRO  28          2HG       PRO  28   6.914  11.822  -9.889
  615   1HD   PRO  28          1HD       PRO  28   8.956  10.734  -8.201
  616   2HD   PRO  28          2HD       PRO  28   7.640  11.809  -7.708
  617    H    LYS  29           H        LYS  29   7.415   7.249  -6.735
  618    HA   LYS  29           HA       LYS  29   7.688   4.995  -8.356
  619   1HB   LYS  29          1HB       LYS  29   9.411   6.363  -9.473
  620   2HB   LYS  29          2HB       LYS  29  10.296   6.485  -7.942
  621   1HG   LYS  29          1HG       LYS  29  11.187   4.429  -8.219
  622   2HG   LYS  29          2HG       LYS  29   9.604   3.706  -8.548
  623   1HD   LYS  29          1HD       LYS  29   9.918   3.774 -10.802
  624   2HD   LYS  29          2HD       LYS  29  10.654   5.385 -10.758
  625   1HE   LYS  29          1HE       LYS  29  12.294   3.222  -9.551
  626   2HE   LYS  29          2HE       LYS  29  12.016   3.043 -11.289
  627   1HZ   LYS  29          1HZ       LYS  29  12.777   5.355 -11.501
  628   2HZ   LYS  29          2HZ       LYS  29  13.164   5.370  -9.915
  629   3HZ   LYS  29          3HZ       LYS  29  13.935   4.353 -10.933
  630    H    GLU  30           H        GLU  30   8.270   6.936  -5.506
  631    HA   GLU  30           HA       GLU  30   9.064   4.562  -4.042
  632   1HB   GLU  30          1HB       GLU  30   9.573   7.422  -3.800
  633   2HB   GLU  30          2HB       GLU  30   8.989   6.754  -2.267
  634   1HG   GLU  30          1HG       GLU  30  11.290   6.394  -2.101
  635   2HG   GLU  30          2HG       GLU  30  10.751   4.842  -2.758
  636    H    CYS  31           H        CYS  31   6.583   7.191  -4.117
  637    HA   CYS  31           HA       CYS  31   5.144   6.292  -1.909
  638   1HB   CYS  31          1HB       CYS  31   4.560   8.052  -4.251
  639   2HB   CYS  31          2HB       CYS  31   3.225   7.532  -3.219
  640    H    ASN  32           H        ASN  32   4.664   5.805  -5.487
  641    HA   ASN  32           HA       ASN  32   2.521   4.073  -5.177
  642   1HB   ASN  32          1HB       ASN  32   4.426   4.841  -7.357
  643   2HB   ASN  32          2HB       ASN  32   3.572   3.308  -7.591
  644   1HD2  ASN  32          1HD2      ASN  32   2.679   6.401  -6.074
  645   2HD2  ASN  32          2HD2      ASN  32   1.273   6.722  -7.035
  646    H    ASN  33           H        ASN  33   5.741   3.714  -4.247
  647    HA   ASN  33           HA       ASN  33   5.803   0.884  -4.892
  648   1HB   ASN  33          1HB       ASN  33   7.851   2.004  -5.500
  649   2HB   ASN  33          2HB       ASN  33   7.929   2.869  -3.958
  650   1HD2  ASN  33          1HD2      ASN  33   9.651   2.171  -2.939
  651   2HD2  ASN  33          2HD2      ASN  33  10.101   0.523  -2.658
  652    H    ARG  34           H        ARG  34   5.584   3.315  -2.305
  653    HA   ARG  34           HA       ARG  34   6.054   1.368  -0.263
  654   1HB   ARG  34          1HB       ARG  34   6.015   3.184   1.257
  655   2HB   ARG  34          2HB       ARG  34   6.694   3.904  -0.212
  656   1HG   ARG  34          1HG       ARG  34   5.077   5.477   0.374
  657   2HG   ARG  34          2HG       ARG  34   4.160   4.463  -0.754
  658   1HD   ARG  34          1HD       ARG  34   2.640   4.241   0.912
  659   2HD   ARG  34          2HD       ARG  34   3.810   3.185   1.717
  660    HE   ARG  34           HE       ARG  34   4.245   6.046   2.199
  661   1HH1  ARG  34          1HH1      ARG  34   2.577   3.148   3.294
  662   2HH1  ARG  34          2HH1      ARG  34   2.360   3.729   4.912
  663   1HH2  ARG  34          1HH2      ARG  34   3.959   6.813   4.333
  664   2HH2  ARG  34          2HH2      ARG  34   3.152   5.827   5.507
  665    H    GLY  35           H        GLY  35   3.359   3.078  -1.865
  666   1HA   GLY  35          1HA       GLY  35   1.302   1.630  -1.813
  667   2HA   GLY  35          2HA       GLY  35   1.446   1.715  -0.070
  668    H    CYS  36           H        CYS  36   2.399   4.485  -2.081
  669    HA   CYS  36           HA       CYS  36  -0.052   5.833  -1.204
  670   1HB   CYS  36          1HB       CYS  36   2.750   6.935  -1.403
  671   2HB   CYS  36          2HB       CYS  36   1.310   7.927  -1.156
  672    H    CYS  37           H        CYS  37  -0.402   7.900  -2.700
  673    HA   CYS  37           HA       CYS  37   0.215   7.065  -5.442
  674   1HB   CYS  37          1HB       CYS  37  -2.224   6.991  -4.521
  675   2HB   CYS  37          2HB       CYS  37  -2.178   8.740  -4.766
  676    H    PHE  38           H        PHE  38   1.379   8.560  -6.629
  677    HA   PHE  38           HA       PHE  38   1.847  11.137  -5.348
  678   1HB   PHE  38          1HB       PHE  38   3.704   9.533  -6.081
  679   2HB   PHE  38          2HB       PHE  38   3.151   9.722  -7.749
  680    HD1  PHE  38           HD1      PHE  38   3.708  11.680  -9.006
  681    HD2  PHE  38           HD2      PHE  38   4.762  11.413  -4.904
  682    HE1  PHE  38           HE1      PHE  38   5.210  13.676  -9.261
  683    HE2  PHE  38           HE2      PHE  38   6.262  13.409  -5.159
  684    HZ   PHE  38           HZ       PHE  38   6.469  14.516  -7.335
  685    H    ASP  39           H        ASP  39   0.703  12.877  -6.036
  686    HA   ASP  39           HA       ASP  39  -0.707  12.677  -8.508
  687   1HB   ASP  39          1HB       ASP  39  -1.838  13.712  -6.642
  688   2HB   ASP  39          2HB       ASP  39  -0.492  14.827  -6.358
  689    H    SER  40           H        SER  40   1.062  15.531  -7.125
  690    HA   SER  40           HA       SER  40   2.835  16.621  -7.888
  691   1HB   SER  40          1HB       SER  40   3.322  14.386  -9.240
  692   2HB   SER  40          2HB       SER  40   2.786  15.356 -10.624
  693    HG   SER  40           HG       SER  40   4.924  15.819 -10.572
  694    H    ARG  41           H        ARG  41  -0.207  16.116  -9.479
  695    HA   ARG  41           HA       ARG  41  -0.099  17.989 -11.470
  696   1HB   ARG  41          1HB       ARG  41  -2.417  17.125  -9.686
  697   2HB   ARG  41          2HB       ARG  41  -2.631  18.091 -11.157
  698   1HG   ARG  41          1HG       ARG  41  -1.129  16.066 -12.158
  699   2HG   ARG  41          2HG       ARG  41  -1.931  15.193 -10.840
  700   1HD   ARG  41          1HD       ARG  41  -3.341  14.941 -12.756
  701   2HD   ARG  41          2HD       ARG  41  -4.143  16.155 -11.749
  702    HE   ARG  41           HE       ARG  41  -2.439  17.571 -13.490
  703   1HH1  ARG  41          1HH1      ARG  41  -5.211  15.423 -13.785
  704   2HH1  ARG  41          2HH1      ARG  41  -5.766  16.133 -15.265
  705   1HH2  ARG  41          1HH2      ARG  41  -3.172  18.509 -15.441
  706   2HH2  ARG  41          2HH2      ARG  41  -4.598  17.900 -16.212
  707    H    ILE  42           H        ILE  42  -1.151  18.317  -8.008
  708    HA   ILE  42           HA       ILE  42  -0.855  21.223  -8.331
  709    HB   ILE  42           HB       ILE  42  -2.517  20.188  -6.124
  710   1HG1  ILE  42          1HG1      ILE  42  -3.445  20.009  -8.998
  711   2HG1  ILE  42          2HG1      ILE  42  -3.197  18.647  -7.893
  712   1HG2  ILE  42          1HG2      ILE  42  -2.068  22.615  -6.723
  713   2HG2  ILE  42          2HG2      ILE  42  -3.110  22.357  -8.142
  714   3HG2  ILE  42          3HG2      ILE  42  -3.772  22.150  -6.503
  715   1HD1  ILE  42          1HD1      ILE  42  -5.524  19.048  -7.766
  716   2HD1  ILE  42          2HD1      ILE  42  -4.892  19.908  -6.342
  717   3HD1  ILE  42          3HD1      ILE  42  -5.316  20.815  -7.814
  718    HA   PRO  43           HA       PRO  43   2.344  20.607  -5.447
  719   1HB   PRO  43          1HB       PRO  43   3.189  23.201  -5.298
  720   2HB   PRO  43          2HB       PRO  43   3.727  22.081  -6.549
  721   1HG   PRO  43          1HG       PRO  43   1.769  24.283  -6.690
  722   2HG   PRO  43          2HG       PRO  43   2.655  23.481  -8.036
  723   1HD   PRO  43          1HD       PRO  43  -0.085  23.159  -7.266
  724   2HD   PRO  43          2HD       PRO  43   0.782  22.229  -8.496
  725    H    GLY  44           H        GLY  44  -0.468  22.411  -5.020
  726   1HA   GLY  44          1HA       GLY  44   0.145  23.087  -2.256
  727   2HA   GLY  44          2HA       GLY  44  -1.307  23.474  -3.159
  728    H    VAL  45           H        VAL  45  -0.979  20.351  -4.019
  729    HA   VAL  45           HA       VAL  45  -2.553  19.439  -1.718
  730    HB   VAL  45           HB       VAL  45  -3.123  19.479  -4.423
  731   1HG1  VAL  45          1HG1      VAL  45  -1.645  17.677  -4.976
  732   2HG1  VAL  45          2HG1      VAL  45  -2.236  16.693  -3.616
  733   3HG1  VAL  45          3HG1      VAL  45  -3.304  17.032  -5.000
  734   1HG2  VAL  45          1HG2      VAL  45  -4.739  17.467  -3.279
  735   2HG2  VAL  45          2HG2      VAL  45  -4.311  18.572  -1.952
  736   3HG2  VAL  45          3HG2      VAL  45  -5.095  19.206  -3.418
  737    HA   PRO  46           HA       PRO  46   0.353  16.344  -0.896
  738   1HB   PRO  46          1HB       PRO  46  -1.117  14.102  -0.367
  739   2HB   PRO  46          2HB       PRO  46  -0.907  15.414   0.792
  740   1HG   PRO  46          1HG       PRO  46  -3.224  14.735  -0.903
  741   2HG   PRO  46          2HG       PRO  46  -3.181  15.741   0.590
  742   1HD   PRO  46          1HD       PRO  46  -3.404  16.602  -2.132
  743   2HD   PRO  46          2HD       PRO  46  -3.205  17.637  -0.712
  744    H    TRP  47           H        TRP  47   1.867  15.698  -2.280
  745    HA   TRP  47           HA       TRP  47   0.919  14.358  -4.667
  746   1HB   TRP  47          1HB       TRP  47   3.792  14.582  -4.373
  747   2HB   TRP  47          2HB       TRP  47   2.726  15.187  -5.644
  748    HD1  TRP  47           HD1      TRP  47   1.531  17.688  -5.031
  749    HE1  TRP  47           HE1      TRP  47   2.471  19.799  -3.756
  750    HE3  TRP  47           HE3      TRP  47   5.270  15.223  -2.623
  751    HZ2  TRP  47           HZ2      TRP  47   4.623  20.192  -1.924
  752    HZ3  TRP  47           HZ3      TRP  47   6.745  16.545  -1.109
  753    HH2  TRP  47           HH2      TRP  47   6.469  18.945  -0.742
  754    H    CYS  48           H        CYS  48   0.636  13.107  -1.955
  755    HA   CYS  48           HA       CYS  48   1.575  10.556  -2.653
  756   1HB   CYS  48          1HB       CYS  48   3.715  11.577  -1.895
  757   2HB   CYS  48          2HB       CYS  48   3.005  11.786  -0.290
  758    H    PHE  49           H        PHE  49  -0.463   9.738  -2.164
  759    HA   PHE  49           HA       PHE  49  -1.272   9.969   0.629
  760   1HB   PHE  49          1HB       PHE  49  -3.679  10.045  -0.665
  761   2HB   PHE  49          2HB       PHE  49  -2.811  11.524  -0.238
  762    HD1  PHE  49           HD1      PHE  49  -0.981  12.195  -2.107
  763    HD2  PHE  49           HD2      PHE  49  -4.489   9.910  -2.798
  764    HE1  PHE  49           HE1      PHE  49  -0.929  12.848  -4.530
  765    HE2  PHE  49           HE2      PHE  49  -4.436  10.562  -5.222
  766    HZ   PHE  49           HZ       PHE  49  -2.657  12.023  -6.059
  767    H    LYS  50           H        LYS  50  -3.596   8.513   0.610
  768    HA   LYS  50           HA       LYS  50  -2.789   5.993  -0.668
  769   1HB   LYS  50          1HB       LYS  50  -3.804   4.866   1.316
  770   2HB   LYS  50          2HB       LYS  50  -2.316   5.767   1.658
  771   1HG   LYS  50          1HG       LYS  50  -4.339   7.660   2.025
  772   2HG   LYS  50          2HG       LYS  50  -5.051   6.176   2.681
  773   1HD   LYS  50          1HD       LYS  50  -3.871   7.327   4.462
  774   2HD   LYS  50          2HD       LYS  50  -2.954   5.865   4.061
  775   1HE   LYS  50          1HE       LYS  50  -1.431   7.229   2.647
  776   2HE   LYS  50          2HE       LYS  50  -2.346   8.688   3.055
  777   1HZ   LYS  50          1HZ       LYS  50  -0.261   7.693   4.431
  778   2HZ   LYS  50          2HZ       LYS  50  -1.327   8.789   5.001
  779   3HZ   LYS  50          3HZ       LYS  50  -1.530   7.203   5.332
  780    HA   PRO  51           HA       PRO  51  -6.934   7.218  -2.045
  781   1HB   PRO  51          1HB       PRO  51  -6.459   7.177  -4.734
  782   2HB   PRO  51          2HB       PRO  51  -6.384   8.647  -3.764
  783   1HG   PRO  51          1HG       PRO  51  -4.205   6.983  -4.853
  784   2HG   PRO  51          2HG       PRO  51  -4.141   8.694  -4.298
  785   1HD   PRO  51          1HD       PRO  51  -3.176   6.350  -2.962
  786   2HD   PRO  51          2HD       PRO  51  -3.232   7.992  -2.307
  787    H    LEU  52           H        LEU  52  -6.312   5.650  -4.932
  788    HA   LEU  52           HA       LEU  52  -7.756   3.344  -3.911
  789   1HB   LEU  52          1HB       LEU  52  -8.439   2.956  -6.039
  790   2HB   LEU  52          2HB       LEU  52  -8.303   4.724  -6.032
  791    HG   LEU  52           HG       LEU  52  -7.297   4.304  -8.017
  792   1HD1  LEU  52          1HD1      LEU  52  -5.399   4.592  -5.885
  793   2HD1  LEU  52          2HD1      LEU  52  -4.690   3.600  -7.181
  794   3HD1  LEU  52          3HD1      LEU  52  -5.333   5.218  -7.551
  795   1HD2  LEU  52          1HD2      LEU  52  -7.049   2.236  -8.777
  796   2HD2  LEU  52          2HD2      LEU  52  -5.700   1.938  -7.656
  797   3HD2  LEU  52          3HD2      LEU  52  -7.372   1.628  -7.135
  798    H    GLN  53           H        GLN  53  -5.114   3.646  -2.892
  799    HA   GLN  53           HA       GLN  53  -3.139   2.449  -4.305
  800   1HB   GLN  53          1HB       GLN  53  -3.760   2.256  -1.333
  801   2HB   GLN  53          2HB       GLN  53  -2.210   1.785  -2.051
  802   1HG   GLN  53          1HG       GLN  53  -3.484   4.552  -2.182
  803   2HG   GLN  53          2HG       GLN  53  -2.135   4.096  -1.131
  804   1HE2  GLN  53          1HE2      GLN  53  -3.195   4.937  -4.302
  805   2HE2  GLN  53          2HE2      GLN  53  -1.653   5.015  -5.087
  806    H    GLU  54           H        GLU  54  -6.101   1.047  -3.121
  807    HA   GLU  54           HA       GLU  54  -5.550  -1.472  -2.511
  808   1HB   GLU  54          1HB       GLU  54  -7.732  -2.075  -3.350
  809   2HB   GLU  54          2HB       GLU  54  -7.830  -0.419  -2.727
  810   1HG   GLU  54          1HG       GLU  54  -8.604   0.244  -4.735
  811   2HG   GLU  54          2HG       GLU  54  -7.063  -0.221  -5.472
  812    H    ALA  55           H        ALA  55  -4.916   0.082  -5.587
  813    HA   ALA  55           HA       ALA  55  -5.014  -1.700  -7.509
  814   1HB   ALA  55          1HB       ALA  55  -2.717  -0.848  -8.229
  815   2HB   ALA  55          2HB       ALA  55  -3.928   0.404  -7.858
  816   3HB   ALA  55          3HB       ALA  55  -2.653   0.020  -6.677
  817    H    GLU  56           H        GLU  56  -2.109  -1.668  -5.315
  818    HA   GLU  56           HA       GLU  56  -2.223  -4.562  -5.358
  819   1HB   GLU  56          1HB       GLU  56  -0.152  -2.878  -6.623
  820   2HB   GLU  56          2HB       GLU  56   0.503  -4.125  -5.549
  821   1HG   GLU  56          1HG       GLU  56  -0.443  -5.876  -6.815
  822   2HG   GLU  56          2HG       GLU  56  -1.638  -4.819  -7.582
  823    H    CYS  57           H        CYS  57  -2.608  -2.078  -3.488
  824    HA   CYS  57           HA       CYS  57  -0.534  -2.618  -1.539
  825   1HB   CYS  57          1HB       CYS  57  -1.988  -0.350  -2.265
  826   2HB   CYS  57          2HB       CYS  57  -2.605  -0.788  -0.671
  827    H    THR  58           H        THR  58  -4.171  -2.484  -1.745
  828    HA   THR  58           HA       THR  58  -4.547  -3.828   0.717
  829    HB   THR  58           HB       THR  58  -6.124  -2.237  -0.615
  830    HG1  THR  58           HG1      THR  58  -6.757  -4.869   0.489
  831   1HG2  THR  58          1HG2      THR  58  -6.646  -4.923  -1.992
  832   2HG2  THR  58          2HG2      THR  58  -7.797  -3.565  -2.001
  833   3HG2  THR  58          3HG2      THR  58  -6.208  -3.391  -2.785
  834    H    PHE  59           H        PHE  59  -4.408  -4.919  -2.708
  835    HA   PHE  59           HA       PHE  59  -5.334  -7.370  -2.682
  836   1HB   PHE  59          1HB       PHE  59  -3.129  -5.899  -3.896
  837   2HB   PHE  59          2HB       PHE  59  -2.604  -7.567  -3.646
  838    HD1  PHE  59           HD1      PHE  59  -2.943  -9.000  -5.409
  839    HD2  PHE  59           HD2      PHE  59  -5.624  -5.750  -4.901
  840    HE1  PHE  59           HE1      PHE  59  -4.160  -9.678  -7.496
  841    HE2  PHE  59           HE2      PHE  59  -6.842  -6.429  -6.989
  842    HZ   PHE  59           HZ       PHE  59  -6.095  -8.385  -8.261
  Start of MODEL   32
    1   1H    GLU   1           H1       GLU   1 -15.371  -3.621  -0.894
    2    HA   GLU   1           HA       GLU   1 -16.443  -4.291   0.875
    3   1HB   GLU   1          1HB       GLU   1 -18.697  -5.468   0.622
    4   2HB   GLU   1          2HB       GLU   1 -18.578  -3.858  -0.109
    5   1HG   GLU   1          1HG       GLU   1 -17.812  -6.140  -1.864
    6   2HG   GLU   1          2HG       GLU   1 -19.523  -6.078  -1.415
    7    H    GLU   2           H        GLU   2 -15.751  -6.591  -1.710
    8    HA   GLU   2           HA       GLU   2 -15.854  -8.815   0.105
    9   1HB   GLU   2          1HB       GLU   2 -15.801  -8.405  -2.788
   10   2HB   GLU   2          2HB       GLU   2 -14.662  -9.672  -2.296
   11   1HG   GLU   2          1HG       GLU   2 -16.643 -10.582  -0.866
   12   2HG   GLU   2          2HG       GLU   2 -17.667  -9.538  -1.865
   13    H    TYR   3           H        TYR   3 -14.058  -6.849   1.009
   14    HA   TYR   3           HA       TYR   3 -11.411  -7.652   0.134
   15   1HB   TYR   3          1HB       TYR   3 -12.798  -5.575   1.856
   16   2HB   TYR   3          2HB       TYR   3 -11.104  -5.908   2.235
   17    HD1  TYR   3           HD1      TYR   3  -9.598  -4.419   1.310
   18    HD2  TYR   3           HD2      TYR   3 -13.170  -5.339  -0.860
   19    HE1  TYR   3           HE1      TYR   3  -8.892  -2.827  -0.543
   20    HE2  TYR   3           HE2      TYR   3 -12.452  -3.743  -2.704
   21    HH   TYR   3           HH       TYR   3  -9.271  -2.386  -2.776
   22    H    VAL   4           H        VAL   4 -11.522  -9.911   0.870
   23    HA   VAL   4           HA       VAL   4 -11.180 -10.073   3.785
   24    HB   VAL   4           HB       VAL   4 -11.937 -12.554   3.203
   25   1HG1  VAL   4          1HG1      VAL   4 -14.345 -11.737   3.708
   26   2HG1  VAL   4          2HG1      VAL   4 -13.067 -11.420   4.907
   27   3HG1  VAL   4          3HG1      VAL   4 -13.609 -10.119   3.818
   28   1HG2  VAL   4          1HG2      VAL   4 -12.255 -12.289   0.839
   29   2HG2  VAL   4          2HG2      VAL   4 -13.862 -12.452   1.588
   30   3HG2  VAL   4          3HG2      VAL   4 -13.275 -10.850   1.080
   31    H    GLY   5           H        GLY   5 -10.417 -11.613   0.587
   32   1HA   GLY   5          1HA       GLY   5  -8.195 -13.075   1.582
   33   2HA   GLY   5          2HA       GLY   5  -8.606 -12.769  -0.094
   34    H    LEU   6           H        LEU   6  -8.623  -9.743   1.319
   35    HA   LEU   6           HA       LEU   6  -5.735  -9.385   0.981
   36   1HB   LEU   6          1HB       LEU   6  -7.352  -7.159   0.027
   37   2HB   LEU   6          2HB       LEU   6  -5.916  -7.919  -0.679
   38    HG   LEU   6           HG       LEU   6  -7.454  -9.763  -1.495
   39   1HD1  LEU   6          1HD1      LEU   6  -9.581  -9.823  -0.878
   40   2HD1  LEU   6          2HD1      LEU   6  -9.338  -8.353   0.098
   41   3HD1  LEU   6          3HD1      LEU   6  -9.856  -8.220  -1.600
   42   1HD2  LEU   6          1HD2      LEU   6  -8.428  -8.268  -3.342
   43   2HD2  LEU   6          2HD2      LEU   6  -7.619  -6.925  -2.499
   44   3HD2  LEU   6          3HD2      LEU   6  -6.662  -8.288  -3.126
   45    H    SER   7           H        SER   7  -7.976  -9.565   3.203
   46    HA   SER   7           HA       SER   7  -7.379  -6.978   4.393
   47   1HB   SER   7          1HB       SER   7  -9.296  -7.416   5.884
   48   2HB   SER   7          2HB       SER   7  -9.782  -7.502   4.182
   49    HG   SER   7           HG       SER   7  -9.177  -9.747   5.914
   50    H    ALA   8           H        ALA   8  -7.863  -7.661   7.118
   51    HA   ALA   8           HA       ALA   8  -5.389  -8.610   7.901
   52   1HB   ALA   8          1HB       ALA   8  -7.963  -7.872   9.121
   53   2HB   ALA   8          2HB       ALA   8  -7.081  -9.113  10.043
   54   3HB   ALA   8          3HB       ALA   8  -6.302  -7.555   9.679
   55    H    ASN   9           H        ASN   9  -4.976 -10.533   6.618
   56    HA   ASN   9           HA       ASN   9  -5.291 -12.845   7.962
   57   1HB   ASN   9          1HB       ASN   9  -7.780 -12.212   6.889
   58   2HB   ASN   9          2HB       ASN   9  -7.115 -13.292   5.655
   59   1HD2  ASN   9          1HD2      ASN   9  -5.819 -15.185   6.765
   60   2HD2  ASN   9          2HD2      ASN   9  -6.701 -16.072   7.963
   61    H    GLN  10           H        GLN  10  -5.260 -11.139   4.814
   62    HA   GLN  10           HA       GLN  10  -4.178 -13.207   3.305
   63   1HB   GLN  10          1HB       GLN  10  -5.278 -11.145   2.413
   64   2HB   GLN  10          2HB       GLN  10  -3.851 -10.204   2.884
   65   1HG   GLN  10          1HG       GLN  10  -2.446 -11.588   1.396
   66   2HG   GLN  10          2HG       GLN  10  -3.848 -12.574   0.954
   67   1HE2  GLN  10          1HE2      GLN  10  -3.069  -9.109   1.290
   68   2HE2  GLN  10          2HE2      GLN  10  -3.696  -8.595  -0.239
   69    H    CYS  11           H        CYS  11  -2.771 -10.823   5.533
   70    HA   CYS  11           HA       CYS  11  -0.126 -11.036   4.637
   71   1HB   CYS  11          1HB       CYS  11  -0.831  -9.188   5.984
   72   2HB   CYS  11          2HB       CYS  11  -1.279 -10.252   7.319
   73    H    ALA  12           H        ALA  12  -2.222 -13.356   5.896
   74    HA   ALA  12           HA       ALA  12  -0.030 -14.818   7.196
   75   1HB   ALA  12          1HB       ALA  12  -2.752 -14.285   7.943
   76   2HB   ALA  12          2HB       ALA  12  -2.580 -16.033   7.653
   77   3HB   ALA  12          3HB       ALA  12  -1.520 -15.218   8.827
   78    H    VAL  13           H        VAL  13  -1.037 -14.399   4.210
   79    HA   VAL  13           HA       VAL  13  -2.152 -16.585   3.140
   80    HB   VAL  13           HB       VAL  13  -0.670 -14.419   2.264
   81   1HG1  VAL  13          1HG1      VAL  13   0.939 -15.304   0.642
   82   2HG1  VAL  13          2HG1      VAL  13   1.390 -15.768   2.301
   83   3HG1  VAL  13          3HG1      VAL  13   0.629 -16.959   1.220
   84   1HG2  VAL  13          1HG2      VAL  13  -1.321 -16.103   0.030
   85   2HG2  VAL  13          2HG2      VAL  13  -2.589 -16.265   1.269
   86   3HG2  VAL  13          3HG2      VAL  13  -2.168 -14.658   0.630
   87    HA   PRO  14           HA       PRO  14   0.418 -19.997   3.786
   88   1HB   PRO  14          1HB       PRO  14   0.137 -21.455   1.493
   89   2HB   PRO  14          2HB       PRO  14  -1.067 -21.442   2.780
   90   1HG   PRO  14          1HG       PRO  14  -1.077 -20.085   0.161
   91   2HG   PRO  14          2HG       PRO  14  -2.472 -20.460   1.237
   92   1HD   PRO  14          1HD       PRO  14  -1.186 -17.938   0.802
   93   2HD   PRO  14          2HD       PRO  14  -2.449 -18.287   1.989
   94    H    ALA  15           H        ALA  15   1.695 -17.582   2.712
   95    HA   ALA  15           HA       ALA  15   3.616 -16.962   1.786
   96   1HB   ALA  15          1HB       ALA  15   4.449 -18.144   3.762
   97   2HB   ALA  15          2HB       ALA  15   4.449 -19.684   2.869
   98   3HB   ALA  15          3HB       ALA  15   5.568 -18.382   2.399
   99    H    LYS  16           H        LYS  16   2.457 -17.127  -0.355
  100    HA   LYS  16           HA       LYS  16   4.012 -18.007  -2.335
  101   1HB   LYS  16          1HB       LYS  16   2.700 -20.170  -3.011
  102   2HB   LYS  16          2HB       LYS  16   4.079 -20.260  -1.902
  103   1HG   LYS  16          1HG       LYS  16   2.764 -21.064  -0.258
  104   2HG   LYS  16          2HG       LYS  16   1.630 -19.712  -0.422
  105   1HD   LYS  16          1HD       LYS  16   0.137 -21.025  -1.484
  106   2HD   LYS  16          2HD       LYS  16   1.348 -21.558  -2.664
  107   1HE   LYS  16          1HE       LYS  16   1.942 -23.430  -1.393
  108   2HE   LYS  16          2HE       LYS  16   1.407 -22.709   0.132
  109   1HZ   LYS  16          1HZ       LYS  16  -0.678 -23.040  -1.775
  110   2HZ   LYS  16          2HZ       LYS  16   0.013 -24.456  -1.345
  111   3HZ   LYS  16          3HZ       LYS  16  -0.627 -23.480  -0.203
  112    H    ASP  17           H        ASP  17   2.438 -15.842  -1.941
  113    HA   ASP  17           HA       ASP  17   0.784 -15.977  -4.222
  114   1HB   ASP  17          1HB       ASP  17  -0.685 -16.897  -2.345
  115   2HB   ASP  17          2HB       ASP  17  -0.583 -15.303  -1.579
  116    H    ARG  18           H        ARG  18   2.187 -14.417  -1.368
  117    HA   ARG  18           HA       ARG  18   1.336 -11.878  -1.569
  118   1HB   ARG  18          1HB       ARG  18   4.204 -12.784  -1.036
  119   2HB   ARG  18          2HB       ARG  18   3.514 -11.229  -0.538
  120   1HG   ARG  18          1HG       ARG  18   2.361 -12.161   1.206
  121   2HG   ARG  18          2HG       ARG  18   1.988 -13.648   0.317
  122   1HD   ARG  18          1HD       ARG  18   4.231 -14.508   0.717
  123   2HD   ARG  18          2HD       ARG  18   4.755 -12.972   1.424
  124    HE   ARG  18           HE       ARG  18   2.455 -14.282   2.737
  125   1HH1  ARG  18          1HH1      ARG  18   5.936 -13.769   2.711
  126   2HH1  ARG  18          2HH1      ARG  18   6.146 -14.230   4.367
  127   1HH2  ARG  18          1HH2      ARG  18   2.730 -14.890   4.922
  128   2HH2  ARG  18          2HH2      ARG  18   4.309 -14.871   5.634
  129    H    VAL  19           H        VAL  19   3.004  -9.945  -2.265
  130    HA   VAL  19           HA       VAL  19   3.644 -10.498  -5.076
  131    HB   VAL  19           HB       VAL  19   2.903  -7.930  -3.661
  132   1HG1  VAL  19          1HG1      VAL  19   3.916  -8.497  -6.429
  133   2HG1  VAL  19          2HG1      VAL  19   2.725  -7.197  -6.187
  134   3HG1  VAL  19          3HG1      VAL  19   4.286  -7.144  -5.333
  135   1HG2  VAL  19          1HG2      VAL  19   0.851  -8.027  -4.985
  136   2HG2  VAL  19          2HG2      VAL  19   1.377  -9.559  -5.720
  137   3HG2  VAL  19          3HG2      VAL  19   1.016  -9.486  -3.980
  138    H    ASP  20           H        ASP  20   5.241 -10.909  -2.433
  139    HA   ASP  20           HA       ASP  20   7.190 -10.353  -1.561
  140   1HB   ASP  20          1HB       ASP  20   8.122 -11.867  -3.044
  141   2HB   ASP  20          2HB       ASP  20   7.592 -10.965  -4.473
  142    H    CYS  21           H        CYS  21   6.893  -8.118  -0.870
  143    HA   CYS  21           HA       CYS  21   6.877  -5.910  -2.450
  144   1HB   CYS  21          1HB       CYS  21   6.718  -6.345   0.186
  145   2HB   CYS  21          2HB       CYS  21   8.356  -5.685   0.117
  146    H    GLY  22           H        GLY  22   9.622  -7.905  -1.286
  147   1HA   GLY  22          1HA       GLY  22  11.822  -7.877  -1.751
  148   2HA   GLY  22          2HA       GLY  22  11.341  -7.342  -3.349
  149    H    TYR  23           H        TYR  23  11.548  -5.934   0.006
  150    HA   TYR  23           HA       TYR  23  12.370  -3.406  -1.174
  151   1HB   TYR  23          1HB       TYR  23  11.051  -4.499   1.217
  152   2HB   TYR  23          2HB       TYR  23  12.389  -3.458   1.713
  153    HD1  TYR  23           HD1      TYR  23   9.025  -3.599   0.356
  154    HD2  TYR  23           HD2      TYR  23  12.401  -1.048   0.990
  155    HE1  TYR  23           HE1      TYR  23   7.556  -1.554   0.001
  156    HE2  TYR  23           HE2      TYR  23  10.921   0.988   0.633
  157    HH   TYR  23           HH       TYR  23   8.773   1.453  -0.616
  158    HA   PRO  24           HA       PRO  24  16.547  -4.109  -0.250
  159   1HB   PRO  24          1HB       PRO  24  17.498  -1.562  -0.516
  160   2HB   PRO  24          2HB       PRO  24  17.223  -2.637  -1.886
  161   1HG   PRO  24          1HG       PRO  24  15.624  -0.356  -0.914
  162   2HG   PRO  24          2HG       PRO  24  15.614  -1.122  -2.544
  163   1HD   PRO  24          1HD       PRO  24  13.683  -1.376  -0.444
  164   2HD   PRO  24          2HD       PRO  24  13.710  -2.275  -1.966
  165    H    HIS  25           H        HIS  25  14.425  -2.592   1.739
  166    HA   HIS  25           HA       HIS  25  16.486  -2.518   3.815
  167   1HB   HIS  25          1HB       HIS  25  14.995  -0.331   2.809
  168   2HB   HIS  25          2HB       HIS  25  14.358  -0.686   4.419
  169    HD1  HIS  25           HD1      HIS  25  16.146   1.857   3.540
  170    HD2  HIS  25           HD2      HIS  25  17.451  -1.537   5.633
  171    HE1  HIS  25           HE1      HIS  25  18.237   2.566   4.818
  172    HE2  HIS  25           HE2      HIS  25  18.962   0.454   6.127
  173    H    VAL  26           H        VAL  26  14.348  -4.501   2.743
  174    HA   VAL  26           HA       VAL  26  12.178  -4.751   4.304
  175    HB   VAL  26           HB       VAL  26  12.519  -6.308   2.607
  176   1HG1  VAL  26          1HG1      VAL  26  14.715  -7.934   3.451
  177   2HG1  VAL  26          2HG1      VAL  26  14.554  -6.955   1.974
  178   3HG1  VAL  26          3HG1      VAL  26  15.245  -6.234   3.447
  179   1HG2  VAL  26          1HG2      VAL  26  11.810  -8.214   3.623
  180   2HG2  VAL  26          2HG2      VAL  26  13.163  -8.234   4.780
  181   3HG2  VAL  26          3HG2      VAL  26  11.770  -7.160   5.057
  182    H    THR  27           H        THR  27  11.696  -5.024   6.435
  183    HA   THR  27           HA       THR  27  13.421  -6.391   8.215
  184    HB   THR  27           HB       THR  27  13.963  -3.577   7.734
  185    HG1  THR  27           HG1      THR  27  15.757  -4.294   8.995
  186   1HG2  THR  27          1HG2      THR  27  13.312  -2.525   9.658
  187   2HG2  THR  27          2HG2      THR  27  12.258  -3.921   9.985
  188   3HG2  THR  27          3HG2      THR  27  13.909  -3.877  10.649
  189    HA   PRO  28           HA       PRO  28   9.686  -6.589  10.315
  190   1HB   PRO  28          1HB       PRO  28  10.500  -7.332  12.814
  191   2HB   PRO  28          2HB       PRO  28  10.351  -8.464  11.473
  192   1HG   PRO  28          1HG       PRO  28  12.756  -7.241  12.667
  193   2HG   PRO  28          2HG       PRO  28  12.636  -8.724  11.654
  194   1HD   PRO  28          1HD       PRO  28  13.579  -6.126  10.902
  195   2HD   PRO  28          2HD       PRO  28  13.331  -7.511   9.829
  196    H    LYS  29           H        LYS  29  10.188  -4.020   9.867
  197    HA   LYS  29           HA       LYS  29   8.760  -2.768  11.849
  198   1HB   LYS  29          1HB       LYS  29  11.059  -3.357  13.027
  199   2HB   LYS  29          2HB       LYS  29  11.581  -1.861  12.232
  200   1HG   LYS  29          1HG       LYS  29  10.533  -0.657  13.815
  201   2HG   LYS  29          2HG       LYS  29   8.984  -1.398  13.384
  202   1HD   LYS  29          1HD       LYS  29  10.882  -3.013  15.051
  203   2HD   LYS  29          2HD       LYS  29  10.083  -1.643  15.842
  204   1HE   LYS  29          1HE       LYS  29   7.889  -2.622  14.836
  205   2HE   LYS  29          2HE       LYS  29   8.825  -4.099  14.562
  206   1HZ   LYS  29          1HZ       LYS  29   8.012  -4.420  16.641
  207   2HZ   LYS  29          2HZ       LYS  29   9.436  -3.721  17.028
  208   3HZ   LYS  29          3HZ       LYS  29   8.059  -2.844  17.066
  209    H    GLU  30           H        GLU  30  10.937  -2.867   9.128
  210    HA   GLU  30           HA       GLU  30  10.376  -0.092   8.527
  211   1HB   GLU  30          1HB       GLU  30  12.512  -1.971   7.923
  212   2HB   GLU  30          2HB       GLU  30  11.911  -1.221   6.434
  213   1HG   GLU  30          1HG       GLU  30  13.622   0.232   7.216
  214   2HG   GLU  30          2HG       GLU  30  12.114   1.032   7.687
  215    H    CYS  31           H        CYS  31   9.920  -3.435   7.241
  216    HA   CYS  31           HA       CYS  31   8.721  -2.767   4.858
  217   1HB   CYS  31          1HB       CYS  31   8.477  -5.139   6.682
  218   2HB   CYS  31          2HB       CYS  31   7.527  -5.033   5.198
  219    H    ASN  32           H        ASN  32   7.272  -3.408   8.131
  220    HA   ASN  32           HA       ASN  32   4.666  -2.881   7.293
  221   1HB   ASN  32          1HB       ASN  32   6.121  -3.298   9.856
  222   2HB   ASN  32          2HB       ASN  32   4.653  -2.321  10.013
  223   1HD2  ASN  32          1HD2      ASN  32   5.747  -5.168   8.163
  224   2HD2  ASN  32          2HD2      ASN  32   4.389  -6.186   8.505
  225    H    ASN  33           H        ASN  33   7.331  -0.853   7.456
  226    HA   ASN  33           HA       ASN  33   5.794   1.417   8.413
  227   1HB   ASN  33          1HB       ASN  33   8.187   0.837   9.260
  228   2HB   ASN  33          2HB       ASN  33   8.759   1.409   7.687
  229   1HD2  ASN  33          1HD2      ASN  33   9.883   2.847   9.315
  230   2HD2  ASN  33          2HD2      ASN  33   9.123   4.354   9.709
  231    H    ARG  34           H        ARG  34   7.375  -0.106   5.620
  232    HA   ARG  34           HA       ARG  34   7.265   2.274   4.054
  233   1HB   ARG  34          1HB       ARG  34   7.719  -0.548   3.015
  234   2HB   ARG  34          2HB       ARG  34   8.325   0.970   2.331
  235   1HG   ARG  34          1HG       ARG  34   9.296   0.900   4.982
  236   2HG   ARG  34          2HG       ARG  34   9.503  -0.754   4.380
  237   1HD   ARG  34          1HD       ARG  34  11.105  -0.126   2.866
  238   2HD   ARG  34          2HD       ARG  34  10.297   1.398   2.473
  239    HE   ARG  34           HE       ARG  34  11.490   1.286   5.161
  240   1HH1  ARG  34          1HH1      ARG  34  11.984   2.143   1.785
  241   2HH1  ARG  34          2HH1      ARG  34  13.283   3.239   2.120
  242   1HH2  ARG  34          1HH2      ARG  34  13.203   2.731   5.606
  243   2HH2  ARG  34          2HH2      ARG  34  13.980   3.576   4.308
  244    H    GLY  35           H        GLY  35   5.248  -0.511   4.794
  245   1HA   GLY  35          1HA       GLY  35   2.878  -0.143   4.270
  246   2HA   GLY  35          2HA       GLY  35   3.373   0.284   2.644
  247    H    CYS  36           H        CYS  36   5.102  -2.279   4.382
  248    HA   CYS  36           HA       CYS  36   3.715  -4.228   2.687
  249   1HB   CYS  36          1HB       CYS  36   6.604  -4.358   3.546
  250   2HB   CYS  36          2HB       CYS  36   5.764  -5.455   2.444
  251    H    CYS  37           H        CYS  37   4.453  -6.593   3.753
  252    HA   CYS  37           HA       CYS  37   3.977  -6.302   6.629
  253   1HB   CYS  37          1HB       CYS  37   1.996  -7.060   5.165
  254   2HB   CYS  37          2HB       CYS  37   2.863  -8.593   5.029
  255    H    PHE  38           H        PHE  38   5.553  -7.315   7.841
  256    HA   PHE  38           HA       PHE  38   7.481  -8.930   6.397
  257   1HB   PHE  38          1HB       PHE  38   8.046  -7.015   7.994
  258   2HB   PHE  38          2HB       PHE  38   7.307  -7.938   9.307
  259    HD1  PHE  38           HD1      PHE  38   8.477  -9.766  10.327
  260    HD2  PHE  38           HD2      PHE  38  10.155  -7.757   6.987
  261    HE1  PHE  38           HE1      PHE  38  10.683 -10.881  10.766
  262    HE2  PHE  38           HE2      PHE  38  12.361  -8.872   7.425
  263    HZ   PHE  38           HZ       PHE  38  12.599 -10.420   9.309
  264    H    ASP  39           H        ASP  39   7.416 -11.124   6.397
  265    HA   ASP  39           HA       ASP  39   5.592 -12.382   8.221
  266   1HB   ASP  39          1HB       ASP  39   5.503 -13.148   5.946
  267   2HB   ASP  39          2HB       ASP  39   7.260 -13.350   5.864
  268    H    SER  40           H        SER  40   8.758 -13.617   6.963
  269    HA   SER  40           HA       SER  40  10.667 -14.009   8.023
  270   1HB   SER  40          1HB       SER  40   9.667 -12.334   9.864
  271   2HB   SER  40          2HB       SER  40   9.549 -13.830  10.806
  272    HG   SER  40           HG       SER  40  11.994 -13.337   9.443
  273    H    ARG  41           H        ARG  41   7.546 -15.377   8.631
  274    HA   ARG  41           HA       ARG  41   8.211 -17.538  10.190
  275   1HB   ARG  41          1HB       ARG  41   6.105 -17.215   8.009
  276   2HB   ARG  41          2HB       ARG  41   6.149 -18.602   9.111
  277   1HG   ARG  41          1HG       ARG  41   6.310 -16.493  10.872
  278   2HG   ARG  41          2HG       ARG  41   5.294 -15.794   9.599
  279   1HD   ARG  41          1HD       ARG  41   3.601 -16.829  10.732
  280   2HD   ARG  41          2HD       ARG  41   4.145 -18.280   9.879
  281    HE   ARG  41           HE       ARG  41   5.720 -18.005  12.232
  282   1HH1  ARG  41          1HH1      ARG  41   2.376 -18.645  11.342
  283   2HH1  ARG  41          2HH1      ARG  41   2.040 -19.570  12.767
  284   1HH2  ARG  41          1HH2      ARG  41   5.277 -19.226  14.112
  285   2HH2  ARG  41          2HH2      ARG  41   3.701 -19.903  14.353
  286    H    ILE  42           H        ILE  42   8.244 -17.070   6.604
  287    HA   ILE  42           HA       ILE  42   9.769 -19.573   6.415
  288    HB   ILE  42           HB       ILE  42   8.183 -18.552   4.109
  289   1HG1  ILE  42          1HG1      ILE  42   7.022 -19.953   6.518
  290   2HG1  ILE  42          2HG1      ILE  42   6.505 -18.418   5.797
  291   1HG2  ILE  42          1HG2      ILE  42   8.172 -21.408   4.712
  292   2HG2  ILE  42          2HG2      ILE  42   8.647 -20.546   3.228
  293   3HG2  ILE  42          3HG2      ILE  42   9.815 -20.740   4.558
  294   1HD1  ILE  42          1HD1      ILE  42   5.965 -21.232   4.937
  295   2HD1  ILE  42          2HD1      ILE  42   4.936 -19.785   4.808
  296   3HD1  ILE  42          3HD1      ILE  42   6.249 -20.051   3.636
  297    HA   PRO  43           HA       PRO  43  12.760 -16.743   4.969
  298   1HB   PRO  43          1HB       PRO  43  14.841 -18.507   4.825
  299   2HB   PRO  43          2HB       PRO  43  14.402 -17.653   6.303
  300   1HG   PRO  43          1HG       PRO  43  13.911 -20.453   5.514
  301   2HG   PRO  43          2HG       PRO  43  13.901 -19.733   7.164
  302   1HD   PRO  43          1HD       PRO  43  11.668 -20.511   5.548
  303   2HD   PRO  43          2HD       PRO  43  11.604 -19.660   7.096
  304    H    GLY  44           H        GLY  44  11.458 -19.411   3.399
  305   1HA   GLY  44          1HA       GLY  44  12.977 -18.957   0.952
  306   2HA   GLY  44          2HA       GLY  44  11.784 -20.202   1.256
  307    H    VAL  45           H        VAL  45  10.212 -17.652   2.534
  308    HA   VAL  45           HA       VAL  45   9.020 -16.939  -0.053
  309    HB   VAL  45           HB       VAL  45   7.899 -18.078   2.220
  310   1HG1  VAL  45          1HG1      VAL  45   7.133 -16.508   3.603
  311   2HG1  VAL  45          2HG1      VAL  45   7.967 -15.265   2.639
  312   3HG1  VAL  45          3HG1      VAL  45   6.284 -15.705   2.261
  313   1HG2  VAL  45          1HG2      VAL  45   6.474 -18.525   0.562
  314   2HG2  VAL  45          2HG2      VAL  45   5.794 -16.893   0.771
  315   3HG2  VAL  45          3HG2      VAL  45   7.098 -17.171  -0.409
  316    HA   PRO  46           HA       PRO  46   9.809 -12.761   0.750
  317   1HB   PRO  46          1HB       PRO  46   7.505 -11.433   0.128
  318   2HB   PRO  46          2HB       PRO  46   8.635 -12.025  -1.089
  319   1HG   PRO  46          1HG       PRO  46   6.028 -13.111  -0.234
  320   2HG   PRO  46          2HG       PRO  46   6.927 -13.421  -1.763
  321   1HD   PRO  46          1HD       PRO  46   6.643 -15.135   0.515
  322   2HD   PRO  46          2HD       PRO  46   7.668 -15.419  -0.899
  323    H    TRP  47           H        TRP  47  10.401 -12.030   2.687
  324    HA   TRP  47           HA       TRP  47   8.370 -12.122   4.754
  325   1HB   TRP  47          1HB       TRP  47  10.879 -10.960   5.556
  326   2HB   TRP  47          2HB       TRP  47  10.065 -12.413   6.140
  327    HD1  TRP  47           HD1      TRP  47  10.722 -14.758   4.782
  328    HE1  TRP  47           HE1      TRP  47  12.902 -15.544   3.519
  329    HE3  TRP  47           HE3      TRP  47  12.697 -10.108   4.203
  330    HZ2  TRP  47           HZ2      TRP  47  15.156 -14.164   2.443
  331    HZ3  TRP  47           HZ3      TRP  47  14.891  -9.915   3.034
  332    HH2  TRP  47           HH2      TRP  47  16.113 -11.847   2.168
  333    H    CYS  48           H        CYS  48   8.069 -10.307   2.409
  334    HA   CYS  48           HA       CYS  48   7.415  -7.979   3.844
  335   1HB   CYS  48          1HB       CYS  48   9.887  -7.680   3.628
  336   2HB   CYS  48          2HB       CYS  48   9.681  -7.622   1.875
  337    H    PHE  49           H        PHE  49   5.387  -7.963   2.884
  338    HA   PHE  49           HA       PHE  49   5.344  -7.575   0.005
  339   1HB   PHE  49          1HB       PHE  49   3.190  -9.206   0.302
  340   2HB   PHE  49          2HB       PHE  49   4.791  -9.871  -0.041
  341    HD1  PHE  49           HD1      PHE  49   6.232 -10.359   2.135
  342    HD2  PHE  49           HD2      PHE  49   1.998 -10.086   2.053
  343    HE1  PHE  49           HE1      PHE  49   6.104 -11.713   4.245
  344    HE2  PHE  49           HE2      PHE  49   1.870 -11.440   4.162
  345    HZ   PHE  49           HZ       PHE  49   3.924 -12.237   5.233
  346    H    LYS  50           H        LYS  50   2.611  -7.508  -0.423
  347    HA   LYS  50           HA       LYS  50   1.716  -5.505   1.532
  348   1HB   LYS  50          1HB       LYS  50   0.454  -4.968  -0.906
  349   2HB   LYS  50          2HB       LYS  50   1.718  -4.013  -0.114
  350   1HG   LYS  50          1HG       LYS  50   2.502  -6.428  -1.736
  351   2HG   LYS  50          2HG       LYS  50   2.041  -4.947  -2.595
  352   1HD   LYS  50          1HD       LYS  50   4.275  -5.313  -0.562
  353   2HD   LYS  50          2HD       LYS  50   4.448  -4.903  -2.278
  354   1HE   LYS  50          1HE       LYS  50   3.476  -3.190   0.019
  355   2HE   LYS  50          2HE       LYS  50   4.723  -2.820  -1.182
  356   1HZ   LYS  50          1HZ       LYS  50   1.862  -3.091  -1.791
  357   2HZ   LYS  50          2HZ       LYS  50   2.612  -1.664  -1.534
  358   3HZ   LYS  50          3HZ       LYS  50   3.032  -2.588  -2.814
  359    HA   PRO  51           HA       PRO  51  -1.253  -8.918   1.352
  360   1HB   PRO  51          1HB       PRO  51  -1.321  -9.482   4.025
  361   2HB   PRO  51          2HB       PRO  51  -0.298 -10.349   2.882
  362   1HG   PRO  51          1HG       PRO  51   0.400  -8.262   4.848
  363   2HG   PRO  51          2HG       PRO  51   1.481  -9.461   4.051
  364   1HD   PRO  51          1HD       PRO  51   1.204  -6.665   3.497
  365   2HD   PRO  51          2HD       PRO  51   2.165  -7.833   2.578
  366    H    LEU  52           H        LEU  52  -1.819  -7.885   4.568
  367    HA   LEU  52           HA       LEU  52  -4.272  -6.645   3.615
  368   1HB   LEU  52          1HB       LEU  52  -5.156  -7.024   5.692
  369   2HB   LEU  52          2HB       LEU  52  -4.127  -8.443   5.428
  370    HG   LEU  52           HG       LEU  52  -2.634  -6.386   6.786
  371   1HD1  LEU  52          1HD1      LEU  52  -5.415  -6.478   7.528
  372   2HD1  LEU  52          2HD1      LEU  52  -4.403  -7.057   8.874
  373   3HD1  LEU  52          3HD1      LEU  52  -4.104  -5.454   8.161
  374   1HD2  LEU  52          1HD2      LEU  52  -3.263  -8.646   8.444
  375   2HD2  LEU  52          2HD2      LEU  52  -2.935  -9.194   6.782
  376   3HD2  LEU  52          3HD2      LEU  52  -1.729  -8.214   7.650
  377    H    GLN  53           H        GLN  53  -1.718  -5.327   3.089
  378    HA   GLN  53           HA       GLN  53  -1.065  -3.446   4.956
  379   1HB   GLN  53          1HB       GLN  53  -1.018  -3.265   1.921
  380   2HB   GLN  53          2HB       GLN  53  -0.178  -2.131   2.995
  381   1HG   GLN  53          1HG       GLN  53   0.289  -5.134   2.762
  382   2HG   GLN  53          2HG       GLN  53   1.389  -3.858   2.221
  383   1HE2  GLN  53          1HE2      GLN  53   0.197  -5.746   4.833
  384   2HE2  GLN  53          2HE2      GLN  53   1.227  -5.152   6.093
  385    H    GLU  54           H        GLU  54  -3.956  -3.751   3.038
  386    HA   GLU  54           HA       GLU  54  -4.778  -1.288   2.513
  387   1HB   GLU  54          1HB       GLU  54  -6.979  -2.101   2.568
  388   2HB   GLU  54          2HB       GLU  54  -6.019  -3.574   2.349
  389   1HG   GLU  54          1HG       GLU  54  -7.240  -4.335   4.116
  390   2HG   GLU  54          2HG       GLU  54  -6.095  -3.404   5.091
  391    H    ALA  55           H        ALA  55  -4.166  -2.630   5.711
  392    HA   ALA  55           HA       ALA  55  -5.693  -1.273   7.418
  393   1HB   ALA  55          1HB       ALA  55  -4.101  -2.601   8.438
  394   2HB   ALA  55          2HB       ALA  55  -2.787  -2.023   7.386
  395   3HB   ALA  55          3HB       ALA  55  -3.378  -1.000   8.717
  396    H    GLU  56           H        GLU  56  -2.498   0.128   6.396
  397    HA   GLU  56           HA       GLU  56  -3.860   2.703   6.328
  398   1HB   GLU  56          1HB       GLU  56  -1.177   2.038   7.588
  399   2HB   GLU  56          2HB       GLU  56  -1.706   3.697   7.261
  400   1HG   GLU  56          1HG       GLU  56  -3.540   3.509   8.789
  401   2HG   GLU  56          2HG       GLU  56  -3.383   1.749   8.893
  402    H    CYS  57           H        CYS  57  -3.071   0.653   4.234
  403    HA   CYS  57           HA       CYS  57  -1.039   2.198   2.818
  404   1HB   CYS  57          1HB       CYS  57  -0.850  -0.334   3.243
  405   2HB   CYS  57          2HB       CYS  57  -2.067  -0.499   1.975
  406    H    THR  58           H        THR  58  -4.196   0.447   2.329
  407    HA   THR  58           HA       THR  58  -4.713   2.042  -0.043
  408    HB   THR  58           HB       THR  58  -5.166  -0.560   0.504
  409    HG1  THR  58           HG1      THR  58  -7.040   1.314  -0.764
  410   1HG2  THR  58          1HG2      THR  58  -7.574  -0.887   1.016
  411   2HG2  THR  58          2HG2      THR  58  -6.771  -0.086   2.388
  412   3HG2  THR  58          3HG2      THR  58  -7.771   0.864   1.264
  413    H    PHE  59           H        PHE  59  -5.820   1.736   3.348
  414    HA   PHE  59           HA       PHE  59  -8.110   3.036   3.438
  415   1HB   PHE  59          1HB       PHE  59  -6.007   2.448   5.153
  416   2HB   PHE  59          2HB       PHE  59  -5.952   4.214   5.177
  417    HD1  PHE  59           HD1      PHE  59  -7.445   5.416   6.522
  418    HD2  PHE  59           HD2      PHE  59  -8.208   1.316   5.735
  419    HE1  PHE  59           HE1      PHE  59  -9.295   5.435   8.217
  420    HE2  PHE  59           HE2      PHE  59 -10.059   1.336   7.430
  421    HZ   PHE  59           HZ       PHE  59 -10.582   3.395   8.650
  422   1H    GLU   1           H1       GLU   1 -22.786   0.064  -6.021
  423    HA   GLU   1           HA       GLU   1 -22.881  -0.104  -3.205
  424   1HB   GLU   1          1HB       GLU   1 -21.431  -2.140  -4.292
  425   2HB   GLU   1          2HB       GLU   1 -20.165  -0.910  -4.135
  426   1HG   GLU   1          1HG       GLU   1 -20.119  -2.080  -2.075
  427   2HG   GLU   1          2HG       GLU   1 -21.024  -0.605  -1.704
  428    H    GLU   2           H        GLU   2 -21.059   1.321  -2.220
  429    HA   GLU   2           HA       GLU   2 -20.811   3.589  -3.975
  430   1HB   GLU   2          1HB       GLU   2 -20.211   4.829  -1.959
  431   2HB   GLU   2          2HB       GLU   2 -21.668   3.870  -1.648
  432   1HG   GLU   2          1HG       GLU   2 -19.691   2.102  -0.925
  433   2HG   GLU   2          2HG       GLU   2 -18.932   3.640  -0.487
  434    H    TYR   3           H        TYR   3 -19.209   2.381  -5.376
  435    HA   TYR   3           HA       TYR   3 -16.597   2.015  -4.153
  436   1HB   TYR   3          1HB       TYR   3 -16.352   1.472  -6.829
  437   2HB   TYR   3          2HB       TYR   3 -17.023   0.287  -5.706
  438    HD1  TYR   3           HD1      TYR   3 -18.273   3.284  -7.607
  439    HD2  TYR   3           HD2      TYR   3 -18.925  -0.787  -6.465
  440    HE1  TYR   3           HE1      TYR   3 -20.430   3.245  -8.952
  441    HE2  TYR   3           HE2      TYR   3 -21.079  -0.813  -7.813
  442    HH   TYR   3           HH       TYR   3 -22.443   0.314  -9.046
  443    H    VAL   4           H        VAL   4 -16.486   4.441  -3.704
  444    HA   VAL   4           HA       VAL   4 -15.369   5.735  -6.087
  445    HB   VAL   4           HB       VAL   4 -16.296   7.880  -5.132
  446   1HG1  VAL   4          1HG1      VAL   4 -17.540   5.852  -6.741
  447   2HG1  VAL   4          2HG1      VAL   4 -18.793   6.693  -5.796
  448   3HG1  VAL   4          3HG1      VAL   4 -17.696   7.623  -6.847
  449   1HG2  VAL   4          1HG2      VAL   4 -17.630   5.893  -3.322
  450   2HG2  VAL   4          2HG2      VAL   4 -16.961   7.501  -2.956
  451   3HG2  VAL   4          3HG2      VAL   4 -18.517   7.358  -3.808
  452    H    GLY   5           H        GLY   5 -15.729   6.094  -2.482
  453   1HA   GLY   5          1HA       GLY   5 -13.243   7.408  -2.168
  454   2HA   GLY   5          2HA       GLY   5 -14.229   6.685  -0.912
  455    H    LEU   6           H        LEU   6 -13.694   4.365  -3.352
  456    HA   LEU   6           HA       LEU   6 -11.094   3.535  -2.468
  457   1HB   LEU   6          1HB       LEU   6 -12.224   1.221  -1.884
  458   2HB   LEU   6          2HB       LEU   6 -11.920   2.475  -0.670
  459    HG   LEU   6           HG       LEU   6 -14.145   1.359  -0.505
  460   1HD1  LEU   6          1HD1      LEU   6 -13.495   3.891   0.062
  461   2HD1  LEU   6          2HD1      LEU   6 -14.784   4.196  -1.126
  462   3HD1  LEU   6          3HD1      LEU   6 -15.125   3.227   0.328
  463   1HD2  LEU   6          1HD2      LEU   6 -14.907   2.885  -2.999
  464   2HD2  LEU   6          2HD2      LEU   6 -14.429   1.171  -3.019
  465   3HD2  LEU   6          3HD2      LEU   6 -15.861   1.685  -2.095
  466    H    SER   7           H        SER   7 -12.396   4.412  -4.946
  467    HA   SER   7           HA       SER   7 -12.466   1.889  -6.391
  468   1HB   SER   7          1HB       SER   7 -14.161   4.093  -6.473
  469   2HB   SER   7          2HB       SER   7 -13.153   4.320  -7.913
  470    HG   SER   7           HG       SER   7 -13.995   1.687  -7.607
  471    H    ALA   8           H        ALA   8 -11.631   2.341  -8.861
  472    HA   ALA   8           HA       ALA   8  -8.864   2.876  -8.572
  473   1HB   ALA   8          1HB       ALA   8  -8.707   2.055 -10.754
  474   2HB   ALA   8          2HB       ALA   8 -10.188   1.261 -10.168
  475   3HB   ALA   8          3HB       ALA   8 -10.302   2.693 -11.219
  476    H    ASN   9           H        ASN   9 -11.500   4.942  -8.668
  477    HA   ASN   9           HA       ASN   9 -10.089   6.918 -10.251
  478   1HB   ASN   9          1HB       ASN   9 -12.539   6.477 -10.674
  479   2HB   ASN   9          2HB       ASN   9 -12.899   7.029  -9.032
  480   1HD2  ASN   9          1HD2      ASN   9 -10.707   8.139 -11.612
  481   2HD2  ASN   9          2HD2      ASN   9 -11.280   9.772 -11.700
  482    H    GLN  10           H        GLN  10 -10.142   5.785  -7.128
  483    HA   GLN  10           HA       GLN  10 -10.627   8.066  -5.615
  484   1HB   GLN  10          1HB       GLN  10  -9.837   5.354  -5.190
  485   2HB   GLN  10          2HB       GLN  10  -8.682   6.376  -4.316
  486   1HG   GLN  10          1HG       GLN  10 -11.496   7.240  -4.037
  487   2HG   GLN  10          2HG       GLN  10 -11.196   5.618  -3.398
  488   1HE2  GLN  10          1HE2      GLN  10  -8.860   5.586  -2.298
  489   2HE2  GLN  10          2HE2      GLN  10  -8.641   6.779  -1.063
  490    H    CYS  11           H        CYS  11  -7.641   6.698  -7.101
  491    HA   CYS  11           HA       CYS  11  -5.930   8.604  -5.920
  492   1HB   CYS  11          1HB       CYS  11  -5.095   6.473  -6.651
  493   2HB   CYS  11          2HB       CYS  11  -5.575   6.799  -8.319
  494    H    ALA  12           H        ALA  12  -8.460   8.960  -8.067
  495    HA   ALA  12           HA       ALA  12  -7.102  11.080  -9.579
  496   1HB   ALA  12          1HB       ALA  12  -9.168   9.058 -10.206
  497   2HB   ALA  12          2HB       ALA  12  -9.555  10.701 -10.773
  498   3HB   ALA  12          3HB       ALA  12  -8.041   9.915 -11.285
  499    H    VAL  13           H        VAL  13  -8.261  10.976  -6.692
  500    HA   VAL  13           HA       VAL  13 -10.609  12.266  -6.413
  501    HB   VAL  13           HB       VAL  13  -9.232  13.489  -4.491
  502   1HG1  VAL  13          1HG1      VAL  13 -10.893  11.908  -3.932
  503   2HG1  VAL  13          2HG1      VAL  13 -10.007  10.573  -4.709
  504   3HG1  VAL  13          3HG1      VAL  13  -9.399  11.283  -3.193
  505   1HG2  VAL  13          1HG2      VAL  13  -7.204  12.452  -3.887
  506   2HG2  VAL  13          2HG2      VAL  13  -7.445  11.110  -5.033
  507   3HG2  VAL  13          3HG2      VAL  13  -7.060  12.740  -5.638
  508    HA   PRO  14           HA       PRO  14 -10.218  16.271  -7.990
  509   1HB   PRO  14          1HB       PRO  14 -11.585  17.831  -6.212
  510   2HB   PRO  14          2HB       PRO  14 -12.379  16.834  -7.429
  511   1HG   PRO  14          1HG       PRO  14 -12.061  16.394  -4.529
  512   2HG   PRO  14          2HG       PRO  14 -13.254  15.649  -5.654
  513   1HD   PRO  14          1HD       PRO  14 -10.900  14.475  -4.522
  514   2HD   PRO  14          2HD       PRO  14 -11.953  13.755  -5.746
  515    H    ALA  15           H        ALA  15  -8.473  15.375  -5.428
  516    HA   ALA  15           HA       ALA  15  -6.461  16.182  -4.822
  517   1HB   ALA  15          1HB       ALA  15  -5.509  18.065  -5.794
  518   2HB   ALA  15          2HB       ALA  15  -6.738  17.647  -7.012
  519   3HB   ALA  15          3HB       ALA  15  -7.051  18.952  -5.842
  520    H    LYS  16           H        LYS  16  -8.572  15.879  -3.115
  521    HA   LYS  16           HA       LYS  16  -7.902  17.435  -0.968
  522   1HB   LYS  16          1HB       LYS  16 -10.250  18.735  -0.993
  523   2HB   LYS  16          2HB       LYS  16  -8.732  19.450  -1.566
  524   1HG   LYS  16          1HG       LYS  16  -9.373  19.356  -3.768
  525   2HG   LYS  16          2HG       LYS  16 -10.267  17.839  -3.565
  526   1HD   LYS  16          1HD       LYS  16 -12.028  19.305  -3.882
  527   2HD   LYS  16          2HD       LYS  16 -11.889  19.408  -2.119
  528   1HE   LYS  16          1HE       LYS  16 -10.454  21.428  -2.376
  529   2HE   LYS  16          2HE       LYS  16 -10.629  21.330  -4.134
  530   1HZ   LYS  16          1HZ       LYS  16 -12.339  22.675  -3.691
  531   2HZ   LYS  16          2HZ       LYS  16 -13.145  21.293  -3.367
  532   3HZ   LYS  16          3HZ       LYS  16 -12.522  22.179  -2.146
  533    H    ASP  17           H        ASP  17  -8.321  14.748  -1.442
  534    HA   ASP  17           HA       ASP  17 -10.456  14.290   0.413
  535   1HB   ASP  17          1HB       ASP  17 -11.555  14.118  -1.815
  536   2HB   ASP  17          2HB       ASP  17 -10.368  12.903  -2.309
  537    H    ARG  18           H        ARG  18  -7.347  14.023  -0.339
  538    HA   ARG  18           HA       ARG  18  -7.050  11.185  -0.012
  539   1HB   ARG  18          1HB       ARG  18  -4.893  13.337  -0.172
  540   2HB   ARG  18          2HB       ARG  18  -4.660  11.597  -0.412
  541   1HG   ARG  18          1HG       ARG  18  -5.476  11.659  -2.546
  542   2HG   ARG  18          2HG       ARG  18  -6.718  12.861  -2.161
  543   1HD   ARG  18          1HD       ARG  18  -4.941  14.623  -2.113
  544   2HD   ARG  18          2HD       ARG  18  -3.738  13.408  -2.569
  545    HE   ARG  18           HE       ARG  18  -6.117  13.874  -4.317
  546   1HH1  ARG  18          1HH1      ARG  18  -2.632  13.964  -3.834
  547   2HH1  ARG  18          2HH1      ARG  18  -2.278  14.228  -5.509
  548   1HH2  ARG  18          1HH2      ARG  18  -5.651  14.223  -6.527
  549   2HH2  ARG  18          2HH2      ARG  18  -4.007  14.377  -7.051
  550    H    VAL  19           H        VAL  19  -4.949  10.704   1.581
  551    HA   VAL  19           HA       VAL  19  -5.642  12.025   4.113
  552    HB   VAL  19           HB       VAL  19  -4.512   9.253   3.705
  553   1HG1  VAL  19          1HG1      VAL  19  -5.087  10.936   6.035
  554   2HG1  VAL  19          2HG1      VAL  19  -5.867   9.338   6.119
  555   3HG1  VAL  19          3HG1      VAL  19  -4.104   9.457   5.901
  556   1HG2  VAL  19          1HG2      VAL  19  -6.690   8.334   3.936
  557   2HG2  VAL  19          2HG2      VAL  19  -7.394   9.914   4.354
  558   3HG2  VAL  19          3HG2      VAL  19  -6.821   9.607   2.699
  559    H    ASP  20           H        ASP  20  -3.685  12.836   1.933
  560    HA   ASP  20           HA       ASP  20  -1.517  13.197   1.642
  561   1HB   ASP  20          1HB       ASP  20  -1.858  15.188   2.753
  562   2HB   ASP  20          2HB       ASP  20  -2.418  14.396   4.234
  563    H    CYS  21           H        CYS  21  -0.569  11.027   1.608
  564    HA   CYS  21           HA       CYS  21  -0.077   9.421   3.732
  565   1HB   CYS  21          1HB       CYS  21   0.370   9.180   1.161
  566   2HB   CYS  21          2HB       CYS  21   2.010   9.664   1.601
  567    H    GLY  22           H        GLY  22   1.641  12.361   2.631
  568   1HA   GLY  22          1HA       GLY  22   3.271  13.598   3.558
  569   2HA   GLY  22          2HA       GLY  22   2.720  12.987   5.106
  570    H    TYR  23           H        TYR  23   4.428  11.578   2.210
  571    HA   TYR  23           HA       TYR  23   6.118  10.063   4.019
  572   1HB   TYR  23          1HB       TYR  23   4.901   9.715   1.514
  573   2HB   TYR  23          2HB       TYR  23   6.557  10.120   1.049
  574    HD1  TYR  23           HD1      TYR  23   5.394   8.160   4.012
  575    HD2  TYR  23           HD2      TYR  23   7.393   8.080   0.230
  576    HE1  TYR  23           HE1      TYR  23   6.087   5.748   4.421
  577    HE2  TYR  23           HE2      TYR  23   8.079   5.668   0.652
  578    HH   TYR  23           HH       TYR  23   8.102   4.284   3.553
  579    HA   PRO  24           HA       PRO  24   9.400  12.879   3.648
  580   1HB   PRO  24          1HB       PRO  24  11.389  11.359   4.741
  581   2HB   PRO  24          2HB       PRO  24  10.234  12.276   5.707
  582   1HG   PRO  24          1HG       PRO  24  10.359   9.383   5.143
  583   2HG   PRO  24          2HG       PRO  24   9.503  10.229   6.482
  584   1HD   PRO  24          1HD       PRO  24   8.395   9.072   4.108
  585   2HD   PRO  24          2HD       PRO  24   7.531  10.035   5.317
  586    H    HIS  25           H        HIS  25   9.019  10.151   1.850
  587    HA   HIS  25           HA       HIS  25  11.340  10.936   0.243
  588   1HB   HIS  25          1HB       HIS  25  10.866   8.456   1.510
  589   2HB   HIS  25          2HB       HIS  25  10.599   8.191  -0.218
  590    HD1  HIS  25           HD1      HIS  25  13.122   7.388   1.833
  591    HD2  HIS  25           HD2      HIS  25  13.054  10.095  -1.370
  592    HE1  HIS  25           HE1      HIS  25  15.540   7.640   1.059
  593    HE2  HIS  25           HE2      HIS  25  15.428   9.273  -0.945
  594    H    VAL  26           H        VAL  26   8.349  11.678   0.331
  595    HA   VAL  26           HA       VAL  26   6.839  10.537  -1.573
  596    HB   VAL  26           HB       VAL  26   5.960  12.309  -0.336
  597   1HG1  VAL  26          1HG1      VAL  26   8.327  13.910  -1.318
  598   2HG1  VAL  26          2HG1      VAL  26   6.880  14.694  -0.640
  599   3HG1  VAL  26          3HG1      VAL  26   7.828  13.562   0.354
  600   1HG2  VAL  26          1HG2      VAL  26   4.759  13.391  -1.938
  601   2HG2  VAL  26          2HG2      VAL  26   6.206  13.876  -2.854
  602   3HG2  VAL  26          3HG2      VAL  26   5.576  12.218  -2.999
  603    H    THR  27           H        THR  27   7.076  10.013  -3.682
  604    HA   THR  27           HA       THR  27   8.221  11.787  -5.556
  605    HB   THR  27           HB       THR  27  10.072  10.143  -4.064
  606    HG1  THR  27           HG1      THR  27  10.988  11.984  -4.888
  607   1HG2  THR  27          1HG2      THR  27  11.227   9.320  -6.289
  608   2HG2  THR  27          2HG2      THR  27   9.961   8.297  -5.568
  609   3HG2  THR  27          3HG2      THR  27   9.578   9.343  -6.958
  610    HA   PRO  28           HA       PRO  28   5.941   9.197  -8.103
  611   1HB   PRO  28          1HB       PRO  28   6.979   9.776 -10.561
  612   2HB   PRO  28          2HB       PRO  28   5.805  10.806  -9.745
  613   1HG   PRO  28          1HG       PRO  28   8.718  11.142 -10.075
  614   2HG   PRO  28          2HG       PRO  28   7.481  12.389  -9.682
  615   1HD   PRO  28          1HD       PRO  28   9.383  11.156  -7.934
  616   2HD   PRO  28          2HD       PRO  28   8.083  12.259  -7.467
  617    H    LYS  29           H        LYS  29   7.699   7.708  -6.700
  618    HA   LYS  29           HA       LYS  29   7.927   5.478  -8.344
  619   1HB   LYS  29          1HB       LYS  29   9.697   6.850  -9.427
  620   2HB   LYS  29          2HB       LYS  29  10.597   6.843  -7.900
  621   1HG   LYS  29          1HG       LYS  29  11.398   4.780  -8.325
  622   2HG   LYS  29          2HG       LYS  29   9.770   4.138  -8.603
  623   1HD   LYS  29          1HD       LYS  29   9.963   5.325 -10.925
  624   2HD   LYS  29          2HD       LYS  29  11.703   5.369 -10.591
  625   1HE   LYS  29          1HE       LYS  29  11.856   3.237 -11.304
  626   2HE   LYS  29          2HE       LYS  29  10.806   2.723  -9.975
  627   1HZ   LYS  29          1HZ       LYS  29   9.794   3.781 -12.518
  628   2HZ   LYS  29          2HZ       LYS  29  10.014   2.187 -12.241
  629   3HZ   LYS  29          3HZ       LYS  29   8.939   3.031 -11.346
  630    H    GLU  30           H        GLU  30   8.423   7.351  -5.468
  631    HA   GLU  30           HA       GLU  30   9.254   4.974  -4.026
  632   1HB   GLU  30          1HB       GLU  30   9.672   7.847  -3.719
  633   2HB   GLU  30          2HB       GLU  30   9.096   7.119  -2.210
  634   1HG   GLU  30          1HG       GLU  30  11.413   6.846  -2.039
  635   2HG   GLU  30          2HG       GLU  30  10.922   5.284  -2.711
  636    H    CYS  31           H        CYS  31   6.695   7.516  -4.161
  637    HA   CYS  31           HA       CYS  31   5.233   6.603  -1.981
  638   1HB   CYS  31          1HB       CYS  31   4.466   8.156  -4.444
  639   2HB   CYS  31          2HB       CYS  31   3.308   7.781  -3.167
  640    H    ASN  32           H        ASN  32   4.781   6.053  -5.557
  641    HA   ASN  32           HA       ASN  32   2.751   4.198  -5.218
  642   1HB   ASN  32          1HB       ASN  32   4.572   5.087  -7.417
  643   2HB   ASN  32          2HB       ASN  32   3.857   3.484  -7.638
  644   1HD2  ASN  32          1HD2      ASN  32   2.792   6.598  -6.264
  645   2HD2  ASN  32          2HD2      ASN  32   1.327   6.750  -7.173
  646    H    ASN  33           H        ASN  33   5.971   4.028  -4.278
  647    HA   ASN  33           HA       ASN  33   6.228   1.216  -4.946
  648   1HB   ASN  33          1HB       ASN  33   8.212   2.459  -5.499
  649   2HB   ASN  33          2HB       ASN  33   8.195   3.334  -3.961
  650   1HD2  ASN  33          1HD2      ASN  33   9.950   2.762  -2.914
  651   2HD2  ASN  33          2HD2      ASN  33  10.500   1.149  -2.607
  652    H    ARG  34           H        ARG  34   5.808   3.594  -2.332
  653    HA   ARG  34           HA       ARG  34   6.351   1.643  -0.309
  654   1HB   ARG  34          1HB       ARG  34   6.224   3.429   1.229
  655   2HB   ARG  34          2HB       ARG  34   6.841   4.225  -0.230
  656   1HG   ARG  34          1HG       ARG  34   5.127   5.671   0.420
  657   2HG   ARG  34          2HG       ARG  34   4.278   4.636  -0.743
  658   1HD   ARG  34          1HD       ARG  34   2.780   4.242   0.906
  659   2HD   ARG  34          2HD       ARG  34   4.027   3.262   1.696
  660    HE   ARG  34           HE       ARG  34   4.316   6.103   2.271
  661   1HH1  ARG  34          1HH1      ARG  34   2.566   3.191   3.190
  662   2HH1  ARG  34          2HH1      ARG  34   2.226   3.748   4.794
  663   1HH2  ARG  34          1HH2      ARG  34   3.868   6.839   4.386
  664   2HH2  ARG  34          2HH2      ARG  34   2.972   5.837   5.480
  665    H    GLY  35           H        GLY  35   3.608   3.187  -1.976
  666   1HA   GLY  35          1HA       GLY  35   1.630   1.648  -1.964
  667   2HA   GLY  35          2HA       GLY  35   1.732   1.725  -0.217
  668    H    CYS  36           H        CYS  36   2.604   4.579  -2.128
  669    HA   CYS  36           HA       CYS  36   0.044   5.770  -1.341
  670   1HB   CYS  36          1HB       CYS  36   2.772   7.061  -1.415
  671   2HB   CYS  36          2HB       CYS  36   1.257   7.923  -1.140
  672    H    CYS  37           H        CYS  37  -0.371   7.835  -2.807
  673    HA   CYS  37           HA       CYS  37   0.346   7.058  -5.538
  674   1HB   CYS  37          1HB       CYS  37  -2.139   7.199  -4.514
  675   2HB   CYS  37          2HB       CYS  37  -1.962   8.860  -5.085
  676    H    PHE  38           H        PHE  38   1.396   8.602  -6.814
  677    HA   PHE  38           HA       PHE  38   2.234  10.998  -5.429
  678   1HB   PHE  38          1HB       PHE  38   3.687   9.359  -6.819
  679   2HB   PHE  38          2HB       PHE  38   2.837   9.943  -8.253
  680    HD1  PHE  38           HD1      PHE  38   3.621  11.834  -9.373
  681    HD2  PHE  38           HD2      PHE  38   4.948  11.087  -5.412
  682    HE1  PHE  38           HE1      PHE  38   5.284  13.703  -9.578
  683    HE2  PHE  38           HE2      PHE  38   6.611  12.955  -5.617
  684    HZ   PHE  38           HZ       PHE  38   6.759  14.241  -7.698
  685    H    ASP  39           H        ASP  39   1.322  12.978  -5.716
  686    HA   ASP  39           HA       ASP  39  -0.923  13.287  -7.278
  687   1HB   ASP  39          1HB       ASP  39  -0.588  14.789  -5.463
  688   2HB   ASP  39          2HB       ASP  39   1.038  15.231  -6.009
  689    H    SER  40           H        SER  40   1.552  15.780  -7.769
  690    HA   SER  40           HA       SER  40   2.900  16.216  -9.487
  691   1HB   SER  40          1HB       SER  40   2.698  13.683 -10.091
  692   2HB   SER  40          2HB       SER  40   1.517  14.220 -11.301
  693    HG   SER  40           HG       SER  40   3.624  15.845 -11.560
  694    H    ARG  41           H        ARG  41  -0.482  16.178  -9.234
  695    HA   ARG  41           HA       ARG  41  -0.907  17.639 -11.672
  696   1HB   ARG  41          1HB       ARG  41  -2.879  16.987  -9.437
  697   2HB   ARG  41          2HB       ARG  41  -3.295  17.532 -11.071
  698   1HG   ARG  41          1HG       ARG  41  -1.698  15.313 -11.552
  699   2HG   ARG  41          2HG       ARG  41  -2.574  14.833 -10.088
  700   1HD   ARG  41          1HD       ARG  41  -4.162  14.183 -11.610
  701   2HD   ARG  41          2HD       ARG  41  -4.630  15.889 -11.545
  702    HE   ARG  41           HE       ARG  41  -2.640  15.798 -13.484
  703   1HH1  ARG  41          1HH1      ARG  41  -5.700  14.128 -13.009
  704   2HH1  ARG  41          2HH1      ARG  41  -5.991  13.910 -14.702
  705   1HH2  ARG  41          1HH2      ARG  41  -3.023  15.511 -15.718
  706   2HH2  ARG  41          2HH2      ARG  41  -4.457  14.702 -16.254
  707    H    ILE  42           H        ILE  42  -1.527  18.091  -8.107
  708    HA   ILE  42           HA       ILE  42  -1.170  20.973  -8.558
  709    HB   ILE  42           HB       ILE  42  -2.812  19.974  -6.287
  710   1HG1  ILE  42          1HG1      ILE  42  -3.767  20.051  -9.155
  711   2HG1  ILE  42          2HG1      ILE  42  -3.710  18.638  -8.087
  712   1HG2  ILE  42          1HG2      ILE  42  -2.959  22.187  -6.082
  713   2HG2  ILE  42          2HG2      ILE  42  -2.310  22.468  -7.716
  714   3HG2  ILE  42          3HG2      ILE  42  -4.044  22.139  -7.493
  715   1HD1  ILE  42          1HD1      ILE  42  -5.227  20.170  -6.522
  716   2HD1  ILE  42          2HD1      ILE  42  -5.581  21.007  -8.052
  717   3HD1  ILE  42          3HD1      ILE  42  -5.950  19.274  -7.879
  718    HA   PRO  43           HA       PRO  43   2.123  20.347  -5.789
  719   1HB   PRO  43          1HB       PRO  43   3.032  22.922  -5.721
  720   2HB   PRO  43          2HB       PRO  43   3.490  21.771  -6.974
  721   1HG   PRO  43          1HG       PRO  43   1.577  24.014  -7.066
  722   2HG   PRO  43          2HG       PRO  43   2.384  23.171  -8.436
  723   1HD   PRO  43          1HD       PRO  43  -0.325  22.925  -7.544
  724   2HD   PRO  43          2HD       PRO  43   0.466  21.956  -8.795
  725    H    GLY  44           H        GLY  44  -0.698  22.002  -5.235
  726   1HA   GLY  44          1HA       GLY  44   0.066  22.799  -2.526
  727   2HA   GLY  44          2HA       GLY  44  -1.425  23.172  -3.365
  728    H    VAL  45           H        VAL  45  -1.063  20.011  -4.161
  729    HA   VAL  45           HA       VAL  45  -2.620  19.157  -1.831
  730    HB   VAL  45           HB       VAL  45  -3.103  19.021  -4.564
  731   1HG1  VAL  45          1HG1      VAL  45  -2.411  17.079  -5.412
  732   2HG1  VAL  45          2HG1      VAL  45  -1.504  16.781  -3.910
  733   3HG1  VAL  45          3HG1      VAL  45  -3.171  16.181  -4.077
  734   1HG2  VAL  45          1HG2      VAL  45  -4.365  18.281  -2.067
  735   2HG2  VAL  45          2HG2      VAL  45  -5.103  18.826  -3.592
  736   3HG2  VAL  45          3HG2      VAL  45  -4.756  17.099  -3.340
  737    HA   PRO  46           HA       PRO  46   0.344  16.173  -0.811
  738   1HB   PRO  46          1HB       PRO  46  -1.052  13.881  -0.309
  739   2HB   PRO  46          2HB       PRO  46  -0.958  15.220   0.832
  740   1HG   PRO  46          1HG       PRO  46  -3.156  14.409  -0.961
  741   2HG   PRO  46          2HG       PRO  46  -3.231  15.443   0.511
  742   1HD   PRO  46          1HD       PRO  46  -3.355  16.243  -2.237
  743   2HD   PRO  46          2HD       PRO  46  -3.271  17.311  -0.829
  744    H    TRP  47           H        TRP  47   1.952  15.570  -2.106
  745    HA   TRP  47           HA       TRP  47   1.188  14.160  -4.515
  746   1HB   TRP  47          1HB       TRP  47   4.037  14.532  -3.972
  747   2HB   TRP  47          2HB       TRP  47   3.080  14.946  -5.397
  748    HD1  TRP  47           HD1      TRP  47   1.753  17.415  -5.230
  749    HE1  TRP  47           HE1      TRP  47   2.375  19.683  -4.033
  750    HE3  TRP  47           HE3      TRP  47   5.149  15.400  -2.027
  751    HZ2  TRP  47           HZ2      TRP  47   4.178  20.365  -1.929
  752    HZ3  TRP  47           HZ3      TRP  47   6.296  16.937  -0.433
  753    HH2  TRP  47           HH2      TRP  47   5.858  19.340  -0.351
  754    H    CYS  48           H        CYS  48   0.722  12.890  -1.878
  755    HA   CYS  48           HA       CYS  48   1.797  10.379  -2.463
  756   1HB   CYS  48          1HB       CYS  48   3.798  11.690  -1.454
  757   2HB   CYS  48          2HB       CYS  48   2.973  11.440   0.087
  758    H    PHE  49           H        PHE  49  -0.349   9.677  -2.169
  759    HA   PHE  49           HA       PHE  49  -1.293   9.817   0.596
  760   1HB   PHE  49          1HB       PHE  49  -3.623   9.927  -0.804
  761   2HB   PHE  49          2HB       PHE  49  -2.756  11.402  -0.362
  762    HD1  PHE  49           HD1      PHE  49  -0.796  11.950  -2.184
  763    HD2  PHE  49           HD2      PHE  49  -4.400   9.846  -2.949
  764    HE1  PHE  49           HE1      PHE  49  -0.641  12.567  -4.612
  765    HE2  PHE  49           HE2      PHE  49  -4.246  10.463  -5.377
  766    HZ   PHE  49           HZ       PHE  49  -2.368  11.817  -6.180
  767    H    LYS  50           H        LYS  50  -3.553   8.336   0.507
  768    HA   LYS  50           HA       LYS  50  -2.740   5.865  -0.856
  769   1HB   LYS  50          1HB       LYS  50  -3.899   4.767   1.190
  770   2HB   LYS  50          2HB       LYS  50  -2.230   5.343   1.337
  771   1HG   LYS  50          1HG       LYS  50  -4.326   7.360   1.945
  772   2HG   LYS  50          2HG       LYS  50  -4.266   5.994   3.072
  773   1HD   LYS  50          1HD       LYS  50  -1.839   7.644   2.260
  774   2HD   LYS  50          2HD       LYS  50  -2.806   7.984   3.705
  775   1HE   LYS  50          1HE       LYS  50  -1.825   5.175   3.331
  776   2HE   LYS  50          2HE       LYS  50  -0.610   6.393   3.744
  777   1HZ   LYS  50          1HZ       LYS  50  -1.909   6.964   5.652
  778   2HZ   LYS  50          2HZ       LYS  50  -3.095   5.920   5.240
  779   3HZ   LYS  50          3HZ       LYS  50  -1.625   5.356   5.674
  780    HA   PRO  51           HA       PRO  51  -6.919   7.089  -2.104
  781   1HB   PRO  51          1HB       PRO  51  -6.507   7.102  -4.804
  782   2HB   PRO  51          2HB       PRO  51  -6.413   8.552  -3.808
  783   1HG   PRO  51          1HG       PRO  51  -4.258   6.911  -4.979
  784   2HG   PRO  51          2HG       PRO  51  -4.182   8.613  -4.394
  785   1HD   PRO  51          1HD       PRO  51  -3.184   6.247  -3.126
  786   2HD   PRO  51          2HD       PRO  51  -3.226   7.876  -2.437
  787    H    LEU  52           H        LEU  52  -6.080   5.474  -4.980
  788    HA   LEU  52           HA       LEU  52  -7.591   3.175  -3.990
  789   1HB   LEU  52          1HB       LEU  52  -8.358   2.848  -6.081
  790   2HB   LEU  52          2HB       LEU  52  -8.144   4.607  -6.108
  791    HG   LEU  52           HG       LEU  52  -7.192   4.125  -8.102
  792   1HD1  LEU  52          1HD1      LEU  52  -5.072   4.747  -7.852
  793   2HD1  LEU  52          2HD1      LEU  52  -5.311   4.554  -6.098
  794   3HD1  LEU  52          3HD1      LEU  52  -4.636   3.214  -7.057
  795   1HD2  LEU  52          1HD2      LEU  52  -7.099   2.038  -8.845
  796   2HD2  LEU  52          2HD2      LEU  52  -5.725   1.678  -7.773
  797   3HD2  LEU  52          3HD2      LEU  52  -7.391   1.459  -7.187
  798    H    GLN  53           H        GLN  53  -4.892   3.566  -3.067
  799    HA   GLN  53           HA       GLN  53  -2.938   2.413  -4.508
  800   1HB   GLN  53          1HB       GLN  53  -3.506   2.100  -1.535
  801   2HB   GLN  53          2HB       GLN  53  -1.948   1.729  -2.298
  802   1HG   GLN  53          1HG       GLN  53  -3.343   4.439  -2.326
  803   2HG   GLN  53          2HG       GLN  53  -1.988   4.008  -1.272
  804   1HE2  GLN  53          1HE2      GLN  53  -3.049   4.874  -4.444
  805   2HE2  GLN  53          2HE2      GLN  53  -1.502   5.053  -5.201
  806    H    GLU  54           H        GLU  54  -5.835   0.907  -3.255
  807    HA   GLU  54           HA       GLU  54  -5.278  -1.595  -2.719
  808   1HB   GLU  54          1HB       GLU  54  -7.399  -2.245  -3.844
  809   2HB   GLU  54          2HB       GLU  54  -7.569  -0.753  -2.904
  810   1HG   GLU  54          1HG       GLU  54  -8.030   0.477  -4.756
  811   2HG   GLU  54          2HG       GLU  54  -6.735  -0.277  -5.698
  812    H    ALA  55           H        ALA  55  -4.698  -0.025  -5.829
  813    HA   ALA  55           HA       ALA  55  -4.653  -1.855  -7.707
  814   1HB   ALA  55          1HB       ALA  55  -3.615   0.515  -7.628
  815   2HB   ALA  55          2HB       ALA  55  -2.114  -0.305  -7.132
  816   3HB   ALA  55          3HB       ALA  55  -2.857  -0.683  -8.704
  817    H    GLU  56           H        GLU  56  -1.879  -1.582  -5.363
  818    HA   GLU  56           HA       GLU  56  -1.728  -4.465  -5.412
  819   1HB   GLU  56          1HB       GLU  56   0.686  -4.465  -5.850
  820   2HB   GLU  56          2HB       GLU  56  -0.180  -3.717  -7.203
  821   1HG   GLU  56          1HG       GLU  56   0.576  -1.784  -5.119
  822   2HG   GLU  56          2HG       GLU  56   1.982  -2.616  -5.802
  823    H    CYS  57           H        CYS  57  -2.368  -1.999  -3.589
  824    HA   CYS  57           HA       CYS  57  -0.313  -2.307  -1.581
  825   1HB   CYS  57          1HB       CYS  57  -2.069  -0.249  -2.343
  826   2HB   CYS  57          2HB       CYS  57  -2.577  -0.742  -0.726
  827    H    THR  58           H        THR  58  -3.941  -2.579  -1.829
  828    HA   THR  58           HA       THR  58  -4.125  -4.046   0.608
  829    HB   THR  58           HB       THR  58  -5.862  -2.486  -0.542
  830    HG1  THR  58           HG1      THR  58  -6.333  -5.246   0.327
  831   1HG2  THR  58          1HG2      THR  58  -6.392  -5.114  -2.028
  832   2HG2  THR  58          2HG2      THR  58  -7.465  -3.693  -2.021
  833   3HG2  THR  58          3HG2      THR  58  -5.864  -3.595  -2.792
  834    H    PHE  59           H        PHE  59  -3.869  -4.890  -2.855
  835    HA   PHE  59           HA       PHE  59  -4.654  -7.515  -2.716
  836   1HB   PHE  59          1HB       PHE  59  -2.839  -5.748  -4.325
  837   2HB   PHE  59          2HB       PHE  59  -2.510  -7.475  -4.503
  838    HD1  PHE  59           HD1      PHE  59  -3.617  -8.588  -6.187
  839    HD2  PHE  59           HD2      PHE  59  -5.414  -5.121  -4.526
  840    HE1  PHE  59           HE1      PHE  59  -5.484  -8.756  -7.856
  841    HE2  PHE  59           HE2      PHE  59  -7.281  -5.289  -6.195
  842    HZ   PHE  59           HZ       PHE  59  -7.294  -7.105  -7.840
  Start of MODEL   33
    1   1H    GLU   1           H1       GLU   1 -13.857  -8.198  -5.997
    2    HA   GLU   1           HA       GLU   1 -14.498  -5.867  -4.639
    3   1HB   GLU   1          1HB       GLU   1 -15.988  -8.159  -5.848
    4   2HB   GLU   1          2HB       GLU   1 -16.888  -7.135  -4.716
    5   1HG   GLU   1          1HG       GLU   1 -16.974  -5.412  -6.191
    6   2HG   GLU   1          2HG       GLU   1 -15.271  -5.586  -6.641
    7    H    GLU   2           H        GLU   2 -14.698  -9.355  -3.696
    8    HA   GLU   2           HA       GLU   2 -15.566  -8.549  -1.068
    9   1HB   GLU   2          1HB       GLU   2 -16.167 -10.712  -2.654
   10   2HB   GLU   2          2HB       GLU   2 -14.971 -11.416  -1.553
   11   1HG   GLU   2          1HG       GLU   2 -16.272 -10.764   0.381
   12   2HG   GLU   2          2HG       GLU   2 -17.372  -9.788  -0.607
   13    H    TYR   3           H        TYR   3 -13.618  -7.438  -0.371
   14    HA   TYR   3           HA       TYR   3 -11.082  -8.623  -0.462
   15   1HB   TYR   3          1HB       TYR   3 -12.225  -6.725   1.659
   16   2HB   TYR   3          2HB       TYR   3 -10.573  -6.736   1.032
   17    HD1  TYR   3           HD1      TYR   3 -10.418  -6.281  -1.602
   18    HD2  TYR   3           HD2      TYR   3 -13.675  -5.094   0.903
   19    HE1  TYR   3           HE1      TYR   3 -11.068  -4.490  -3.285
   20    HE2  TYR   3           HE2      TYR   3 -14.314  -3.306  -0.787
   21    HH   TYR   3           HH       TYR   3 -12.781  -3.156  -3.917
   22    H    VAL   4           H        VAL   4 -11.833 -10.888   0.210
   23    HA   VAL   4           HA       VAL   4 -11.563 -11.068   3.124
   24    HB   VAL   4           HB       VAL   4 -13.478 -12.597   1.354
   25   1HG1  VAL   4          1HG1      VAL   4 -12.183 -13.717   3.433
   26   2HG1  VAL   4          2HG1      VAL   4 -13.525 -12.943   4.308
   27   3HG1  VAL   4          3HG1      VAL   4 -13.866 -14.109   3.009
   28   1HG2  VAL   4          1HG2      VAL   4 -13.883 -10.136   2.381
   29   2HG2  VAL   4          2HG2      VAL   4 -15.180 -11.340   2.185
   30   3HG2  VAL   4          3HG2      VAL   4 -14.397 -11.125   3.769
   31    H    GLY   5           H        GLY   5 -11.495 -12.890  -0.019
   32   1HA   GLY   5          1HA       GLY   5  -9.882 -14.991   0.867
   33   2HA   GLY   5          2HA       GLY   5 -10.077 -14.451  -0.790
   34    H    LEU   6           H        LEU   6  -9.132 -11.638   0.508
   35    HA   LEU   6           HA       LEU   6  -6.289 -12.309   0.630
   36   1HB   LEU   6          1HB       LEU   6  -6.957  -9.863  -0.850
   37   2HB   LEU   6          2HB       LEU   6  -5.672 -11.055  -1.120
   38    HG   LEU   6           HG       LEU   6  -7.171 -10.980  -3.015
   39   1HD1  LEU   6          1HD1      LEU   6  -6.505 -13.305  -1.573
   40   2HD1  LEU   6          2HD1      LEU   6  -8.176 -13.535  -2.143
   41   3HD1  LEU   6          3HD1      LEU   6  -6.883 -13.159  -3.306
   42   1HD2  LEU   6          1HD2      LEU   6  -9.170 -10.497  -1.142
   43   2HD2  LEU   6          2HD2      LEU   6  -9.378 -10.724  -2.896
   44   3HD2  LEU   6          3HD2      LEU   6  -9.556 -12.109  -1.792
   45    H    SER   7           H        SER   7  -8.360 -11.713   2.669
   46    HA   SER   7           HA       SER   7  -7.363  -9.110   3.524
   47   1HB   SER   7          1HB       SER   7  -9.401  -8.645   4.458
   48   2HB   SER   7          2HB       SER   7  -9.958  -9.784   3.218
   49    HG   SER   7           HG       SER   7  -9.800 -11.478   4.875
   50    H    ALA   8           H        ALA   8  -6.744  -8.874   5.811
   51    HA   ALA   8           HA       ALA   8  -5.312  -9.634   7.386
   52   1HB   ALA   8          1HB       ALA   8  -6.628 -11.106   9.021
   53   2HB   ALA   8          2HB       ALA   8  -7.384  -9.562   8.563
   54   3HB   ALA   8          3HB       ALA   8  -7.944 -11.081   7.824
   55    H    ASN   9           H        ASN   9  -7.034 -12.771   7.145
   56    HA   ASN   9           HA       ASN   9  -4.982 -14.374   7.473
   57   1HB   ASN   9          1HB       ASN   9  -7.536 -14.806   6.812
   58   2HB   ASN   9          2HB       ASN   9  -6.859 -15.087   5.201
   59   1HD2  ASN   9          1HD2      ASN   9  -4.903 -16.539   5.169
   60   2HD2  ASN   9          2HD2      ASN   9  -4.948 -17.972   6.140
   61    H    GLN  10           H        GLN  10  -5.624 -12.335   4.667
   62    HA   GLN  10           HA       GLN  10  -4.284 -13.675   2.699
   63   1HB   GLN  10          1HB       GLN  10  -5.063 -11.869   1.625
   64   2HB   GLN  10          2HB       GLN  10  -5.323 -11.015   3.155
   65   1HG   GLN  10          1HG       GLN  10  -3.155 -10.054   3.112
   66   2HG   GLN  10          2HG       GLN  10  -2.555 -11.217   1.919
   67   1HE2  GLN  10          1HE2      GLN  10  -3.087 -10.992  -0.238
   68   2HE2  GLN  10          2HE2      GLN  10  -3.716  -9.528  -0.918
   69    H    CYS  11           H        CYS  11  -3.011 -11.273   5.104
   70    HA   CYS  11           HA       CYS  11  -0.385 -11.362   4.155
   71   1HB   CYS  11          1HB       CYS  11  -1.029  -9.520   5.458
   72   2HB   CYS  11          2HB       CYS  11  -1.606 -10.535   6.782
   73    H    ALA  12           H        ALA  12  -2.297 -13.795   5.462
   74    HA   ALA  12           HA       ALA  12  -0.048 -15.067   6.847
   75   1HB   ALA  12          1HB       ALA  12  -2.472 -14.693   7.835
   76   2HB   ALA  12          2HB       ALA  12  -2.871 -16.118   6.846
   77   3HB   ALA  12          3HB       ALA  12  -1.620 -16.231   8.107
   78    H    VAL  13           H        VAL  13  -0.534 -14.705   3.829
   79    HA   VAL  13           HA       VAL  13  -1.433 -16.899   2.559
   80    HB   VAL  13           HB       VAL  13   0.790 -16.383   1.115
   81   1HG1  VAL  13          1HG1      VAL  13  -1.330 -16.107   0.138
   82   2HG1  VAL  13          2HG1      VAL  13  -1.822 -14.878   1.327
   83   3HG1  VAL  13          3HG1      VAL  13  -0.608 -14.482   0.086
   84   1HG2  VAL  13          1HG2      VAL  13   0.279 -13.720   2.434
   85   2HG2  VAL  13          2HG2      VAL  13   1.504 -14.840   3.076
   86   3HG2  VAL  13          3HG2      VAL  13   1.644 -14.228   1.410
   87    HA   PRO  14           HA       PRO  14   1.135 -20.250   3.483
   88   1HB   PRO  14          1HB       PRO  14   1.464 -21.548   1.104
   89   2HB   PRO  14          2HB       PRO  14   0.000 -21.675   2.075
   90   1HG   PRO  14          1HG       PRO  14   0.514 -20.134  -0.387
   91   2HG   PRO  14          2HG       PRO  14  -1.066 -20.639   0.312
   92   1HD   PRO  14          1HD       PRO  14   0.144 -18.045   0.342
   93   2HD   PRO  14          2HD       PRO  14  -1.336 -18.528   1.181
   94    H    ALA  15           H        ALA  15   2.363 -17.670   2.065
   95    HA   ALA  15           HA       ALA  15   4.479 -16.942   2.071
   96   1HB   ALA  15          1HB       ALA  15   4.710 -19.279   3.592
   97   2HB   ALA  15          2HB       ALA  15   5.934 -19.471   2.313
   98   3HB   ALA  15          3HB       ALA  15   5.963 -18.035   3.366
   99    H    LYS  16           H        LYS  16   3.037 -17.413  -0.240
  100    HA   LYS  16           HA       LYS  16   5.017 -17.490  -2.164
  101   1HB   LYS  16          1HB       LYS  16   3.978 -19.771  -3.176
  102   2HB   LYS  16          2HB       LYS  16   5.485 -19.689  -2.249
  103   1HG   LYS  16          1HG       LYS  16   4.525 -20.615  -0.361
  104   2HG   LYS  16          2HG       LYS  16   2.919 -19.951  -0.707
  105   1HD   LYS  16          1HD       LYS  16   2.480 -22.135  -1.248
  106   2HD   LYS  16          2HD       LYS  16   3.164 -21.656  -2.812
  107   1HE   LYS  16          1HE       LYS  16   5.007 -22.960  -2.518
  108   2HE   LYS  16          2HE       LYS  16   5.204 -22.475  -0.827
  109   1HZ   LYS  16          1HZ       LYS  16   4.599 -24.839  -1.250
  110   2HZ   LYS  16          2HZ       LYS  16   3.636 -24.062  -0.184
  111   3HZ   LYS  16          3HZ       LYS  16   3.115 -24.333  -1.708
  112    H    ASP  17           H        ASP  17   2.933 -15.784  -1.513
  113    HA   ASP  17           HA       ASP  17   1.471 -15.914  -3.968
  114   1HB   ASP  17          1HB       ASP  17   0.023 -17.160  -2.380
  115   2HB   ASP  17          2HB       ASP  17   0.051 -15.787  -1.265
  116    H    ARG  18           H        ARG  18   3.452 -14.322  -2.006
  117    HA   ARG  18           HA       ARG  18   1.974 -11.864  -1.800
  118   1HB   ARG  18          1HB       ARG  18   4.887 -12.372  -1.059
  119   2HB   ARG  18          2HB       ARG  18   3.849 -11.064  -0.465
  120   1HG   ARG  18          1HG       ARG  18   2.887 -12.393   1.109
  121   2HG   ARG  18          2HG       ARG  18   2.764 -13.784   0.016
  122   1HD   ARG  18          1HD       ARG  18   5.177 -14.252   0.358
  123   2HD   ARG  18          2HD       ARG  18   5.308 -12.856   1.438
  124    HE   ARG  18           HE       ARG  18   3.282 -14.898   2.146
  125   1HH1  ARG  18          1HH1      ARG  18   6.508 -13.601   2.693
  126   2HH1  ARG  18          2HH1      ARG  18   6.691 -14.365   4.238
  127   1HH2  ARG  18          1HH2      ARG  18   3.524 -15.904   4.184
  128   2HH2  ARG  18          2HH2      ARG  18   4.982 -15.683   5.091
  129    H    VAL  19           H        VAL  19   3.536  -9.799  -2.347
  130    HA   VAL  19           HA       VAL  19   4.474 -10.289  -5.085
  131    HB   VAL  19           HB       VAL  19   3.715  -7.619  -3.930
  132   1HG1  VAL  19          1HG1      VAL  19   4.479  -7.048  -5.967
  133   2HG1  VAL  19          2HG1      VAL  19   4.399  -8.720  -6.572
  134   3HG1  VAL  19          3HG1      VAL  19   2.938  -7.705  -6.568
  135   1HG2  VAL  19          1HG2      VAL  19   1.716  -8.704  -3.479
  136   2HG2  VAL  19          2HG2      VAL  19   1.449  -8.131  -5.142
  137   3HG2  VAL  19          3HG2      VAL  19   1.892  -9.830  -4.847
  138    H    ASP  20           H        ASP  20   5.890 -10.648  -2.372
  139    HA   ASP  20           HA       ASP  20   7.703  -9.958  -1.317
  140   1HB   ASP  20          1HB       ASP  20   8.928 -11.296  -2.732
  141   2HB   ASP  20          2HB       ASP  20   8.362 -10.465  -4.189
  142    H    CYS  21           H        CYS  21   7.274  -7.806  -0.524
  143    HA   CYS  21           HA       CYS  21   7.140  -5.530  -2.030
  144   1HB   CYS  21          1HB       CYS  21   6.895  -6.130   0.597
  145   2HB   CYS  21          2HB       CYS  21   8.415  -5.233   0.619
  146    H    GLY  22           H        GLY  22   9.942  -7.390  -0.811
  147   1HA   GLY  22          1HA       GLY  22  12.146  -7.239  -1.215
  148   2HA   GLY  22          2HA       GLY  22  11.728  -6.428  -2.711
  149    H    TYR  23           H        TYR  23  11.458  -5.569   0.819
  150    HA   TYR  23           HA       TYR  23  12.374  -2.892   0.172
  151   1HB   TYR  23          1HB       TYR  23  10.539  -4.095   1.914
  152   2HB   TYR  23          2HB       TYR  23  11.915  -3.829   2.990
  153    HD1  TYR  23           HD1      TYR  23  10.873  -1.649   0.155
  154    HD2  TYR  23           HD2      TYR  23  11.023  -2.144   4.402
  155    HE1  TYR  23           HE1      TYR  23  10.141   0.766   0.470
  156    HE2  TYR  23           HE2      TYR  23  10.292   0.272   4.703
  157    HH   TYR  23           HH       TYR  23  10.547   2.516   2.519
  158    HA   PRO  24           HA       PRO  24  16.417  -3.708   1.516
  159   1HB   PRO  24          1HB       PRO  24  17.340  -1.142   1.694
  160   2HB   PRO  24          2HB       PRO  24  17.267  -2.038   0.178
  161   1HG   PRO  24          1HG       PRO  24  15.507   0.094   1.206
  162   2HG   PRO  24          2HG       PRO  24  15.724  -0.462  -0.493
  163   1HD   PRO  24          1HD       PRO  24  13.543  -0.986   1.288
  164   2HD   PRO  24          2HD       PRO  24  13.787  -1.687  -0.317
  165    H    HIS  25           H        HIS  25  14.039  -2.354   3.372
  166    HA   HIS  25           HA       HIS  25  15.783  -2.638   5.704
  167   1HB   HIS  25          1HB       HIS  25  13.755  -0.465   5.158
  168   2HB   HIS  25          2HB       HIS  25  14.423  -0.791   6.761
  169    HD1  HIS  25           HD1      HIS  25  17.410  -1.315   5.722
  170    HD2  HIS  25           HD2      HIS  25  14.998   1.990   4.796
  171    HE1  HIS  25           HE1      HIS  25  19.001   0.573   5.073
  172    HE2  HIS  25           HE2      HIS  25  17.460   2.559   4.462
  173    H    VAL  26           H        VAL  26  14.213  -4.699   4.494
  174    HA   VAL  26           HA       VAL  26  11.644  -4.923   5.493
  175    HB   VAL  26           HB       VAL  26  12.256  -6.408   3.829
  176   1HG1  VAL  26          1HG1      VAL  26  14.825  -6.446   5.212
  177   2HG1  VAL  26          2HG1      VAL  26  14.317  -8.073   4.698
  178   3HG1  VAL  26          3HG1      VAL  26  14.442  -6.760   3.503
  179   1HG2  VAL  26          1HG2      VAL  26  12.640  -8.381   6.040
  180   2HG2  VAL  26          2HG2      VAL  26  11.151  -7.405   6.045
  181   3HG2  VAL  26          3HG2      VAL  26  11.541  -8.425   4.639
  182    H    THR  27           H        THR  27  10.870  -5.010   7.533
  183    HA   THR  27           HA       THR  27  12.070  -6.631   9.514
  184    HB   THR  27           HB       THR  27  13.132  -3.950   9.203
  185    HG1  THR  27           HG1      THR  27  14.623  -5.200  10.258
  186   1HG2  THR  27          1HG2      THR  27  12.085  -4.490  12.006
  187   2HG2  THR  27          2HG2      THR  27  12.742  -2.976  11.339
  188   3HG2  THR  27          3HG2      THR  27  11.117  -3.526  10.864
  189    HA   PRO  28           HA       PRO  28   8.068  -6.239  11.006
  190   1HB   PRO  28          1HB       PRO  28   8.351  -7.150  13.565
  191   2HB   PRO  28          2HB       PRO  28   8.230  -8.219  12.170
  192   1HG   PRO  28          1HG       PRO  28  10.588  -7.437  13.761
  193   2HG   PRO  28          2HG       PRO  28  10.386  -8.862  12.680
  194   1HD   PRO  28          1HD       PRO  28  11.845  -6.447  12.190
  195   2HD   PRO  28          2HD       PRO  28  11.543  -7.750  11.034
  196    H    LYS  29           H        LYS  29   8.829  -3.791  10.699
  197    HA   LYS  29           HA       LYS  29   7.442  -2.412  12.641
  198   1HB   LYS  29          1HB       LYS  29   9.218  -3.051  14.181
  199   2HB   LYS  29          2HB       LYS  29  10.436  -2.322  13.120
  200   1HG   LYS  29          1HG       LYS  29   9.981  -0.239  13.881
  201   2HG   LYS  29          2HG       LYS  29   8.229  -0.470  13.740
  202   1HD   LYS  29          1HD       LYS  29   9.865  -1.712  15.979
  203   2HD   LYS  29          2HD       LYS  29   9.191  -0.079  16.114
  204   1HE   LYS  29          1HE       LYS  29   6.925  -0.955  15.807
  205   2HE   LYS  29          2HE       LYS  29   7.550  -2.586  15.514
  206   1HZ   LYS  29          1HZ       LYS  29   8.594  -2.246  17.809
  207   2HZ   LYS  29          2HZ       LYS  29   7.479  -1.068  17.999
  208   3HZ   LYS  29          3HZ       LYS  29   7.003  -2.605  17.719
  209    H    GLU  30           H        GLU  30   9.811  -2.667  10.057
  210    HA   GLU  30           HA       GLU  30   9.394   0.129   9.409
  211   1HB   GLU  30          1HB       GLU  30  11.556  -1.775   9.062
  212   2HB   GLU  30          2HB       GLU  30  11.121  -1.065   7.496
  213   1HG   GLU  30          1HG       GLU  30  11.521   1.153   8.286
  214   2HG   GLU  30          2HG       GLU  30  11.545   0.642   9.980
  215    H    CYS  31           H        CYS  31   9.052  -3.207   8.059
  216    HA   CYS  31           HA       CYS  31   8.023  -2.410   5.596
  217   1HB   CYS  31          1HB       CYS  31   8.062  -4.929   7.183
  218   2HB   CYS  31          2HB       CYS  31   6.942  -4.826   5.820
  219    H    ASN  32           H        ASN  32   6.406  -3.578   8.645
  220    HA   ASN  32           HA       ASN  32   3.837  -3.162   7.705
  221   1HB   ASN  32          1HB       ASN  32   5.171  -3.707  10.300
  222   2HB   ASN  32          2HB       ASN  32   3.639  -2.836  10.469
  223   1HD2  ASN  32          1HD2      ASN  32   5.029  -5.459   8.492
  224   2HD2  ASN  32          2HD2      ASN  32   3.710  -6.571   8.646
  225    H    ASN  33           H        ASN  33   6.302  -0.935   8.299
  226    HA   ASN  33           HA       ASN  33   4.460   1.101   9.247
  227   1HB   ASN  33          1HB       ASN  33   6.470   1.007  10.582
  228   2HB   ASN  33          2HB       ASN  33   7.509   0.930   9.151
  229   1HD2  ASN  33          1HD2      ASN  33   8.580   2.715   8.847
  230   2HD2  ASN  33          2HD2      ASN  33   8.027   4.336   9.102
  231    H    ARG  34           H        ARG  34   6.471  -0.042   6.563
  232    HA   ARG  34           HA       ARG  34   6.354   2.466   5.200
  233   1HB   ARG  34          1HB       ARG  34   7.807   1.494   3.621
  234   2HB   ARG  34          2HB       ARG  34   8.248   0.635   5.108
  235   1HG   ARG  34          1HG       ARG  34   8.014  -1.133   3.615
  236   2HG   ARG  34          2HG       ARG  34   6.381  -1.077   4.302
  237   1HD   ARG  34          1HD       ARG  34   5.608  -0.853   2.192
  238   2HD   ARG  34          2HD       ARG  34   6.333   0.761   2.152
  239    HE   ARG  34           HE       ARG  34   8.402  -1.078   1.586
  240   1HH1  ARG  34          1HH1      ARG  34   5.356  -0.077   0.137
  241   2HH1  ARG  34          2HH1      ARG  34   5.860  -0.436  -1.481
  242   1HH2  ARG  34          1HH2      ARG  34   9.069  -1.552  -0.548
  243   2HH2  ARG  34          2HH2      ARG  34   7.986  -1.281  -1.873
  244    H    GLY  35           H        GLY  35   4.640  -0.642   5.319
  245   1HA   GLY  35          1HA       GLY  35   2.282  -0.355   4.538
  246   2HA   GLY  35          2HA       GLY  35   2.971   0.200   3.025
  247    H    CYS  36           H        CYS  36   4.682  -2.305   4.844
  248    HA   CYS  36           HA       CYS  36   3.686  -4.265   2.906
  249   1HB   CYS  36          1HB       CYS  36   6.465  -4.059   4.071
  250   2HB   CYS  36          2HB       CYS  36   5.891  -5.337   2.995
  251    H    CYS  37           H        CYS  37   4.386  -6.623   3.909
  252    HA   CYS  37           HA       CYS  37   3.608  -6.533   6.734
  253   1HB   CYS  37          1HB       CYS  37   1.865  -7.332   5.007
  254   2HB   CYS  37          2HB       CYS  37   2.847  -8.797   4.907
  255    H    PHE  38           H        PHE  38   5.054  -7.582   8.081
  256    HA   PHE  38           HA       PHE  38   7.281  -8.923   6.795
  257   1HB   PHE  38          1HB       PHE  38   7.396  -7.114   8.640
  258   2HB   PHE  38          2HB       PHE  38   6.678  -8.292   9.745
  259    HD1  PHE  38           HD1      PHE  38   8.033  -9.878  10.830
  260    HD2  PHE  38           HD2      PHE  38   9.634  -7.636   7.602
  261    HE1  PHE  38           HE1      PHE  38  10.325 -10.753  11.360
  262    HE2  PHE  38           HE2      PHE  38  11.926  -8.512   8.131
  263    HZ   PHE  38           HZ       PHE  38  12.244 -10.059  10.004
  264    H    ASP  39           H        ASP  39   7.365 -11.105   6.587
  265    HA   ASP  39           HA       ASP  39   5.384 -12.661   7.904
  266   1HB   ASP  39          1HB       ASP  39   5.765 -13.625   5.865
  267   2HB   ASP  39          2HB       ASP  39   7.426 -13.023   5.772
  268    H    SER  40           H        SER  40   8.875 -13.520   7.457
  269    HA   SER  40           HA       SER  40  10.485 -13.866   8.926
  270   1HB   SER  40          1HB       SER  40   9.043 -12.249  10.473
  271   2HB   SER  40          2HB       SER  40   8.702 -13.749  11.353
  272    HG   SER  40           HG       SER  40  11.283 -13.869  11.024
  273    H    ARG  41           H        ARG  41   7.323 -15.374   8.989
  274    HA   ARG  41           HA       ARG  41   7.933 -17.564  10.571
  275   1HB   ARG  41          1HB       ARG  41   6.034 -17.625   8.195
  276   2HB   ARG  41          2HB       ARG  41   5.887 -18.514   9.722
  277   1HG   ARG  41          1HG       ARG  41   6.006 -15.816  10.490
  278   2HG   ARG  41          2HG       ARG  41   4.996 -15.800   9.032
  279   1HD   ARG  41          1HD       ARG  41   3.536 -16.127  10.929
  280   2HD   ARG  41          2HD       ARG  41   3.629 -17.681  10.084
  281    HE   ARG  41           HE       ARG  41   5.611 -17.342  12.226
  282   1HH1  ARG  41          1HH1      ARG  41   2.363 -18.434  11.425
  283   2HH1  ARG  41          2HH1      ARG  41   2.238 -19.480  12.800
  284   1HH2  ARG  41          1HH2      ARG  41   5.445 -18.721  14.040
  285   2HH2  ARG  41          2HH2      ARG  41   4.003 -19.644  14.298
  286    H    ILE  42           H        ILE  42   8.211 -16.932   7.024
  287    HA   ILE  42           HA       ILE  42   9.794 -19.400   6.833
  288    HB   ILE  42           HB       ILE  42   8.221 -18.240   4.552
  289   1HG1  ILE  42          1HG1      ILE  42   7.237 -19.885   6.842
  290   2HG1  ILE  42          2HG1      ILE  42   6.423 -18.595   5.940
  291   1HG2  ILE  42          1HG2      ILE  42  10.151 -20.094   4.517
  292   2HG2  ILE  42          2HG2      ILE  42   8.763 -21.145   4.881
  293   3HG2  ILE  42          3HG2      ILE  42   8.751 -20.130   3.419
  294   1HD1  ILE  42          1HD1      ILE  42   5.306 -20.433   5.075
  295   2HD1  ILE  42          2HD1      ILE  42   6.674 -20.378   3.937
  296   3HD1  ILE  42          3HD1      ILE  42   6.698 -21.518   5.303
  297    HA   PRO  43           HA       PRO  43  12.752 -16.327   5.793
  298   1HB   PRO  43          1HB       PRO  43  14.957 -17.908   6.114
  299   2HB   PRO  43          2HB       PRO  43  14.220 -17.002   7.433
  300   1HG   PRO  43          1HG       PRO  43  14.078 -19.878   6.798
  301   2HG   PRO  43          2HG       PRO  43  13.745 -19.058   8.364
  302   1HD   PRO  43          1HD       PRO  43  11.872 -20.131   6.484
  303   2HD   PRO  43          2HD       PRO  43  11.491 -19.191   7.933
  304    H    GLY  44           H        GLY  44  11.714 -18.989   4.167
  305   1HA   GLY  44          1HA       GLY  44  13.663 -18.705   2.002
  306   2HA   GLY  44          2HA       GLY  44  12.433 -19.941   2.173
  307    H    VAL  45           H        VAL  45  10.829 -17.159   3.024
  308    HA   VAL  45           HA       VAL  45  10.089 -16.600   0.234
  309    HB   VAL  45           HB       VAL  45   7.860 -16.616   0.763
  310   1HG1  VAL  45          1HG1      VAL  45   9.398 -18.761   2.069
  311   2HG1  VAL  45          2HG1      VAL  45   7.736 -18.582   2.679
  312   3HG1  VAL  45          3HG1      VAL  45   8.023 -18.854   0.943
  313   1HG2  VAL  45          1HG2      VAL  45   6.879 -16.306   2.945
  314   2HG2  VAL  45          2HG2      VAL  45   8.474 -16.419   3.729
  315   3HG2  VAL  45          3HG2      VAL  45   8.092 -15.030   2.683
  316    HA   PRO  46           HA       PRO  46  10.415 -12.381   1.201
  317   1HB   PRO  46          1HB       PRO  46   8.065 -11.166   0.519
  318   2HB   PRO  46          2HB       PRO  46   9.282 -11.644  -0.664
  319   1HG   PRO  46          1HG       PRO  46   6.710 -12.910   0.031
  320   2HG   PRO  46          2HG       PRO  46   7.692 -13.110  -1.464
  321   1HD   PRO  46          1HD       PRO  46   7.408 -14.922   0.734
  322   2HD   PRO  46          2HD       PRO  46   8.510 -15.092  -0.638
  323    H    TRP  47           H        TRP  47  10.838 -11.533   3.129
  324    HA   TRP  47           HA       TRP  47   8.767 -11.899   5.135
  325   1HB   TRP  47          1HB       TRP  47  11.228 -10.523   5.910
  326   2HB   TRP  47          2HB       TRP  47  10.408 -11.902   6.645
  327    HD1  TRP  47           HD1      TRP  47  10.989 -14.377   5.394
  328    HE1  TRP  47           HE1      TRP  47  13.202 -15.301   4.294
  329    HE3  TRP  47           HE3      TRP  47  13.165  -9.834   4.704
  330    HZ2  TRP  47           HZ2      TRP  47  15.562 -14.056   3.282
  331    HZ3  TRP  47           HZ3      TRP  47  15.424  -9.776   3.653
  332    HH2  TRP  47           HH2      TRP  47  16.619 -11.790   2.951
  333    H    CYS  48           H        CYS  48   8.502 -10.033   2.762
  334    HA   CYS  48           HA       CYS  48   7.488  -7.838   4.207
  335   1HB   CYS  48          1HB       CYS  48   9.879  -7.241   4.257
  336   2HB   CYS  48          2HB       CYS  48   9.910  -7.248   2.492
  337    H    PHE  49           H        PHE  49   5.555  -7.959   3.078
  338    HA   PHE  49           HA       PHE  49   5.735  -7.559   0.196
  339   1HB   PHE  49          1HB       PHE  49   3.596  -9.257   0.404
  340   2HB   PHE  49          2HB       PHE  49   5.233  -9.856   0.111
  341    HD1  PHE  49           HD1      PHE  49   6.624 -10.221   2.372
  342    HD2  PHE  49           HD2      PHE  49   2.390 -10.256   2.074
  343    HE1  PHE  49           HE1      PHE  49   6.487 -11.583   4.475
  344    HE2  PHE  49           HE2      PHE  49   2.254 -11.619   4.178
  345    HZ   PHE  49           HZ       PHE  49   4.304 -12.265   5.354
  346    H    LYS  50           H        LYS  50   3.048  -7.589  -0.453
  347    HA   LYS  50           HA       LYS  50   1.910  -5.619   1.406
  348   1HB   LYS  50          1HB       LYS  50   0.929  -4.526  -0.613
  349   2HB   LYS  50          2HB       LYS  50   2.691  -4.391  -0.482
  350   1HG   LYS  50          1HG       LYS  50   2.182  -6.795  -1.903
  351   2HG   LYS  50          2HG       LYS  50   1.084  -5.589  -2.595
  352   1HD   LYS  50          1HD       LYS  50   3.063  -5.354  -3.860
  353   2HD   LYS  50          2HD       LYS  50   3.182  -4.039  -2.678
  354   1HE   LYS  50          1HE       LYS  50   4.975  -4.992  -1.627
  355   2HE   LYS  50          2HE       LYS  50   4.337  -6.635  -1.786
  356   1HZ   LYS  50          1HZ       LYS  50   4.887  -6.125  -4.279
  357   2HZ   LYS  50          2HZ       LYS  50   5.983  -5.116  -3.609
  358   3HZ   LYS  50          3HZ       LYS  50   6.018  -6.711  -3.257
  359    HA   PRO  51           HA       PRO  51  -0.917  -9.118   0.850
  360   1HB   PRO  51          1HB       PRO  51  -1.225  -9.765   3.485
  361   2HB   PRO  51          2HB       PRO  51  -0.070 -10.569   2.425
  362   1HG   PRO  51          1HG       PRO  51   0.373  -8.526   4.507
  363   2HG   PRO  51          2HG       PRO  51   1.561  -9.670   3.784
  364   1HD   PRO  51          1HD       PRO  51   1.258  -6.867   3.283
  365   2HD   PRO  51          2HD       PRO  51   2.335  -7.980   2.431
  366    H    LEU  52           H        LEU  52  -1.963  -8.411   3.982
  367    HA   LEU  52           HA       LEU  52  -4.290  -7.130   2.841
  368   1HB   LEU  52          1HB       LEU  52  -5.393  -7.724   4.717
  369   2HB   LEU  52          2HB       LEU  52  -4.168  -9.004   4.647
  370    HG   LEU  52           HG       LEU  52  -3.203  -6.761   6.193
  371   1HD1  LEU  52          1HD1      LEU  52  -5.167  -7.728   7.976
  372   2HD1  LEU  52          2HD1      LEU  52  -4.983  -6.080   7.325
  373   3HD1  LEU  52          3HD1      LEU  52  -6.018  -7.259   6.485
  374   1HD2  LEU  52          1HD2      LEU  52  -3.579  -8.940   7.885
  375   2HD2  LEU  52          2HD2      LEU  52  -3.311  -9.665   6.281
  376   3HD2  LEU  52          3HD2      LEU  52  -2.112  -8.540   6.962
  377    H    GLN  53           H        GLN  53  -1.720  -5.719   2.675
  378    HA   GLN  53           HA       GLN  53  -1.320  -3.910   4.658
  379   1HB   GLN  53          1HB       GLN  53  -1.045  -3.569   1.648
  380   2HB   GLN  53          2HB       GLN  53  -0.358  -2.445   2.833
  381   1HG   GLN  53          1HG       GLN  53   0.297  -5.400   2.487
  382   2HG   GLN  53          2HG       GLN  53   1.370  -4.033   2.143
  383   1HE2  GLN  53          1HE2      GLN  53  -0.038  -6.106   4.522
  384   2HE2  GLN  53          2HE2      GLN  53   0.855  -5.567   5.904
  385    H    GLU  54           H        GLU  54  -4.069  -4.236   2.567
  386    HA   GLU  54           HA       GLU  54  -4.952  -1.780   2.083
  387   1HB   GLU  54          1HB       GLU  54  -7.102  -2.686   1.935
  388   2HB   GLU  54          2HB       GLU  54  -6.081  -4.126   1.776
  389   1HG   GLU  54          1HG       GLU  54  -7.418  -4.949   3.429
  390   2HG   GLU  54          2HG       GLU  54  -6.379  -4.001   4.504
  391    H    ALA  55           H        ALA  55  -4.457  -3.221   5.252
  392    HA   ALA  55           HA       ALA  55  -6.141  -2.018   6.925
  393   1HB   ALA  55          1HB       ALA  55  -3.114  -2.085   7.260
  394   2HB   ALA  55          2HB       ALA  55  -4.325  -2.026   8.564
  395   3HB   ALA  55          3HB       ALA  55  -4.203  -3.468   7.529
  396    H    GLU  56           H        GLU  56  -3.001  -0.410   6.028
  397    HA   GLU  56           HA       GLU  56  -4.494   2.089   6.019
  398   1HB   GLU  56          1HB       GLU  56  -1.988   1.395   7.545
  399   2HB   GLU  56          2HB       GLU  56  -2.244   3.065   7.009
  400   1HG   GLU  56          1HG       GLU  56  -4.667   1.975   8.207
  401   2HG   GLU  56          2HG       GLU  56  -3.305   1.811   9.324
  402    H    CYS  57           H        CYS  57  -3.477   0.157   3.907
  403    HA   CYS  57           HA       CYS  57  -1.469   1.863   2.650
  404   1HB   CYS  57          1HB       CYS  57  -1.213  -0.697   3.003
  405   2HB   CYS  57          2HB       CYS  57  -2.291  -0.830   1.611
  406    H    THR  58           H        THR  58  -4.526   0.001   1.984
  407    HA   THR  58           HA       THR  58  -4.994   1.303  -0.494
  408    HB   THR  58           HB       THR  58  -5.813  -1.014   0.486
  409    HG1  THR  58           HG1      THR  58  -7.593   0.932  -0.807
  410   1HG2  THR  58          1HG2      THR  58  -8.186   0.764   1.212
  411   2HG2  THR  58          2HG2      THR  58  -8.003  -0.984   1.496
  412   3HG2  THR  58          3HG2      THR  58  -7.044   0.177   2.445
  413    H    PHE  59           H        PHE  59  -6.134   1.846   2.875
  414    HA   PHE  59           HA       PHE  59  -8.122   3.557   2.615
  415   1HB   PHE  59          1HB       PHE  59  -6.087   2.936   4.477
  416   2HB   PHE  59          2HB       PHE  59  -5.922   4.684   4.277
  417    HD1  PHE  59           HD1      PHE  59  -7.128   6.009   5.719
  418    HD2  PHE  59           HD2      PHE  59  -8.620   2.145   4.791
  419    HE1  PHE  59           HE1      PHE  59  -9.028   6.356   7.322
  420    HE2  PHE  59           HE2      PHE  59 -10.519   2.493   6.395
  421    HZ   PHE  59           HZ       PHE  59 -10.700   4.595   7.641
  422   1H    GLU   1           H1       GLU   1 -23.739   0.475  -0.657
  423    HA   GLU   1           HA       GLU   1 -21.049  -0.598  -0.690
  424   1HB   GLU   1          1HB       GLU   1 -23.249  -0.284  -2.710
  425   2HB   GLU   1          2HB       GLU   1 -21.581  -0.365  -3.300
  426   1HG   GLU   1          1HG       GLU   1 -21.251  -2.519  -2.212
  427   2HG   GLU   1          2HG       GLU   1 -22.826  -2.416  -1.412
  428    H    GLU   2           H        GLU   2 -20.240   1.446   0.364
  429    HA   GLU   2           HA       GLU   2 -20.343   3.757  -1.352
  430   1HB   GLU   2          1HB       GLU   2 -19.234   3.257   1.429
  431   2HB   GLU   2          2HB       GLU   2 -19.015   4.799   0.585
  432   1HG   GLU   2          1HG       GLU   2 -21.496   4.991   0.368
  433   2HG   GLU   2          2HG       GLU   2 -21.685   3.479   1.269
  434    H    TYR   3           H        TYR   3 -19.117   2.518  -3.088
  435    HA   TYR   3           HA       TYR   3 -16.308   2.095  -2.486
  436   1HB   TYR   3          1HB       TYR   3 -16.582   1.520  -5.100
  437   2HB   TYR   3          2HB       TYR   3 -17.241   0.407  -3.898
  438    HD1  TYR   3           HD1      TYR   3 -19.140  -0.544  -4.867
  439    HD2  TYR   3           HD2      TYR   3 -18.554   3.683  -5.161
  440    HE1  TYR   3           HE1      TYR   3 -21.438  -0.292  -5.925
  441    HE2  TYR   3           HE2      TYR   3 -20.853   3.921  -6.218
  442    HH   TYR   3           HH       TYR   3 -22.374   1.988  -7.671
  443    H    VAL   4           H        VAL   4 -16.350   4.627  -2.023
  444    HA   VAL   4           HA       VAL   4 -15.653   5.918  -4.570
  445    HB   VAL   4           HB       VAL   4 -16.264   7.992  -2.947
  446   1HG1  VAL   4          1HG1      VAL   4 -17.884   8.427  -4.479
  447   2HG1  VAL   4          2HG1      VAL   4 -17.133   7.051  -5.322
  448   3HG1  VAL   4          3HG1      VAL   4 -18.602   6.805  -4.347
  449   1HG2  VAL   4          1HG2      VAL   4 -17.040   6.615  -1.104
  450   2HG2  VAL   4          2HG2      VAL   4 -18.421   7.474  -1.828
  451   3HG2  VAL   4          3HG2      VAL   4 -18.162   5.748  -2.180
  452    H    GLY   5           H        GLY   5 -15.180   6.069  -0.967
  453   1HA   GLY   5          1HA       GLY   5 -12.694   7.433  -1.168
  454   2HA   GLY   5          2HA       GLY   5 -13.372   6.654   0.249
  455    H    LEU   6           H        LEU   6 -13.406   4.429  -2.331
  456    HA   LEU   6           HA       LEU   6 -10.675   3.543  -1.894
  457   1HB   LEU   6          1HB       LEU   6 -11.418   1.265  -1.359
  458   2HB   LEU   6          2HB       LEU   6 -11.775   2.454  -0.092
  459    HG   LEU   6           HG       LEU   6 -13.596   0.877  -0.322
  460   1HD1  LEU   6          1HD1      LEU   6 -13.898   3.512  -0.074
  461   2HD1  LEU   6          2HD1      LEU   6 -14.801   3.287  -1.592
  462   3HD1  LEU   6          3HD1      LEU   6 -15.280   2.393  -0.129
  463   1HD2  LEU   6          1HD2      LEU   6 -13.071   0.384  -2.771
  464   2HD2  LEU   6          2HD2      LEU   6 -14.786   0.427  -2.296
  465   3HD2  LEU   6          3HD2      LEU   6 -14.064   1.810  -3.153
  466    H    SER   7           H        SER   7 -12.360   4.762  -4.079
  467    HA   SER   7           HA       SER   7 -12.469   2.500  -5.892
  468   1HB   SER   7          1HB       SER   7 -14.275   4.481  -5.493
  469   2HB   SER   7          2HB       SER   7 -13.326   5.220  -6.796
  470    HG   SER   7           HG       SER   7 -15.287   3.640  -7.212
  471    H    ALA   8           H        ALA   8 -11.793   3.200  -8.294
  472    HA   ALA   8           HA       ALA   8  -9.042   3.899  -8.130
  473   1HB   ALA   8          1HB       ALA   8 -10.079   3.946 -10.820
  474   2HB   ALA   8          2HB       ALA   8  -9.044   2.724 -10.043
  475   3HB   ALA   8          3HB       ALA   8 -10.816   2.589  -9.933
  476    H    ASN   9           H        ASN   9 -11.829   5.759  -7.953
  477    HA   ASN   9           HA       ASN   9 -10.741   7.906  -9.546
  478   1HB   ASN   9          1HB       ASN   9 -13.358   7.044  -8.876
  479   2HB   ASN   9          2HB       ASN   9 -13.150   8.570  -8.004
  480   1HD2  ASN   9          1HD2      ASN   9 -11.985  10.293  -9.369
  481   2HD2  ASN   9          2HD2      ASN   9 -12.580  10.535 -10.977
  482    H    GLN  10           H        GLN  10 -10.492   6.625  -6.418
  483    HA   GLN  10           HA       GLN  10 -10.718   8.936  -4.864
  484   1HB   GLN  10          1HB       GLN  10 -10.330   6.214  -4.423
  485   2HB   GLN  10          2HB       GLN  10  -8.816   6.932  -3.846
  486   1HG   GLN  10          1HG       GLN  10 -10.974   8.586  -2.938
  487   2HG   GLN  10          2HG       GLN  10 -11.413   6.909  -2.578
  488   1HE2  GLN  10          1HE2      GLN  10  -8.852   5.842  -2.252
  489   2HE2  GLN  10          2HE2      GLN  10  -8.134   6.471  -0.806
  490    H    CYS  11           H        CYS  11  -8.085   7.477  -6.781
  491    HA   CYS  11           HA       CYS  11  -6.053   9.090  -5.642
  492   1HB   CYS  11          1HB       CYS  11  -5.503   6.976  -6.626
  493   2HB   CYS  11          2HB       CYS  11  -6.163   7.466  -8.189
  494    H    ALA  12           H        ALA  12  -8.770   9.886  -7.380
  495    HA   ALA  12           HA       ALA  12  -7.397  11.977  -8.919
  496   1HB   ALA  12          1HB       ALA  12  -9.465  10.119  -9.568
  497   2HB   ALA  12          2HB       ALA  12 -10.198  11.740  -9.535
  498   3HB   ALA  12          3HB       ALA  12  -8.796  11.418 -10.583
  499    H    VAL  13           H        VAL  13  -8.402  11.592  -5.899
  500    HA   VAL  13           HA       VAL  13 -10.445  13.168  -5.239
  501    HB   VAL  13           HB       VAL  13  -7.803  12.563  -4.075
  502   1HG1  VAL  13          1HG1      VAL  13  -9.362  14.519  -2.467
  503   2HG1  VAL  13          2HG1      VAL  13  -7.605  14.256  -2.570
  504   3HG1  VAL  13          3HG1      VAL  13  -8.443  15.175  -3.843
  505   1HG2  VAL  13          1HG2      VAL  13 -10.594  12.580  -2.880
  506   2HG2  VAL  13          2HG2      VAL  13  -9.857  11.198  -3.726
  507   3HG2  VAL  13          3HG2      VAL  13  -9.143  11.796  -2.208
  508    HA   PRO  14           HA       PRO  14  -9.670  17.173  -6.660
  509   1HB   PRO  14          1HB       PRO  14 -11.179  18.662  -4.938
  510   2HB   PRO  14          2HB       PRO  14 -11.858  17.802  -6.317
  511   1HG   PRO  14          1HG       PRO  14 -11.916  17.129  -3.446
  512   2HG   PRO  14          2HG       PRO  14 -12.992  16.532  -4.760
  513   1HD   PRO  14          1HD       PRO  14 -10.846  15.157  -3.455
  514   2HD   PRO  14          2HD       PRO  14 -11.769  14.588  -4.852
  515    H    ALA  15           H        ALA  15  -7.595  16.099  -5.086
  516    HA   ALA  15           HA       ALA  15  -5.895  16.713  -3.789
  517   1HB   ALA  15          1HB       ALA  15  -4.942  18.021  -5.383
  518   2HB   ALA  15          2HB       ALA  15  -6.451  18.911  -5.694
  519   3HB   ALA  15          3HB       ALA  15  -5.418  19.365  -4.317
  520    H    LYS  16           H        LYS  16  -7.633  16.378  -1.985
  521    HA   LYS  16           HA       LYS  16  -7.162  17.995   0.088
  522   1HB   LYS  16          1HB       LYS  16  -9.379  19.351   0.145
  523   2HB   LYS  16          2HB       LYS  16  -7.981  19.986  -0.740
  524   1HG   LYS  16          1HG       LYS  16  -9.167  19.994  -2.653
  525   2HG   LYS  16          2HG       LYS  16  -9.510  18.262  -2.495
  526   1HD   LYS  16          1HD       LYS  16 -11.056  20.273  -0.853
  527   2HD   LYS  16          2HD       LYS  16 -11.497  20.011  -2.550
  528   1HE   LYS  16          1HE       LYS  16 -12.740  18.271  -1.818
  529   2HE   LYS  16          2HE       LYS  16 -11.219  17.415  -1.517
  530   1HZ   LYS  16          1HZ       LYS  16 -11.455  18.946   0.642
  531   2HZ   LYS  16          2HZ       LYS  16 -13.027  18.631   0.333
  532   3HZ   LYS  16          3HZ       LYS  16 -11.977  17.401   0.558
  533    H    ASP  17           H        ASP  17  -7.573  15.289  -0.442
  534    HA   ASP  17           HA       ASP  17  -9.564  14.764   1.508
  535   1HB   ASP  17          1HB       ASP  17 -10.705  14.870  -0.855
  536   2HB   ASP  17          2HB       ASP  17  -9.908  13.312  -1.135
  537    H    ARG  18           H        ARG  18  -6.589  14.408   0.355
  538    HA   ARG  18           HA       ARG  18  -6.436  11.537   0.427
  539   1HB   ARG  18          1HB       ARG  18  -4.186  13.575   0.117
  540   2HB   ARG  18          2HB       ARG  18  -4.100  11.847  -0.268
  541   1HG   ARG  18          1HG       ARG  18  -5.037  12.164  -2.304
  542   2HG   ARG  18          2HG       ARG  18  -6.324  13.194  -1.650
  543   1HD   ARG  18          1HD       ARG  18  -4.758  15.115  -1.615
  544   2HD   ARG  18          2HD       ARG  18  -3.462  14.089  -2.249
  545    HE   ARG  18           HE       ARG  18  -5.954  14.243  -3.847
  546   1HH1  ARG  18          1HH1      ARG  18  -2.634  15.319  -3.400
  547   2HH1  ARG  18          2HH1      ARG  18  -2.468  15.896  -5.025
  548   1HH2  ARG  18          1HH2      ARG  18  -5.737  15.005  -5.990
  549   2HH2  ARG  18          2HH2      ARG  18  -4.244  15.717  -6.508
  550    H    VAL  19           H        VAL  19  -4.216  10.788   1.690
  551    HA   VAL  19           HA       VAL  19  -4.503  11.918   4.385
  552    HB   VAL  19           HB       VAL  19  -3.566   9.180   3.506
  553   1HG1  VAL  19          1HG1      VAL  19  -3.478  10.609   6.060
  554   2HG1  VAL  19          2HG1      VAL  19  -4.329   9.049   6.170
  555   3HG1  VAL  19          3HG1      VAL  19  -2.659   9.111   5.556
  556   1HG2  VAL  19          1HG2      VAL  19  -5.830   8.660   4.837
  557   2HG2  VAL  19          2HG2      VAL  19  -6.251  10.272   4.214
  558   3HG2  VAL  19          3HG2      VAL  19  -5.801   8.972   3.085
  559    H    ASP  20           H        ASP  20  -2.791  12.774   1.943
  560    HA   ASP  20           HA       ASP  20  -0.678  13.163   1.437
  561   1HB   ASP  20          1HB       ASP  20  -0.893  15.090   2.706
  562   2HB   ASP  20          2HB       ASP  20  -1.199  14.202   4.207
  563    H    CYS  21           H        CYS  21   0.291  11.043   1.147
  564    HA   CYS  21           HA       CYS  21   1.007   9.329   3.164
  565   1HB   CYS  21          1HB       CYS  21   1.206   9.398   0.411
  566   2HB   CYS  21          2HB       CYS  21   2.892   9.320   0.933
  567    H    GLY  22           H        GLY  22   2.574  12.266   1.870
  568   1HA   GLY  22          1HA       GLY  22   4.385  13.429   2.513
  569   2HA   GLY  22          2HA       GLY  22   4.075  12.810   4.123
  570    H    TYR  23           H        TYR  23   5.242  11.394   0.974
  571    HA   TYR  23           HA       TYR  23   7.165   9.812   2.468
  572   1HB   TYR  23          1HB       TYR  23   5.533   9.502   0.215
  573   2HB   TYR  23          2HB       TYR  23   7.084   9.894  -0.537
  574    HD1  TYR  23           HD1      TYR  23   6.404   7.902   2.557
  575    HD2  TYR  23           HD2      TYR  23   7.777   7.867  -1.495
  576    HE1  TYR  23           HE1      TYR  23   7.130   5.479   2.816
  577    HE2  TYR  23           HE2      TYR  23   8.498   5.445  -1.222
  578    HH   TYR  23           HH       TYR  23   9.008   3.888   0.355
  579    HA   PRO  24           HA       PRO  24  10.447  12.492   1.548
  580   1HB   PRO  24          1HB       PRO  24  12.546  10.846   2.136
  581   2HB   PRO  24          2HB       PRO  24  11.652  11.742   3.361
  582   1HG   PRO  24          1HG       PRO  24  11.534   8.885   2.638
  583   2HG   PRO  24          2HG       PRO  24  11.002   9.679   4.162
  584   1HD   PRO  24          1HD       PRO  24   9.388   8.699   2.009
  585   2HD   PRO  24          2HD       PRO  24   8.829   9.616   3.414
  586    H    HIS  25           H        HIS  25   9.665   9.805  -0.233
  587    HA   HIS  25           HA       HIS  25  11.553  10.696  -2.285
  588   1HB   HIS  25          1HB       HIS  25  11.257   8.074  -1.071
  589   2HB   HIS  25          2HB       HIS  25  11.021   8.008  -2.821
  590    HD1  HIS  25           HD1      HIS  25  13.320   6.620  -2.840
  591    HD2  HIS  25           HD2      HIS  25  13.622  10.647  -1.705
  592    HE1  HIS  25           HE1      HIS  25  15.794   7.225  -3.002
  593    HE2  HIS  25           HE2      HIS  25  15.910   9.726  -2.346
  594    H    VAL  26           H        VAL  26   8.818  11.607  -1.739
  595    HA   VAL  26           HA       VAL  26   6.880  10.324  -3.196
  596    HB   VAL  26           HB       VAL  26   6.208  12.069  -1.832
  597   1HG1  VAL  26          1HG1      VAL  26   7.179  14.501  -2.560
  598   2HG1  VAL  26          2HG1      VAL  26   7.891  13.481  -1.285
  599   3HG1  VAL  26          3HG1      VAL  26   8.581  13.466  -2.927
  600   1HG2  VAL  26          1HG2      VAL  26   4.829  13.340  -3.179
  601   2HG2  VAL  26          2HG2      VAL  26   6.092  13.615  -4.404
  602   3HG2  VAL  26          3HG2      VAL  26   5.282  12.033  -4.299
  603    H    THR  27           H        THR  27   6.801   9.701  -5.286
  604    HA   THR  27           HA       THR  27   7.406  11.504  -7.382
  605    HB   THR  27           HB       THR  27   9.634  10.083  -6.276
  606    HG1  THR  27           HG1      THR  27  10.367  11.749  -7.532
  607   1HG2  THR  27          1HG2      THR  27  10.332   9.101  -8.625
  608   2HG2  THR  27          2HG2      THR  27   9.333   8.092  -7.551
  609   3HG2  THR  27          3HG2      THR  27   8.579   8.970  -8.904
  610    HA   PRO  28           HA       PRO  28   4.824   8.724  -9.381
  611   1HB   PRO  28          1HB       PRO  28   5.327   9.271 -12.009
  612   2HB   PRO  28          2HB       PRO  28   4.283  10.269 -11.001
  613   1HG   PRO  28          1HG       PRO  28   7.052  10.733 -11.907
  614   2HG   PRO  28          2HG       PRO  28   5.852  11.934 -11.305
  615   1HD   PRO  28          1HD       PRO  28   8.123  10.849  -9.939
  616   2HD   PRO  28          2HD       PRO  28   6.882  11.905  -9.249
  617    H    LYS  29           H        LYS  29   6.840   7.334  -8.309
  618    HA   LYS  29           HA       LYS  29   6.899   5.099  -9.978
  619   1HB   LYS  29          1HB       LYS  29   8.426   6.473 -11.328
  620   2HB   LYS  29          2HB       LYS  29   9.513   6.636  -9.937
  621   1HG   LYS  29          1HG       LYS  29  10.402   4.592 -10.296
  622   2HG   LYS  29          2HG       LYS  29   8.807   3.832 -10.429
  623   1HD   LYS  29          1HD       LYS  29   9.318   3.541 -12.615
  624   2HD   LYS  29          2HD       LYS  29   9.003   5.275 -12.804
  625   1HE   LYS  29          1HE       LYS  29  11.460   5.647 -12.186
  626   2HE   LYS  29          2HE       LYS  29  11.686   3.899 -12.340
  627   1HZ   LYS  29          1HZ       LYS  29  12.044   4.420 -14.456
  628   2HZ   LYS  29          2HZ       LYS  29  10.420   4.530 -14.596
  629   3HZ   LYS  29          3HZ       LYS  29  11.314   5.878 -14.365
  630    H    GLU  30           H        GLU  30   7.879   7.021  -7.222
  631    HA   GLU  30           HA       GLU  30   8.901   4.645  -5.914
  632   1HB   GLU  30          1HB       GLU  30   9.351   7.528  -5.683
  633   2HB   GLU  30          2HB       GLU  30   9.060   6.783  -4.102
  634   1HG   GLU  30          1HG       GLU  30  11.256   6.223  -4.164
  635   2HG   GLU  30          2HG       GLU  30  10.780   4.967  -5.318
  636    H    CYS  31           H        CYS  31   6.392   7.230  -5.592
  637    HA   CYS  31           HA       CYS  31   5.294   6.261  -3.222
  638   1HB   CYS  31          1HB       CYS  31   4.376   8.072  -5.409
  639   2HB   CYS  31          2HB       CYS  31   3.191   7.499  -4.231
  640    H    ASN  32           H        ASN  32   4.242   5.895  -6.694
  641    HA   ASN  32           HA       ASN  32   2.208   4.119  -6.138
  642   1HB   ASN  32          1HB       ASN  32   3.795   4.947  -8.538
  643   2HB   ASN  32          2HB       ASN  32   2.940   3.404  -8.688
  644   1HD2  ASN  32          1HD2      ASN  32   2.311   6.570  -7.171
  645   2HD2  ASN  32          2HD2      ASN  32   0.752   6.843  -7.873
  646    H    ASN  33           H        ASN  33   5.553   3.769  -5.725
  647    HA   ASN  33           HA       ASN  33   5.510   0.942  -6.382
  648   1HB   ASN  33          1HB       ASN  33   7.438   2.061  -7.297
  649   2HB   ASN  33          2HB       ASN  33   7.755   2.927  -5.786
  650   1HD2  ASN  33          1HD2      ASN  33   9.479   2.213  -4.815
  651   2HD2  ASN  33          2HD2      ASN  33  10.019   0.572  -4.691
  652    H    ARG  34           H        ARG  34   5.640   3.347  -3.778
  653    HA   ARG  34           HA       ARG  34   6.439   1.385  -1.846
  654   1HB   ARG  34          1HB       ARG  34   6.823   3.172  -0.415
  655   2HB   ARG  34          2HB       ARG  34   6.957   4.024  -1.964
  656   1HG   ARG  34          1HG       ARG  34   5.441   5.421  -0.962
  657   2HG   ARG  34          2HG       ARG  34   4.274   4.231  -1.569
  658   1HD   ARG  34          1HD       ARG  34   5.234   3.229   0.916
  659   2HD   ARG  34          2HD       ARG  34   4.913   4.950   1.180
  660    HE   ARG  34           HE       ARG  34   2.800   3.456  -0.242
  661   1HH1  ARG  34          1HH1      ARG  34   3.981   4.660   2.846
  662   2HH1  ARG  34          2HH1      ARG  34   2.431   4.576   3.616
  663   1HH2  ARG  34          1HH2      ARG  34   0.757   3.345   0.773
  664   2HH2  ARG  34          2HH2      ARG  34   0.584   3.823   2.429
  665    H    GLY  35           H        GLY  35   3.536   2.885  -3.167
  666   1HA   GLY  35          1HA       GLY  35   1.519   1.526  -2.753
  667   2HA   GLY  35          2HA       GLY  35   1.914   1.602  -1.048
  668    H    CYS  36           H        CYS  36   2.625   4.422  -3.052
  669    HA   CYS  36           HA       CYS  36   0.263   5.725  -1.904
  670   1HB   CYS  36          1HB       CYS  36   3.012   6.884  -2.361
  671   2HB   CYS  36          2HB       CYS  36   1.595   7.814  -1.866
  672    H    CYS  37           H        CYS  37  -0.339   7.763  -3.282
  673    HA   CYS  37           HA       CYS  37   0.058   7.059  -6.099
  674   1HB   CYS  37          1HB       CYS  37  -2.277   6.904  -4.964
  675   2HB   CYS  37          2HB       CYS  37  -2.281   8.664  -5.119
  676    H    PHE  38           H        PHE  38   1.114   8.601  -7.323
  677    HA   PHE  38           HA       PHE  38   1.746  11.105  -6.001
  678   1HB   PHE  38          1HB       PHE  38   3.415   9.544  -7.179
  679   2HB   PHE  38          2HB       PHE  38   2.592   9.899  -8.703
  680    HD1  PHE  38           HD1      PHE  38   4.713  11.283  -6.034
  681    HD2  PHE  38           HD2      PHE  38   2.963  11.976  -9.837
  682    HE1  PHE  38           HE1      PHE  38   6.196  13.282  -6.352
  683    HE2  PHE  38           HE2      PHE  38   4.446  13.975 -10.155
  684    HZ   PHE  38           HZ       PHE  38   6.046  14.605  -8.409
  685    H    ASP  39           H        ASP  39   0.594  12.933  -6.383
  686    HA   ASP  39           HA       ASP  39  -1.278  12.906  -8.538
  687   1HB   ASP  39          1HB       ASP  39  -1.917  13.845  -6.370
  688   2HB   ASP  39          2HB       ASP  39  -0.573  14.996  -6.428
  689    H    SER  40           H        SER  40   0.761  15.675  -7.391
  690    HA   SER  40           HA       SER  40   2.355  16.818  -8.405
  691   1HB   SER  40          1HB       SER  40   2.576  14.566  -9.880
  692   2HB   SER  40          2HB       SER  40   1.979  15.658 -11.143
  693    HG   SER  40           HG       SER  40   3.887  16.636 -11.191
  694    H    ARG  41           H        ARG  41  -0.900  16.356  -9.379
  695    HA   ARG  41           HA       ARG  41  -1.068  18.269 -11.390
  696   1HB   ARG  41          1HB       ARG  41  -3.204  17.355  -9.407
  697   2HB   ARG  41          2HB       ARG  41  -3.522  18.179 -10.943
  698   1HG   ARG  41          1HG       ARG  41  -1.963  16.093 -11.788
  699   2HG   ARG  41          2HG       ARG  41  -2.776  15.341 -10.404
  700   1HD   ARG  41          1HD       ARG  41  -4.668  15.120 -11.614
  701   2HD   ARG  41          2HD       ARG  41  -4.714  16.860 -11.935
  702    HE   ARG  41           HE       ARG  41  -3.803  16.454 -14.056
  703   1HH1  ARG  41          1HH1      ARG  41  -3.376  13.599 -12.044
  704   2HH1  ARG  41          2HH1      ARG  41  -2.804  12.611 -13.346
  705   1HH2  ARG  41          1HH2      ARG  41  -3.048  15.150 -15.774
  706   2HH2  ARG  41          2HH2      ARG  41  -2.616  13.498 -15.482
  707    H    ILE  42           H        ILE  42  -1.518  18.372  -7.804
  708    HA   ILE  42           HA       ILE  42  -1.460  21.302  -8.006
  709    HB   ILE  42           HB       ILE  42  -2.885  19.839  -5.809
  710   1HG1  ILE  42          1HG1      ILE  42  -3.861  20.373  -8.597
  711   2HG1  ILE  42          2HG1      ILE  42  -4.041  18.914  -7.608
  712   1HG2  ILE  42          1HG2      ILE  42  -3.899  21.879  -5.351
  713   2HG2  ILE  42          2HG2      ILE  42  -2.238  22.343  -5.792
  714   3HG2  ILE  42          3HG2      ILE  42  -3.557  22.531  -6.971
  715   1HD1  ILE  42          1HD1      ILE  42  -6.178  19.824  -7.419
  716   2HD1  ILE  42          2HD1      ILE  42  -5.391  20.590  -6.018
  717   3HD1  ILE  42          3HD1      ILE  42  -5.587  21.500  -7.535
  718    HA   PRO  43           HA       PRO  43   2.129  20.469  -5.629
  719   1HB   PRO  43          1HB       PRO  43   3.256  22.942  -5.901
  720   2HB   PRO  43          2HB       PRO  43   3.499  21.638  -7.063
  721   1HG   PRO  43          1HG       PRO  43   1.784  24.033  -7.229
  722   2HG   PRO  43          2HG       PRO  43   2.389  22.992  -8.566
  723   1HD   PRO  43          1HD       PRO  43  -0.239  23.086  -7.433
  724   2HD   PRO  43          2HD       PRO  43   0.349  21.933  -8.639
  725    H    GLY  44           H        GLY  44  -0.518  22.302  -4.977
  726   1HA   GLY  44          1HA       GLY  44   0.550  23.403  -2.490
  727   2HA   GLY  44          2HA       GLY  44  -1.030  23.686  -3.193
  728    H    VAL  45           H        VAL  45  -0.716  20.434  -3.602
  729    HA   VAL  45           HA       VAL  45  -1.724  19.848  -0.905
  730    HB   VAL  45           HB       VAL  45  -3.470  18.626  -1.749
  731   1HG1  VAL  45          1HG1      VAL  45  -4.673  20.261  -2.696
  732   2HG1  VAL  45          2HG1      VAL  45  -3.171  21.215  -2.709
  733   3HG1  VAL  45          3HG1      VAL  45  -3.648  20.286  -4.150
  734   1HG2  VAL  45          1HG2      VAL  45  -2.178  18.519  -4.493
  735   2HG2  VAL  45          2HG2      VAL  45  -2.043  17.239  -3.264
  736   3HG2  VAL  45          3HG2      VAL  45  -3.632  17.650  -3.950
  737    HA   PRO  46           HA       PRO  46   0.866  16.363  -0.941
  738   1HB   PRO  46          1HB       PRO  46  -0.654  14.157  -0.403
  739   2HB   PRO  46          2HB       PRO  46  -0.158  15.311   0.833
  740   1HG   PRO  46          1HG       PRO  46  -2.769  14.960  -0.494
  741   2HG   PRO  46          2HG       PRO  46  -2.404  15.781   1.066
  742   1HD   PRO  46          1HD       PRO  46  -3.016  16.964  -1.470
  743   2HD   PRO  46          2HD       PRO  46  -2.508  17.813  -0.004
  744    H    TRP  47           H        TRP  47   2.096  15.716  -2.580
  745    HA   TRP  47           HA       TRP  47   0.648  14.703  -4.894
  746   1HB   TRP  47          1HB       TRP  47   3.536  14.846  -5.121
  747   2HB   TRP  47          2HB       TRP  47   2.278  15.574  -6.120
  748    HD1  TRP  47           HD1      TRP  47   1.284  18.028  -5.090
  749    HE1  TRP  47           HE1      TRP  47   2.503  20.009  -3.842
  750    HE3  TRP  47           HE3      TRP  47   5.333  15.317  -3.636
  751    HZ2  TRP  47           HZ2      TRP  47   4.968  20.215  -2.419
  752    HZ3  TRP  47           HZ3      TRP  47   7.101  16.484  -2.320
  753    HH2  TRP  47           HH2      TRP  47   6.965  18.848  -1.711
  754    H    CYS  48           H        CYS  48   0.843  13.204  -2.298
  755    HA   CYS  48           HA       CYS  48   1.556  10.716  -3.403
  756   1HB   CYS  48          1HB       CYS  48   3.823  11.535  -2.967
  757   2HB   CYS  48          2HB       CYS  48   3.418  11.769  -1.263
  758    H    PHE  49           H        PHE  49  -0.233   9.662  -2.601
  759    HA   PHE  49           HA       PHE  49  -0.613   9.697   0.273
  760   1HB   PHE  49          1HB       PHE  49  -3.206   9.900  -0.572
  761   2HB   PHE  49          2HB       PHE  49  -2.255  11.329  -0.154
  762    HD1  PHE  49           HD1      PHE  49  -0.886  12.358  -2.151
  763    HD2  PHE  49           HD2      PHE  49  -4.249   9.813  -2.618
  764    HE1  PHE  49           HE1      PHE  49  -1.241  13.252  -4.470
  765    HE2  PHE  49           HE2      PHE  49  -4.604  10.707  -4.937
  766    HZ   PHE  49           HZ       PHE  49  -3.096  12.417  -5.835
  767    H    LYS  50           H        LYS  50  -3.048   8.302   0.376
  768    HA   LYS  50           HA       LYS  50  -2.437   5.892  -1.189
  769   1HB   LYS  50          1HB       LYS  50  -3.410   4.705   0.901
  770   2HB   LYS  50          2HB       LYS  50  -1.722   5.244   0.913
  771   1HG   LYS  50          1HG       LYS  50  -3.680   7.274   1.828
  772   2HG   LYS  50          2HG       LYS  50  -3.595   5.835   2.861
  773   1HD   LYS  50          1HD       LYS  50  -1.180   7.462   1.966
  774   2HD   LYS  50          2HD       LYS  50  -2.001   7.695   3.518
  775   1HE   LYS  50          1HE       LYS  50  -1.298   4.881   2.960
  776   2HE   LYS  50          2HE       LYS  50   0.114   5.944   3.042
  777   1HZ   LYS  50          1HZ       LYS  50  -1.496   6.669   5.117
  778   2HZ   LYS  50          2HZ       LYS  50  -1.552   5.037   5.116
  779   3HZ   LYS  50          3HZ       LYS  50  -0.114   5.806   5.215
  780    HA   PRO  51           HA       PRO  51  -6.685   7.270  -1.943
  781   1HB   PRO  51          1HB       PRO  51  -6.547   7.400  -4.667
  782   2HB   PRO  51          2HB       PRO  51  -6.310   8.800  -3.621
  783   1HG   PRO  51          1HG       PRO  51  -4.333   7.166  -5.079
  784   2HG   PRO  51          2HG       PRO  51  -4.149   8.834  -4.428
  785   1HD   PRO  51          1HD       PRO  51  -3.097   6.387  -3.377
  786   2HD   PRO  51          2HD       PRO  51  -3.024   7.980  -2.615
  787    H    LEU  52           H        LEU  52  -5.995   5.689  -4.921
  788    HA   LEU  52           HA       LEU  52  -7.620   3.461  -3.955
  789   1HB   LEU  52          1HB       LEU  52  -8.376   3.176  -6.064
  790   2HB   LEU  52          2HB       LEU  52  -8.112   4.928  -6.051
  791    HG   LEU  52           HG       LEU  52  -5.706   3.748  -6.956
  792   1HD1  LEU  52          1HD1      LEU  52  -7.051   2.738  -9.108
  793   2HD1  LEU  52          2HD1      LEU  52  -6.348   1.770  -7.790
  794   3HD1  LEU  52          3HD1      LEU  52  -8.075   2.198  -7.755
  795   1HD2  LEU  52          1HD2      LEU  52  -7.272   5.889  -7.576
  796   2HD2  LEU  52          2HD2      LEU  52  -5.875   5.339  -8.530
  797   3HD2  LEU  52          3HD2      LEU  52  -7.521   4.849  -8.999
  798    H    GLN  53           H        GLN  53  -4.941   3.661  -2.984
  799    HA   GLN  53           HA       GLN  53  -3.046   2.409  -4.460
  800   1HB   GLN  53          1HB       GLN  53  -3.595   2.196  -1.476
  801   2HB   GLN  53          2HB       GLN  53  -2.078   1.696  -2.242
  802   1HG   GLN  53          1HG       GLN  53  -3.280   4.497  -2.300
  803   2HG   GLN  53          2HG       GLN  53  -1.921   3.989  -1.286
  804   1HE2  GLN  53          1HE2      GLN  53  -0.711   2.265  -3.202
  805   2HE2  GLN  53          2HE2      GLN  53   0.008   3.233  -4.445
  806    H    GLU  54           H        GLU  54  -6.037   1.111  -3.262
  807    HA   GLU  54           HA       GLU  54  -5.573  -1.433  -2.667
  808   1HB   GLU  54          1HB       GLU  54  -7.785  -1.956  -3.555
  809   2HB   GLU  54          2HB       GLU  54  -7.817  -0.349  -2.810
  810   1HG   GLU  54          1HG       GLU  54  -8.223   0.691  -4.800
  811   2HG   GLU  54          2HG       GLU  54  -7.112  -0.353  -5.698
  812    H    ALA  55           H        ALA  55  -4.954   0.118  -5.757
  813    HA   ALA  55           HA       ALA  55  -5.125  -1.600  -7.701
  814   1HB   ALA  55          1HB       ALA  55  -3.507  -0.344  -8.665
  815   2HB   ALA  55          2HB       ALA  55  -3.477   0.546  -7.124
  816   3HB   ALA  55          3HB       ALA  55  -2.311  -0.767  -7.416
  817    H    GLU  56           H        GLU  56  -2.107  -1.826  -5.691
  818    HA   GLU  56           HA       GLU  56  -2.484  -4.707  -5.726
  819   1HB   GLU  56          1HB       GLU  56  -0.150  -3.137  -6.787
  820   2HB   GLU  56          2HB       GLU  56   0.166  -4.708  -6.031
  821   1HG   GLU  56          1HG       GLU  56  -0.170  -5.338  -8.246
  822   2HG   GLU  56          2HG       GLU  56  -1.813  -5.515  -7.614
  823    H    CYS  57           H        CYS  57  -2.506  -2.127  -3.845
  824    HA   CYS  57           HA       CYS  57  -0.478  -2.869  -1.948
  825   1HB   CYS  57          1HB       CYS  57  -1.731  -0.514  -2.588
  826   2HB   CYS  57          2HB       CYS  57  -2.520  -0.959  -1.072
  827    H    THR  58           H        THR  58  -4.109  -2.537  -1.975
  828    HA   THR  58           HA       THR  58  -4.630  -3.721   0.442
  829    HB   THR  58           HB       THR  58  -6.206  -2.521  -1.193
  830    HG1  THR  58           HG1      THR  58  -7.694  -3.555   0.087
  831   1HG2  THR  58          1HG2      THR  58  -6.696  -5.315  -2.292
  832   2HG2  THR  58          2HG2      THR  58  -7.281  -3.756  -2.923
  833   3HG2  THR  58          3HG2      THR  58  -5.572  -4.213  -3.123
  834    H    PHE  59           H        PHE  59  -3.955  -5.301  -2.712
  835    HA   PHE  59           HA       PHE  59  -4.599  -7.883  -1.845
  836   1HB   PHE  59          1HB       PHE  59  -3.038  -6.484  -4.014
  837   2HB   PHE  59          2HB       PHE  59  -2.675  -8.201  -3.798
  838    HD1  PHE  59           HD1      PHE  59  -5.664  -5.968  -4.067
  839    HD2  PHE  59           HD2      PHE  59  -3.870  -9.671  -5.100
  840    HE1  PHE  59           HE1      PHE  59  -7.668  -6.550  -5.461
  841    HE2  PHE  59           HE2      PHE  59  -5.874 -10.253  -6.494
  842    HZ   PHE  59           HZ       PHE  59  -7.749  -8.685  -6.658
  Start of MODEL   34
    1   1H    GLU   1           H1       GLU   1 -16.028  -1.251  -0.789
    2    HA   GLU   1           HA       GLU   1 -14.079  -1.884   0.374
    3   1HB   GLU   1          1HB       GLU   1 -14.797  -1.080   2.772
    4   2HB   GLU   1          2HB       GLU   1 -14.893   0.047   1.409
    5   1HG   GLU   1          1HG       GLU   1 -17.342  -1.466   1.533
    6   2HG   GLU   1          2HG       GLU   1 -17.001  -0.838   3.152
    7    H    GLU   2           H        GLU   2 -15.577  -4.380  -0.097
    8    HA   GLU   2           HA       GLU   2 -15.643  -5.617   2.499
    9   1HB   GLU   2          1HB       GLU   2 -16.436  -6.436  -0.293
   10   2HB   GLU   2          2HB       GLU   2 -16.248  -7.674   0.959
   11   1HG   GLU   2          1HG       GLU   2 -17.964  -5.188   1.319
   12   2HG   GLU   2          2HG       GLU   2 -18.610  -6.701   0.664
   13    H    TYR   3           H        TYR   3 -13.144  -4.910   2.442
   14    HA   TYR   3           HA       TYR   3 -11.542  -6.878   1.021
   15   1HB   TYR   3          1HB       TYR   3  -9.850  -5.322   2.534
   16   2HB   TYR   3          2HB       TYR   3 -10.462  -4.782   0.967
   17    HD1  TYR   3           HD1      TYR   3 -11.021  -4.570   4.641
   18    HD2  TYR   3           HD2      TYR   3 -11.870  -2.875   0.806
   19    HE1  TYR   3           HE1      TYR   3 -12.077  -2.546   5.760
   20    HE2  TYR   3           HE2      TYR   3 -12.922  -0.857   1.938
   21    HH   TYR   3           HH       TYR   3 -12.432  -0.099   5.085
   22    H    VAL   4           H        VAL   4 -11.637  -8.870   2.024
   23    HA   VAL   4           HA       VAL   4 -11.083  -8.859   4.910
   24    HB   VAL   4           HB       VAL   4 -12.209 -11.023   4.971
   25   1HG1  VAL   4          1HG1      VAL   4 -14.396  -9.656   3.674
   26   2HG1  VAL   4          2HG1      VAL   4 -14.098  -9.921   5.409
   27   3HG1  VAL   4          3HG1      VAL   4 -13.412  -8.494   4.596
   28   1HG2  VAL   4          1HG2      VAL   4 -11.787 -11.889   2.773
   29   2HG2  VAL   4          2HG2      VAL   4 -13.550 -11.752   2.973
   30   3HG2  VAL   4          3HG2      VAL   4 -12.668 -10.542   2.010
   31    H    GLY   5           H        GLY   5 -10.544 -10.667   1.808
   32   1HA   GLY   5          1HA       GLY   5  -8.404 -12.220   2.855
   33   2HA   GLY   5          2HA       GLY   5  -8.859 -12.026   1.174
   34    H    LEU   6           H        LEU   6  -8.566  -8.912   2.437
   35    HA   LEU   6           HA       LEU   6  -5.692  -8.804   1.884
   36   1HB   LEU   6          1HB       LEU   6  -7.161  -6.489   0.927
   37   2HB   LEU   6          2HB       LEU   6  -5.879  -7.435   0.149
   38    HG   LEU   6           HG       LEU   6  -7.883  -7.447  -1.203
   39   1HD1  LEU   6          1HD1      LEU   6  -6.526  -9.754  -0.302
   40   2HD1  LEU   6          2HD1      LEU   6  -8.248 -10.189  -0.429
   41   3HD1  LEU   6          3HD1      LEU   6  -7.394  -9.513  -1.838
   42   1HD2  LEU   6          1HD2      LEU   6  -9.244  -7.509   1.251
   43   2HD2  LEU   6          2HD2      LEU   6  -9.945  -7.495  -0.385
   44   3HD2  LEU   6          3HD2      LEU   6  -9.641  -9.043   0.440
   45    H    SER   7           H        SER   7  -7.773  -8.705   4.256
   46    HA   SER   7           HA       SER   7  -6.912  -6.117   5.268
   47   1HB   SER   7          1HB       SER   7  -8.715  -6.515   7.008
   48   2HB   SER   7          2HB       SER   7  -9.307  -6.324   5.347
   49    HG   SER   7           HG       SER   7 -10.040  -8.226   6.881
   50    H    ALA   8           H        ALA   8  -7.177  -6.586   8.040
   51    HA   ALA   8           HA       ALA   8  -4.734  -7.741   8.657
   52   1HB   ALA   8          1HB       ALA   8  -6.465  -6.142   9.940
   53   2HB   ALA   8          2HB       ALA   8  -6.923  -7.685  10.702
   54   3HB   ALA   8          3HB       ALA   8  -5.244  -7.103  10.810
   55    H    ASN   9           H        ASN   9  -4.628  -9.798   7.563
   56    HA   ASN   9           HA       ASN   9  -5.047 -11.942   9.111
   57   1HB   ASN   9          1HB       ASN   9  -7.569 -11.097   8.197
   58   2HB   ASN   9          2HB       ASN   9  -7.161 -12.429   7.104
   59   1HD2  ASN   9          1HD2      ASN   9  -5.942 -14.260   8.427
   60   2HD2  ASN   9          2HD2      ASN   9  -6.801 -14.840   9.815
   61    H    GLN  10           H        GLN  10  -5.179 -10.481   5.853
   62    HA   GLN  10           HA       GLN  10  -4.556 -12.765   4.400
   63   1HB   GLN  10          1HB       GLN  10  -5.466 -10.638   3.466
   64   2HB   GLN  10          2HB       GLN  10  -3.894  -9.863   3.731
   65   1HG   GLN  10          1HG       GLN  10  -2.874 -11.685   2.278
   66   2HG   GLN  10          2HG       GLN  10  -4.518 -12.216   1.889
   67   1HE2  GLN  10          1HE2      GLN  10  -3.056  -9.005   2.351
   68   2HE2  GLN  10          2HE2      GLN  10  -3.457  -8.352   0.798
   69    H    CYS  11           H        CYS  11  -2.580 -10.405   6.208
   70    HA   CYS  11           HA       CYS  11  -0.118 -11.060   5.084
   71   1HB   CYS  11          1HB       CYS  11  -0.432  -9.059   6.369
   72   2HB   CYS  11          2HB       CYS  11  -0.825  -9.986   7.819
   73    H    ALA  12           H        ALA  12  -2.333 -12.998   6.726
   74    HA   ALA  12           HA       ALA  12  -0.247 -14.619   7.994
   75   1HB   ALA  12          1HB       ALA  12  -1.764 -14.984   9.614
   76   2HB   ALA  12          2HB       ALA  12  -2.795 -13.763   8.831
   77   3HB   ALA  12          3HB       ALA  12  -2.993 -15.486   8.429
   78    H    VAL  13           H        VAL  13  -1.037 -14.294   4.997
   79    HA   VAL  13           HA       VAL  13  -2.405 -16.397   4.006
   80    HB   VAL  13           HB       VAL  13  -0.409 -16.278   2.224
   81   1HG1  VAL  13          1HG1      VAL  13  -1.598 -14.213   1.300
   82   2HG1  VAL  13          2HG1      VAL  13  -2.608 -15.641   1.625
   83   3HG1  VAL  13          3HG1      VAL  13  -2.611 -14.271   2.762
   84   1HG2  VAL  13          1HG2      VAL  13  -0.211 -13.543   3.485
   85   2HG2  VAL  13          2HG2      VAL  13   0.895 -14.858   3.948
   86   3HG2  VAL  13          3HG2      VAL  13   0.839 -14.295   2.261
   87    HA   PRO  14           HA       PRO  14  -0.195 -20.024   4.807
   88   1HB   PRO  14          1HB       PRO  14  -0.377 -21.471   2.498
   89   2HB   PRO  14          2HB       PRO  14  -1.693 -21.345   3.662
   90   1HG   PRO  14          1HG       PRO  14  -1.334 -20.012   1.054
   91   2HG   PRO  14          2HG       PRO  14  -2.852 -20.258   1.990
   92   1HD   PRO  14          1HD       PRO  14  -1.318 -17.860   1.682
   93   2HD   PRO  14          2HD       PRO  14  -2.716 -18.089   2.741
   94    H    ALA  15           H        ALA  15   1.121 -17.734   2.964
   95    HA   ALA  15           HA       ALA  15   3.309 -17.306   2.684
   96   1HB   ALA  15          1HB       ALA  15   3.584 -19.259   4.452
   97   2HB   ALA  15          2HB       ALA  15   4.116 -20.184   3.027
   98   3HB   ALA  15          3HB       ALA  15   4.979 -18.700   3.497
   99    H    LYS  16           H        LYS  16   1.513 -17.623   0.626
  100    HA   LYS  16           HA       LYS  16   3.129 -18.025  -1.554
  101   1HB   LYS  16          1HB       LYS  16   1.751 -20.229  -2.277
  102   2HB   LYS  16          2HB       LYS  16   3.375 -20.264  -1.569
  103   1HG   LYS  16          1HG       LYS  16   2.614 -21.063   0.447
  104   2HG   LYS  16          2HG       LYS  16   1.081 -20.177   0.356
  105   1HD   LYS  16          1HD       LYS  16   0.435 -22.426   0.108
  106   2HD   LYS  16          2HD       LYS  16   0.493 -21.852  -1.568
  107   1HE   LYS  16          1HE       LYS  16   3.006 -22.695  -1.433
  108   2HE   LYS  16          2HE       LYS  16   2.400 -23.681  -0.095
  109   1HZ   LYS  16          1HZ       LYS  16   2.294 -24.473  -2.561
  110   2HZ   LYS  16          2HZ       LYS  16   1.123 -24.875  -1.496
  111   3HZ   LYS  16          3HZ       LYS  16   0.880 -23.657  -2.556
  112    H    ASP  17           H        ASP  17   1.300 -16.116  -0.653
  113    HA   ASP  17           HA       ASP  17  -0.538 -16.220  -2.859
  114   1HB   ASP  17          1HB       ASP  17  -1.829 -17.186  -0.987
  115   2HB   ASP  17          2HB       ASP  17  -1.438 -15.790   0.030
  116    H    ARG  18           H        ARG  18   1.904 -14.738  -1.404
  117    HA   ARG  18           HA       ARG  18   0.742 -12.121  -1.147
  118   1HB   ARG  18          1HB       ARG  18   3.677 -12.892  -0.890
  119   2HB   ARG  18          2HB       ARG  18   2.886 -11.456  -0.216
  120   1HG   ARG  18          1HG       ARG  18   2.142 -12.593   1.603
  121   2HG   ARG  18          2HG       ARG  18   1.650 -14.003   0.647
  122   1HD   ARG  18          1HD       ARG  18   4.008 -14.760   0.556
  123   2HD   ARG  18          2HD       ARG  18   4.517 -13.337   1.479
  124    HE   ARG  18           HE       ARG  18   2.448 -15.032   2.740
  125   1HH1  ARG  18          1HH1      ARG  18   5.869 -14.244   2.486
  126   2HH1  ARG  18          2HH1      ARG  18   6.279 -14.967   4.006
  127   1HH2  ARG  18          1HH2      ARG  18   2.990 -15.987   4.744
  128   2HH2  ARG  18          2HH2      ARG  18   4.631 -15.967   5.298
  129    H    VAL  19           H        VAL  19   2.593 -10.349  -2.071
  130    HA   VAL  19           HA       VAL  19   2.869 -11.079  -4.904
  131    HB   VAL  19           HB       VAL  19   2.697  -8.271  -3.850
  132   1HG1  VAL  19          1HG1      VAL  19   2.700  -9.610  -6.467
  133   2HG1  VAL  19          2HG1      VAL  19   1.402  -8.406  -6.279
  134   3HG1  VAL  19          3HG1      VAL  19   3.101  -7.931  -6.035
  135   1HG2  VAL  19          1HG2      VAL  19   0.534 -10.285  -3.948
  136   2HG2  VAL  19          2HG2      VAL  19   0.653  -8.765  -3.028
  137   3HG2  VAL  19          3HG2      VAL  19   0.159  -8.734  -4.737
  138    H    ASP  20           H        ASP  20   4.709 -11.527  -2.492
  139    HA   ASP  20           HA       ASP  20   6.756 -11.031  -1.815
  140   1HB   ASP  20          1HB       ASP  20   7.497 -12.611  -3.321
  141   2HB   ASP  20          2HB       ASP  20   6.808 -11.767  -4.718
  142    H    CYS  21           H        CYS  21   6.653  -8.772  -1.158
  143    HA   CYS  21           HA       CYS  21   6.579  -6.600  -2.788
  144   1HB   CYS  21          1HB       CYS  21   6.615  -6.922  -0.163
  145   2HB   CYS  21          2HB       CYS  21   8.310  -6.467  -0.360
  146    H    GLY  22           H        GLY  22   9.289  -8.771  -1.947
  147   1HA   GLY  22          1HA       GLY  22  11.395  -8.933  -2.711
  148   2HA   GLY  22          2HA       GLY  22  10.812  -8.186  -4.185
  149    H    TYR  23           H        TYR  23  11.276  -7.030  -0.762
  150    HA   TYR  23           HA       TYR  23  12.365  -4.554  -1.805
  151   1HB   TYR  23          1HB       TYR  23  10.778  -5.396   0.349
  152   2HB   TYR  23          2HB       TYR  23  12.356  -5.224   1.123
  153    HD1  TYR  23           HD1      TYR  23  10.785  -3.183  -1.598
  154    HD2  TYR  23           HD2      TYR  23  12.185  -3.301   2.443
  155    HE1  TYR  23           HE1      TYR  23  10.396  -0.681  -1.383
  156    HE2  TYR  23           HE2      TYR  23  11.791  -0.797   2.644
  157    HH   TYR  23           HH       TYR  23  11.654   1.191   0.385
  158    HA   PRO  24           HA       PRO  24  16.469  -5.812  -1.163
  159   1HB   PRO  24          1HB       PRO  24  17.703  -3.393  -1.464
  160   2HB   PRO  24          2HB       PRO  24  17.228  -4.409  -2.823
  161   1HG   PRO  24          1HG       PRO  24  15.970  -1.967  -1.749
  162   2HG   PRO  24          2HG       PRO  24  15.778  -2.704  -3.380
  163   1HD   PRO  24          1HD       PRO  24  13.948  -2.753  -1.176
  164   2HD   PRO  24          2HD       PRO  24  13.783  -3.628  -2.705
  165    H    HIS  25           H        HIS  25  14.666  -4.038   0.942
  166    HA   HIS  25           HA       HIS  25  16.805  -4.304   2.918
  167   1HB   HIS  25          1HB       HIS  25  14.844  -2.007   2.795
  168   2HB   HIS  25          2HB       HIS  25  16.163  -2.217   3.951
  169    HD1  HIS  25           HD1      HIS  25  18.666  -2.335   2.678
  170    HD2  HIS  25           HD2      HIS  25  15.505  -0.429   0.686
  171    HE1  HIS  25           HE1      HIS  25  19.735  -0.843   0.904
  172    HE2  HIS  25           HE2      HIS  25  17.742   0.260  -0.323
  173    H    VAL  26           H        VAL  26  14.829  -6.264   2.266
  174    HA   VAL  26           HA       VAL  26  12.504  -6.081   3.759
  175    HB   VAL  26           HB       VAL  26  12.619  -7.757   2.160
  176   1HG1  VAL  26          1HG1      VAL  26  15.345  -8.278   3.279
  177   2HG1  VAL  26          2HG1      VAL  26  14.475  -9.632   2.517
  178   3HG1  VAL  26          3HG1      VAL  26  14.804  -8.151   1.587
  179   1HG2  VAL  26          1HG2      VAL  26  11.835  -8.408   4.624
  180   2HG2  VAL  26          2HG2      VAL  26  11.844  -9.590   3.292
  181   3HG2  VAL  26          3HG2      VAL  26  13.177  -9.568   4.471
  182    H    THR  27           H        THR  27  12.113  -6.009   5.911
  183    HA   THR  27           HA       THR  27  13.602  -7.548   7.761
  184    HB   THR  27           HB       THR  27  14.647  -4.917   7.044
  185    HG1  THR  27           HG1      THR  27  15.369  -6.689   9.242
  186   1HG2  THR  27          1HG2      THR  27  13.508  -5.304   9.832
  187   2HG2  THR  27          2HG2      THR  27  15.057  -4.452   9.629
  188   3HG2  THR  27          3HG2      THR  27  13.584  -3.818   8.856
  189    HA   PRO  28           HA       PRO  28   9.965  -6.826   9.919
  190   1HB   PRO  28          1HB       PRO  28  10.673  -7.639  12.429
  191   2HB   PRO  28          2HB       PRO  28  10.228  -8.758  11.143
  192   1HG   PRO  28          1HG       PRO  28  12.886  -8.070  12.221
  193   2HG   PRO  28          2HG       PRO  28  12.398  -9.524  11.278
  194   1HD   PRO  28          1HD       PRO  28  13.880  -7.242  10.389
  195   2HD   PRO  28          2HD       PRO  28  13.287  -8.571   9.385
  196    H    LYS  29           H        LYS  29  10.920  -4.453   9.339
  197    HA   LYS  29           HA       LYS  29   9.949  -2.875  11.382
  198   1HB   LYS  29          1HB       LYS  29  11.850  -3.581  12.703
  199   2HB   LYS  29          2HB       LYS  29  12.975  -3.080  11.429
  200   1HG   LYS  29          1HG       LYS  29  12.811  -0.881  11.997
  201   2HG   LYS  29          2HG       LYS  29  11.064  -0.969  12.272
  202   1HD   LYS  29          1HD       LYS  29  11.435  -1.982  14.472
  203   2HD   LYS  29          2HD       LYS  29  13.183  -2.043  14.193
  204   1HE   LYS  29          1HE       LYS  29  13.452   0.202  14.601
  205   2HE   LYS  29          2HE       LYS  29  11.893   0.640  13.886
  206   1HZ   LYS  29          1HZ       LYS  29  12.104  -0.782  16.437
  207   2HZ   LYS  29          2HZ       LYS  29  12.113   0.848  16.352
  208   3HZ   LYS  29          3HZ       LYS  29  10.811   0.010  15.833
  209    H    GLU  30           H        GLU  30  11.833  -3.466   8.485
  210    HA   GLU  30           HA       GLU  30  11.628  -0.668   7.764
  211   1HB   GLU  30          1HB       GLU  30  13.451  -2.838   7.155
  212   2HB   GLU  30          2HB       GLU  30  12.831  -2.138   5.650
  213   1HG   GLU  30          1HG       GLU  30  14.491  -0.610   5.964
  214   2HG   GLU  30          2HG       GLU  30  13.361   0.135   7.104
  215    H    CYS  31           H        CYS  31  10.650  -3.974   6.678
  216    HA   CYS  31           HA       CYS  31   9.308  -3.139   4.386
  217   1HB   CYS  31          1HB       CYS  31   9.309  -5.578   6.091
  218   2HB   CYS  31          2HB       CYS  31   7.989  -5.378   4.936
  219    H    ASN  32           H        ASN  32   8.094  -4.007   7.711
  220    HA   ASN  32           HA       ASN  32   5.481  -3.274   7.203
  221   1HB   ASN  32          1HB       ASN  32   7.168  -3.911   9.553
  222   2HB   ASN  32          2HB       ASN  32   5.838  -2.810   9.941
  223   1HD2  ASN  32          1HD2      ASN  32   6.456  -5.697   7.941
  224   2HD2  ASN  32          2HD2      ASN  32   5.034  -6.580   8.385
  225    H    ASN  33           H        ASN  33   8.282  -1.372   7.274
  226    HA   ASN  33           HA       ASN  33   6.877   0.927   8.360
  227   1HB   ASN  33          1HB       ASN  33   9.042   0.609   9.391
  228   2HB   ASN  33          2HB       ASN  33   9.832   0.355   7.827
  229   1HD2  ASN  33          1HD2      ASN  33  10.855   1.999   6.988
  230   2HD2  ASN  33          2HD2      ASN  33  10.617   3.678   7.342
  231    H    ARG  34           H        ARG  34   8.224  -0.603   5.478
  232    HA   ARG  34           HA       ARG  34   8.244   1.850   4.001
  233   1HB   ARG  34          1HB       ARG  34   9.444   0.689   2.404
  234   2HB   ARG  34          2HB       ARG  34   9.769  -0.377   3.781
  235   1HG   ARG  34          1HG       ARG  34   9.045  -1.941   2.246
  236   2HG   ARG  34          2HG       ARG  34   7.479  -1.518   2.960
  237   1HD   ARG  34          1HD       ARG  34   7.709   0.398   1.003
  238   2HD   ARG  34          2HD       ARG  34   8.559  -0.953   0.239
  239    HE   ARG  34           HE       ARG  34   5.980  -1.662   1.459
  240   1HH1  ARG  34          1HH1      ARG  34   7.613  -0.567  -1.459
  241   2HH1  ARG  34          2HH1      ARG  34   6.354  -1.107  -2.519
  242   1HH2  ARG  34          1HH2      ARG  34   4.320  -2.375   0.061
  243   2HH2  ARG  34          2HH2      ARG  34   4.468  -2.143  -1.649
  244    H    GLY  35           H        GLY  35   6.165  -0.947   4.616
  245   1HA   GLY  35          1HA       GLY  35   3.783  -0.399   4.158
  246   2HA   GLY  35          2HA       GLY  35   4.291  -0.008   2.527
  247    H    CYS  36           H        CYS  36   5.937  -2.640   4.220
  248    HA   CYS  36           HA       CYS  36   4.405  -4.530   2.583
  249   1HB   CYS  36          1HB       CYS  36   7.350  -4.535   3.240
  250   2HB   CYS  36          2HB       CYS  36   6.498  -5.899   2.511
  251    H    CYS  37           H        CYS  37   4.990  -6.918   3.618
  252    HA   CYS  37           HA       CYS  37   4.674  -6.603   6.514
  253   1HB   CYS  37          1HB       CYS  37   2.566  -7.193   5.286
  254   2HB   CYS  37          2HB       CYS  37   3.323  -8.725   4.842
  255    H    PHE  38           H        PHE  38   6.181  -7.764   7.691
  256    HA   PHE  38           HA       PHE  38   8.040  -9.386   6.185
  257   1HB   PHE  38          1HB       PHE  38   8.548  -7.596   7.997
  258   2HB   PHE  38          2HB       PHE  38   7.876  -8.719   9.181
  259    HD1  PHE  38           HD1      PHE  38  10.606  -8.229   6.738
  260    HD2  PHE  38           HD2      PHE  38   9.177 -10.512  10.016
  261    HE1  PHE  38           HE1      PHE  38  12.857  -9.317   6.962
  262    HE2  PHE  38           HE2      PHE  38  11.428 -11.598  10.242
  263    HZ   PHE  38           HZ       PHE  38  13.242 -10.988   8.712
  264    H    ASP  39           H        ASP  39   7.973 -11.581   6.072
  265    HA   ASP  39           HA       ASP  39   5.922 -12.922   7.493
  266   1HB   ASP  39          1HB       ASP  39   6.443 -13.641   5.249
  267   2HB   ASP  39          2HB       ASP  39   8.159 -13.839   5.637
  268    H    SER  40           H        SER  40   9.236 -14.256   7.035
  269    HA   SER  40           HA       SER  40  10.856 -14.669   8.489
  270   1HB   SER  40          1HB       SER  40   9.805 -12.776   9.942
  271   2HB   SER  40          2HB       SER  40   9.086 -14.095  10.883
  272    HG   SER  40           HG       SER  40  11.194 -13.290  11.677
  273    H    ARG  41           H        ARG  41   7.528 -15.758   8.759
  274    HA   ARG  41           HA       ARG  41   8.049 -17.969  10.401
  275   1HB   ARG  41          1HB       ARG  41   5.801 -17.692   8.362
  276   2HB   ARG  41          2HB       ARG  41   5.778 -18.657   9.848
  277   1HG   ARG  41          1HG       ARG  41   6.331 -16.204  10.887
  278   2HG   ARG  41          2HG       ARG  41   5.403 -15.712   9.459
  279   1HD   ARG  41          1HD       ARG  41   3.833 -15.980  11.264
  280   2HD   ARG  41          2HD       ARG  41   3.604 -17.377  10.201
  281    HE   ARG  41           HE       ARG  41   5.546 -17.869  12.325
  282   1HH1  ARG  41          1HH1      ARG  41   2.113 -17.837  11.554
  283   2HH1  ARG  41          2HH1      ARG  41   1.691 -18.958  12.806
  284   1HH2  ARG  41          1HH2      ARG  41   4.991 -19.348  13.975
  285   2HH2  ARG  41          2HH2      ARG  41   3.339 -19.824  14.192
  286    H    ILE  42           H        ILE  42   7.804 -17.431   6.834
  287    HA   ILE  42           HA       ILE  42   8.978 -20.102   6.476
  288    HB   ILE  42           HB       ILE  42   7.307 -18.801   4.366
  289   1HG1  ILE  42          1HG1      ILE  42   6.348 -19.735   6.980
  290   2HG1  ILE  42          2HG1      ILE  42   5.565 -18.690   5.781
  291   1HG2  ILE  42          1HG2      ILE  42   8.749 -20.922   4.101
  292   2HG2  ILE  42          2HG2      ILE  42   7.488 -21.724   5.068
  293   3HG2  ILE  42          3HG2      ILE  42   7.068 -20.958   3.518
  294   1HD1  ILE  42          1HD1      ILE  42   5.316 -20.917   4.397
  295   2HD1  ILE  42          2HD1      ILE  42   5.603 -21.714   5.961
  296   3HD1  ILE  42          3HD1      ILE  42   4.213 -20.621   5.762
  297    HA   PRO  43           HA       PRO  43  12.111 -17.449   4.889
  298   1HB   PRO  43          1HB       PRO  43  14.147 -19.263   5.058
  299   2HB   PRO  43          2HB       PRO  43  13.699 -18.190   6.382
  300   1HG   PRO  43          1HG       PRO  43  13.151 -21.064   6.002
  301   2HG   PRO  43          2HG       PRO  43  13.126 -20.107   7.528
  302   1HD   PRO  43          1HD       PRO  43  10.909 -21.064   5.988
  303   2HD   PRO  43          2HD       PRO  43  10.834 -19.993   7.392
  304    H    GLY  44           H        GLY  44  10.572 -20.064   3.624
  305   1HA   GLY  44          1HA       GLY  44  12.238 -20.177   1.223
  306   2HA   GLY  44          2HA       GLY  44  10.893 -21.220   1.638
  307    H    VAL  45           H        VAL  45   9.771 -18.203   2.451
  308    HA   VAL  45           HA       VAL  45   8.772 -17.712  -0.270
  309    HB   VAL  45           HB       VAL  45   6.634 -17.434   0.496
  310   1HG1  VAL  45          1HG1      VAL  45   6.054 -19.317   1.936
  311   2HG1  VAL  45          2HG1      VAL  45   7.327 -19.788   0.786
  312   3HG1  VAL  45          3HG1      VAL  45   7.743 -19.446   2.482
  313   1HG2  VAL  45          1HG2      VAL  45   7.619 -17.101   3.349
  314   2HG2  VAL  45          2HG2      VAL  45   7.249 -15.759   2.239
  315   3HG2  VAL  45          3HG2      VAL  45   5.958 -16.874   2.749
  316    HA   PRO  46           HA       PRO  46   9.691 -13.517   0.377
  317   1HB   PRO  46          1HB       PRO  46   7.427 -12.056  -0.065
  318   2HB   PRO  46          2HB       PRO  46   8.403 -12.735  -1.365
  319   1HG   PRO  46          1HG       PRO  46   5.824 -13.641  -0.259
  320   2HG   PRO  46          2HG       PRO  46   6.559 -14.029  -1.856
  321   1HD   PRO  46          1HD       PRO  46   6.374 -15.687   0.471
  322   2HD   PRO  46          2HD       PRO  46   7.250 -16.058  -1.021
  323    H    TRP  47           H        TRP  47  10.454 -12.566   2.145
  324    HA   TRP  47           HA       TRP  47   8.650 -12.595   4.433
  325   1HB   TRP  47          1HB       TRP  47  11.345 -11.526   4.803
  326   2HB   TRP  47          2HB       TRP  47  10.463 -12.749   5.720
  327    HD1  TRP  47           HD1      TRP  47  10.594 -15.338   4.621
  328    HE1  TRP  47           HE1      TRP  47  12.495 -16.595   3.291
  329    HE3  TRP  47           HE3      TRP  47  13.124 -11.149   3.242
  330    HZ2  TRP  47           HZ2      TRP  47  14.792 -15.715   1.844
  331    HZ3  TRP  47           HZ3      TRP  47  15.186 -11.436   1.871
  332    HH2  TRP  47           HH2      TRP  47  16.028 -13.622   1.174
  333    H    CYS  48           H        CYS  48   8.242 -10.837   2.031
  334    HA   CYS  48           HA       CYS  48   7.809  -8.437   3.460
  335   1HB   CYS  48          1HB       CYS  48  10.233  -8.227   2.965
  336   2HB   CYS  48          2HB       CYS  48   9.856  -8.278   1.241
  337    H    PHE  49           H        PHE  49   5.668  -8.466   2.753
  338    HA   PHE  49           HA       PHE  49   5.310  -8.238  -0.139
  339   1HB   PHE  49          1HB       PHE  49   3.053  -9.590   0.699
  340   2HB   PHE  49          2HB       PHE  49   4.475 -10.418   0.057
  341    HD1  PHE  49           HD1      PHE  49   6.362 -10.755   1.997
  342    HD2  PHE  49           HD2      PHE  49   2.173 -10.470   2.612
  343    HE1  PHE  49           HE1      PHE  49   6.595 -11.999   4.164
  344    HE2  PHE  49           HE2      PHE  49   2.406 -11.716   4.779
  345    HZ   PHE  49           HZ       PHE  49   4.615 -12.465   5.530
  346    H    LYS  50           H        LYS  50   2.548  -7.951  -0.222
  347    HA   LYS  50           HA       LYS  50   2.074  -5.717   1.624
  348   1HB   LYS  50          1HB       LYS  50   0.812  -4.669  -0.296
  349   2HB   LYS  50          2HB       LYS  50   2.579  -4.677  -0.434
  350   1HG   LYS  50          1HG       LYS  50   1.438  -7.113  -1.553
  351   2HG   LYS  50          2HG       LYS  50   0.696  -5.688  -2.301
  352   1HD   LYS  50          1HD       LYS  50   3.649  -6.404  -2.148
  353   2HD   LYS  50          2HD       LYS  50   2.654  -6.255  -3.607
  354   1HE   LYS  50          1HE       LYS  50   2.432  -3.783  -2.210
  355   2HE   LYS  50          2HE       LYS  50   4.151  -4.208  -2.183
  356   1HZ   LYS  50          1HZ       LYS  50   2.708  -3.183  -4.278
  357   2HZ   LYS  50          2HZ       LYS  50   4.262  -3.686  -4.304
  358   3HZ   LYS  50          3HZ       LYS  50   3.062  -4.719  -4.707
  359    HA   PRO  51           HA       PRO  51  -1.226  -8.824   1.889
  360   1HB   PRO  51          1HB       PRO  51  -1.037  -9.352   4.563
  361   2HB   PRO  51          2HB       PRO  51  -0.259 -10.339   3.328
  362   1HG   PRO  51          1HG       PRO  51   0.894  -8.327   5.151
  363   2HG   PRO  51          2HG       PRO  51   1.734  -9.646   4.259
  364   1HD   PRO  51          1HD       PRO  51   1.704  -6.842   3.677
  365   2HD   PRO  51          2HD       PRO  51   2.413  -8.119   2.680
  366    H    LEU  52           H        LEU  52  -1.220  -7.630   5.117
  367    HA   LEU  52           HA       LEU  52  -3.694  -6.252   4.498
  368   1HB   LEU  52          1HB       LEU  52  -4.261  -6.559   6.633
  369   2HB   LEU  52          2HB       LEU  52  -3.074  -7.869   6.507
  370    HG   LEU  52           HG       LEU  52  -2.925  -5.258   7.964
  371   1HD1  LEU  52          1HD1      LEU  52  -1.560  -7.149   9.403
  372   2HD1  LEU  52          2HD1      LEU  52  -3.285  -6.750   9.591
  373   3HD1  LEU  52          3HD1      LEU  52  -2.795  -8.128   8.574
  374   1HD2  LEU  52          1HD2      LEU  52  -0.328  -6.259   8.075
  375   2HD2  LEU  52          2HD2      LEU  52  -0.762  -6.333   6.349
  376   3HD2  LEU  52          3HD2      LEU  52  -0.878  -4.791   7.232
  377    H    GLN  53           H        GLN  53  -1.031  -5.274   3.498
  378    HA   GLN  53           HA       GLN  53  -0.123  -3.186   5.032
  379   1HB   GLN  53          1HB       GLN  53  -0.173  -3.605   2.025
  380   2HB   GLN  53          2HB       GLN  53   0.701  -2.266   2.790
  381   1HG   GLN  53          1HG       GLN  53   1.159  -5.253   3.163
  382   2HG   GLN  53          2HG       GLN  53   2.271  -4.088   2.429
  383   1HE2  GLN  53          1HE2      GLN  53   1.344  -5.717   5.209
  384   2HE2  GLN  53          2HE2      GLN  53   2.242  -4.835   6.399
  385    H    GLU  54           H        GLU  54  -3.047  -3.524   3.102
  386    HA   GLU  54           HA       GLU  54  -3.668  -1.077   2.309
  387   1HB   GLU  54          1HB       GLU  54  -5.926  -1.711   2.390
  388   2HB   GLU  54          2HB       GLU  54  -5.079  -3.266   2.345
  389   1HG   GLU  54          1HG       GLU  54  -6.624  -3.588   4.072
  390   2HG   GLU  54          2HG       GLU  54  -5.183  -3.094   4.974
  391    H    ALA  55           H        ALA  55  -3.212  -2.113   5.641
  392    HA   ALA  55           HA       ALA  55  -4.694  -0.350   7.079
  393   1HB   ALA  55          1HB       ALA  55  -2.212  -0.409   8.368
  394   2HB   ALA  55          2HB       ALA  55  -3.540  -1.574   8.579
  395   3HB   ALA  55          3HB       ALA  55  -2.239  -1.909   7.410
  396    H    GLU  56           H        GLU  56  -1.199   0.409   6.907
  397    HA   GLU  56           HA       GLU  56  -1.980   3.167   6.487
  398   1HB   GLU  56          1HB       GLU  56   0.290   3.710   7.293
  399   2HB   GLU  56          2HB       GLU  56  -0.571   2.685   8.453
  400   1HG   GLU  56          1HG       GLU  56   0.820   1.004   6.566
  401   2HG   GLU  56          2HG       GLU  56   1.960   2.210   7.182
  402    H    CYS  57           H        CYS  57  -1.797   0.935   4.374
  403    HA   CYS  57           HA       CYS  57   0.304   2.124   2.725
  404   1HB   CYS  57          1HB       CYS  57   0.259  -0.375   3.229
  405   2HB   CYS  57          2HB       CYS  57  -1.141  -0.458   2.155
  406    H    THR  58           H        THR  58  -3.013   0.634   2.418
  407    HA   THR  58           HA       THR  58  -3.559   2.458   0.204
  408    HB   THR  58           HB       THR  58  -4.024  -0.231   0.567
  409    HG1  THR  58           HG1      THR  58  -5.772   0.360  -1.125
  410   1HG2  THR  58          1HG2      THR  58  -5.796   0.268   2.326
  411   2HG2  THR  58          2HG2      THR  58  -6.671   1.217   1.099
  412   3HG2  THR  58          3HG2      THR  58  -6.445  -0.535   0.876
  413    H    PHE  59           H        PHE  59  -3.747   2.536   3.545
  414    HA   PHE  59           HA       PHE  59  -6.092   3.245   4.425
  415   1HB   PHE  59          1HB       PHE  59  -3.473   3.753   5.091
  416   2HB   PHE  59          2HB       PHE  59  -3.982   5.397   4.682
  417    HD1  PHE  59           HD1      PHE  59  -4.052   6.480   6.743
  418    HD2  PHE  59           HD2      PHE  59  -5.923   2.692   6.346
  419    HE1  PHE  59           HE1      PHE  59  -5.041   6.728   9.037
  420    HE2  PHE  59           HE2      PHE  59  -6.912   2.940   8.640
  421    HZ   PHE  59           HZ       PHE  59  -6.459   4.955   9.958
  422   1H    GLU   1           H1       GLU   1 -23.964   2.722  -7.484
  423    HA   GLU   1           HA       GLU   1 -21.397   3.475  -7.730
  424   1HB   GLU   1          1HB       GLU   1 -23.595   3.977  -5.851
  425   2HB   GLU   1          2HB       GLU   1 -22.007   4.201  -5.099
  426   1HG   GLU   1          1HG       GLU   1 -21.705   5.425  -7.578
  427   2HG   GLU   1          2HG       GLU   1 -23.379   5.820  -7.160
  428    H    GLU   2           H        GLU   2 -20.401   1.192  -7.802
  429    HA   GLU   2           HA       GLU   2 -19.974   0.084  -5.179
  430   1HB   GLU   2          1HB       GLU   2 -20.463  -1.285  -7.284
  431   2HB   GLU   2          2HB       GLU   2 -18.812  -0.908  -7.810
  432   1HG   GLU   2          1HG       GLU   2 -18.118  -2.675  -6.593
  433   2HG   GLU   2          2HG       GLU   2 -18.552  -1.776  -5.130
  434    H    TYR   3           H        TYR   3 -17.252  -0.805  -6.786
  435    HA   TYR   3           HA       TYR   3 -15.632   1.041  -5.305
  436   1HB   TYR   3          1HB       TYR   3 -15.294  -1.327  -7.217
  437   2HB   TYR   3          2HB       TYR   3 -13.873  -0.438  -6.658
  438    HD1  TYR   3           HD1      TYR   3 -13.585  -0.243  -4.068
  439    HD2  TYR   3           HD2      TYR   3 -16.124  -3.111  -5.974
  440    HE1  TYR   3           HE1      TYR   3 -13.532  -1.689  -1.978
  441    HE2  TYR   3           HE2      TYR   3 -16.063  -4.547  -3.877
  442    HH   TYR   3           HH       TYR   3 -13.828  -4.015  -1.393
  443    H    VAL   4           H        VAL   4 -16.299   3.063  -6.402
  444    HA   VAL   4           HA       VAL   4 -14.875   3.344  -8.957
  445    HB   VAL   4           HB       VAL   4 -17.508   4.540  -8.078
  446   1HG1  VAL   4          1HG1      VAL   4 -16.789   5.138 -10.813
  447   2HG1  VAL   4          2HG1      VAL   4 -17.238   6.245  -9.493
  448   3HG1  VAL   4          3HG1      VAL   4 -15.541   5.748  -9.700
  449   1HG2  VAL   4          1HG2      VAL   4 -16.973   2.951 -10.590
  450   2HG2  VAL   4          2HG2      VAL   4 -17.359   2.151  -9.047
  451   3HG2  VAL   4          3HG2      VAL   4 -18.522   3.283  -9.778
  452    H    GLY   5           H        GLY   5 -16.291   5.209  -6.171
  453   1HA   GLY   5          1HA       GLY   5 -14.582   7.423  -6.459
  454   2HA   GLY   5          2HA       GLY   5 -15.505   6.982  -5.036
  455    H    LEU   6           H        LEU   6 -13.834   4.204  -5.595
  456    HA   LEU   6           HA       LEU   6 -11.347   5.130  -4.383
  457   1HB   LEU   6          1HB       LEU   6 -12.275   2.689  -3.152
  458   2HB   LEU   6          2HB       LEU   6 -11.659   4.180  -2.413
  459    HG   LEU   6           HG       LEU   6 -13.907   3.584  -1.628
  460   1HD1  LEU   6          1HD1      LEU   6 -14.738   5.962  -3.031
  461   2HD1  LEU   6          2HD1      LEU   6 -14.280   5.749  -1.323
  462   3HD1  LEU   6          3HD1      LEU   6 -13.031   6.095  -2.544
  463   1HD2  LEU   6          1HD2      LEU   6 -15.627   3.007  -2.935
  464   2HD2  LEU   6          2HD2      LEU   6 -15.313   4.321  -4.095
  465   3HD2  LEU   6          3HD2      LEU   6 -14.402   2.796  -4.211
  466    H    SER   7           H        SER   7 -12.114   4.292  -7.103
  467    HA   SER   7           HA       SER   7 -10.948   1.646  -7.227
  468   1HB   SER   7          1HB       SER   7 -13.076   2.605  -8.530
  469   2HB   SER   7          2HB       SER   7 -11.840   3.135  -9.684
  470    HG   SER   7           HG       SER   7 -12.056   1.133 -10.434
  471    H    ALA   8           H        ALA   8  -9.960   2.069 -10.016
  472    HA   ALA   8           HA       ALA   8  -7.375   3.060  -9.326
  473   1HB   ALA   8          1HB       ALA   8  -8.566   1.370 -11.291
  474   2HB   ALA   8          2HB       ALA   8  -7.751   2.692 -12.160
  475   3HB   ALA   8          3HB       ALA   8  -6.836   1.682 -11.015
  476    H    ASN   9           H        ASN   9 -10.152   4.718  -9.705
  477    HA   ASN   9           HA       ASN   9  -8.963   6.745 -11.411
  478   1HB   ASN   9          1HB       ASN   9 -11.454   5.728 -11.549
  479   2HB   ASN   9          2HB       ASN   9 -11.778   6.973 -10.335
  480   1HD2  ASN   9          1HD2      ASN   9 -10.895   9.166 -10.858
  481   2HD2  ASN   9          2HD2      ASN   9 -11.059   9.745 -12.482
  482    H    GLN  10           H        GLN  10  -9.363   5.817  -8.156
  483    HA   GLN  10           HA       GLN  10 -10.032   8.271  -6.996
  484   1HB   GLN  10          1HB       GLN  10 -10.293   6.115  -5.842
  485   2HB   GLN  10          2HB       GLN  10  -8.535   5.883  -5.831
  486   1HG   GLN  10          1HG       GLN  10  -8.200   7.595  -4.256
  487   2HG   GLN  10          2HG       GLN  10  -9.742   8.384  -4.622
  488   1HE2  GLN  10          1HE2      GLN  10  -8.198   5.569  -3.169
  489   2HE2  GLN  10          2HE2      GLN  10  -9.457   5.158  -2.052
  490    H    CYS  11           H        CYS  11  -7.000   6.812  -8.143
  491    HA   CYS  11           HA       CYS  11  -5.221   8.401  -6.727
  492   1HB   CYS  11          1HB       CYS  11  -5.129   6.783  -9.215
  493   2HB   CYS  11          2HB       CYS  11  -3.831   7.955  -8.965
  494    H    ALA  12           H        ALA  12  -7.627   9.222  -9.013
  495    HA   ALA  12           HA       ALA  12  -6.199  11.702  -9.697
  496   1HB   ALA  12          1HB       ALA  12  -8.396  10.268 -11.244
  497   2HB   ALA  12          2HB       ALA  12  -7.536  11.745 -11.746
  498   3HB   ALA  12          3HB       ALA  12  -6.659  10.199 -11.631
  499    H    VAL  13           H        VAL  13  -7.879  10.851  -7.269
  500    HA   VAL  13           HA       VAL  13 -10.402  11.764  -7.242
  501    HB   VAL  13           HB       VAL  13  -8.429  11.140  -5.394
  502   1HG1  VAL  13          1HG1      VAL  13  -7.801  13.472  -5.121
  503   2HG1  VAL  13          2HG1      VAL  13  -9.498  13.928  -4.835
  504   3HG1  VAL  13          3HG1      VAL  13  -8.641  12.904  -3.658
  505   1HG2  VAL  13          1HG2      VAL  13 -11.273  11.249  -5.579
  506   2HG2  VAL  13          2HG2      VAL  13 -10.267  10.299  -4.459
  507   3HG2  VAL  13          3HG2      VAL  13 -10.801  11.936  -4.007
  508    HA   PRO  14           HA       PRO  14 -10.413  16.026  -7.959
  509   1HB   PRO  14          1HB       PRO  14 -12.296  16.997  -6.236
  510   2HB   PRO  14          2HB       PRO  14 -12.701  16.180  -7.745
  511   1HG   PRO  14          1HG       PRO  14 -12.809  15.194  -4.966
  512   2HG   PRO  14          2HG       PRO  14 -13.656  14.553  -6.419
  513   1HD   PRO  14          1HD       PRO  14 -11.367  13.481  -5.073
  514   2HD   PRO  14          2HD       PRO  14 -12.067  12.901  -6.591
  515    H    ALA  15           H        ALA  15  -8.464  15.006  -5.969
  516    HA   ALA  15           HA       ALA  15  -7.079  15.796  -4.417
  517   1HB   ALA  15          1HB       ALA  15  -7.541  18.208  -6.202
  518   2HB   ALA  15          2HB       ALA  15  -6.317  18.195  -4.910
  519   3HB   ALA  15          3HB       ALA  15  -6.204  17.035  -6.255
  520    H    LYS  16           H        LYS  16  -8.950  15.394  -2.849
  521    HA   LYS  16           HA       LYS  16  -9.019  17.189  -0.876
  522   1HB   LYS  16          1HB       LYS  16 -11.388  18.213  -1.269
  523   2HB   LYS  16          2HB       LYS  16  -9.952  18.995  -1.954
  524   1HG   LYS  16          1HG       LYS  16 -10.790  18.750  -4.027
  525   2HG   LYS  16          2HG       LYS  16 -10.898  16.995  -3.814
  526   1HD   LYS  16          1HD       LYS  16 -12.979  18.939  -2.744
  527   2HD   LYS  16          2HD       LYS  16 -13.096  18.205  -4.353
  528   1HE   LYS  16          1HE       LYS  16 -12.607  16.008  -2.748
  529   2HE   LYS  16          2HE       LYS  16 -13.580  17.021  -1.671
  530   1HZ   LYS  16          1HZ       LYS  16 -15.356  16.648  -2.911
  531   2HZ   LYS  16          2HZ       LYS  16 -14.583  16.907  -4.326
  532   3HZ   LYS  16          3HZ       LYS  16 -14.525  15.435  -3.621
  533    H    ASP  17           H        ASP  17  -9.010  14.415  -1.269
  534    HA   ASP  17           HA       ASP  17 -11.135  13.735   0.465
  535   1HB   ASP  17          1HB       ASP  17 -12.124  13.633  -1.916
  536   2HB   ASP  17          2HB       ASP  17 -11.045  12.260  -2.199
  537    H    ARG  18           H        ARG  18  -8.042  13.680  -0.318
  538    HA   ARG  18           HA       ARG  18  -7.577  10.849  -0.164
  539   1HB   ARG  18          1HB       ARG  18  -5.554  13.133  -0.218
  540   2HB   ARG  18          2HB       ARG  18  -5.218  11.425  -0.551
  541   1HG   ARG  18          1HG       ARG  18  -6.123  11.527  -2.663
  542   2HG   ARG  18          2HG       ARG  18  -7.350  12.723  -2.210
  543   1HD   ARG  18          1HD       ARG  18  -5.794  14.523  -2.375
  544   2HD   ARG  18          2HD       ARG  18  -4.394  13.439  -2.353
  545    HE   ARG  18           HE       ARG  18  -6.104  12.857  -4.608
  546   1HH1  ARG  18          1HH1      ARG  18  -3.729  15.189  -3.464
  547   2HH1  ARG  18          2HH1      ARG  18  -3.228  15.652  -5.056
  548   1HH2  ARG  18          1HH2      ARG  18  -5.443  13.467  -6.709
  549   2HH2  ARG  18          2HH2      ARG  18  -4.209  14.665  -6.914
  550    H    VAL  19           H        VAL  19  -5.390  10.449   1.373
  551    HA   VAL  19           HA       VAL  19  -6.215  11.464   4.000
  552    HB   VAL  19           HB       VAL  19  -4.668   8.960   3.310
  553   1HG1  VAL  19          1HG1      VAL  19  -5.440  10.294   5.830
  554   2HG1  VAL  19          2HG1      VAL  19  -5.807   8.554   5.763
  555   3HG1  VAL  19          3HG1      VAL  19  -4.142   9.123   5.499
  556   1HG2  VAL  19          1HG2      VAL  19  -6.618   8.094   2.639
  557   2HG2  VAL  19          2HG2      VAL  19  -7.158   8.218   4.331
  558   3HG2  VAL  19          3HG2      VAL  19  -7.524   9.526   3.182
  559    H    ASP  20           H        ASP  20  -4.344  12.595   1.767
  560    HA   ASP  20           HA       ASP  20  -2.283  13.351   1.552
  561   1HB   ASP  20          1HB       ASP  20  -3.035  15.202   2.744
  562   2HB   ASP  20          2HB       ASP  20  -3.323  14.274   4.224
  563    H    CYS  21           H        CYS  21  -1.071  11.293   1.484
  564    HA   CYS  21           HA       CYS  21  -0.325   9.773   3.601
  565   1HB   CYS  21          1HB       CYS  21   0.080   9.528   1.047
  566   2HB   CYS  21          2HB       CYS  21   1.625  10.316   1.385
  567    H    GLY  22           H        GLY  22   1.001  12.891   2.426
  568   1HA   GLY  22          1HA       GLY  22   2.633  14.237   3.217
  569   2HA   GLY  22          2HA       GLY  22   1.922  13.865   4.775
  570    H    TYR  23           H        TYR  23   4.045  12.189   2.335
  571    HA   TYR  23           HA       TYR  23   5.504  10.962   4.527
  572   1HB   TYR  23          1HB       TYR  23   4.988  10.661   1.598
  573   2HB   TYR  23          2HB       TYR  23   6.662  10.312   2.036
  574    HD1  TYR  23           HD1      TYR  23   4.267   8.491   0.978
  575    HD2  TYR  23           HD2      TYR  23   6.098   9.121   4.793
  576    HE1  TYR  23           HE1      TYR  23   3.577   6.153   1.703
  577    HE2  TYR  23           HE2      TYR  23   5.402   6.782   5.506
  578    HH   TYR  23           HH       TYR  23   4.887   4.634   4.364
  579    HA   PRO  24           HA       PRO  24   8.827  13.722   4.254
  580   1HB   PRO  24          1HB       PRO  24  10.821  12.216   5.358
  581   2HB   PRO  24          2HB       PRO  24   9.621  13.080   6.317
  582   1HG   PRO  24          1HG       PRO  24   9.830  10.207   5.676
  583   2HG   PRO  24          2HG       PRO  24   8.918  10.996   7.014
  584   1HD   PRO  24          1HD       PRO  24   7.902   9.882   4.579
  585   2HD   PRO  24          2HD       PRO  24   6.984  10.788   5.789
  586    H    HIS  25           H        HIS  25   8.546  11.058   2.354
  587    HA   HIS  25           HA       HIS  25  10.879  11.952   0.826
  588   1HB   HIS  25          1HB       HIS  25  10.012   9.167   1.541
  589   2HB   HIS  25          2HB       HIS  25  10.918   9.463   0.052
  590    HD1  HIS  25           HD1      HIS  25  13.363   9.120   0.360
  591    HD2  HIS  25           HD2      HIS  25  11.525  10.501   3.870
  592    HE1  HIS  25           HE1      HIS  25  15.204   9.271   2.120
  593    HE2  HIS  25           HE2      HIS  25  14.026  10.176   4.237
  594    H    VAL  26           H        VAL  26   7.731  12.320   0.947
  595    HA   VAL  26           HA       VAL  26   6.422  11.187  -1.085
  596    HB   VAL  26           HB       VAL  26   5.294  12.743   0.221
  597   1HG1  VAL  26          1HG1      VAL  26   6.183  14.612   1.074
  598   2HG1  VAL  26          2HG1      VAL  26   7.702  14.144   0.272
  599   3HG1  VAL  26          3HG1      VAL  26   6.572  15.254  -0.540
  600   1HG2  VAL  26          1HG2      VAL  26   4.074  13.902  -1.332
  601   2HG2  VAL  26          2HG2      VAL  26   5.516  14.515  -2.177
  602   3HG2  VAL  26          3HG2      VAL  26   4.985  12.834  -2.426
  603    H    THR  27           H        THR  27   6.950  10.724  -3.151
  604    HA   THR  27           HA       THR  27   7.833  12.777  -4.910
  605    HB   THR  27           HB       THR  27   9.858  11.440  -3.407
  606    HG1  THR  27           HG1      THR  27  10.172  13.498  -4.333
  607   1HG2  THR  27          1HG2      THR  27   9.910   9.507  -4.867
  608   2HG2  THR  27          2HG2      THR  27   9.626  10.510  -6.309
  609   3HG2  THR  27          3HG2      THR  27  11.189  10.593  -5.460
  610    HA   PRO  28           HA       PRO  28   6.105  10.036  -7.718
  611   1HB   PRO  28          1HB       PRO  28   7.314  10.727 -10.069
  612   2HB   PRO  28          2HB       PRO  28   5.989  11.647  -9.360
  613   1HG   PRO  28          1HG       PRO  28   8.881  12.225  -9.414
  614   2HG   PRO  28          2HG       PRO  28   7.514  13.363  -9.134
  615   1HD   PRO  28          1HD       PRO  28   9.342  12.269  -7.220
  616   2HD   PRO  28          2HD       PRO  28   7.916  13.257  -6.873
  617    H    LYS  29           H        LYS  29   7.856   8.689  -6.161
  618    HA   LYS  29           HA       LYS  29   8.398   6.488  -7.757
  619   1HB   LYS  29          1HB       LYS  29  10.161   8.270  -8.536
  620   2HB   LYS  29          2HB       LYS  29  11.019   7.771  -7.067
  621   1HG   LYS  29          1HG       LYS  29  11.464   5.673  -7.890
  622   2HG   LYS  29          2HG       LYS  29   9.940   5.572  -8.787
  623   1HD   LYS  29          1HD       LYS  29  10.801   6.815 -10.605
  624   2HD   LYS  29          2HD       LYS  29  12.135   7.485  -9.651
  625   1HE   LYS  29          1HE       LYS  29  13.041   5.111  -9.464
  626   2HE   LYS  29          2HE       LYS  29  11.810   4.613 -10.635
  627   1HZ   LYS  29          1HZ       LYS  29  14.238   6.010 -11.055
  628   2HZ   LYS  29          2HZ       LYS  29  13.302   5.215 -12.130
  629   3HZ   LYS  29          3HZ       LYS  29  12.975   6.770 -11.756
  630    H    GLU  30           H        GLU  30   8.470   8.394  -4.883
  631    HA   GLU  30           HA       GLU  30   9.450   6.126  -3.357
  632   1HB   GLU  30          1HB       GLU  30   9.539   9.032  -3.048
  633   2HB   GLU  30          2HB       GLU  30   8.953   8.241  -1.574
  634   1HG   GLU  30          1HG       GLU  30  11.137   7.883  -1.099
  635   2HG   GLU  30          2HG       GLU  30  11.090   6.623  -2.342
  636    H    CYS  31           H        CYS  31   6.663   8.396  -3.702
  637    HA   CYS  31           HA       CYS  31   5.138   7.417  -1.622
  638   1HB   CYS  31          1HB       CYS  31   4.302   8.619  -4.261
  639   2HB   CYS  31          2HB       CYS  31   3.197   8.313  -2.918
  640    H    ASN  32           H        ASN  32   5.077   6.570  -5.166
  641    HA   ASN  32           HA       ASN  32   3.229   4.549  -4.914
  642   1HB   ASN  32          1HB       ASN  32   5.313   5.360  -6.910
  643   2HB   ASN  32          2HB       ASN  32   4.710   3.704  -7.061
  644   1HD2  ASN  32          1HD2      ASN  32   3.127   6.694  -5.978
  645   2HD2  ASN  32          2HD2      ASN  32   1.874   6.731  -7.173
  646    H    ASN  33           H        ASN  33   6.464   4.787  -3.771
  647    HA   ASN  33           HA       ASN  33   6.978   1.962  -4.005
  648   1HB   ASN  33          1HB       ASN  33   8.745   3.820  -4.309
  649   2HB   ASN  33          2HB       ASN  33   8.671   4.055  -2.556
  650   1HD2  ASN  33          1HD2      ASN  33  11.021   3.504  -3.083
  651   2HD2  ASN  33          2HD2      ASN  33  11.490   1.844  -2.924
  652    H    ARG  34           H        ARG  34   5.953   4.482  -1.713
  653    HA   ARG  34           HA       ARG  34   6.367   2.775   0.544
  654   1HB   ARG  34          1HB       ARG  34   4.898   5.445   0.429
  655   2HB   ARG  34          2HB       ARG  34   5.587   4.678   1.868
  656   1HG   ARG  34          1HG       ARG  34   7.663   4.895  -0.095
  657   2HG   ARG  34          2HG       ARG  34   6.852   6.468  -0.009
  658   1HD   ARG  34          1HD       ARG  34   7.683   6.891   2.066
  659   2HD   ARG  34          2HD       ARG  34   7.343   5.254   2.646
  660    HE   ARG  34           HE       ARG  34   9.563   5.319   0.767
  661   1HH1  ARG  34          1HH1      ARG  34   8.690   5.873   4.130
  662   2HH1  ARG  34          2HH1      ARG  34  10.289   5.578   4.727
  663   1HH2  ARG  34          1HH2      ARG  34  11.673   4.930   1.554
  664   2HH2  ARG  34          2HH2      ARG  34  11.998   5.038   3.252
  665    H    GLY  35           H        GLY  35   3.833   3.667  -1.739
  666   1HA   GLY  35          1HA       GLY  35   2.013   2.050  -1.888
  667   2HA   GLY  35          2HA       GLY  35   1.878   2.121  -0.143
  668    H    CYS  36           H        CYS  36   2.623   5.052  -2.015
  669    HA   CYS  36           HA       CYS  36  -0.132   5.934  -1.543
  670   1HB   CYS  36          1HB       CYS  36   2.413   7.536  -1.274
  671   2HB   CYS  36          2HB       CYS  36   0.785   8.219  -1.221
  672    H    CYS  37           H        CYS  37  -0.680   7.855  -3.093
  673    HA   CYS  37           HA       CYS  37   0.545   7.255  -5.686
  674   1HB   CYS  37          1HB       CYS  37  -2.043   6.922  -5.030
  675   2HB   CYS  37          2HB       CYS  37  -2.094   8.596  -5.592
  676    H    PHE  38           H        PHE  38   1.765   8.910  -6.533
  677    HA   PHE  38           HA       PHE  38   1.666  11.471  -5.202
  678   1HB   PHE  38          1HB       PHE  38   3.759  10.139  -5.911
  679   2HB   PHE  38          2HB       PHE  38   3.305  10.440  -7.593
  680    HD1  PHE  38           HD1      PHE  38   3.948  12.430  -8.650
  681    HD2  PHE  38           HD2      PHE  38   4.243  12.136  -4.427
  682    HE1  PHE  38           HE1      PHE  38   5.205  14.602  -8.587
  683    HE2  PHE  38           HE2      PHE  38   5.501  14.307  -4.363
  684    HZ   PHE  38           HZ       PHE  38   5.966  15.514  -6.444
  685    H    ASP  39           H        ASP  39   0.499  13.189  -5.915
  686    HA   ASP  39           HA       ASP  39  -0.758  12.936  -8.482
  687   1HB   ASP  39          1HB       ASP  39  -2.123  13.693  -6.621
  688   2HB   ASP  39          2HB       ASP  39  -0.971  14.980  -6.228
  689    H    SER  40           H        SER  40   0.476  15.915  -6.825
  690    HA   SER  40           HA       SER  40   2.114  17.297  -7.371
  691   1HB   SER  40          1HB       SER  40   3.037  15.180  -8.744
  692   2HB   SER  40          2HB       SER  40   2.595  16.201 -10.125
  693    HG   SER  40           HG       SER  40   3.911  17.913  -9.063
  694    H    ARG  41           H        ARG  41  -0.678  16.450  -9.188
  695    HA   ARG  41           HA       ARG  41  -0.596  18.424 -11.138
  696   1HB   ARG  41          1HB       ARG  41  -2.951  17.037  -9.779
  697   2HB   ARG  41          2HB       ARG  41  -3.107  18.035 -11.235
  698   1HG   ARG  41          1HG       ARG  41  -1.026  16.259 -11.840
  699   2HG   ARG  41          2HG       ARG  41  -2.181  15.257 -10.943
  700   1HD   ARG  41          1HD       ARG  41  -2.755  15.148 -13.295
  701   2HD   ARG  41          2HD       ARG  41  -3.999  16.119 -12.497
  702    HE   ARG  41           HE       ARG  41  -2.116  17.985 -13.324
  703   1HH1  ARG  41          1HH1      ARG  41  -3.952  15.462 -14.951
  704   2HH1  ARG  41          2HH1      ARG  41  -3.987  16.291 -16.472
  705   1HH2  ARG  41          1HH2      ARG  41  -2.162  19.079 -15.328
  706   2HH2  ARG  41          2HH2      ARG  41  -2.961  18.363 -16.687
  707    H    ILE  42           H        ILE  42  -1.854  18.315  -7.762
  708    HA   ILE  42           HA       ILE  42  -2.229  21.224  -7.933
  709    HB   ILE  42           HB       ILE  42  -3.832  19.588  -6.028
  710   1HG1  ILE  42          1HG1      ILE  42  -4.422  19.832  -8.984
  711   2HG1  ILE  42          2HG1      ILE  42  -4.154  18.338  -8.067
  712   1HG2  ILE  42          1HG2      ILE  42  -4.890  21.513  -5.708
  713   2HG2  ILE  42          2HG2      ILE  42  -3.661  22.291  -6.736
  714   3HG2  ILE  42          3HG2      ILE  42  -5.184  21.713  -7.453
  715   1HD1  ILE  42          1HD1      ILE  42  -6.584  19.990  -8.335
  716   2HD1  ILE  42          2HD1      ILE  42  -6.418  18.289  -7.836
  717   3HD1  ILE  42          3HD1      ILE  42  -6.197  19.592  -6.643
  718    HA   PRO  43           HA       PRO  43   0.850  20.853  -4.831
  719   1HB   PRO  43          1HB       PRO  43   1.627  23.471  -4.857
  720   2HB   PRO  43          2HB       PRO  43   2.309  22.253  -5.934
  721   1HG   PRO  43          1HG       PRO  43   0.331  24.374  -6.480
  722   2HG   PRO  43          2HG       PRO  43   1.362  23.471  -7.649
  723   1HD   PRO  43          1HD       PRO  43  -1.434  23.145  -7.121
  724   2HD   PRO  43          2HD       PRO  43  -0.431  22.127  -8.163
  725    H    GLY  44           H        GLY  44  -2.113  22.290  -4.791
  726   1HA   GLY  44          1HA       GLY  44  -1.792  23.462  -2.139
  727   2HA   GLY  44          2HA       GLY  44  -3.211  23.511  -3.167
  728    H    VAL  45           H        VAL  45  -2.354  20.365  -3.493
  729    HA   VAL  45           HA       VAL  45  -3.779  19.559  -1.051
  730    HB   VAL  45           HB       VAL  45  -5.119  18.119  -2.231
  731   1HG1  VAL  45          1HG1      VAL  45  -6.342  19.601  -3.379
  732   2HG1  VAL  45          2HG1      VAL  45  -5.013  20.756  -3.115
  733   3HG1  VAL  45          3HG1      VAL  45  -5.078  19.802  -4.616
  734   1HG2  VAL  45          1HG2      VAL  45  -3.312  18.295  -4.664
  735   2HG2  VAL  45          2HG2      VAL  45  -3.224  17.011  -3.434
  736   3HG2  VAL  45          3HG2      VAL  45  -4.694  17.200  -4.418
  737    HA   PRO  46           HA       PRO  46  -0.743  16.496  -0.555
  738   1HB   PRO  46          1HB       PRO  46  -2.002  14.084  -0.298
  739   2HB   PRO  46          2HB       PRO  46  -1.924  15.275   0.999
  740   1HG   PRO  46          1HG       PRO  46  -4.154  14.575  -0.803
  741   2HG   PRO  46          2HG       PRO  46  -4.217  15.412   0.791
  742   1HD   PRO  46          1HD       PRO  46  -4.499  16.541  -1.826
  743   2HD   PRO  46          2HD       PRO  46  -4.409  17.428  -0.298
  744    H    TRP  47           H        TRP  47   0.851  16.096  -1.940
  745    HA   TRP  47           HA       TRP  47   0.042  14.936  -4.478
  746   1HB   TRP  47          1HB       TRP  47   2.873  15.448  -4.139
  747   2HB   TRP  47          2HB       TRP  47   1.745  16.051  -5.353
  748    HD1  TRP  47           HD1      TRP  47   0.283  18.336  -4.519
  749    HE1  TRP  47           HE1      TRP  47   0.982  20.403  -3.036
  750    HE3  TRP  47           HE3      TRP  47   4.269  16.075  -2.315
  751    HZ2  TRP  47           HZ2      TRP  47   3.077  20.852  -1.150
  752    HZ3  TRP  47           HZ3      TRP  47   5.588  17.399  -0.664
  753    HH2  TRP  47           HH2      TRP  47   5.048  19.707  -0.071
  754    H    CYS  48           H        CYS  48  -0.081  13.414  -1.888
  755    HA   CYS  48           HA       CYS  48   1.110  11.054  -2.822
  756   1HB   CYS  48          1HB       CYS  48   3.157  12.178  -2.014
  757   2HB   CYS  48          2HB       CYS  48   2.459  12.251  -0.393
  758    H    PHE  49           H        PHE  49  -0.835  10.000  -2.399
  759    HA   PHE  49           HA       PHE  49  -1.613   9.892   0.412
  760   1HB   PHE  49          1HB       PHE  49  -4.034   9.814  -0.850
  761   2HB   PHE  49          2HB       PHE  49  -3.320  11.341  -0.318
  762    HD1  PHE  49           HD1      PHE  49  -1.615  12.352  -2.147
  763    HD2  PHE  49           HD2      PHE  49  -4.856   9.744  -2.981
  764    HE1  PHE  49           HE1      PHE  49  -1.678  13.187  -4.514
  765    HE2  PHE  49           HE2      PHE  49  -4.919  10.578  -5.349
  766    HZ   PHE  49           HZ       PHE  49  -3.329  12.290  -6.086
  767    H    LYS  50           H        LYS  50  -3.872   8.241   0.113
  768    HA   LYS  50           HA       LYS  50  -2.722   5.906  -1.250
  769   1HB   LYS  50          1HB       LYS  50  -4.306   4.926   0.809
  770   2HB   LYS  50          2HB       LYS  50  -2.535   4.954   0.754
  771   1HG   LYS  50          1HG       LYS  50  -4.060   7.398   1.661
  772   2HG   LYS  50          2HG       LYS  50  -3.819   6.056   2.791
  773   1HD   LYS  50          1HD       LYS  50  -1.687   7.679   1.350
  774   2HD   LYS  50          2HD       LYS  50  -2.007   7.659   3.093
  775   1HE   LYS  50          1HE       LYS  50  -0.757   5.523   1.347
  776   2HE   LYS  50          2HE       LYS  50  -0.123   6.234   2.839
  777   1HZ   LYS  50          1HZ       LYS  50  -2.501   4.516   2.671
  778   2HZ   LYS  50          2HZ       LYS  50  -1.020   4.012   3.138
  779   3HZ   LYS  50          3HZ       LYS  50  -1.834   5.103   4.041
  780    HA   PRO  51           HA       PRO  51  -6.859   6.839  -2.866
  781   1HB   PRO  51          1HB       PRO  51  -6.188   7.072  -5.504
  782   2HB   PRO  51          2HB       PRO  51  -6.339   8.455  -4.421
  783   1HG   PRO  51          1HG       PRO  51  -3.925   7.108  -5.455
  784   2HG   PRO  51          2HG       PRO  51  -4.079   8.767  -4.768
  785   1HD   PRO  51          1HD       PRO  51  -2.975   6.426  -3.540
  786   2HD   PRO  51          2HD       PRO  51  -3.250   7.993  -2.768
  787    H    LEU  52           H        LEU  52  -5.438   5.461  -5.670
  788    HA   LEU  52           HA       LEU  52  -6.957   3.040  -5.098
  789   1HB   LEU  52          1HB       LEU  52  -7.212   2.774  -7.308
  790   2HB   LEU  52          2HB       LEU  52  -7.016   4.535  -7.266
  791    HG   LEU  52           HG       LEU  52  -4.432   3.684  -7.592
  792   1HD1  LEU  52          1HD1      LEU  52  -6.043   1.424  -8.217
  793   2HD1  LEU  52          2HD1      LEU  52  -5.370   2.055  -9.738
  794   3HD1  LEU  52          3HD1      LEU  52  -4.284   1.625  -8.396
  795   1HD2  LEU  52          1HD2      LEU  52  -6.231   5.260  -8.930
  796   2HD2  LEU  52          2HD2      LEU  52  -4.546   4.964  -9.424
  797   3HD2  LEU  52          3HD2      LEU  52  -5.865   4.002 -10.136
  798    H    GLN  53           H        GLN  53  -4.713   3.369  -3.453
  799    HA   GLN  53           HA       GLN  53  -2.386   2.324  -4.497
  800   1HB   GLN  53          1HB       GLN  53  -3.520   2.207  -1.677
  801   2HB   GLN  53          2HB       GLN  53  -1.848   1.788  -2.085
  802   1HG   GLN  53          1HG       GLN  53  -3.205   4.483  -2.518
  803   2HG   GLN  53          2HG       GLN  53  -1.991   4.120  -1.281
  804   1HE2  GLN  53          1HE2      GLN  53  -0.278   2.507  -2.760
  805   2HE2  GLN  53          2HE2      GLN  53   0.526   3.450  -3.971
  806    H    GLU  54           H        GLU  54  -5.448   0.817  -3.769
  807    HA   GLU  54           HA       GLU  54  -4.766  -1.682  -3.020
  808   1HB   GLU  54          1HB       GLU  54  -6.922  -0.863  -5.006
  809   2HB   GLU  54          2HB       GLU  54  -6.876  -2.413  -4.147
  810   1HG   GLU  54          1HG       GLU  54  -6.882  -1.089  -1.977
  811   2HG   GLU  54          2HG       GLU  54  -7.172   0.371  -2.934
  812    H    ALA  55           H        ALA  55  -4.065  -0.080  -6.046
  813    HA   ALA  55           HA       ALA  55  -4.003  -1.865  -7.981
  814   1HB   ALA  55          1HB       ALA  55  -1.420  -0.864  -8.140
  815   2HB   ALA  55          2HB       ALA  55  -2.889  -0.041  -8.721
  816   3HB   ALA  55          3HB       ALA  55  -2.244   0.327  -7.104
  817    H    GLU  56           H        GLU  56  -1.342  -1.705  -5.499
  818    HA   GLU  56           HA       GLU  56  -1.264  -4.567  -5.513
  819   1HB   GLU  56          1HB       GLU  56   0.762  -2.896  -6.889
  820   2HB   GLU  56          2HB       GLU  56   1.434  -4.122  -5.801
  821   1HG   GLU  56          1HG       GLU  56   0.099  -5.863  -6.954
  822   2HG   GLU  56          2HG       GLU  56  -0.589  -4.639  -8.033
  823    H    CYS  57           H        CYS  57  -1.816  -2.169  -3.708
  824    HA   CYS  57           HA       CYS  57   0.333  -2.577  -1.771
  825   1HB   CYS  57          1HB       CYS  57  -0.784  -0.255  -2.677
  826   2HB   CYS  57          2HB       CYS  57  -1.692  -0.528  -1.188
  827    H    THR  58           H        THR  58  -3.266  -1.981  -1.808
  828    HA   THR  58           HA       THR  58  -3.753  -3.163   0.664
  829    HB   THR  58           HB       THR  58  -5.171  -1.666  -1.096
  830    HG1  THR  58           HG1      THR  58  -7.022  -2.526   0.281
  831   1HG2  THR  58          1HG2      THR  58  -6.169  -4.545  -1.421
  832   2HG2  THR  58          2HG2      THR  58  -7.110  -3.099  -1.857
  833   3HG2  THR  58          3HG2      THR  58  -5.605  -3.477  -2.728
  834    H    PHE  59           H        PHE  59  -4.030  -4.590  -2.654
  835    HA   PHE  59           HA       PHE  59  -4.993  -6.998  -2.170
  836   1HB   PHE  59          1HB       PHE  59  -3.369  -5.717  -4.084
  837   2HB   PHE  59          2HB       PHE  59  -2.381  -7.104  -3.611
  838    HD1  PHE  59           HD1      PHE  59  -5.495  -6.027  -5.213
  839    HD2  PHE  59           HD2      PHE  59  -3.078  -9.353  -4.162
  840    HE1  PHE  59           HE1      PHE  59  -6.830  -7.486  -6.758
  841    HE2  PHE  59           HE2      PHE  59  -4.413 -10.812  -5.707
  842    HZ   PHE  59           HZ       PHE  59  -6.274  -9.862  -6.987
  Start of MODEL   35
    1   1H    GLU   1           H1       GLU   1 -16.739 -11.313  -6.153
    2    HA   GLU   1           HA       GLU   1 -15.405  -9.405  -4.913
    3   1HB   GLU   1          1HB       GLU   1 -17.711  -9.241  -5.855
    4   2HB   GLU   1          2HB       GLU   1 -18.350 -10.005  -4.389
    5   1HG   GLU   1          1HG       GLU   1 -18.221  -8.070  -3.220
    6   2HG   GLU   1          2HG       GLU   1 -16.577  -7.735  -3.786
    7    H    GLU   2           H        GLU   2 -15.705 -12.400  -3.562
    8    HA   GLU   2           HA       GLU   2 -16.182 -11.564  -0.870
    9   1HB   GLU   2          1HB       GLU   2 -16.609 -13.900  -2.177
   10   2HB   GLU   2          2HB       GLU   2 -15.046 -14.272  -1.430
   11   1HG   GLU   2          1HG       GLU   2 -15.964 -14.421   0.639
   12   2HG   GLU   2          2HG       GLU   2 -16.913 -12.943   0.427
   13    H    TYR   3           H        TYR   3 -14.373  -9.935  -0.889
   14    HA   TYR   3           HA       TYR   3 -11.722 -10.571  -1.273
   15   1HB   TYR   3          1HB       TYR   3 -13.461  -8.614   0.181
   16   2HB   TYR   3          2HB       TYR   3 -11.837  -8.738   0.865
   17    HD1  TYR   3           HD1      TYR   3 -11.097  -6.533   0.282
   18    HD2  TYR   3           HD2      TYR   3 -12.621  -9.153  -2.737
   19    HE1  TYR   3           HE1      TYR   3 -10.238  -4.964  -1.524
   20    HE2  TYR   3           HE2      TYR   3 -11.758  -7.575  -4.533
   21    HH   TYR   3           HH       TYR   3 -10.180  -5.897  -4.843
   22    H    VAL   4           H        VAL   4 -11.296 -12.710  -0.444
   23    HA   VAL   4           HA       VAL   4 -11.199 -12.794   2.492
   24    HB   VAL   4           HB       VAL   4 -11.300 -15.230   2.250
   25   1HG1  VAL   4          1HG1      VAL   4 -13.435 -13.365   1.530
   26   2HG1  VAL   4          2HG1      VAL   4 -13.710 -15.001   0.886
   27   3HG1  VAL   4          3HG1      VAL   4 -13.459 -14.762   2.632
   28   1HG2  VAL   4          1HG2      VAL   4 -12.030 -16.148  -0.005
   29   2HG2  VAL   4          2HG2      VAL   4 -11.515 -14.593  -0.704
   30   3HG2  VAL   4          3HG2      VAL   4 -10.329 -15.636   0.117
   31    H    GLY   5           H        GLY   5  -9.544 -13.954  -0.529
   32   1HA   GLY   5          1HA       GLY   5  -7.109 -14.549   0.822
   33   2HA   GLY   5          2HA       GLY   5  -7.378 -14.465  -0.907
   34    H    LEU   6           H        LEU   6  -8.573 -11.595   0.442
   35    HA   LEU   6           HA       LEU   6  -5.976 -10.266   0.358
   36   1HB   LEU   6          1HB       LEU   6  -8.113  -8.809  -1.005
   37   2HB   LEU   6          2HB       LEU   6  -6.395  -8.975  -1.410
   38    HG   LEU   6           HG       LEU   6  -6.906 -11.230  -2.352
   39   1HD1  LEU   6          1HD1      LEU   6  -8.808 -12.182  -1.668
   40   2HD1  LEU   6          2HD1      LEU   6  -9.542 -10.622  -1.225
   41   3HD1  LEU   6          3HD1      LEU   6  -9.597 -11.183  -2.913
   42   1HD2  LEU   6          1HD2      LEU   6  -7.707  -8.635  -3.428
   43   2HD2  LEU   6          2HD2      LEU   6  -6.791  -9.962  -4.182
   44   3HD2  LEU   6          3HD2      LEU   6  -8.571  -9.998  -4.181
   45    H    SER   7           H        SER   7  -8.238 -11.140   2.326
   46    HA   SER   7           HA       SER   7  -8.866  -8.472   3.296
   47   1HB   SER   7          1HB       SER   7 -10.305 -10.989   3.196
   48   2HB   SER   7          2HB       SER   7 -10.210 -10.417   4.872
   49    HG   SER   7           HG       SER   7 -11.538  -8.785   4.406
   50    H    ALA   8           H        ALA   8  -9.324  -9.097   6.030
   51    HA   ALA   8           HA       ALA   8  -6.688  -9.035   7.016
   52   1HB   ALA   8          1HB       ALA   8  -8.467  -9.638   9.127
   53   2HB   ALA   8          2HB       ALA   8  -7.888  -8.031   8.628
   54   3HB   ALA   8          3HB       ALA   8  -9.408  -8.675   7.963
   55    H    ASN   9           H        ASN   9  -5.581 -10.923   6.312
   56    HA   ASN   9           HA       ASN   9  -5.289 -12.924   7.961
   57   1HB   ASN   9          1HB       ASN   9  -7.638 -13.594   7.835
   58   2HB   ASN   9          2HB       ASN   9  -7.584 -13.650   6.067
   59   1HD2  ASN   9          1HD2      ASN   9  -5.959 -15.142   5.121
   60   2HD2  ASN   9          2HD2      ASN   9  -5.721 -16.688   5.865
   61    H    GLN  10           H        GLN  10  -5.655 -11.760   4.663
   62    HA   GLN  10           HA       GLN  10  -4.461 -13.784   3.249
   63   1HB   GLN  10          1HB       GLN  10  -4.364 -12.277   1.482
   64   2HB   GLN  10          2HB       GLN  10  -5.612 -11.535   2.498
   65   1HG   GLN  10          1HG       GLN  10  -3.857 -10.072   3.515
   66   2HG   GLN  10          2HG       GLN  10  -2.652 -10.780   2.427
   67   1HE2  GLN  10          1HE2      GLN  10  -2.592 -10.216   0.308
   68   2HE2  GLN  10          2HE2      GLN  10  -3.529  -8.941  -0.397
   69    H    CYS  11           H        CYS  11  -3.053 -11.137   5.211
   70    HA   CYS  11           HA       CYS  11  -0.440 -11.355   4.317
   71   1HB   CYS  11          1HB       CYS  11  -1.125  -9.477   5.598
   72   2HB   CYS  11          2HB       CYS  11  -1.584 -10.487   6.973
   73    H    ALA  12           H        ALA  12  -2.455 -13.611   5.924
   74    HA   ALA  12           HA       ALA  12  -0.214 -14.933   7.248
   75   1HB   ALA  12          1HB       ALA  12  -1.771 -15.806   8.664
   76   2HB   ALA  12          2HB       ALA  12  -2.781 -14.469   8.062
   77   3HB   ALA  12          3HB       ALA  12  -2.946 -16.096   7.358
   78    H    VAL  13           H        VAL  13  -0.848 -14.666   4.198
   79    HA   VAL  13           HA       VAL  13  -1.728 -17.028   3.151
   80    HB   VAL  13           HB       VAL  13  -0.563 -14.689   2.254
   81   1HG1  VAL  13          1HG1      VAL  13   1.212 -15.395   0.691
   82   2HG1  VAL  13          2HG1      VAL  13   1.680 -15.651   2.390
   83   3HG1  VAL  13          3HG1      VAL  13   1.167 -17.032   1.391
   84   1HG2  VAL  13          1HG2      VAL  13  -0.850 -16.437   0.027
   85   2HG2  VAL  13          2HG2      VAL  13  -2.081 -16.894   1.229
   86   3HG2  VAL  13          3HG2      VAL  13  -1.998 -15.219   0.634
   87    HA   PRO  14           HA       PRO  14   1.316 -19.997   3.922
   88   1HB   PRO  14          1HB       PRO  14   1.472 -21.430   1.602
   89   2HB   PRO  14          2HB       PRO  14   0.178 -21.642   2.780
   90   1HG   PRO  14          1HG       PRO  14   0.167 -20.247   0.180
   91   2HG   PRO  14          2HG       PRO  14  -1.232 -20.866   1.127
   92   1HD   PRO  14          1HD       PRO  14  -0.343 -18.161   0.825
   93   2HD   PRO  14          2HD       PRO  14  -1.629 -18.736   1.896
   94    H    ALA  15           H        ALA  15   2.259 -17.380   2.958
   95    HA   ALA  15           HA       ALA  15   4.106 -16.443   2.144
   96   1HB   ALA  15          1HB       ALA  15   4.818 -18.577   4.013
   97   2HB   ALA  15          2HB       ALA  15   6.141 -18.224   2.876
   98   3HB   ALA  15          3HB       ALA  15   5.460 -16.923   3.880
   99    H    LYS  16           H        LYS  16   2.989 -17.223  -0.032
  100    HA   LYS  16           HA       LYS  16   5.031 -17.869  -1.782
  101   1HB   LYS  16          1HB       LYS  16   4.253 -20.139  -2.515
  102   2HB   LYS  16          2HB       LYS  16   5.098 -20.096  -0.958
  103   1HG   LYS  16          1HG       LYS  16   3.309 -21.018   0.048
  104   2HG   LYS  16          2HG       LYS  16   2.280 -19.679  -0.487
  105   1HD   LYS  16          1HD       LYS  16   1.227 -21.506  -1.478
  106   2HD   LYS  16          2HD       LYS  16   2.292 -20.984  -2.795
  107   1HE   LYS  16          1HE       LYS  16   3.953 -22.686  -2.133
  108   2HE   LYS  16          2HE       LYS  16   2.940 -23.179  -0.768
  109   1HZ   LYS  16          1HZ       LYS  16   2.733 -24.540  -2.803
  110   2HZ   LYS  16          2HZ       LYS  16   1.313 -23.940  -2.264
  111   3HZ   LYS  16          3HZ       LYS  16   2.043 -23.268  -3.560
  112    H    ASP  17           H        ASP  17   2.892 -15.964  -1.376
  113    HA   ASP  17           HA       ASP  17   1.784 -16.143  -3.983
  114   1HB   ASP  17          1HB       ASP  17   0.215 -17.462  -2.405
  115   2HB   ASP  17          2HB       ASP  17  -0.177 -15.901  -1.667
  116    H    ARG  18           H        ARG  18   3.466 -14.485  -1.933
  117    HA   ARG  18           HA       ARG  18   1.844 -12.127  -1.699
  118   1HB   ARG  18          1HB       ARG  18   4.761 -12.557  -0.911
  119   2HB   ARG  18          2HB       ARG  18   3.718 -11.230  -0.372
  120   1HG   ARG  18          1HG       ARG  18   2.652 -12.537   1.174
  121   2HG   ARG  18          2HG       ARG  18   2.664 -13.974   0.137
  122   1HD   ARG  18          1HD       ARG  18   4.930 -14.490   0.733
  123   2HD   ARG  18          2HD       ARG  18   5.188 -12.900   1.467
  124    HE   ARG  18           HE       ARG  18   3.013 -14.381   2.725
  125   1HH1  ARG  18          1HH1      ARG  18   6.509 -13.975   2.653
  126   2HH1  ARG  18          2HH1      ARG  18   6.738 -14.555   4.268
  127   1HH2  ARG  18          1HH2      ARG  18   3.316 -15.148   4.857
  128   2HH2  ARG  18          2HH2      ARG  18   4.910 -15.227   5.530
  129    H    VAL  19           H        VAL  19   3.130  -9.941  -2.240
  130    HA   VAL  19           HA       VAL  19   4.062 -10.261  -4.986
  131    HB   VAL  19           HB       VAL  19   3.215  -7.799  -3.446
  132   1HG1  VAL  19          1HG1      VAL  19   4.279  -6.763  -5.140
  133   2HG1  VAL  19          2HG1      VAL  19   4.343  -8.237  -6.135
  134   3HG1  VAL  19          3HG1      VAL  19   2.864  -7.246  -6.107
  135   1HG2  VAL  19          1HG2      VAL  19   1.503  -8.839  -5.626
  136   2HG2  VAL  19          2HG2      VAL  19   1.559  -9.839  -4.156
  137   3HG2  VAL  19          3HG2      VAL  19   1.062  -8.133  -4.053
  138    H    ASP  20           H        ASP  20   5.601 -10.814  -2.351
  139    HA   ASP  20           HA       ASP  20   7.465 -10.159  -1.334
  140   1HB   ASP  20          1HB       ASP  20   8.529 -11.600  -2.796
  141   2HB   ASP  20          2HB       ASP  20   8.008 -10.707  -4.233
  142    H    CYS  21           H        CYS  21   6.981  -7.938  -0.646
  143    HA   CYS  21           HA       CYS  21   7.003  -5.713  -2.203
  144   1HB   CYS  21          1HB       CYS  21   6.654  -6.195   0.413
  145   2HB   CYS  21          2HB       CYS  21   8.251  -5.443   0.475
  146    H    GLY  22           H        GLY  22   9.717  -7.622  -0.849
  147   1HA   GLY  22          1HA       GLY  22  11.951  -7.471  -1.095
  148   2HA   GLY  22          2HA       GLY  22  11.582  -6.990  -2.739
  149    H    TYR  23           H        TYR  23  11.461  -5.524   0.594
  150    HA   TYR  23           HA       TYR  23  12.209  -2.964  -0.556
  151   1HB   TYR  23          1HB       TYR  23  10.850  -4.128   1.780
  152   2HB   TYR  23          2HB       TYR  23  12.099  -3.006   2.328
  153    HD1  TYR  23           HD1      TYR  23   8.853  -3.356   0.687
  154    HD2  TYR  23           HD2      TYR  23  11.959  -0.603   1.726
  155    HE1  TYR  23           HE1      TYR  23   7.279  -1.407   0.254
  156    HE2  TYR  23           HE2      TYR  23  10.375   1.337   1.290
  157    HH   TYR  23           HH       TYR  23   6.987   0.810   0.740
  158    HA   PRO  24           HA       PRO  24  16.371  -3.373   0.580
  159   1HB   PRO  24          1HB       PRO  24  17.144  -0.756   0.460
  160   2HB   PRO  24          2HB       PRO  24  17.014  -1.788  -0.961
  161   1HG   PRO  24          1HG       PRO  24  15.209   0.330   0.016
  162   2HG   PRO  24          2HG       PRO  24  15.330  -0.364  -1.639
  163   1HD   PRO  24          1HD       PRO  24  13.328  -0.843   0.351
  164   2HD   PRO  24          2HD       PRO  24  13.490  -1.672  -1.204
  165    H    HIS  25           H        HIS  25  14.073  -1.881   2.476
  166    HA   HIS  25           HA       HIS  25  16.010  -1.847   4.674
  167   1HB   HIS  25          1HB       HIS  25  14.195   0.226   3.717
  168   2HB   HIS  25          2HB       HIS  25  13.965  -0.130   5.433
  169    HD1  HIS  25           HD1      HIS  25  15.912   0.473   7.054
  170    HD2  HIS  25           HD2      HIS  25  16.671   1.401   3.034
  171    HE1  HIS  25           HE1      HIS  25  17.981   1.967   7.043
  172    HE2  HIS  25           HE2      HIS  25  18.430   2.460   4.543
  173    H    VAL  26           H        VAL  26  14.043  -3.901   3.444
  174    HA   VAL  26           HA       VAL  26  11.798  -4.310   4.843
  175    HB   VAL  26           HB       VAL  26  12.405  -5.815   3.152
  176   1HG1  VAL  26          1HG1      VAL  26  14.906  -6.396   4.769
  177   2HG1  VAL  26          2HG1      VAL  26  14.384  -7.357   3.365
  178   3HG1  VAL  26          3HG1      VAL  26  14.798  -5.637   3.163
  179   1HG2  VAL  26          1HG2      VAL  26  11.345  -6.718   5.418
  180   2HG2  VAL  26          2HG2      VAL  26  11.741  -7.810   4.069
  181   3HG2  VAL  26          3HG2      VAL  26  12.848  -7.672   5.458
  182    H    THR  27           H        THR  27  11.182  -4.576   6.935
  183    HA   THR  27           HA       THR  27  12.858  -5.858   8.838
  184    HB   THR  27           HB       THR  27  13.124  -2.961   8.439
  185    HG1  THR  27           HG1      THR  27  14.189  -5.018  10.245
  186   1HG2  THR  27          1HG2      THR  27  13.279  -2.819  11.128
  187   2HG2  THR  27          2HG2      THR  27  11.778  -2.389  10.273
  188   3HG2  THR  27          3HG2      THR  27  11.946  -3.994  11.022
  189    HA   PRO  28           HA       PRO  28   8.982  -6.368  10.605
  190   1HB   PRO  28          1HB       PRO  28   9.654  -7.173  13.128
  191   2HB   PRO  28          2HB       PRO  28   9.669  -8.252  11.735
  192   1HG   PRO  28          1HG       PRO  28  11.907  -6.952  13.152
  193   2HG   PRO  28          2HG       PRO  28  11.946  -8.395  12.075
  194   1HD   PRO  28          1HD       PRO  28  12.788  -5.719  11.500
  195   2HD   PRO  28          2HD       PRO  28  12.699  -7.067  10.357
  196    H    LYS  29           H        LYS  29   9.361  -3.760  10.297
  197    HA   LYS  29           HA       LYS  29   7.732  -2.682  12.234
  198   1HB   LYS  29          1HB       LYS  29   9.954  -3.169  13.551
  199   2HB   LYS  29          2HB       LYS  29  10.491  -1.656  12.798
  200   1HG   LYS  29          1HG       LYS  29   9.318  -0.494  14.326
  201   2HG   LYS  29          2HG       LYS  29   7.816  -1.254  13.773
  202   1HD   LYS  29          1HD       LYS  29   8.778  -3.284  15.258
  203   2HD   LYS  29          2HD       LYS  29   9.589  -1.952  16.099
  204   1HE   LYS  29          1HE       LYS  29   6.918  -1.098  15.685
  205   2HE   LYS  29          2HE       LYS  29   6.794  -2.783  16.209
  206   1HZ   LYS  29          1HZ       LYS  29   6.869  -1.512  18.130
  207   2HZ   LYS  29          2HZ       LYS  29   8.391  -2.093  18.003
  208   3HZ   LYS  29          3HZ       LYS  29   8.071  -0.545  17.594
  209    H    GLU  30           H        GLU  30  10.055  -2.538   9.640
  210    HA   GLU  30           HA       GLU  30   9.324   0.214   9.099
  211   1HB   GLU  30          1HB       GLU  30  11.637  -1.479   8.563
  212   2HB   GLU  30          2HB       GLU  30  11.081  -0.683   7.081
  213   1HG   GLU  30          1HG       GLU  30  12.724   0.726   8.229
  214   2HG   GLU  30          2HG       GLU  30  11.140   1.515   8.279
  215    H    CYS  31           H        CYS  31   9.221  -3.106   7.687
  216    HA   CYS  31           HA       CYS  31   8.148  -2.458   5.242
  217   1HB   CYS  31          1HB       CYS  31   7.959  -4.889   6.992
  218   2HB   CYS  31          2HB       CYS  31   7.086  -4.814   5.458
  219    H    ASN  32           H        ASN  32   6.506  -3.313   8.373
  220    HA   ASN  32           HA       ASN  32   3.940  -2.953   7.369
  221   1HB   ASN  32          1HB       ASN  32   5.244  -3.313  10.012
  222   2HB   ASN  32          2HB       ASN  32   3.723  -2.411  10.097
  223   1HD2  ASN  32          1HD2      ASN  32   5.092  -5.199   8.341
  224   2HD2  ASN  32          2HD2      ASN  32   3.757  -6.278   8.570
  225    H    ASN  33           H        ASN  33   6.450  -0.733   7.847
  226    HA   ASN  33           HA       ASN  33   4.657   1.403   8.646
  227   1HB   ASN  33          1HB       ASN  33   7.013   0.971   9.695
  228   2HB   ASN  33          2HB       ASN  33   7.663   1.654   8.195
  229   1HD2  ASN  33          1HD2      ASN  33   8.535   3.154   9.874
  230   2HD2  ASN  33          2HD2      ASN  33   7.607   4.559  10.279
  231    H    ARG  34           H        ARG  34   6.543   0.019   5.987
  232    HA   ARG  34           HA       ARG  34   6.446   2.417   4.444
  233   1HB   ARG  34          1HB       ARG  34   7.151  -0.373   3.453
  234   2HB   ARG  34          2HB       ARG  34   7.693   1.175   2.785
  235   1HG   ARG  34          1HG       ARG  34   8.494   1.232   5.482
  236   2HG   ARG  34          2HG       ARG  34   8.834  -0.427   4.959
  237   1HD   ARG  34          1HD       ARG  34  10.463   0.242   3.477
  238   2HD   ARG  34          2HD       ARG  34   9.632   1.749   3.062
  239    HE   ARG  34           HE       ARG  34  10.439   2.043   5.731
  240   1HH1  ARG  34          1HH1      ARG  34  12.036   1.447   2.653
  241   2HH1  ARG  34          2HH1      ARG  34  13.510   2.226   3.122
  242   1HH2  ARG  34          1HH2      ARG  34  12.384   3.070   6.350
  243   2HH2  ARG  34          2HH2      ARG  34  13.710   3.155   5.239
  244    H    GLY  35           H        GLY  35   4.501  -0.448   5.011
  245   1HA   GLY  35          1HA       GLY  35   2.180  -0.217   4.284
  246   2HA   GLY  35          2HA       GLY  35   2.780   0.271   2.712
  247    H    CYS  36           H        CYS  36   4.502  -2.233   4.541
  248    HA   CYS  36           HA       CYS  36   3.366  -4.216   2.707
  249   1HB   CYS  36          1HB       CYS  36   6.188  -4.157   3.776
  250   2HB   CYS  36          2HB       CYS  36   5.509  -5.338   2.651
  251    H    CYS  37           H        CYS  37   4.230  -6.554   3.811
  252    HA   CYS  37           HA       CYS  37   3.496  -6.353   6.638
  253   1HB   CYS  37          1HB       CYS  37   1.653  -7.170   5.063
  254   2HB   CYS  37          2HB       CYS  37   2.617  -8.638   4.884
  255    H    PHE  38           H        PHE  38   5.014  -7.332   7.952
  256    HA   PHE  38           HA       PHE  38   7.171  -8.740   6.641
  257   1HB   PHE  38          1HB       PHE  38   7.320  -6.904   8.469
  258   2HB   PHE  38          2HB       PHE  38   6.657  -8.088   9.600
  259    HD1  PHE  38           HD1      PHE  38   8.028  -9.862  10.457
  260    HD2  PHE  38           HD2      PHE  38   9.565  -7.193   7.539
  261    HE1  PHE  38           HE1      PHE  38  10.349 -10.707  10.907
  262    HE2  PHE  38           HE2      PHE  38  11.886  -8.037   7.989
  263    HZ   PHE  38           HZ       PHE  38  12.250  -9.783   9.668
  264    H    ASP  39           H        ASP  39   7.273 -10.926   6.482
  265    HA   ASP  39           HA       ASP  39   5.308 -12.456   7.865
  266   1HB   ASP  39          1HB       ASP  39   5.616 -13.483   5.854
  267   2HB   ASP  39          2HB       ASP  39   7.251 -12.836   5.658
  268    H    SER  40           H        SER  40   8.793 -13.302   7.332
  269    HA   SER  40           HA       SER  40  10.440 -13.622   8.768
  270   1HB   SER  40          1HB       SER  40   8.974 -12.043  10.354
  271   2HB   SER  40          2HB       SER  40   8.733 -13.557  11.244
  272    HG   SER  40           HG       SER  40  11.392 -13.081  10.495
  273    H    ARG  41           H        ARG  41   7.297 -15.171   8.909
  274    HA   ARG  41           HA       ARG  41   7.943 -17.349  10.473
  275   1HB   ARG  41          1HB       ARG  41   6.069 -17.465   8.082
  276   2HB   ARG  41          2HB       ARG  41   5.921 -18.337   9.618
  277   1HG   ARG  41          1HG       ARG  41   5.991 -15.617  10.334
  278   2HG   ARG  41          2HG       ARG  41   4.973 -15.661   8.885
  279   1HD   ARG  41          1HD       ARG  41   3.605 -15.961  10.907
  280   2HD   ARG  41          2HD       ARG  41   3.583 -17.450   9.950
  281    HE   ARG  41           HE       ARG  41   5.732 -17.581  11.837
  282   1HH1  ARG  41          1HH1      ARG  41   2.215 -17.641  11.745
  283   2HH1  ARG  41          2HH1      ARG  41   2.066 -18.588  13.187
  284   1HH2  ARG  41          1HH2      ARG  41   5.537 -18.831  13.740
  285   2HH2  ARG  41          2HH2      ARG  41   3.968 -19.270  14.329
  286    H    ILE  42           H        ILE  42   8.215 -16.748   6.917
  287    HA   ILE  42           HA       ILE  42   9.850 -19.184   6.756
  288    HB   ILE  42           HB       ILE  42   8.356 -18.083   4.409
  289   1HG1  ILE  42          1HG1      ILE  42   7.207 -19.602   6.721
  290   2HG1  ILE  42          2HG1      ILE  42   6.510 -18.260   5.794
  291   1HG2  ILE  42          1HG2      ILE  42   8.545 -20.295   3.556
  292   2HG2  ILE  42          2HG2      ILE  42  10.141 -19.844   4.201
  293   3HG2  ILE  42          3HG2      ILE  42   9.080 -20.930   5.130
  294   1HD1  ILE  42          1HD1      ILE  42   6.763 -21.186   5.018
  295   2HD1  ILE  42          2HD1      ILE  42   5.299 -20.175   5.074
  296   3HD1  ILE  42          3HD1      ILE  42   6.506 -19.924   3.790
  297    HA   PRO  43           HA       PRO  43  12.756 -16.044   5.746
  298   1HB   PRO  43          1HB       PRO  43  14.990 -17.554   6.181
  299   2HB   PRO  43          2HB       PRO  43  14.190 -16.629   7.450
  300   1HG   PRO  43          1HG       PRO  43  14.143 -19.527   6.899
  301   2HG   PRO  43          2HG       PRO  43  13.740 -18.669   8.429
  302   1HD   PRO  43          1HD       PRO  43  11.955 -19.848   6.526
  303   2HD   PRO  43          2HD       PRO  43  11.505 -18.876   7.933
  304    H    GLY  44           H        GLY  44  11.828 -18.769   4.165
  305   1HA   GLY  44          1HA       GLY  44  13.841 -18.504   2.057
  306   2HA   GLY  44          2HA       GLY  44  12.635 -19.764   2.226
  307    H    VAL  45           H        VAL  45  10.925 -17.015   2.944
  308    HA   VAL  45           HA       VAL  45  10.291 -16.519   0.117
  309    HB   VAL  45           HB       VAL  45   8.047 -16.655   0.521
  310   1HG1  VAL  45          1HG1      VAL  45   7.579 -18.709   1.685
  311   2HG1  VAL  45          2HG1      VAL  45   9.169 -18.867   0.898
  312   3HG1  VAL  45          3HG1      VAL  45   9.068 -18.563   2.649
  313   1HG2  VAL  45          1HG2      VAL  45   6.928 -16.351   2.643
  314   2HG2  VAL  45          2HG2      VAL  45   8.484 -16.338   3.510
  315   3HG2  VAL  45          3HG2      VAL  45   8.073 -15.010   2.397
  316    HA   PRO  46           HA       PRO  46  10.362 -12.284   1.078
  317   1HB   PRO  46          1HB       PRO  46   7.979 -11.186   0.314
  318   2HB   PRO  46          2HB       PRO  46   9.257 -11.606  -0.825
  319   1HG   PRO  46          1HG       PRO  46   6.727 -12.994  -0.213
  320   2HG   PRO  46          2HG       PRO  46   7.767 -13.148  -1.675
  321   1HD   PRO  46          1HD       PRO  46   7.497 -14.968   0.518
  322   2HD   PRO  46          2HD       PRO  46   8.652 -15.088  -0.816
  323    H    TRP  47           H        TRP  47  10.687 -11.440   3.027
  324    HA   TRP  47           HA       TRP  47   8.538 -11.868   4.943
  325   1HB   TRP  47          1HB       TRP  47  10.914 -10.473   5.883
  326   2HB   TRP  47          2HB       TRP  47  10.117 -11.919   6.505
  327    HD1  TRP  47           HD1      TRP  47  10.882 -14.306   5.207
  328    HE1  TRP  47           HE1      TRP  47  13.181 -15.084   4.170
  329    HE3  TRP  47           HE3      TRP  47  12.858  -9.643   4.763
  330    HZ2  TRP  47           HZ2      TRP  47  15.515 -13.692   3.300
  331    HZ3  TRP  47           HZ3      TRP  47  15.153  -9.440   3.810
  332    HH2  TRP  47           HH2      TRP  47  16.471 -11.368   3.092
  333    H    CYS  48           H        CYS  48   8.212 -10.027   2.631
  334    HA   CYS  48           HA       CYS  48   7.226  -7.818   4.071
  335   1HB   CYS  48          1HB       CYS  48   9.658  -7.258   4.004
  336   2HB   CYS  48          2HB       CYS  48   9.548  -7.182   2.243
  337    H    PHE  49           H        PHE  49   5.274  -7.829   2.994
  338    HA   PHE  49           HA       PHE  49   5.368  -7.498   0.110
  339   1HB   PHE  49          1HB       PHE  49   3.257  -9.225   0.377
  340   2HB   PHE  49          2HB       PHE  49   4.892  -9.798   0.031
  341    HD1  PHE  49           HD1      PHE  49   6.357 -10.286   2.160
  342    HD2  PHE  49           HD2      PHE  49   2.117 -10.108   2.168
  343    HE1  PHE  49           HE1      PHE  49   6.302 -11.655   4.263
  344    HE2  PHE  49           HE2      PHE  49   2.063 -11.478   4.271
  345    HZ   PHE  49           HZ       PHE  49   4.156 -12.236   5.293
  346    H    LYS  50           H        LYS  50   2.655  -7.581  -0.455
  347    HA   LYS  50           HA       LYS  50   1.555  -5.602   1.419
  348   1HB   LYS  50          1HB       LYS  50   0.455  -5.175  -1.147
  349   2HB   LYS  50          2HB       LYS  50   1.522  -4.105  -0.220
  350   1HG   LYS  50          1HG       LYS  50   2.702  -6.423  -1.749
  351   2HG   LYS  50          2HG       LYS  50   2.223  -4.966  -2.639
  352   1HD   LYS  50          1HD       LYS  50   4.264  -5.238  -0.406
  353   2HD   LYS  50          2HD       LYS  50   4.538  -4.671  -2.063
  354   1HE   LYS  50          1HE       LYS  50   3.163  -3.258   0.238
  355   2HE   LYS  50          2HE       LYS  50   4.516  -2.684  -0.747
  356   1HZ   LYS  50          1HZ       LYS  50   2.533  -3.090  -2.521
  357   2HZ   LYS  50          2HZ       LYS  50   1.726  -2.502  -1.228
  358   3HZ   LYS  50          3HZ       LYS  50   2.950  -1.643  -1.885
  359    HA   PRO  51           HA       PRO  51  -1.236  -9.152   1.051
  360   1HB   PRO  51          1HB       PRO  51  -1.443  -9.730   3.712
  361   2HB   PRO  51          2HB       PRO  51  -0.311 -10.545   2.635
  362   1HG   PRO  51          1HG       PRO  51   0.166  -8.437   4.645
  363   2HG   PRO  51          2HG       PRO  51   1.349  -9.581   3.914
  364   1HD   PRO  51          1HD       PRO  51   0.981  -6.799   3.347
  365   2HD   PRO  51          2HD       PRO  51   2.047  -7.919   2.489
  366    H    LEU  52           H        LEU  52  -2.102  -8.247   4.220
  367    HA   LEU  52           HA       LEU  52  -4.524  -7.086   3.120
  368   1HB   LEU  52          1HB       LEU  52  -5.549  -7.759   4.972
  369   2HB   LEU  52          2HB       LEU  52  -4.169  -8.866   5.078
  370    HG   LEU  52           HG       LEU  52  -4.773  -6.393   6.679
  371   1HD1  LEU  52          1HD1      LEU  52  -4.706  -9.263   7.127
  372   2HD1  LEU  52          2HD1      LEU  52  -3.687  -8.385   8.294
  373   3HD1  LEU  52          3HD1      LEU  52  -5.408  -7.963   8.119
  374   1HD2  LEU  52          1HD2      LEU  52  -2.213  -7.336   7.440
  375   2HD2  LEU  52          2HD2      LEU  52  -2.175  -7.076   5.680
  376   3HD2  LEU  52          3HD2      LEU  52  -2.654  -5.749   6.765
  377    H    GLN  53           H        GLN  53  -2.031  -5.629   2.747
  378    HA   GLN  53           HA       GLN  53  -1.596  -3.733   4.676
  379   1HB   GLN  53          1HB       GLN  53  -1.326  -3.559   1.652
  380   2HB   GLN  53          2HB       GLN  53  -0.651  -2.361   2.771
  381   1HG   GLN  53          1HG       GLN  53   0.028  -5.328   2.623
  382   2HG   GLN  53          2HG       GLN  53   1.083  -3.987   2.151
  383   1HE2  GLN  53          1HE2      GLN  53  -0.113  -5.970   4.666
  384   2HE2  GLN  53          2HE2      GLN  53   0.746  -5.278   6.001
  385    H    GLU  54           H        GLU  54  -4.278  -4.131   2.453
  386    HA   GLU  54           HA       GLU  54  -5.172  -1.695   1.935
  387   1HB   GLU  54          1HB       GLU  54  -7.308  -2.622   1.706
  388   2HB   GLU  54          2HB       GLU  54  -6.265  -4.051   1.592
  389   1HG   GLU  54          1HG       GLU  54  -7.716  -4.858   3.169
  390   2HG   GLU  54          2HG       GLU  54  -6.655  -3.987   4.286
  391    H    ALA  55           H        ALA  55  -4.857  -3.147   5.135
  392    HA   ALA  55           HA       ALA  55  -6.623  -1.882   6.694
  393   1HB   ALA  55          1HB       ALA  55  -4.030  -1.596   7.916
  394   2HB   ALA  55          2HB       ALA  55  -5.285  -2.816   8.237
  395   3HB   ALA  55          3HB       ALA  55  -4.062  -3.107   6.976
  396    H    GLU  56           H        GLU  56  -3.326  -0.413   6.410
  397    HA   GLU  56           HA       GLU  56  -4.699   2.159   6.277
  398   1HB   GLU  56          1HB       GLU  56  -2.462   1.168   7.942
  399   2HB   GLU  56          2HB       GLU  56  -2.172   2.761   7.219
  400   1HG   GLU  56          1HG       GLU  56  -4.711   3.127   8.077
  401   2HG   GLU  56          2HG       GLU  56  -4.202   1.911   9.259
  402    H    CYS  57           H        CYS  57  -3.822   0.278   4.071
  403    HA   CYS  57           HA       CYS  57  -1.726   1.925   2.873
  404   1HB   CYS  57          1HB       CYS  57  -1.471  -0.596   3.120
  405   2HB   CYS  57          2HB       CYS  57  -2.693  -0.743   1.854
  406    H    THR  58           H        THR  58  -4.752   0.095   1.974
  407    HA   THR  58           HA       THR  58  -5.196   1.578  -0.378
  408    HB   THR  58           HB       THR  58  -6.069  -0.773   0.460
  409    HG1  THR  58           HG1      THR  58  -6.611   0.626  -1.516
  410   1HG2  THR  58          1HG2      THR  58  -8.539   0.835   1.130
  411   2HG2  THR  58          2HG2      THR  58  -8.115  -0.825   1.611
  412   3HG2  THR  58          3HG2      THR  58  -7.345   0.560   2.420
  413    H    PHE  59           H        PHE  59  -5.949   2.177   3.025
  414    HA   PHE  59           HA       PHE  59  -8.032   3.757   3.106
  415   1HB   PHE  59          1HB       PHE  59  -5.733   3.358   4.586
  416   2HB   PHE  59          2HB       PHE  59  -5.482   5.036   4.093
  417    HD1  PHE  59           HD1      PHE  59  -6.436   6.736   5.352
  418    HD2  PHE  59           HD2      PHE  59  -8.022   2.814   5.675
  419    HE1  PHE  59           HE1      PHE  59  -7.929   7.494   7.221
  420    HE2  PHE  59           HE2      PHE  59  -9.515   3.572   7.544
  421    HZ   PHE  59           HZ       PHE  59  -9.450   5.903   8.295
  422   1H    GLU   1           H1       GLU   1 -19.441  -1.020   1.648
  423    HA   GLU   1           HA       GLU   1 -19.825  -2.813  -0.591
  424   1HB   GLU   1          1HB       GLU   1 -21.659  -1.018   1.015
  425   2HB   GLU   1          2HB       GLU   1 -22.187  -1.714  -0.526
  426   1HG   GLU   1          1HG       GLU   1 -21.307  -3.970   0.559
  427   2HG   GLU   1          2HG       GLU   1 -21.524  -3.095   2.081
  428    H    GLU   2           H        GLU   2 -20.251   0.723   0.175
  429    HA   GLU   2           HA       GLU   2 -20.198   1.310  -2.621
  430   1HB   GLU   2          1HB       GLU   2 -20.455   2.984  -0.107
  431   2HB   GLU   2          2HB       GLU   2 -20.334   3.728  -1.711
  432   1HG   GLU   2          1HG       GLU   2 -22.571   3.466  -1.869
  433   2HG   GLU   2          2HG       GLU   2 -22.285   1.726  -2.021
  434    H    TYR   3           H        TYR   3 -17.905   0.138  -2.545
  435    HA   TYR   3           HA       TYR   3 -15.808   1.938  -1.652
  436   1HB   TYR   3          1HB       TYR   3 -16.168  -0.876  -2.766
  437   2HB   TYR   3          2HB       TYR   3 -14.557  -0.155  -2.841
  438    HD1  TYR   3           HD1      TYR   3 -17.328  -0.618  -0.340
  439    HD2  TYR   3           HD2      TYR   3 -13.118  -0.660  -1.098
  440    HE1  TYR   3           HE1      TYR   3 -16.897  -1.357   2.054
  441    HE2  TYR   3           HE2      TYR   3 -12.701  -1.399   1.298
  442    HH   TYR   3           HH       TYR   3 -14.398  -2.787   3.074
  443    H    VAL   4           H        VAL   4 -16.513   3.665  -3.233
  444    HA   VAL   4           HA       VAL   4 -15.359   3.070  -5.870
  445    HB   VAL   4           HB       VAL   4 -17.621   3.284  -6.310
  446   1HG1  VAL   4          1HG1      VAL   4 -18.271   3.979  -4.010
  447   2HG1  VAL   4          2HG1      VAL   4 -17.803   5.648  -4.412
  448   3HG1  VAL   4          3HG1      VAL   4 -19.144   4.865  -5.282
  449   1HG2  VAL   4          1HG2      VAL   4 -16.138   4.877  -7.607
  450   2HG2  VAL   4          2HG2      VAL   4 -17.868   5.294  -7.570
  451   3HG2  VAL   4          3HG2      VAL   4 -16.720   6.170  -6.530
  452    H    GLY   5           H        GLY   5 -16.101   5.615  -3.398
  453   1HA   GLY   5          1HA       GLY   5 -14.319   7.528  -4.510
  454   2HA   GLY   5          2HA       GLY   5 -15.057   7.555  -2.921
  455    H    LEU   6           H        LEU   6 -13.661   4.530  -3.115
  456    HA   LEU   6           HA       LEU   6 -11.057   5.512  -2.186
  457   1HB   LEU   6          1HB       LEU   6 -11.994   3.091  -0.874
  458   2HB   LEU   6          2HB       LEU   6 -11.222   4.536  -0.200
  459    HG   LEU   6           HG       LEU   6 -13.380   4.228   0.810
  460   1HD1  LEU   6          1HD1      LEU   6 -13.661   6.426   0.862
  461   2HD1  LEU   6          2HD1      LEU   6 -12.592   6.571  -0.555
  462   3HD1  LEU   6          3HD1      LEU   6 -14.351   6.417  -0.779
  463   1HD2  LEU   6          1HD2      LEU   6 -14.988   4.647  -1.629
  464   2HD2  LEU   6          2HD2      LEU   6 -14.170   3.070  -1.516
  465   3HD2  LEU   6          3HD2      LEU   6 -15.273   3.595  -0.222
  466    H    SER   7           H        SER   7 -12.576   4.068  -4.646
  467    HA   SER   7           HA       SER   7 -10.611   1.925  -4.839
  468   1HB   SER   7          1HB       SER   7 -13.170   1.492  -5.009
  469   2HB   SER   7          2HB       SER   7 -13.048   2.212  -6.623
  470    HG   SER   7           HG       SER   7 -12.825  -0.095  -6.711
  471    H    ALA   8           H        ALA   8 -10.940   1.628  -7.747
  472    HA   ALA   8           HA       ALA   8  -8.966   3.356  -8.629
  473   1HB   ALA   8          1HB       ALA   8  -9.569   2.497 -10.866
  474   2HB   ALA   8          2HB       ALA   8  -9.532   1.187  -9.662
  475   3HB   ALA   8          3HB       ALA   8 -11.090   1.849 -10.208
  476    H    ASN   9           H        ASN   9  -9.516   5.514  -7.974
  477    HA   ASN   9           HA       ASN   9 -10.492   7.112  -9.856
  478   1HB   ASN   9          1HB       ASN   9 -12.719   6.278  -9.838
  479   2HB   ASN   9          2HB       ASN   9 -12.739   6.089  -8.078
  480   1HD2  ASN   9          1HD2      ASN   9 -11.788   8.760 -10.229
  481   2HD2  ASN   9          2HD2      ASN   9 -12.864   9.956  -9.587
  482    H    GLN  10           H        GLN  10 -10.223   6.229  -6.440
  483    HA   GLN  10           HA       GLN  10 -10.556   8.770  -5.350
  484   1HB   GLN  10          1HB       GLN  10 -10.722   6.773  -3.983
  485   2HB   GLN  10          2HB       GLN  10  -9.046   6.324  -4.340
  486   1HG   GLN  10          1HG       GLN  10  -8.173   8.049  -3.000
  487   2HG   GLN  10          2HG       GLN  10  -9.660   9.005  -3.073
  488   1HE2  GLN  10          1HE2      GLN  10  -8.204   6.029  -1.846
  489   2HE2  GLN  10          2HE2      GLN  10  -9.198   5.847  -0.440
  490    H    CYS  11           H        CYS  11  -7.846   7.128  -6.940
  491    HA   CYS  11           HA       CYS  11  -5.756   8.631  -5.937
  492   1HB   CYS  11          1HB       CYS  11  -6.234   7.060  -8.421
  493   2HB   CYS  11          2HB       CYS  11  -4.827   8.125  -8.370
  494    H    ALA  12           H        ALA  12  -8.504   9.552  -7.791
  495    HA   ALA  12           HA       ALA  12  -7.110  11.943  -8.780
  496   1HB   ALA  12          1HB       ALA  12  -8.609  10.105 -10.182
  497   2HB   ALA  12          2HB       ALA  12  -9.824  11.346  -9.793
  498   3HB   ALA  12          3HB       ALA  12  -8.346  11.795 -10.677
  499    H    VAL  13           H        VAL  13  -8.172  11.272  -5.991
  500    HA   VAL  13           HA       VAL  13 -10.543  12.380  -5.370
  501    HB   VAL  13           HB       VAL  13  -8.249  11.588  -4.044
  502   1HG1  VAL  13          1HG1      VAL  13  -7.787  13.361  -2.399
  503   2HG1  VAL  13          2HG1      VAL  13  -7.369  13.874  -4.052
  504   3HG1  VAL  13          3HG1      VAL  13  -8.864  14.465  -3.287
  505   1HG2  VAL  13          1HG2      VAL  13  -9.906  10.936  -2.705
  506   2HG2  VAL  13          2HG2      VAL  13 -10.051  12.605  -2.104
  507   3HG2  VAL  13          3HG2      VAL  13 -11.029  12.071  -3.492
  508    HA   PRO  14           HA       PRO  14 -10.393  16.631  -6.144
  509   1HB   PRO  14          1HB       PRO  14 -11.636  17.773  -3.996
  510   2HB   PRO  14          2HB       PRO  14 -12.509  16.989  -5.311
  511   1HG   PRO  14          1HG       PRO  14 -11.924  16.027  -2.584
  512   2HG   PRO  14          2HG       PRO  14 -13.194  15.459  -3.726
  513   1HD   PRO  14          1HD       PRO  14 -10.721  14.190  -3.036
  514   2HD   PRO  14          2HD       PRO  14 -11.861  13.671  -4.285
  515    H    ALA  15           H        ALA  15  -8.073  15.436  -4.708
  516    HA   ALA  15           HA       ALA  15  -6.261  16.106  -3.600
  517   1HB   ALA  15          1HB       ALA  15  -6.739  18.770  -4.978
  518   2HB   ALA  15          2HB       ALA  15  -5.184  18.002  -4.577
  519   3HB   ALA  15          3HB       ALA  15  -6.213  17.313  -5.856
  520    H    LYS  16           H        LYS  16  -7.786  15.966  -1.614
  521    HA   LYS  16           HA       LYS  16  -7.121  17.765   0.243
  522   1HB   LYS  16          1HB       LYS  16  -9.312  19.145   0.395
  523   2HB   LYS  16          2HB       LYS  16  -8.022  19.674  -0.699
  524   1HG   LYS  16          1HG       LYS  16  -9.425  19.517  -2.450
  525   2HG   LYS  16          2HG       LYS  16  -9.721  17.806  -2.104
  526   1HD   LYS  16          1HD       LYS  16 -11.103  19.819  -0.370
  527   2HD   LYS  16          2HD       LYS  16 -11.677  19.681  -2.040
  528   1HE   LYS  16          1HE       LYS  16 -12.663  17.680  -1.633
  529   2HE   LYS  16          2HE       LYS  16 -11.254  17.057  -0.761
  530   1HZ   LYS  16          1HZ       LYS  16 -12.323  18.944   0.864
  531   2HZ   LYS  16          2HZ       LYS  16 -13.634  18.185   0.253
  532   3HZ   LYS  16          3HZ       LYS  16 -12.484  17.327   1.034
  533    H    ASP  17           H        ASP  17  -7.599  15.017  -0.023
  534    HA   ASP  17           HA       ASP  17  -9.322  14.669   2.190
  535   1HB   ASP  17          1HB       ASP  17 -10.849  14.697   0.102
  536   2HB   ASP  17          2HB       ASP  17 -10.083  13.166  -0.347
  537    H    ARG  18           H        ARG  18  -6.523  14.183   0.833
  538    HA   ARG  18           HA       ARG  18  -6.428  11.314   0.862
  539   1HB   ARG  18          1HB       ARG  18  -4.176  13.337   0.468
  540   2HB   ARG  18          2HB       ARG  18  -4.094  11.606   0.097
  541   1HG   ARG  18          1HG       ARG  18  -5.310  11.834  -1.836
  542   2HG   ARG  18          2HG       ARG  18  -6.325  13.135  -1.187
  543   1HD   ARG  18          1HD       ARG  18  -4.597  14.771  -1.557
  544   2HD   ARG  18          2HD       ARG  18  -3.382  13.529  -1.888
  545    HE   ARG  18           HE       ARG  18  -5.657  13.393  -3.709
  546   1HH1  ARG  18          1HH1      ARG  18  -2.595  15.018  -3.099
  547   2HH1  ARG  18          2HH1      ARG  18  -2.346  15.446  -4.759
  548   1HH2  ARG  18          1HH2      ARG  18  -5.327  13.956  -5.899
  549   2HH2  ARG  18          2HH2      ARG  18  -3.910  14.838  -6.362
  550    H    VAL  19           H        VAL  19  -4.030  10.613   1.954
  551    HA   VAL  19           HA       VAL  19  -4.250  11.596   4.713
  552    HB   VAL  19           HB       VAL  19  -3.255   8.936   3.673
  553   1HG1  VAL  19          1HG1      VAL  19  -2.171   9.043   5.678
  554   2HG1  VAL  19          2HG1      VAL  19  -3.326  10.208   6.369
  555   3HG1  VAL  19          3HG1      VAL  19  -3.754   8.484   6.271
  556   1HG2  VAL  19          1HG2      VAL  19  -5.685   9.010   5.345
  557   2HG2  VAL  19          2HG2      VAL  19  -5.868   9.752   3.737
  558   3HG2  VAL  19          3HG2      VAL  19  -5.324   8.064   3.882
  559    H    ASP  20           H        ASP  20  -2.682  12.604   2.224
  560    HA   ASP  20           HA       ASP  20  -0.604  13.079   1.640
  561   1HB   ASP  20          1HB       ASP  20  -0.849  14.965   2.963
  562   2HB   ASP  20          2HB       ASP  20  -1.051  14.033   4.455
  563    H    CYS  21           H        CYS  21   0.291  10.887   1.320
  564    HA   CYS  21           HA       CYS  21   1.192   9.203   3.247
  565   1HB   CYS  21          1HB       CYS  21   1.069   8.928   0.701
  566   2HB   CYS  21          2HB       CYS  21   2.698   9.607   0.670
  567    H    GLY  22           H        GLY  22   2.705  12.151   1.864
  568   1HA   GLY  22          1HA       GLY  22   4.604  13.259   2.372
  569   2HA   GLY  22          2HA       GLY  22   4.165  12.899   4.030
  570    H    TYR  23           H        TYR  23   5.553  11.115   1.170
  571    HA   TYR  23           HA       TYR  23   7.228   9.600   2.998
  572   1HB   TYR  23          1HB       TYR  23   6.126   9.527   0.222
  573   2HB   TYR  23          2HB       TYR  23   7.800   8.965   0.304
  574    HD1  TYR  23           HD1      TYR  23   5.076   7.469  -0.339
  575    HD2  TYR  23           HD2      TYR  23   7.607   7.711   3.101
  576    HE1  TYR  23           HE1      TYR  23   4.260   5.188   0.431
  577    HE2  TYR  23           HE2      TYR  23   6.783   5.430   3.859
  578    HH   TYR  23           HH       TYR  23   5.824   3.455   2.902
  579    HA   PRO  24           HA       PRO  24  10.772  11.943   2.172
  580   1HB   PRO  24          1HB       PRO  24  12.727  10.140   2.791
  581   2HB   PRO  24          2HB       PRO  24  11.859  11.075   4.007
  582   1HG   PRO  24          1HG       PRO  24  11.562   8.248   3.220
  583   2HG   PRO  24          2HG       PRO  24  11.038   9.050   4.744
  584   1HD   PRO  24          1HD       PRO  24   9.432   8.228   2.520
  585   2HD   PRO  24          2HD       PRO  24   8.892   9.157   3.924
  586    H    HIS  25           H        HIS  25   9.839   9.382   0.297
  587    HA   HIS  25           HA       HIS  25  11.908  10.117  -1.643
  588   1HB   HIS  25          1HB       HIS  25  11.328   7.555  -0.501
  589   2HB   HIS  25          2HB       HIS  25  10.941   7.509  -2.224
  590    HD1  HIS  25           HD1      HIS  25  12.919   7.755  -3.904
  591    HD2  HIS  25           HD2      HIS  25  14.059   7.873   0.131
  592    HE1  HIS  25           HE1      HIS  25  15.459   7.510  -3.871
  593    HE2  HIS  25           HE2      HIS  25  16.106   7.645  -1.370
  594    H    VAL  26           H        VAL  26   8.921  10.860  -0.894
  595    HA   VAL  26           HA       VAL  26   7.099  10.026  -2.648
  596    HB   VAL  26           HB       VAL  26   6.489  11.659  -1.108
  597   1HG1  VAL  26          1HG1      VAL  26   9.031  12.738  -1.569
  598   2HG1  VAL  26          2HG1      VAL  26   7.896  14.020  -2.057
  599   3HG1  VAL  26          3HG1      VAL  26   7.806  13.328  -0.419
  600   1HG2  VAL  26          1HG2      VAL  26   5.137  13.001  -2.364
  601   2HG2  VAL  26          2HG2      VAL  26   6.453  13.507  -3.449
  602   3HG2  VAL  26          3HG2      VAL  26   5.694  11.911  -3.655
  603    H    THR  27           H        THR  27   7.155   9.586  -4.786
  604    HA   THR  27           HA       THR  27   7.995  11.591  -6.635
  605    HB   THR  27           HB       THR  27   9.970   9.736  -5.636
  606    HG1  THR  27           HG1      THR  27  10.437  11.114  -8.050
  607   1HG2  THR  27          1HG2      THR  27  10.716   9.111  -8.091
  608   2HG2  THR  27          2HG2      THR  27   9.533   8.060  -7.274
  609   3HG2  THR  27          3HG2      THR  27   8.984   9.255  -8.475
  610    HA   PRO  28           HA       PRO  28   5.245   9.380  -9.070
  611   1HB   PRO  28          1HB       PRO  28   5.990  10.109 -11.596
  612   2HB   PRO  28          2HB       PRO  28   5.013  11.133 -10.546
  613   1HG   PRO  28          1HG       PRO  28   7.873  11.312 -11.246
  614   2HG   PRO  28          2HG       PRO  28   6.796  12.597 -10.589
  615   1HD   PRO  28          1HD       PRO  28   8.815  11.096  -9.223
  616   2HD   PRO  28          2HD       PRO  28   7.673  12.233  -8.496
  617    H    LYS  29           H        LYS  29   7.068   7.670  -8.046
  618    HA   LYS  29           HA       LYS  29   6.891   5.566  -9.836
  619   1HB   LYS  29          1HB       LYS  29   8.689   7.167 -10.909
  620   2HB   LYS  29          2HB       LYS  29   9.769   6.389  -9.738
  621   1HG   LYS  29          1HG       LYS  29   9.674   4.366 -10.809
  622   2HG   LYS  29          2HG       LYS  29   7.970   4.553 -11.261
  623   1HD   LYS  29          1HD       LYS  29   8.990   6.467 -12.834
  624   2HD   LYS  29          2HD       LYS  29  10.456   5.482 -12.687
  625   1HE   LYS  29          1HE       LYS  29   9.367   3.566 -13.632
  626   2HE   LYS  29          2HE       LYS  29   7.761   4.289 -13.458
  627   1HZ   LYS  29          1HZ       LYS  29   9.765   4.731 -15.464
  628   2HZ   LYS  29          2HZ       LYS  29   8.138   4.818 -15.578
  629   3HZ   LYS  29          3HZ       LYS  29   8.982   6.075 -14.966
  630    H    GLU  30           H        GLU  30   7.958   7.196  -6.979
  631    HA   GLU  30           HA       GLU  30   8.903   4.696  -5.853
  632   1HB   GLU  30          1HB       GLU  30   9.476   7.530  -5.420
  633   2HB   GLU  30          2HB       GLU  30   9.142   6.695  -3.893
  634   1HG   GLU  30          1HG       GLU  30  11.347   6.130  -4.014
  635   2HG   GLU  30          2HG       GLU  30  10.783   4.872  -5.127
  636    H    CYS  31           H        CYS  31   6.460   7.312  -5.409
  637    HA   CYS  31           HA       CYS  31   5.336   6.388  -3.071
  638   1HB   CYS  31          1HB       CYS  31   4.102   7.857  -5.399
  639   2HB   CYS  31          2HB       CYS  31   3.268   7.573  -3.869
  640    H    ASN  32           H        ASN  32   4.363   5.766  -6.528
  641    HA   ASN  32           HA       ASN  32   2.373   3.966  -5.906
  642   1HB   ASN  32          1HB       ASN  32   4.032   4.632  -8.318
  643   2HB   ASN  32          2HB       ASN  32   3.160   3.093  -8.371
  644   1HD2  ASN  32          1HD2      ASN  32   2.433   6.274  -6.946
  645   2HD2  ASN  32          2HD2      ASN  32   0.931   6.544  -7.763
  646    H    ASN  33           H        ASN  33   5.762   3.756  -5.491
  647    HA   ASN  33           HA       ASN  33   5.864   0.915  -5.977
  648   1HB   ASN  33          1HB       ASN  33   7.729   2.668  -6.541
  649   2HB   ASN  33          2HB       ASN  33   8.109   2.615  -4.812
  650   1HD2  ASN  33          1HD2      ASN  33  10.158   1.913  -6.014
  651   2HD2  ASN  33          2HD2      ASN  33  10.406   0.208  -6.198
  652    H    ARG  34           H        ARG  34   5.765   3.379  -3.397
  653    HA   ARG  34           HA       ARG  34   6.419   1.473  -1.374
  654   1HB   ARG  34          1HB       ARG  34   5.270   4.250  -0.918
  655   2HB   ARG  34          2HB       ARG  34   6.349   3.332   0.148
  656   1HG   ARG  34          1HG       ARG  34   7.751   3.546  -2.281
  657   2HG   ARG  34          2HG       ARG  34   6.997   5.137  -2.073
  658   1HD   ARG  34          1HD       ARG  34   8.613   5.653  -0.585
  659   2HD   ARG  34          2HD       ARG  34   8.018   4.376   0.486
  660    HE   ARG  34           HE       ARG  34   9.736   3.404  -1.682
  661   1HH1  ARG  34          1HH1      ARG  34   9.675   4.698   1.591
  662   2HH1  ARG  34          2HH1      ARG  34  11.212   4.024   2.022
  663   1HH2  ARG  34          1HH2      ARG  34  11.763   2.515  -1.112
  664   2HH2  ARG  34          2HH2      ARG  34  12.407   2.774   0.474
  665    H    GLY  35           H        GLY  35   3.573   2.876  -2.937
  666   1HA   GLY  35          1HA       GLY  35   1.577   1.453  -2.721
  667   2HA   GLY  35          2HA       GLY  35   1.838   1.477  -0.989
  668    H    CYS  36           H        CYS  36   2.532   4.360  -2.950
  669    HA   CYS  36           HA       CYS  36   0.076   5.556  -1.889
  670   1HB   CYS  36          1HB       CYS  36   2.822   6.786  -2.106
  671   2HB   CYS  36          2HB       CYS  36   1.352   7.703  -1.767
  672    H    CYS  37           H        CYS  37  -0.575   7.552  -3.262
  673    HA   CYS  37           HA       CYS  37   0.032   6.940  -6.061
  674   1HB   CYS  37          1HB       CYS  37  -2.395   6.886  -4.872
  675   2HB   CYS  37          2HB       CYS  37  -2.358   8.563  -5.426
  676    H    PHE  38           H        PHE  38   1.215   8.493  -7.129
  677    HA   PHE  38           HA       PHE  38   1.736  10.970  -5.752
  678   1HB   PHE  38          1HB       PHE  38   3.373   9.409  -7.049
  679   2HB   PHE  38          2HB       PHE  38   2.603   9.986  -8.530
  680    HD1  PHE  38           HD1      PHE  38   3.071  12.182  -9.378
  681    HD2  PHE  38           HD2      PHE  38   4.726  10.923  -5.678
  682    HE1  PHE  38           HE1      PHE  38   4.642  14.140  -9.413
  683    HE2  PHE  38           HE2      PHE  38   6.297  12.881  -5.714
  684    HZ   PHE  38           HZ       PHE  38   6.235  14.465  -7.581
  685    H    ASP  39           H        ASP  39   0.660  12.854  -6.102
  686    HA   ASP  39           HA       ASP  39  -1.284  12.897  -8.185
  687   1HB   ASP  39          1HB       ASP  39  -2.180  14.062  -6.440
  688   2HB   ASP  39          2HB       ASP  39  -0.597  14.483  -5.771
  689    H    SER  40           H        SER  40   0.896  15.598  -7.136
  690    HA   SER  40           HA       SER  40   2.484  16.681  -8.222
  691   1HB   SER  40          1HB       SER  40   2.609  14.431  -9.674
  692   2HB   SER  40          2HB       SER  40   1.928  15.487 -10.924
  693    HG   SER  40           HG       SER  40   3.877  16.311 -11.188
  694    H    ARG  41           H        ARG  41  -0.787  16.177  -9.370
  695    HA   ARG  41           HA       ARG  41  -0.908  18.223 -11.227
  696   1HB   ARG  41          1HB       ARG  41  -3.228  17.429  -9.433
  697   2HB   ARG  41          2HB       ARG  41  -3.287  17.922 -11.134
  698   1HG   ARG  41          1HG       ARG  41  -1.596  15.693 -11.136
  699   2HG   ARG  41          2HG       ARG  41  -2.846  15.260  -9.955
  700   1HD   ARG  41          1HD       ARG  41  -3.358  14.596 -12.350
  701   2HD   ARG  41          2HD       ARG  41  -4.605  15.603 -11.596
  702    HE   ARG  41           HE       ARG  41  -2.549  17.095 -13.077
  703   1HH1  ARG  41          1HH1      ARG  41  -5.680  15.501 -13.255
  704   2HH1  ARG  41          2HH1      ARG  41  -6.193  16.383 -14.654
  705   1HH2  ARG  41          1HH2      ARG  41  -3.225  18.260 -14.924
  706   2HH2  ARG  41          2HH2      ARG  41  -4.788  17.963 -15.610
  707    H    ILE  42           H        ILE  42  -1.515  18.104  -7.665
  708    HA   ILE  42           HA       ILE  42  -1.594  21.042  -7.701
  709    HB   ILE  42           HB       ILE  42  -2.822  19.435  -5.503
  710   1HG1  ILE  42          1HG1      ILE  42  -3.918  19.774  -8.275
  711   2HG1  ILE  42          2HG1      ILE  42  -3.911  18.334  -7.242
  712   1HG2  ILE  42          1HG2      ILE  42  -3.793  22.015  -6.721
  713   2HG2  ILE  42          2HG2      ILE  42  -4.088  21.355  -5.095
  714   3HG2  ILE  42          3HG2      ILE  42  -2.478  21.981  -5.523
  715   1HD1  ILE  42          1HD1      ILE  42  -6.117  18.970  -6.958
  716   2HD1  ILE  42          2HD1      ILE  42  -5.390  19.966  -5.674
  717   3HD1  ILE  42          3HD1      ILE  42  -5.768  20.690  -7.255
  718    HA   PRO  43           HA       PRO  43   2.115  20.316  -5.467
  719   1HB   PRO  43          1HB       PRO  43   3.107  22.849  -5.700
  720   2HB   PRO  43          2HB       PRO  43   3.385  21.592  -6.903
  721   1HG   PRO  43          1HG       PRO  43   1.546  23.897  -6.957
  722   2HG   PRO  43          2HG       PRO  43   2.167  22.924  -8.339
  723   1HD   PRO  43          1HD       PRO  43  -0.431  22.853  -7.139
  724   2HD   PRO  43          2HD       PRO  43   0.183  21.764  -8.388
  725    H    GLY  44           H        GLY  44  -0.592  22.040  -4.712
  726   1HA   GLY  44          1HA       GLY  44   0.497  23.062  -2.195
  727   2HA   GLY  44          2HA       GLY  44  -1.086  23.376  -2.876
  728    H    VAL  45           H        VAL  45  -0.695  20.124  -3.397
  729    HA   VAL  45           HA       VAL  45  -1.774  19.447  -0.748
  730    HB   VAL  45           HB       VAL  45  -3.468  18.234  -1.673
  731   1HG1  VAL  45          1HG1      VAL  45  -2.956  20.382  -3.759
  732   2HG1  VAL  45          2HG1      VAL  45  -4.496  19.520  -3.525
  733   3HG1  VAL  45          3HG1      VAL  45  -3.859  20.570  -2.236
  734   1HG2  VAL  45          1HG2      VAL  45  -3.503  17.218  -3.867
  735   2HG2  VAL  45          2HG2      VAL  45  -2.014  18.074  -4.333
  736   3HG2  VAL  45          3HG2      VAL  45  -1.960  16.821  -3.071
  737    HA   PRO  46           HA       PRO  46   0.938  16.059  -0.741
  738   1HB   PRO  46          1HB       PRO  46  -0.525  13.804  -0.254
  739   2HB   PRO  46          2HB       PRO  46  -0.096  14.964   1.001
  740   1HG   PRO  46          1HG       PRO  46  -2.661  14.539  -0.394
  741   2HG   PRO  46          2HG       PRO  46  -2.360  15.362   1.180
  742   1HD   PRO  46          1HD       PRO  46  -2.947  16.542  -1.364
  743   2HD   PRO  46          2HD       PRO  46  -2.502  17.397   0.120
  744    H    TRP  47           H        TRP  47   2.219  15.507  -2.377
  745    HA   TRP  47           HA       TRP  47   0.875  14.482  -4.737
  746   1HB   TRP  47          1HB       TRP  47   3.784  14.659  -4.800
  747   2HB   TRP  47          2HB       TRP  47   2.574  15.327  -5.897
  748    HD1  TRP  47           HD1      TRP  47   1.448  17.774  -4.994
  749    HE1  TRP  47           HE1      TRP  47   2.525  19.815  -3.713
  750    HE3  TRP  47           HE3      TRP  47   5.460  15.211  -3.206
  751    HZ2  TRP  47           HZ2      TRP  47   4.880  20.122  -2.130
  752    HZ3  TRP  47           HZ3      TRP  47   7.100  16.456  -1.801
  753    HH2  TRP  47           HH2      TRP  47   6.860  18.826  -1.257
  754    H    CYS  48           H        CYS  48   0.977  12.946  -2.154
  755    HA   CYS  48           HA       CYS  48   1.699  10.470  -3.260
  756   1HB   CYS  48          1HB       CYS  48   3.969  11.395  -2.741
  757   2HB   CYS  48          2HB       CYS  48   3.527  11.375  -1.031
  758    H    PHE  49           H        PHE  49  -0.280   9.671  -2.538
  759    HA   PHE  49           HA       PHE  49  -0.626   9.633   0.364
  760   1HB   PHE  49          1HB       PHE  49  -3.202   9.806  -0.568
  761   2HB   PHE  49          2HB       PHE  49  -2.274  11.237  -0.107
  762    HD1  PHE  49           HD1      PHE  49  -0.682  12.077  -2.143
  763    HD2  PHE  49           HD2      PHE  49  -4.320   9.932  -2.557
  764    HE1  PHE  49           HE1      PHE  49  -0.952  12.982  -4.468
  765    HE2  PHE  49           HE2      PHE  49  -4.590  10.837  -4.882
  766    HZ   PHE  49           HZ       PHE  49  -2.902  12.352  -5.810
  767    H    LYS  50           H        LYS  50  -3.065   8.238   0.437
  768    HA   LYS  50           HA       LYS  50  -2.428   5.802  -1.075
  769   1HB   LYS  50          1HB       LYS  50  -3.680   4.989   1.277
  770   2HB   LYS  50          2HB       LYS  50  -1.971   4.790   0.852
  771   1HG   LYS  50          1HG       LYS  50  -2.930   7.406   2.013
  772   2HG   LYS  50          2HG       LYS  50  -2.666   6.028   3.096
  773   1HD   LYS  50          1HD       LYS  50  -0.655   7.380   1.258
  774   2HD   LYS  50          2HD       LYS  50  -0.611   7.315   3.028
  775   1HE   LYS  50          1HE       LYS  50  -0.070   5.115   1.017
  776   2HE   LYS  50          2HE       LYS  50   0.958   5.662   2.350
  777   1HZ   LYS  50          1HZ       LYS  50   0.064   3.898   3.344
  778   2HZ   LYS  50          2HZ       LYS  50  -1.220   4.866   3.627
  779   3HZ   LYS  50          3HZ       LYS  50  -1.242   3.826   2.367
  780    HA   PRO  51           HA       PRO  51  -6.684   7.186  -1.843
  781   1HB   PRO  51          1HB       PRO  51  -6.522   7.423  -4.560
  782   2HB   PRO  51          2HB       PRO  51  -6.320   8.784  -3.459
  783   1HG   PRO  51          1HG       PRO  51  -4.302   7.240  -4.957
  784   2HG   PRO  51          2HG       PRO  51  -4.153   8.887  -4.242
  785   1HD   PRO  51          1HD       PRO  51  -3.067   6.419  -3.274
  786   2HD   PRO  51          2HD       PRO  51  -3.029   7.984  -2.451
  787    H    LEU  52           H        LEU  52  -5.984   5.752  -4.883
  788    HA   LEU  52           HA       LEU  52  -7.581   3.466  -4.029
  789   1HB   LEU  52          1HB       LEU  52  -8.351   3.324  -6.116
  790   2HB   LEU  52          2HB       LEU  52  -7.913   5.042  -6.138
  791    HG   LEU  52           HG       LEU  52  -5.600   3.871  -7.007
  792   1HD1  LEU  52          1HD1      LEU  52  -7.518   1.809  -7.175
  793   2HD1  LEU  52          2HD1      LEU  52  -7.247   2.385  -8.837
  794   3HD1  LEU  52          3HD1      LEU  52  -5.870   1.839  -7.850
  795   1HD2  LEU  52          1HD2      LEU  52  -7.442   4.363  -9.218
  796   2HD2  LEU  52          2HD2      LEU  52  -7.499   5.635  -7.973
  797   3HD2  LEU  52          3HD2      LEU  52  -5.952   5.217  -8.748
  798    H    GLN  53           H        GLN  53  -5.026   3.537  -2.890
  799    HA   GLN  53           HA       GLN  53  -3.055   2.357  -4.388
  800   1HB   GLN  53          1HB       GLN  53  -3.659   2.139  -1.416
  801   2HB   GLN  53          2HB       GLN  53  -2.133   1.622  -2.154
  802   1HG   GLN  53          1HG       GLN  53  -3.307   4.436  -2.177
  803   2HG   GLN  53          2HG       GLN  53  -1.921   3.899  -1.217
  804   1HE2  GLN  53          1HE2      GLN  53  -0.689   2.250  -3.110
  805   2HE2  GLN  53          2HE2      GLN  53  -0.036   3.217  -4.390
  806    H    GLU  54           H        GLU  54  -6.085   1.073  -3.338
  807    HA   GLU  54           HA       GLU  54  -5.570  -1.507  -2.757
  808   1HB   GLU  54          1HB       GLU  54  -7.822  -2.001  -3.531
  809   2HB   GLU  54          2HB       GLU  54  -7.818  -0.405  -2.758
  810   1HG   GLU  54          1HG       GLU  54  -8.625   0.511  -4.648
  811   2HG   GLU  54          2HG       GLU  54  -7.210  -0.051  -5.551
  812    H    ALA  55           H        ALA  55  -4.938   0.156  -5.743
  813    HA   ALA  55           HA       ALA  55  -5.262  -1.523  -7.758
  814   1HB   ALA  55          1HB       ALA  55  -3.060  -0.701  -8.628
  815   2HB   ALA  55          2HB       ALA  55  -4.078   0.594  -7.956
  816   3HB   ALA  55          3HB       ALA  55  -2.708  -0.041  -7.013
  817    H    GLU  56           H        GLU  56  -2.116  -1.698  -5.955
  818    HA   GLU  56           HA       GLU  56  -2.395  -4.594  -6.097
  819   1HB   GLU  56          1HB       GLU  56  -0.537  -3.004  -7.546
  820   2HB   GLU  56          2HB       GLU  56   0.394  -3.826  -6.281
  821   1HG   GLU  56          1HG       GLU  56   0.418  -5.572  -7.736
  822   2HG   GLU  56          2HG       GLU  56  -1.241  -5.863  -7.191
  823    H    CYS  57           H        CYS  57  -2.557  -2.153  -4.056
  824    HA   CYS  57           HA       CYS  57  -0.497  -2.926  -2.198
  825   1HB   CYS  57          1HB       CYS  57  -1.551  -0.556  -2.686
  826   2HB   CYS  57          2HB       CYS  57  -2.719  -1.070  -1.467
  827    H    THR  58           H        THR  58  -4.136  -2.665  -2.171
  828    HA   THR  58           HA       THR  58  -4.592  -4.054   0.152
  829    HB   THR  58           HB       THR  58  -6.201  -2.728  -1.372
  830    HG1  THR  58           HG1      THR  58  -6.923  -5.458  -0.578
  831   1HG2  THR  58          1HG2      THR  58  -5.630  -4.343  -3.400
  832   2HG2  THR  58          2HG2      THR  58  -6.771  -5.448  -2.597
  833   3HG2  THR  58          3HG2      THR  58  -7.319  -3.845  -3.142
  834    H    PHE  59           H        PHE  59  -3.901  -5.333  -3.124
  835    HA   PHE  59           HA       PHE  59  -4.532  -7.995  -2.476
  836   1HB   PHE  59          1HB       PHE  59  -3.124  -6.372  -4.572
  837   2HB   PHE  59          2HB       PHE  59  -2.604  -8.057  -4.491
  838    HD1  PHE  59           HD1      PHE  59  -3.673  -9.486  -5.934
  839    HD2  PHE  59           HD2      PHE  59  -5.820  -6.144  -4.441
  840    HE1  PHE  59           HE1      PHE  59  -5.664 -10.150  -7.312
  841    HE2  PHE  59           HE2      PHE  59  -7.811  -6.808  -5.818
  842    HZ   PHE  59           HZ       PHE  59  -7.709  -8.803  -7.236
  Start of MODEL   36
    1   1H    GLU   1           H1       GLU   1 -10.283 -16.560  -2.360
    2    HA   GLU   1           HA       GLU   1 -11.004 -17.094  -4.842
    3   1HB   GLU   1          1HB       GLU   1 -13.638 -17.653  -3.851
    4   2HB   GLU   1          2HB       GLU   1 -12.641 -18.643  -4.933
    5   1HG   GLU   1          1HG       GLU   1 -12.190 -18.641  -1.935
    6   2HG   GLU   1          2HG       GLU   1 -13.434 -19.672  -2.658
    7    H    GLU   2           H        GLU   2 -13.290 -16.342  -2.111
    8    HA   GLU   2           HA       GLU   2 -13.903 -13.859  -3.364
    9   1HB   GLU   2          1HB       GLU   2 -14.785 -15.057  -0.709
   10   2HB   GLU   2          2HB       GLU   2 -15.470 -13.588  -1.427
   11   1HG   GLU   2          1HG       GLU   2 -16.985 -15.136  -2.225
   12   2HG   GLU   2          2HG       GLU   2 -15.797 -15.229  -3.534
   13    H    TYR   3           H        TYR   3 -14.083 -13.341  -0.032
   14    HA   TYR   3           HA       TYR   3 -11.759 -11.595  -0.154
   15   1HB   TYR   3          1HB       TYR   3 -12.932 -11.074   2.211
   16   2HB   TYR   3          2HB       TYR   3 -13.699 -10.507   0.724
   17    HD1  TYR   3           HD1      TYR   3 -13.858 -12.935   3.484
   18    HD2  TYR   3           HD2      TYR   3 -15.751 -11.548  -0.094
   19    HE1  TYR   3           HE1      TYR   3 -15.967 -14.218   4.093
   20    HE2  TYR   3           HE2      TYR   3 -17.853 -12.837   0.528
   21    HH   TYR   3           HH       TYR   3 -18.626 -14.491   1.836
   22    H    VAL   4           H        VAL   4 -10.163 -13.382  -0.058
   23    HA   VAL   4           HA       VAL   4  -9.715 -14.120   2.730
   24    HB   VAL   4           HB       VAL   4  -9.808 -16.009   0.375
   25   1HG1  VAL   4          1HG1      VAL   4  -8.011 -16.994   1.324
   26   2HG1  VAL   4          2HG1      VAL   4  -8.230 -16.139   2.871
   27   3HG1  VAL   4          3HG1      VAL   4  -9.193 -17.594   2.514
   28   1HG2  VAL   4          1HG2      VAL   4 -11.962 -15.910   1.248
   29   2HG2  VAL   4          2HG2      VAL   4 -11.254 -17.281   2.136
   30   3HG2  VAL   4          3HG2      VAL   4 -11.388 -15.687   2.918
   31    H    GLY   5           H        GLY   5  -8.449 -14.186  -0.672
   32   1HA   GLY   5          1HA       GLY   5  -5.729 -14.263   0.048
   33   2HA   GLY   5          2HA       GLY   5  -6.398 -13.769  -1.494
   34    H    LEU   6           H        LEU   6  -8.046 -11.821   0.594
   35    HA   LEU   6           HA       LEU   6  -5.904  -9.892   0.978
   36   1HB   LEU   6          1HB       LEU   6  -7.049  -8.131  -0.142
   37   2HB   LEU   6          2HB       LEU   6  -6.765  -9.465  -1.273
   38    HG   LEU   6           HG       LEU   6  -9.378  -8.672   0.040
   39   1HD1  LEU   6          1HD1      LEU   6  -8.791  -8.816  -2.914
   40   2HD1  LEU   6          2HD1      LEU   6 -10.107  -7.967  -2.067
   41   3HD1  LEU   6          3HD1      LEU   6  -8.437  -7.358  -1.955
   42   1HD2  LEU   6          1HD2      LEU   6  -8.577 -11.182  -1.371
   43   2HD2  LEU   6          2HD2      LEU   6  -9.693 -10.935  -0.006
   44   3HD2  LEU   6          3HD2      LEU   6 -10.204 -10.522  -1.661
   45    H    SER   7           H        SER   7  -7.895 -11.761   2.485
   46    HA   SER   7           HA       SER   7  -9.207  -9.656   4.006
   47   1HB   SER   7          1HB       SER   7 -10.597 -11.531   3.047
   48   2HB   SER   7          2HB       SER   7  -9.731 -12.658   4.107
   49    HG   SER   7           HG       SER   7 -10.595 -11.593   5.929
   50    H    ALA   8           H        ALA   8  -7.913  -8.984   5.690
   51    HA   ALA   8           HA       ALA   8  -6.155  -9.134   7.131
   52   1HB   ALA   8          1HB       ALA   8  -7.404  -9.317   8.988
   53   2HB   ALA   8          2HB       ALA   8  -8.675 -10.130   8.043
   54   3HB   ALA   8          3HB       ALA   8  -7.400 -11.090   8.832
   55    H    ASN   9           H        ASN   9  -7.361 -12.546   7.325
   56    HA   ASN   9           HA       ASN   9  -5.048 -13.728   7.853
   57   1HB   ASN   9          1HB       ASN   9  -7.240 -14.893   7.652
   58   2HB   ASN   9          2HB       ASN   9  -7.162 -14.761   5.888
   59   1HD2  ASN   9          1HD2      ASN   9  -4.773 -15.564   8.404
   60   2HD2  ASN   9          2HD2      ASN   9  -4.298 -17.106   7.773
   61    H    GLN  10           H        GLN  10  -5.814 -11.931   5.013
   62    HA   GLN  10           HA       GLN  10  -4.545 -13.264   3.010
   63   1HB   GLN  10          1HB       GLN  10  -5.133 -11.418   1.884
   64   2HB   GLN  10          2HB       GLN  10  -5.661 -10.701   3.416
   65   1HG   GLN  10          1HG       GLN  10  -3.457  -9.723   3.770
   66   2HG   GLN  10          2HG       GLN  10  -2.798 -10.570   2.362
   67   1HE2  GLN  10          1HE2      GLN  10  -2.768  -9.549   0.507
   68   2HE2  GLN  10          2HE2      GLN  10  -3.669  -8.133   0.079
   69    H    CYS  11           H        CYS  11  -3.156 -11.014   5.479
   70    HA   CYS  11           HA       CYS  11  -0.566 -11.055   4.422
   71   1HB   CYS  11          1HB       CYS  11  -1.124  -9.289   5.851
   72   2HB   CYS  11          2HB       CYS  11  -1.695 -10.370   7.128
   73    H    ALA  12           H        ALA  12  -2.447 -13.558   5.612
   74    HA   ALA  12           HA       ALA  12  -0.135 -14.944   6.783
   75   1HB   ALA  12          1HB       ALA  12  -2.458 -16.434   7.278
   76   2HB   ALA  12          2HB       ALA  12  -1.607 -15.380   8.431
   77   3HB   ALA  12          3HB       ALA  12  -2.966 -14.740   7.477
   78    H    VAL  13           H        VAL  13  -1.119 -14.413   3.838
   79    HA   VAL  13           HA       VAL  13  -2.126 -16.613   2.650
   80    HB   VAL  13           HB       VAL  13  -0.850 -14.285   1.888
   81   1HG1  VAL  13          1HG1      VAL  13   1.325 -15.409   1.819
   82   2HG1  VAL  13          2HG1      VAL  13   0.666 -16.641   0.716
   83   3HG1  VAL  13          3HG1      VAL  13   0.796 -14.948   0.183
   84   1HG2  VAL  13          1HG2      VAL  13  -2.407 -14.581   0.322
   85   2HG2  VAL  13          2HG2      VAL  13  -1.367 -15.794  -0.463
   86   3HG2  VAL  13          3HG2      VAL  13  -2.557 -16.299   0.761
   87    HA   PRO  14           HA       PRO  14   0.742 -19.832   2.960
   88   1HB   PRO  14          1HB       PRO  14   0.718 -21.024   0.503
   89   2HB   PRO  14          2HB       PRO  14  -0.544 -21.274   1.707
   90   1HG   PRO  14          1HG       PRO  14  -0.556 -19.618  -0.735
   91   2HG   PRO  14          2HG       PRO  14  -1.958 -20.244   0.204
   92   1HD   PRO  14          1HD       PRO  14  -0.901 -17.583   0.141
   93   2HD   PRO  14          2HD       PRO  14  -2.183 -18.184   1.201
   94    H    ALA  15           H        ALA  15   1.817 -17.189   2.213
   95    HA   ALA  15           HA       ALA  15   3.700 -16.292   1.442
   96   1HB   ALA  15          1HB       ALA  15   5.011 -17.095   3.105
   97   2HB   ALA  15          2HB       ALA  15   4.371 -18.747   2.935
   98   3HB   ALA  15          3HB       ALA  15   5.671 -18.182   1.861
   99    H    LYS  16           H        LYS  16   2.496 -16.652  -0.761
  100    HA   LYS  16           HA       LYS  16   4.379 -17.220  -2.675
  101   1HB   LYS  16          1HB       LYS  16   3.359 -19.352  -3.624
  102   2HB   LYS  16          2HB       LYS  16   4.416 -19.518  -2.211
  103   1HG   LYS  16          1HG       LYS  16   2.745 -20.512  -1.081
  104   2HG   LYS  16          2HG       LYS  16   1.731 -19.071  -1.272
  105   1HD   LYS  16          1HD       LYS  16   0.379 -20.331  -2.567
  106   2HD   LYS  16          2HD       LYS  16   1.657 -20.331  -3.794
  107   1HE   LYS  16          1HE       LYS  16   2.364 -22.468  -3.239
  108   2HE   LYS  16          2HE       LYS  16   1.882 -22.315  -1.542
  109   1HZ   LYS  16          1HZ       LYS  16   0.507 -23.582  -3.485
  110   2HZ   LYS  16          2HZ       LYS  16  -0.091 -23.147  -2.029
  111   3HZ   LYS  16          3HZ       LYS  16  -0.314 -22.180  -3.326
  112    H    ASP  17           H        ASP  17   2.405 -15.260  -1.970
  113    HA   ASP  17           HA       ASP  17   1.132 -15.111  -4.503
  114   1HB   ASP  17          1HB       ASP  17  -0.428 -16.481  -2.965
  115   2HB   ASP  17          2HB       ASP  17  -0.660 -14.987  -2.043
  116    H    ARG  18           H        ARG  18   3.017 -13.786  -2.351
  117    HA   ARG  18           HA       ARG  18   1.578 -11.349  -1.861
  118   1HB   ARG  18          1HB       ARG  18   4.468 -12.049  -1.174
  119   2HB   ARG  18          2HB       ARG  18   3.515 -10.726  -0.481
  120   1HG   ARG  18          1HG       ARG  18   2.396 -12.118   0.945
  121   2HG   ARG  18          2HG       ARG  18   2.297 -13.436  -0.236
  122   1HD   ARG  18          1HD       ARG  18   4.567 -14.119   0.232
  123   2HD   ARG  18          2HD       ARG  18   4.885 -12.662   1.187
  124    HE   ARG  18           HE       ARG  18   2.648 -14.197   2.237
  125   1HH1  ARG  18          1HH1      ARG  18   6.161 -14.013   2.168
  126   2HH1  ARG  18          2HH1      ARG  18   6.362 -14.849   3.671
  127   1HH2  ARG  18          1HH2      ARG  18   2.912 -15.300   4.221
  128   2HH2  ARG  18          2HH2      ARG  18   4.501 -15.586   4.847
  129    H    VAL  19           H        VAL  19   3.058  -9.230  -2.203
  130    HA   VAL  19           HA       VAL  19   3.934  -9.367  -4.989
  131    HB   VAL  19           HB       VAL  19   3.238  -7.004  -3.231
  132   1HG1  VAL  19          1HG1      VAL  19   4.202  -7.275  -6.048
  133   2HG1  VAL  19          2HG1      VAL  19   2.974  -6.034  -5.700
  134   3HG1  VAL  19          3HG1      VAL  19   4.531  -6.010  -4.839
  135   1HG2  VAL  19          1HG2      VAL  19   1.246  -8.287  -3.560
  136   2HG2  VAL  19          2HG2      VAL  19   1.177  -6.910  -4.685
  137   3HG2  VAL  19          3HG2      VAL  19   1.610  -8.529  -5.285
  138    H    ASP  20           H        ASP  20   5.420 -10.208  -2.376
  139    HA   ASP  20           HA       ASP  20   7.333  -9.803  -1.346
  140   1HB   ASP  20          1HB       ASP  20   8.293 -11.131  -2.983
  141   2HB   ASP  20          2HB       ASP  20   7.854 -10.029  -4.296
  142    H    CYS  21           H        CYS  21   6.947  -7.644  -0.419
  143    HA   CYS  21           HA       CYS  21   7.087  -5.265  -1.704
  144   1HB   CYS  21          1HB       CYS  21   6.715  -5.997   0.831
  145   2HB   CYS  21          2HB       CYS  21   8.374  -5.412   0.974
  146    H    GLY  22           H        GLY  22   9.721  -7.437  -0.598
  147   1HA   GLY  22          1HA       GLY  22  11.970  -7.304  -0.790
  148   2HA   GLY  22          2HA       GLY  22  11.600  -6.808  -2.430
  149    H    TYR  23           H        TYR  23  11.566  -5.355   0.911
  150    HA   TYR  23           HA       TYR  23  12.378  -2.814  -0.246
  151   1HB   TYR  23          1HB       TYR  23  11.038  -3.954   2.136
  152   2HB   TYR  23          2HB       TYR  23  12.274  -2.787   2.618
  153    HD1  TYR  23           HD1      TYR  23   9.322  -3.170   0.343
  154    HD2  TYR  23           HD2      TYR  23  11.755  -0.506   2.643
  155    HE1  TYR  23           HE1      TYR  23   7.699  -1.269  -0.128
  156    HE2  TYR  23           HE2      TYR  23  10.124   1.385   2.165
  157    HH   TYR  23           HH       TYR  23   8.444   2.021   0.852
  158    HA   PRO  24           HA       PRO  24  16.508  -3.174   0.984
  159   1HB   PRO  24          1HB       PRO  24  17.203  -0.567   1.410
  160   2HB   PRO  24          2HB       PRO  24  17.111  -1.290  -0.195
  161   1HG   PRO  24          1HG       PRO  24  15.239   0.532   1.175
  162   2HG   PRO  24          2HG       PRO  24  15.388   0.193  -0.587
  163   1HD   PRO  24          1HD       PRO  24  13.390  -0.738   1.241
  164   2HD   PRO  24          2HD       PRO  24  13.587  -1.228  -0.447
  165    H    HIS  25           H        HIS  25  14.190  -1.975   3.121
  166    HA   HIS  25           HA       HIS  25  16.013  -2.654   5.300
  167   1HB   HIS  25          1HB       HIS  25  14.530  -0.117   4.851
  168   2HB   HIS  25          2HB       HIS  25  14.575  -0.740   6.504
  169    HD1  HIS  25           HD1      HIS  25  16.388   1.429   4.303
  170    HD2  HIS  25           HD2      HIS  25  17.478  -1.353   7.248
  171    HE1  HIS  25           HE1      HIS  25  18.779   2.008   4.983
  172    HE2  HIS  25           HE2      HIS  25  19.373   0.299   6.833
  173    H    VAL  26           H        VAL  26  14.480  -4.616   4.359
  174    HA   VAL  26           HA       VAL  26  11.833  -4.565   5.422
  175    HB   VAL  26           HB       VAL  26  12.061  -5.873   3.539
  176   1HG1  VAL  26          1HG1      VAL  26  14.286  -6.112   3.040
  177   2HG1  VAL  26          2HG1      VAL  26  14.719  -6.626   4.688
  178   3HG1  VAL  26          3HG1      VAL  26  13.925  -7.770   3.579
  179   1HG2  VAL  26          1HG2      VAL  26  11.022  -7.052   5.606
  180   2HG2  VAL  26          2HG2      VAL  26  11.392  -8.021   4.161
  181   3HG2  VAL  26          3HG2      VAL  26  12.484  -8.065   5.566
  182    H    THR  27           H        THR  27  11.180  -5.015   7.466
  183    HA   THR  27           HA       THR  27  12.529  -6.919   9.083
  184    HB   THR  27           HB       THR  27  13.618  -4.274   9.067
  185    HG1  THR  27           HG1      THR  27  14.791  -6.176   9.625
  186   1HG2  THR  27          1HG2      THR  27  11.961  -4.955  11.541
  187   2HG2  THR  27          2HG2      THR  27  13.411  -3.928  11.633
  188   3HG2  THR  27          3HG2      THR  27  12.017  -3.410  10.657
  189    HA   PRO  28           HA       PRO  28   8.672  -6.849  10.957
  190   1HB   PRO  28          1HB       PRO  28   9.196  -7.943  13.405
  191   2HB   PRO  28          2HB       PRO  28   9.020  -8.904  11.938
  192   1HG   PRO  28          1HG       PRO  28  11.452  -8.124  13.413
  193   2HG   PRO  28          2HG       PRO  28  11.237  -9.467  12.235
  194   1HD   PRO  28          1HD       PRO  28  12.535  -6.945  11.843
  195   2HD   PRO  28          2HD       PRO  28  12.209  -8.167  10.607
  196    H    LYS  29           H        LYS  29   9.395  -4.339  10.814
  197    HA   LYS  29           HA       LYS  29   8.043  -3.173  12.915
  198   1HB   LYS  29          1HB       LYS  29  10.225  -4.035  14.066
  199   2HB   LYS  29          2HB       LYS  29  10.962  -2.602  13.326
  200   1HG   LYS  29          1HG       LYS  29  10.016  -1.259  14.869
  201   2HG   LYS  29          2HG       LYS  29   8.402  -1.917  14.544
  202   1HD   LYS  29          1HD       LYS  29  10.140  -3.771  16.038
  203   2HD   LYS  29          2HD       LYS  29   9.870  -2.245  16.898
  204   1HE   LYS  29          1HE       LYS  29   8.051  -3.523  17.615
  205   2HE   LYS  29          2HE       LYS  29   7.336  -2.662  16.242
  206   1HZ   LYS  29          1HZ       LYS  29   7.688  -5.403  16.592
  207   2HZ   LYS  29          2HZ       LYS  29   6.935  -4.625  15.370
  208   3HZ   LYS  29          3HZ       LYS  29   8.533  -4.945  15.272
  209    H    GLU  30           H        GLU  30  10.252  -3.163  10.201
  210    HA   GLU  30           HA       GLU  30   9.793  -0.323   9.835
  211   1HB   GLU  30          1HB       GLU  30  11.910  -2.218   9.101
  212   2HB   GLU  30          2HB       GLU  30  11.424  -1.195   7.738
  213   1HG   GLU  30          1HG       GLU  30  13.236  -0.125   8.992
  214   2HG   GLU  30          2HG       GLU  30  11.755   0.826   9.180
  215    H    CYS  31           H        CYS  31   9.493  -3.509   8.132
  216    HA   CYS  31           HA       CYS  31   8.350  -2.572   5.816
  217   1HB   CYS  31          1HB       CYS  31   8.320  -5.160   7.285
  218   2HB   CYS  31          2HB       CYS  31   7.170  -4.947   5.961
  219    H    ASN  32           H        ASN  32   6.810  -3.701   8.910
  220    HA   ASN  32           HA       ASN  32   4.215  -3.193   8.054
  221   1HB   ASN  32          1HB       ASN  32   5.614  -3.848  10.587
  222   2HB   ASN  32          2HB       ASN  32   4.131  -2.915  10.832
  223   1HD2  ASN  32          1HD2      ASN  32   5.325  -5.551   8.746
  224   2HD2  ASN  32          2HD2      ASN  32   3.965  -6.607   8.929
  225    H    ASN  33           H        ASN  33   6.781  -1.074   8.583
  226    HA   ASN  33           HA       ASN  33   5.075   1.007   9.672
  227   1HB   ASN  33          1HB       ASN  33   7.339   0.545  10.719
  228   2HB   ASN  33          2HB       ASN  33   8.102   1.044   9.202
  229   1HD2  ASN  33          1HD2      ASN  33   9.041   2.474  11.004
  230   2HD2  ASN  33          2HD2      ASN  33   8.304   4.026  11.222
  231    H    ARG  34           H        ARG  34   6.855  -0.152   6.837
  232    HA   ARG  34           HA       ARG  34   6.757   2.383   5.531
  233   1HB   ARG  34          1HB       ARG  34   7.361  -0.278   4.199
  234   2HB   ARG  34          2HB       ARG  34   7.987   1.324   3.767
  235   1HG   ARG  34          1HG       ARG  34   8.805   0.997   6.412
  236   2HG   ARG  34          2HG       ARG  34   8.985  -0.632   5.740
  237   1HD   ARG  34          1HD       ARG  34  10.633   0.028   4.250
  238   2HD   ARG  34          2HD       ARG  34   9.998   1.672   4.091
  239    HE   ARG  34           HE       ARG  34  10.921   1.323   6.766
  240   1HH1  ARG  34          1HH1      ARG  34  12.222   1.500   3.501
  241   2HH1  ARG  34          2HH1      ARG  34  13.756   2.124   4.009
  242   1HH2  ARG  34          1HH2      ARG  34  12.946   2.145   7.436
  243   2HH2  ARG  34          2HH2      ARG  34  14.170   2.493   6.262
  244    H    GLY  35           H        GLY  35   4.810  -0.532   5.841
  245   1HA   GLY  35          1HA       GLY  35   2.460  -0.174   5.216
  246   2HA   GLY  35          2HA       GLY  35   3.036   0.431   3.675
  247    H    CYS  36           H        CYS  36   4.716  -2.257   5.280
  248    HA   CYS  36           HA       CYS  36   3.519  -4.054   3.297
  249   1HB   CYS  36          1HB       CYS  36   6.354  -4.127   4.335
  250   2HB   CYS  36          2HB       CYS  36   5.640  -5.229   3.154
  251    H    CYS  37           H        CYS  37   4.307  -6.496   4.190
  252    HA   CYS  37           HA       CYS  37   3.647  -6.514   7.041
  253   1HB   CYS  37          1HB       CYS  37   1.731  -7.100   5.418
  254   2HB   CYS  37          2HB       CYS  37   2.602  -8.614   5.160
  255    H    PHE  38           H        PHE  38   5.240  -7.575   8.175
  256    HA   PHE  38           HA       PHE  38   7.205  -9.056   6.662
  257   1HB   PHE  38          1HB       PHE  38   7.653  -7.323   8.506
  258   2HB   PHE  38          2HB       PHE  38   6.910  -8.434   9.661
  259    HD1  PHE  38           HD1      PHE  38   8.125 -10.305  10.507
  260    HD2  PHE  38           HD2      PHE  38   9.797  -7.906   7.433
  261    HE1  PHE  38           HE1      PHE  38  10.354 -11.405  10.860
  262    HE2  PHE  38           HE2      PHE  38  12.025  -9.006   7.785
  263    HZ   PHE  38           HZ       PHE  38  12.277 -10.743   9.494
  264    H    ASP  39           H        ASP  39   7.216 -11.244   6.454
  265    HA   ASP  39           HA       ASP  39   5.283 -12.702   7.995
  266   1HB   ASP  39          1HB       ASP  39   5.402 -13.208   5.637
  267   2HB   ASP  39          2HB       ASP  39   7.157 -13.433   5.704
  268    H    SER  40           H        SER  40   8.534 -13.815   6.858
  269    HA   SER  40           HA       SER  40  10.373 -14.287   8.013
  270   1HB   SER  40          1HB       SER  40   9.275 -12.780   9.913
  271   2HB   SER  40          2HB       SER  40   9.015 -14.347  10.702
  272    HG   SER  40           HG       SER  40  11.020 -13.722  11.410
  273    H    ARG  41           H        ARG  41   7.245 -15.726   8.201
  274    HA   ARG  41           HA       ARG  41   7.851 -18.035   9.602
  275   1HB   ARG  41          1HB       ARG  41   5.820 -17.469   7.399
  276   2HB   ARG  41          2HB       ARG  41   5.835 -18.978   8.330
  277   1HG   ARG  41          1HG       ARG  41   5.952 -16.987  10.287
  278   2HG   ARG  41          2HG       ARG  41   4.846 -16.305   9.082
  279   1HD   ARG  41          1HD       ARG  41   3.396 -17.536  10.454
  280   2HD   ARG  41          2HD       ARG  41   3.726 -18.698   9.159
  281    HE   ARG  41           HE       ARG  41   5.683 -18.994  11.237
  282   1HH1  ARG  41          1HH1      ARG  41   2.277 -19.608  10.606
  283   2HH1  ARG  41          2HH1      ARG  41   2.178 -20.933  11.718
  284   1HH2  ARG  41          1HH2      ARG  41   5.554 -20.741  12.704
  285   2HH2  ARG  41          2HH2      ARG  41   4.055 -21.582  12.919
  286    H    ILE  42           H        ILE  42   8.039 -17.163   6.099
  287    HA   ILE  42           HA       ILE  42   9.573 -19.636   5.692
  288    HB   ILE  42           HB       ILE  42   7.990 -18.341   3.506
  289   1HG1  ILE  42          1HG1      ILE  42   6.934 -20.120   5.692
  290   2HG1  ILE  42          2HG1      ILE  42   6.265 -18.596   5.082
  291   1HG2  ILE  42          1HG2      ILE  42   8.126 -20.454   2.457
  292   2HG2  ILE  42          2HG2      ILE  42   9.748 -20.127   3.116
  293   3HG2  ILE  42          3HG2      ILE  42   8.657 -21.253   3.956
  294   1HD1  ILE  42          1HD1      ILE  42   6.240 -21.345   3.801
  295   2HD1  ILE  42          2HD1      ILE  42   4.874 -20.248   4.113
  296   3HD1  ILE  42          3HD1      ILE  42   6.031 -19.879   2.812
  297    HA   PRO  43           HA       PRO  43  12.527 -16.531   4.741
  298   1HB   PRO  43          1HB       PRO  43  14.723 -18.146   4.897
  299   2HB   PRO  43          2HB       PRO  43  14.041 -17.312   6.291
  300   1HG   PRO  43          1HG       PRO  43  13.848 -20.147   5.497
  301   2HG   PRO  43          2HG       PRO  43  13.575 -19.414   7.118
  302   1HD   PRO  43          1HD       PRO  43  11.629 -20.360   5.241
  303   2HD   PRO  43          2HD       PRO  43  11.307 -19.502   6.754
  304    H    GLY  44           H        GLY  44  11.392 -19.067   2.995
  305   1HA   GLY  44          1HA       GLY  44  13.284 -18.706   0.793
  306   2HA   GLY  44          2HA       GLY  44  12.018 -19.910   0.925
  307    H    VAL  45           H        VAL  45  10.460 -17.209   1.989
  308    HA   VAL  45           HA       VAL  45   9.744 -16.371  -0.735
  309    HB   VAL  45           HB       VAL  45   7.510 -16.481  -0.259
  310   1HG1  VAL  45          1HG1      VAL  45   8.414 -18.653   1.641
  311   2HG1  VAL  45          2HG1      VAL  45   7.025 -18.652   0.529
  312   3HG1  VAL  45          3HG1      VAL  45   8.680 -18.757  -0.116
  313   1HG2  VAL  45          1HG2      VAL  45   6.476 -16.379   1.913
  314   2HG2  VAL  45          2HG2      VAL  45   8.051 -16.560   2.726
  315   3HG2  VAL  45          3HG2      VAL  45   7.687 -15.079   1.809
  316    HA   PRO  46           HA       PRO  46   9.989 -12.279   0.701
  317   1HB   PRO  46          1HB       PRO  46   7.618 -11.030   0.175
  318   2HB   PRO  46          2HB       PRO  46   8.834 -11.353  -1.061
  319   1HG   PRO  46          1HG       PRO  46   6.284 -12.730  -0.504
  320   2HG   PRO  46          2HG       PRO  46   7.259 -12.742  -2.017
  321   1HD   PRO  46          1HD       PRO  46   7.018 -14.797  -0.037
  322   2HD   PRO  46          2HD       PRO  46   8.113 -14.793  -1.426
  323    H    TRP  47           H        TRP  47  10.429 -11.709   2.727
  324    HA   TRP  47           HA       TRP  47   8.335 -12.277   4.665
  325   1HB   TRP  47          1HB       TRP  47  10.775 -11.103   5.698
  326   2HB   TRP  47          2HB       TRP  47   9.972 -12.618   6.120
  327    HD1  TRP  47           HD1      TRP  47  10.710 -14.812   4.559
  328    HE1  TRP  47           HE1      TRP  47  12.943 -15.440   3.302
  329    HE3  TRP  47           HE3      TRP  47  12.624 -10.101   4.505
  330    HZ2  TRP  47           HZ2      TRP  47  15.209 -13.930   2.445
  331    HZ3  TRP  47           HZ3      TRP  47  14.851  -9.765   3.439
  332    HH2  TRP  47           HH2      TRP  47  16.135 -11.585   2.432
  333    H    CYS  48           H        CYS  48   8.013 -10.156   2.602
  334    HA   CYS  48           HA       CYS  48   7.132  -8.115   4.310
  335   1HB   CYS  48          1HB       CYS  48   9.477  -7.525   4.454
  336   2HB   CYS  48          2HB       CYS  48   9.606  -7.468   2.693
  337    H    PHE  49           H        PHE  49   5.208  -7.811   3.237
  338    HA   PHE  49           HA       PHE  49   5.352  -7.143   0.416
  339   1HB   PHE  49          1HB       PHE  49   3.146  -8.766   0.445
  340   2HB   PHE  49          2HB       PHE  49   4.751  -9.385   0.045
  341    HD1  PHE  49           HD1      PHE  49   6.151 -10.222   2.106
  342    HD2  PHE  49           HD2      PHE  49   1.929  -9.799   2.101
  343    HE1  PHE  49           HE1      PHE  49   5.986 -11.840   4.019
  344    HE2  PHE  49           HE2      PHE  49   1.764 -11.418   4.012
  345    HZ   PHE  49           HZ       PHE  49   3.795 -12.418   4.948
  346    H    LYS  50           H        LYS  50   2.607  -7.056  -0.133
  347    HA   LYS  50           HA       LYS  50   1.638  -5.213   1.942
  348   1HB   LYS  50          1HB       LYS  50   0.487  -4.477  -0.509
  349   2HB   LYS  50          2HB       LYS  50   1.693  -3.583   0.433
  350   1HG   LYS  50          1HG       LYS  50   2.562  -5.841  -1.373
  351   2HG   LYS  50          2HG       LYS  50   2.190  -4.259  -2.082
  352   1HD   LYS  50          1HD       LYS  50   4.272  -4.912   0.039
  353   2HD   LYS  50          2HD       LYS  50   4.573  -4.328  -1.606
  354   1HE   LYS  50          1HE       LYS  50   3.452  -2.836   0.779
  355   2HE   LYS  50          2HE       LYS  50   4.823  -2.392  -0.249
  356   1HZ   LYS  50          1HZ       LYS  50   1.983  -2.101  -0.743
  357   2HZ   LYS  50          2HZ       LYS  50   3.205  -1.065  -1.064
  358   3HZ   LYS  50          3HZ       LYS  50   2.953  -2.356  -2.031
  359    HA   PRO  51           HA       PRO  51  -1.324  -8.588   1.329
  360   1HB   PRO  51          1HB       PRO  51  -1.481  -9.416   3.926
  361   2HB   PRO  51          2HB       PRO  51  -0.423 -10.171   2.738
  362   1HG   PRO  51          1HG       PRO  51   0.214  -8.298   4.925
  363   2HG   PRO  51          2HG       PRO  51   1.320  -9.416   4.047
  364   1HD   PRO  51          1HD       PRO  51   1.071  -6.577   3.766
  365   2HD   PRO  51          2HD       PRO  51   2.056  -7.653   2.768
  366    H    LEU  52           H        LEU  52  -2.055  -7.968   4.598
  367    HA   LEU  52           HA       LEU  52  -4.461  -6.620   3.708
  368   1HB   LEU  52          1HB       LEU  52  -5.425  -7.389   5.555
  369   2HB   LEU  52          2HB       LEU  52  -4.090  -8.553   5.508
  370    HG   LEU  52           HG       LEU  52  -4.533  -6.204   7.327
  371   1HD1  LEU  52          1HD1      LEU  52  -5.260  -8.018   8.471
  372   2HD1  LEU  52          2HD1      LEU  52  -4.221  -9.149   7.572
  373   3HD1  LEU  52          3HD1      LEU  52  -3.531  -8.149   8.874
  374   1HD2  LEU  52          1HD2      LEU  52  -1.965  -7.211   7.895
  375   2HD2  LEU  52          2HD2      LEU  52  -1.997  -6.886   6.145
  376   3HD2  LEU  52          3HD2      LEU  52  -2.401  -5.592   7.299
  377    H    GLN  53           H        GLN  53  -1.875  -5.260   3.375
  378    HA   GLN  53           HA       GLN  53  -1.295  -3.525   5.393
  379   1HB   GLN  53          1HB       GLN  53  -1.166  -3.149   2.379
  380   2HB   GLN  53          2HB       GLN  53  -0.418  -2.028   3.533
  381   1HG   GLN  53          1HG       GLN  53   0.194  -4.996   3.197
  382   2HG   GLN  53          2HG       GLN  53   1.248  -3.653   2.730
  383   1HE2  GLN  53          1HE2      GLN  53   1.083  -1.953   4.808
  384   2HE2  GLN  53          2HE2      GLN  53   1.703  -2.655   6.265
  385    H    GLU  54           H        GLU  54  -4.096  -3.638   3.284
  386    HA   GLU  54           HA       GLU  54  -4.931  -1.160   2.990
  387   1HB   GLU  54          1HB       GLU  54  -6.372  -2.858   2.254
  388   2HB   GLU  54          2HB       GLU  54  -6.440  -3.642   3.841
  389   1HG   GLU  54          1HG       GLU  54  -7.420  -0.834   3.759
  390   2HG   GLU  54          2HG       GLU  54  -8.395  -1.988   2.836
  391    H    ALA  55           H        ALA  55  -4.490  -2.816   6.081
  392    HA   ALA  55           HA       ALA  55  -6.069  -1.596   7.835
  393   1HB   ALA  55          1HB       ALA  55  -4.630  -2.728   9.136
  394   2HB   ALA  55          2HB       ALA  55  -3.425  -2.768   7.827
  395   3HB   ALA  55          3HB       ALA  55  -3.468  -1.393   8.956
  396    H    GLU  56           H        GLU  56  -2.984  -0.131   6.582
  397    HA   GLU  56           HA       GLU  56  -4.260   2.447   6.926
  398   1HB   GLU  56          1HB       GLU  56  -2.589   1.630   8.865
  399   2HB   GLU  56          2HB       GLU  56  -1.376   2.264   7.740
  400   1HG   GLU  56          1HG       GLU  56  -2.956   4.360   7.632
  401   2HG   GLU  56          2HG       GLU  56  -3.643   3.721   9.132
  402    H    CYS  57           H        CYS  57  -3.455   0.515   4.683
  403    HA   CYS  57           HA       CYS  57  -1.412   2.106   3.363
  404   1HB   CYS  57          1HB       CYS  57  -1.647  -0.543   3.505
  405   2HB   CYS  57          2HB       CYS  57  -2.623  -0.278   2.058
  406    H    THR  58           H        THR  58  -4.417   0.413   2.210
  407    HA   THR  58           HA       THR  58  -4.919   2.302   0.194
  408    HB   THR  58           HB       THR  58  -5.743  -0.237   0.783
  409    HG1  THR  58           HG1      THR  58  -6.532   0.243  -1.230
  410   1HG2  THR  58          1HG2      THR  58  -8.076  -0.283   1.354
  411   2HG2  THR  58          2HG2      THR  58  -7.350   0.799   2.567
  412   3HG2  THR  58          3HG2      THR  58  -8.232   1.482   1.180
  413    H    PHE  59           H        PHE  59  -6.117   2.000   3.570
  414    HA   PHE  59           HA       PHE  59  -8.158   3.655   3.700
  415   1HB   PHE  59          1HB       PHE  59  -6.995   2.655   5.645
  416   2HB   PHE  59          2HB       PHE  59  -5.567   3.656   5.356
  417    HD1  PHE  59           HD1      PHE  59  -5.317   5.593   6.593
  418    HD2  PHE  59           HD2      PHE  59  -9.210   3.975   6.104
  419    HE1  PHE  59           HE1      PHE  59  -6.235   7.324   8.161
  420    HE2  PHE  59           HE2      PHE  59 -10.127   5.706   7.673
  421    HZ   PHE  59           HZ       PHE  59  -8.628   7.360   8.683
  422   1H    GLU   1           H1       GLU   1 -22.990  -0.781  -2.584
  423    HA   GLU   1           HA       GLU   1 -20.604  -0.834  -3.279
  424   1HB   GLU   1          1HB       GLU   1 -20.864   1.733  -4.124
  425   2HB   GLU   1          2HB       GLU   1 -21.730   0.375  -4.864
  426   1HG   GLU   1          1HG       GLU   1 -23.740   0.905  -3.768
  427   2HG   GLU   1          2HG       GLU   1 -22.930   1.819  -2.487
  428    H    GLU   2           H        GLU   2 -19.522  -0.996  -1.044
  429    HA   GLU   2           HA       GLU   2 -18.802   1.572   0.036
  430   1HB   GLU   2          1HB       GLU   2 -19.410  -0.562   1.378
  431   2HB   GLU   2          2HB       GLU   2 -17.769  -1.111   1.003
  432   1HG   GLU   2          1HG       GLU   2 -17.025   0.111   2.742
  433   2HG   GLU   2          2HG       GLU   2 -17.520   1.582   1.891
  434    H    TYR   3           H        TYR   3 -17.784  -0.297  -2.526
  435    HA   TYR   3           HA       TYR   3 -14.937   0.075  -2.074
  436   1HB   TYR   3          1HB       TYR   3 -15.170  -0.966  -4.556
  437   2HB   TYR   3          2HB       TYR   3 -15.427  -1.998  -3.146
  438    HD1  TYR   3           HD1      TYR   3 -17.615   0.535  -4.851
  439    HD2  TYR   3           HD2      TYR   3 -17.088  -3.539  -3.657
  440    HE1  TYR   3           HE1      TYR   3 -19.946  -0.022  -5.699
  441    HE2  TYR   3           HE2      TYR   3 -19.422  -4.083  -4.508
  442    HH   TYR   3           HH       TYR   3 -21.118  -2.054  -6.532
  443    H    VAL   4           H        VAL   4 -15.549   2.553  -2.002
  444    HA   VAL   4           HA       VAL   4 -15.256   3.531  -4.755
  445    HB   VAL   4           HB       VAL   4 -17.506   3.974  -4.008
  446   1HG1  VAL   4          1HG1      VAL   4 -18.083   5.124  -2.013
  447   2HG1  VAL   4          2HG1      VAL   4 -16.914   3.872  -1.534
  448   3HG1  VAL   4          3HG1      VAL   4 -16.391   5.566  -1.685
  449   1HG2  VAL   4          1HG2      VAL   4 -17.416   5.943  -5.051
  450   2HG2  VAL   4          2HG2      VAL   4 -16.680   6.712  -3.625
  451   3HG2  VAL   4          3HG2      VAL   4 -15.648   5.931  -4.848
  452    H    GLY   5           H        GLY   5 -14.843   4.311  -1.232
  453   1HA   GLY   5          1HA       GLY   5 -12.869   6.303  -1.701
  454   2HA   GLY   5          2HA       GLY   5 -13.279   5.545  -0.175
  455    H    LEU   6           H        LEU   6 -12.681   3.096  -2.464
  456    HA   LEU   6           HA       LEU   6  -9.807   3.107  -2.072
  457   1HB   LEU   6          1HB       LEU   6  -9.756   0.898  -1.123
  458   2HB   LEU   6          2HB       LEU   6 -10.627   2.023  -0.066
  459    HG   LEU   6           HG       LEU   6 -11.733  -0.107  -0.050
  460   1HD1  LEU   6          1HD1      LEU   6 -13.033   2.158  -0.268
  461   2HD1  LEU   6          2HD1      LEU   6 -13.539   1.485  -1.836
  462   3HD1  LEU   6          3HD1      LEU   6 -13.902   0.606  -0.332
  463   1HD2  LEU   6          1HD2      LEU   6 -10.789  -0.761  -2.345
  464   2HD2  LEU   6          2HD2      LEU   6 -12.416  -1.340  -1.915
  465   3HD2  LEU   6          3HD2      LEU   6 -12.226   0.042  -3.020
  466    H    SER   7           H        SER   7 -11.910   3.405  -4.262
  467    HA   SER   7           HA       SER   7 -11.190   1.034  -5.789
  468   1HB   SER   7          1HB       SER   7 -13.060   1.742  -7.311
  469   2HB   SER   7          2HB       SER   7 -13.591   1.357  -5.665
  470    HG   SER   7           HG       SER   7 -13.491   3.851  -7.031
  471    H    ALA   8           H        ALA   8 -10.650   1.410  -8.150
  472    HA   ALA   8           HA       ALA   8  -8.635   3.323  -8.401
  473   1HB   ALA   8          1HB       ALA   8  -8.222   2.233 -10.358
  474   2HB   ALA   8          2HB       ALA   8  -9.397   1.057  -9.721
  475   3HB   ALA   8          3HB       ALA   8  -9.923   2.304 -10.877
  476    H    ASN   9           H        ASN   9  -9.612   5.344  -7.708
  477    HA   ASN   9           HA       ASN   9 -10.393   6.912  -9.821
  478   1HB   ASN   9          1HB       ASN   9 -12.559   5.715  -9.702
  479   2HB   ASN   9          2HB       ASN   9 -12.703   6.096  -7.980
  480   1HD2  ASN   9          1HD2      ASN   9 -11.655   7.994 -10.802
  481   2HD2  ASN   9          2HD2      ASN   9 -12.809   9.277 -10.648
  482    H    GLN  10           H        GLN  10 -10.481   6.132  -6.330
  483    HA   GLN  10           HA       GLN  10 -10.891   8.676  -5.348
  484   1HB   GLN  10          1HB       GLN  10 -10.930   6.451  -4.105
  485   2HB   GLN  10          2HB       GLN  10  -9.161   6.541  -4.035
  486   1HG   GLN  10          1HG       GLN  10  -9.343   8.730  -2.868
  487   2HG   GLN  10          2HG       GLN  10 -11.109   8.619  -2.924
  488   1HE2  GLN  10          1HE2      GLN  10  -8.299   6.600  -2.058
  489   2HE2  GLN  10          2HE2      GLN  10  -8.925   5.982  -0.566
  490    H    CYS  11           H        CYS  11  -8.011   7.094  -6.694
  491    HA   CYS  11           HA       CYS  11  -6.115   8.842  -5.606
  492   1HB   CYS  11          1HB       CYS  11  -5.468   6.713  -6.488
  493   2HB   CYS  11          2HB       CYS  11  -6.072   7.127  -8.095
  494    H    ALA  12           H        ALA  12  -8.723   9.393  -7.691
  495    HA   ALA  12           HA       ALA  12  -7.321  11.543  -9.112
  496   1HB   ALA  12          1HB       ALA  12  -8.972  11.357 -10.787
  497   2HB   ALA  12          2HB       ALA  12  -8.660   9.669 -10.313
  498   3HB   ALA  12          3HB       ALA  12 -10.106  10.513  -9.706
  499    H    VAL  13           H        VAL  13  -8.258  11.433  -6.195
  500    HA   VAL  13           HA       VAL  13 -10.543  12.746  -5.673
  501    HB   VAL  13           HB       VAL  13  -8.874  13.977  -3.940
  502   1HG1  VAL  13          1HG1      VAL  13  -9.856  11.108  -3.919
  503   2HG1  VAL  13          2HG1      VAL  13  -9.160  11.927  -2.500
  504   3HG1  VAL  13          3HG1      VAL  13 -10.659  12.543  -3.238
  505   1HG2  VAL  13          1HG2      VAL  13  -7.398  11.411  -4.524
  506   2HG2  VAL  13          2HG2      VAL  13  -6.939  12.940  -5.310
  507   3HG2  VAL  13          3HG2      VAL  13  -6.890  12.801  -3.536
  508    HA   PRO  14           HA       PRO  14 -10.295  16.767  -7.238
  509   1HB   PRO  14          1HB       PRO  14 -11.388  18.338  -5.288
  510   2HB   PRO  14          2HB       PRO  14 -12.352  17.361  -6.394
  511   1HG   PRO  14          1HG       PRO  14 -11.661  16.896  -3.563
  512   2HG   PRO  14          2HG       PRO  14 -13.005  16.180  -4.524
  513   1HD   PRO  14          1HD       PRO  14 -10.544  14.958  -3.718
  514   2HD   PRO  14          2HD       PRO  14 -11.761  14.266  -4.797
  515    H    ALA  15           H        ALA  15  -8.228  15.817  -4.963
  516    HA   ALA  15           HA       ALA  15  -6.153  16.584  -4.585
  517   1HB   ALA  15          1HB       ALA  15  -6.735  18.069  -6.747
  518   2HB   ALA  15          2HB       ALA  15  -6.705  19.369  -5.531
  519   3HB   ALA  15          3HB       ALA  15  -5.271  18.344  -5.773
  520    H    LYS  16           H        LYS  16  -8.063  16.383  -2.633
  521    HA   LYS  16           HA       LYS  16  -7.093  17.926  -0.606
  522   1HB   LYS  16          1HB       LYS  16  -9.309  19.379  -0.365
  523   2HB   LYS  16          2HB       LYS  16  -7.864  19.978  -1.197
  524   1HG   LYS  16          1HG       LYS  16  -8.886  19.947  -3.231
  525   2HG   LYS  16          2HG       LYS  16  -9.704  18.407  -2.918
  526   1HD   LYS  16          1HD       LYS  16 -11.605  19.587  -2.656
  527   2HD   LYS  16          2HD       LYS  16 -10.925  20.246  -1.158
  528   1HE   LYS  16          1HE       LYS  16 -10.421  22.268  -2.130
  529   2HE   LYS  16          2HE       LYS  16 -10.026  21.548  -3.698
  530   1HZ   LYS  16          1HZ       LYS  16 -12.381  21.250  -4.060
  531   2HZ   LYS  16          2HZ       LYS  16 -12.731  21.916  -2.611
  532   3HZ   LYS  16          3HZ       LYS  16 -12.045  22.824  -3.782
  533    H    ASP  17           H        ASP  17  -7.768  15.253  -1.064
  534    HA   ASP  17           HA       ASP  17  -9.681  14.935   1.052
  535   1HB   ASP  17          1HB       ASP  17 -11.028  14.838  -1.047
  536   2HB   ASP  17          2HB       ASP  17  -9.995  13.529  -1.642
  537    H    ARG  18           H        ARG  18  -6.701  14.482  -0.013
  538    HA   ARG  18           HA       ARG  18  -6.553  11.625   0.305
  539   1HB   ARG  18          1HB       ARG  18  -4.246  13.567  -0.117
  540   2HB   ARG  18          2HB       ARG  18  -4.262  11.830  -0.469
  541   1HG   ARG  18          1HG       ARG  18  -5.260  12.142  -2.487
  542   2HG   ARG  18          2HG       ARG  18  -6.397  13.346  -1.857
  543   1HD   ARG  18          1HD       ARG  18  -4.574  15.050  -1.907
  544   2HD   ARG  18          2HD       ARG  18  -3.466  13.844  -2.577
  545    HE   ARG  18           HE       ARG  18  -5.994  14.315  -4.055
  546   1HH1  ARG  18          1HH1      ARG  18  -2.538  14.924  -3.800
  547   2HH1  ARG  18          2HH1      ARG  18  -2.378  15.445  -5.444
  548   1HH2  ARG  18          1HH2      ARG  18  -5.785  15.003  -6.224
  549   2HH2  ARG  18          2HH2      ARG  18  -4.238  15.490  -6.832
  550    H    VAL  19           H        VAL  19  -4.394  10.953   1.667
  551    HA   VAL  19           HA       VAL  19  -4.715  12.297   4.251
  552    HB   VAL  19           HB       VAL  19  -3.572   9.568   3.641
  553   1HG1  VAL  19          1HG1      VAL  19  -3.731  11.189   6.028
  554   2HG1  VAL  19          2HG1      VAL  19  -4.671   9.693   6.236
  555   3HG1  VAL  19          3HG1      VAL  19  -2.951   9.607   5.783
  556   1HG2  VAL  19          1HG2      VAL  19  -5.940   9.738   2.917
  557   2HG2  VAL  19          2HG2      VAL  19  -5.715   8.623   4.287
  558   3HG2  VAL  19          3HG2      VAL  19  -6.384  10.250   4.564
  559    H    ASP  20           H        ASP  20  -2.990  13.011   1.750
  560    HA   ASP  20           HA       ASP  20  -0.889  13.460   1.252
  561   1HB   ASP  20          1HB       ASP  20  -1.190  15.474   2.348
  562   2HB   ASP  20          2HB       ASP  20  -1.520  14.705   3.908
  563    H    CYS  21           H        CYS  21   0.080  11.292   1.189
  564    HA   CYS  21           HA       CYS  21   0.853   9.803   3.330
  565   1HB   CYS  21          1HB       CYS  21   0.997   9.508   0.674
  566   2HB   CYS  21          2HB       CYS  21   2.700   9.840   1.004
  567    H    GLY  22           H        GLY  22   2.420  12.632   1.774
  568   1HA   GLY  22          1HA       GLY  22   4.192  13.889   2.350
  569   2HA   GLY  22          2HA       GLY  22   3.783  13.497   4.007
  570    H    TYR  23           H        TYR  23   5.206  11.747   1.144
  571    HA   TYR  23           HA       TYR  23   7.002  10.361   2.961
  572   1HB   TYR  23          1HB       TYR  23   5.726  10.075   0.322
  573   2HB   TYR  23          2HB       TYR  23   7.467   9.821   0.166
  574    HD1  TYR  23           HD1      TYR  23   8.562   8.011   1.556
  575    HD2  TYR  23           HD2      TYR  23   4.314   8.421   1.257
  576    HE1  TYR  23           HE1      TYR  23   8.267   5.625   2.383
  577    HE2  TYR  23           HE2      TYR  23   4.033   6.034   2.085
  578    HH   TYR  23           HH       TYR  23   6.839   4.138   3.108
  579    HA   PRO  24           HA       PRO  24  10.326  12.982   2.019
  580   1HB   PRO  24          1HB       PRO  24  12.375  11.462   2.996
  581   2HB   PRO  24          2HB       PRO  24  11.364  12.486   4.013
  582   1HG   PRO  24          1HG       PRO  24  11.336   9.559   3.646
  583   2HG   PRO  24          2HG       PRO  24  10.660  10.526   5.005
  584   1HD   PRO  24          1HD       PRO  24   9.258   9.255   2.855
  585   2HD   PRO  24          2HD       PRO  24   8.566  10.329   4.077
  586    H    HIS  25           H        HIS  25   9.634  10.193   0.443
  587    HA   HIS  25           HA       HIS  25  11.789  10.773  -1.453
  588   1HB   HIS  25          1HB       HIS  25  11.594   8.476   0.060
  589   2HB   HIS  25          2HB       HIS  25  10.834   8.000  -1.465
  590    HD1  HIS  25           HD1      HIS  25  12.527   9.200  -3.599
  591    HD2  HIS  25           HD2      HIS  25  14.188   7.708  -0.049
  592    HE1  HIS  25           HE1      HIS  25  14.974   8.691  -4.113
  593    HE2  HIS  25           HE2      HIS  25  15.955   7.829  -1.880
  594    H    VAL  26           H        VAL  26   8.740  11.435  -0.984
  595    HA   VAL  26           HA       VAL  26   7.073  10.234  -2.688
  596    HB   VAL  26           HB       VAL  26   6.270  12.016  -1.428
  597   1HG1  VAL  26          1HG1      VAL  26   8.774  13.201  -1.940
  598   2HG1  VAL  26          2HG1      VAL  26   7.561  14.334  -2.586
  599   3HG1  VAL  26          3HG1      VAL  26   7.476  13.813  -0.885
  600   1HG2  VAL  26          1HG2      VAL  26   5.028  13.293  -2.945
  601   2HG2  VAL  26          2HG2      VAL  26   6.353  13.353  -4.133
  602   3HG2  VAL  26          3HG2      VAL  26   5.453  11.839  -3.880
  603    H    THR  27           H        THR  27   6.984   9.733  -4.821
  604    HA   THR  27           HA       THR  27   8.023  11.469  -6.812
  605    HB   THR  27           HB       THR  27   9.852   9.574  -5.581
  606    HG1  THR  27           HG1      THR  27  11.065  11.166  -6.540
  607   1HG2  THR  27          1HG2      THR  27  10.138   7.957  -7.168
  608   2HG2  THR  27          2HG2      THR  27   8.676   8.549  -7.996
  609   3HG2  THR  27          3HG2      THR  27  10.273   9.205  -8.431
  610    HA   PRO  28           HA       PRO  28   5.216   9.163  -9.092
  611   1HB   PRO  28          1HB       PRO  28   6.005   9.690 -11.652
  612   2HB   PRO  28          2HB       PRO  28   5.043  10.810 -10.691
  613   1HG   PRO  28          1HG       PRO  28   7.915  10.874 -11.366
  614   2HG   PRO  28          2HG       PRO  28   6.861  12.225 -10.816
  615   1HD   PRO  28          1HD       PRO  28   8.828  10.779  -9.320
  616   2HD   PRO  28          2HD       PRO  28   7.705  11.992  -8.690
  617    H    LYS  29           H        LYS  29   7.023   7.504  -7.928
  618    HA   LYS  29           HA       LYS  29   6.791   5.263  -9.527
  619   1HB   LYS  29          1HB       LYS  29   8.591   6.748 -10.767
  620   2HB   LYS  29          2HB       LYS  29   9.681   6.031  -9.569
  621   1HG   LYS  29          1HG       LYS  29   9.549   3.961 -10.515
  622   2HG   LYS  29          2HG       LYS  29   7.816   4.107 -10.862
  623   1HD   LYS  29          1HD       LYS  29   8.212   5.279 -12.885
  624   2HD   LYS  29          2HD       LYS  29   9.877   5.690 -12.438
  625   1HE   LYS  29          1HE       LYS  29  10.036   3.943 -14.064
  626   2HE   LYS  29          2HE       LYS  29  10.368   3.165 -12.509
  627   1HZ   LYS  29          1HZ       LYS  29   8.719   1.816 -13.014
  628   2HZ   LYS  29          2HZ       LYS  29   7.664   3.053 -12.861
  629   3HZ   LYS  29          3HZ       LYS  29   8.282   2.683 -14.327
  630    H    GLU  30           H        GLU  30   8.029   7.125  -6.867
  631    HA   GLU  30           HA       GLU  30   8.973   4.728  -5.551
  632   1HB   GLU  30          1HB       GLU  30   9.512   7.594  -5.356
  633   2HB   GLU  30          2HB       GLU  30   9.212   6.882  -3.761
  634   1HG   GLU  30          1HG       GLU  30  11.549   6.643  -4.121
  635   2HG   GLU  30          2HG       GLU  30  10.885   5.037  -4.458
  636    H    CYS  31           H        CYS  31   6.513   7.354  -5.243
  637    HA   CYS  31           HA       CYS  31   5.441   6.604  -2.828
  638   1HB   CYS  31          1HB       CYS  31   4.271   7.940  -5.250
  639   2HB   CYS  31          2HB       CYS  31   3.289   7.617  -3.820
  640    H    ASN  32           H        ASN  32   4.416   5.672  -6.199
  641    HA   ASN  32           HA       ASN  32   2.464   3.909  -5.399
  642   1HB   ASN  32          1HB       ASN  32   4.065   4.422  -7.871
  643   2HB   ASN  32          2HB       ASN  32   3.308   2.824  -7.786
  644   1HD2  ASN  32          1HD2      ASN  32   2.405   6.105  -6.726
  645   2HD2  ASN  32          2HD2      ASN  32   0.866   6.176  -7.519
  646    H    ASN  33           H        ASN  33   5.883   3.771  -5.061
  647    HA   ASN  33           HA       ASN  33   6.007   0.902  -5.260
  648   1HB   ASN  33          1HB       ASN  33   7.836   2.743  -5.919
  649   2HB   ASN  33          2HB       ASN  33   8.283   2.607  -4.213
  650   1HD2  ASN  33          1HD2      ASN  33  10.306   1.875  -5.231
  651   2HD2  ASN  33          2HD2      ASN  33  10.504   0.195  -5.601
  652    H    ARG  34           H        ARG  34   5.847   3.579  -2.917
  653    HA   ARG  34           HA       ARG  34   6.564   1.875  -0.734
  654   1HB   ARG  34          1HB       ARG  34   5.363   4.650  -0.480
  655   2HB   ARG  34          2HB       ARG  34   6.517   3.854   0.605
  656   1HG   ARG  34          1HG       ARG  34   7.822   3.911  -1.877
  657   2HG   ARG  34          2HG       ARG  34   7.005   5.482  -1.794
  658   1HD   ARG  34          1HD       ARG  34   8.317   6.207  -0.052
  659   2HD   ARG  34          2HD       ARG  34   8.402   4.606   0.701
  660    HE   ARG  34           HE       ARG  34   9.855   4.756  -1.828
  661   1HH1  ARG  34          1HH1      ARG  34  10.064   5.398   1.626
  662   2HH1  ARG  34          2HH1      ARG  34  11.793   5.296   1.670
  663   1HH2  ARG  34          1HH2      ARG  34  12.136   4.622  -1.771
  664   2HH2  ARG  34          2HH2      ARG  34  12.979   4.853  -0.276
  665    H    GLY  35           H        GLY  35   3.695   3.030  -2.424
  666   1HA   GLY  35          1HA       GLY  35   1.722   1.625  -2.057
  667   2HA   GLY  35          2HA       GLY  35   1.990   1.808  -0.336
  668    H    CYS  36           H        CYS  36   2.660   4.540  -2.493
  669    HA   CYS  36           HA       CYS  36   0.177   5.776  -1.545
  670   1HB   CYS  36          1HB       CYS  36   2.874   7.075  -1.942
  671   2HB   CYS  36          2HB       CYS  36   1.380   7.933  -1.553
  672    H    CYS  37           H        CYS  37  -0.398   7.736  -3.083
  673    HA   CYS  37           HA       CYS  37   0.148   6.850  -5.822
  674   1HB   CYS  37          1HB       CYS  37  -2.225   6.675  -4.836
  675   2HB   CYS  37          2HB       CYS  37  -2.278   8.432  -5.012
  676    H    PHE  38           H        PHE  38   1.157   8.351  -7.145
  677    HA   PHE  38           HA       PHE  38   1.709  10.943  -5.955
  678   1HB   PHE  38          1HB       PHE  38   3.433   9.328  -7.001
  679   2HB   PHE  38          2HB       PHE  38   2.662   9.620  -8.564
  680    HD1  PHE  38           HD1      PHE  38   4.499  11.265  -5.797
  681    HD2  PHE  38           HD2      PHE  38   3.233  11.513  -9.840
  682    HE1  PHE  38           HE1      PHE  38   5.975  13.266  -6.137
  683    HE2  PHE  38           HE2      PHE  38   4.711  13.513 -10.180
  684    HZ   PHE  38           HZ       PHE  38   6.065  14.366  -8.324
  685    H    ASP  39           H        ASP  39   0.509  12.704  -6.475
  686    HA   ASP  39           HA       ASP  39  -1.307  12.502  -8.657
  687   1HB   ASP  39          1HB       ASP  39  -2.005  13.600  -6.593
  688   2HB   ASP  39          2HB       ASP  39  -0.653  14.740  -6.688
  689    H    SER  40           H        SER  40   0.698  15.368  -7.699
  690    HA   SER  40           HA       SER  40   2.312  16.424  -8.786
  691   1HB   SER  40          1HB       SER  40   2.587  14.113 -10.083
  692   2HB   SER  40          2HB       SER  40   1.865  15.029 -11.418
  693    HG   SER  40           HG       SER  40   4.001  15.450 -11.682
  694    H    ARG  41           H        ARG  41  -0.949  15.910  -9.742
  695    HA   ARG  41           HA       ARG  41  -1.118  17.708 -11.850
  696   1HB   ARG  41          1HB       ARG  41  -3.201  16.823  -9.803
  697   2HB   ARG  41          2HB       ARG  41  -3.593  17.712 -11.285
  698   1HG   ARG  41          1HG       ARG  41  -2.024  15.604 -12.204
  699   2HG   ARG  41          2HG       ARG  41  -2.958  14.851 -10.900
  700   1HD   ARG  41          1HD       ARG  41  -4.709  14.711 -12.315
  701   2HD   ARG  41          2HD       ARG  41  -4.792  16.479 -12.353
  702    HE   ARG  41           HE       ARG  41  -2.722  15.601 -14.126
  703   1HH1  ARG  41          1HH1      ARG  41  -6.231  15.584 -13.857
  704   2HH1  ARG  41          2HH1      ARG  41  -6.489  15.553 -15.570
  705   1HH2  ARG  41          1HH2      ARG  41  -3.063  15.561 -16.385
  706   2HH2  ARG  41          2HH2      ARG  41  -4.675  15.540 -17.017
  707    H    ILE  42           H        ILE  42  -1.607  18.028  -8.276
  708    HA   ILE  42           HA       ILE  42  -1.511  20.941  -8.653
  709    HB   ILE  42           HB       ILE  42  -2.929  19.646  -6.354
  710   1HG1  ILE  42          1HG1      ILE  42  -3.896  19.888  -9.181
  711   2HG1  ILE  42          2HG1      ILE  42  -4.110  18.560  -8.026
  712   1HG2  ILE  42          1HG2      ILE  42  -4.002  21.712  -6.111
  713   2HG2  ILE  42          2HG2      ILE  42  -2.318  22.131  -6.506
  714   3HG2  ILE  42          3HG2      ILE  42  -3.577  22.234  -7.759
  715   1HD1  ILE  42          1HD1      ILE  42  -5.611  21.163  -8.277
  716   2HD1  ILE  42          2HD1      ILE  42  -6.233  19.522  -7.980
  717   3HD1  ILE  42          3HD1      ILE  42  -5.451  20.428  -6.663
  718    HA   PRO  43           HA       PRO  43   2.074  20.270  -6.230
  719   1HB   PRO  43          1HB       PRO  43   3.153  22.755  -6.575
  720   2HB   PRO  43          2HB       PRO  43   3.420  21.423  -7.699
  721   1HG   PRO  43          1HG       PRO  43   1.660  23.778  -7.935
  722   2HG   PRO  43          2HG       PRO  43   2.284  22.709  -9.241
  723   1HD   PRO  43          1HD       PRO  43  -0.345  22.788  -8.108
  724   2HD   PRO  43          2HD       PRO  43   0.265  21.610  -9.279
  725    H    GLY  44           H        GLY  44  -0.602  22.094  -5.638
  726   1HA   GLY  44          1HA       GLY  44   0.456  23.236  -3.159
  727   2HA   GLY  44          2HA       GLY  44  -1.101  23.550  -3.896
  728    H    VAL  45           H        VAL  45  -0.781  20.263  -4.221
  729    HA   VAL  45           HA       VAL  45  -1.951  19.770  -1.569
  730    HB   VAL  45           HB       VAL  45  -3.652  18.559  -2.472
  731   1HG1  VAL  45          1HG1      VAL  45  -4.035  20.805  -3.220
  732   2HG1  VAL  45          2HG1      VAL  45  -2.962  20.584  -4.623
  733   3HG1  VAL  45          3HG1      VAL  45  -4.511  19.710  -4.540
  734   1HG2  VAL  45          1HG2      VAL  45  -3.635  17.430  -4.644
  735   2HG2  VAL  45          2HG2      VAL  45  -2.038  18.126  -5.008
  736   3HG2  VAL  45          3HG2      VAL  45  -2.217  16.960  -3.676
  737    HA   PRO  46           HA       PRO  46   0.709  16.360  -1.260
  738   1HB   PRO  46          1HB       PRO  46  -0.809  14.194  -0.578
  739   2HB   PRO  46          2HB       PRO  46  -0.351  15.450   0.571
  740   1HG   PRO  46          1HG       PRO  46  -2.926  14.966  -0.784
  741   2HG   PRO  46          2HG       PRO  46  -2.605  15.918   0.709
  742   1HD   PRO  46          1HD       PRO  46  -3.163  16.880  -1.929
  743   2HD   PRO  46          2HD       PRO  46  -2.697  17.854  -0.528
  744    H    TRP  47           H        TRP  47   1.958  15.697  -2.883
  745    HA   TRP  47           HA       TRP  47   0.575  14.428  -5.099
  746   1HB   TRP  47          1HB       TRP  47   3.451  14.623  -5.337
  747   2HB   TRP  47          2HB       TRP  47   2.178  15.271  -6.373
  748    HD1  TRP  47           HD1      TRP  47   1.188  17.784  -5.542
  749    HE1  TRP  47           HE1      TRP  47   2.373  19.847  -4.402
  750    HE3  TRP  47           HE3      TRP  47   5.204  15.189  -3.815
  751    HZ2  TRP  47           HZ2      TRP  47   4.804  20.156  -2.939
  752    HZ3  TRP  47           HZ3      TRP  47   6.938  16.447  -2.540
  753    HH2  TRP  47           HH2      TRP  47   6.785  18.844  -2.093
  754    H    CYS  48           H        CYS  48   0.727  13.123  -2.426
  755    HA   CYS  48           HA       CYS  48   1.567  10.592  -3.313
  756   1HB   CYS  48          1HB       CYS  48   3.780  11.654  -2.808
  757   2HB   CYS  48          2HB       CYS  48   3.286  11.751  -1.114
  758    H    PHE  49           H        PHE  49  -0.318   9.660  -2.544
  759    HA   PHE  49           HA       PHE  49  -0.758   9.833   0.326
  760   1HB   PHE  49          1HB       PHE  49  -3.323   9.943  -0.609
  761   2HB   PHE  49          2HB       PHE  49  -2.404  11.411  -0.259
  762    HD1  PHE  49           HD1      PHE  49  -0.918  12.237  -2.315
  763    HD2  PHE  49           HD2      PHE  49  -4.372   9.793  -2.640
  764    HE1  PHE  49           HE1      PHE  49  -1.213  12.971  -4.697
  765    HE2  PHE  49           HE2      PHE  49  -4.667  10.526  -5.022
  766    HZ   PHE  49           HZ       PHE  49  -3.084  12.106  -6.023
  767    H    LYS  50           H        LYS  50  -3.181   8.412   0.435
  768    HA   LYS  50           HA       LYS  50  -2.479   5.913  -0.940
  769   1HB   LYS  50          1HB       LYS  50  -3.840   5.324   1.472
  770   2HB   LYS  50          2HB       LYS  50  -2.174   4.921   1.022
  771   1HG   LYS  50          1HG       LYS  50  -2.831   7.696   2.009
  772   2HG   LYS  50          2HG       LYS  50  -2.672   6.380   3.185
  773   1HD   LYS  50          1HD       LYS  50  -0.600   7.467   1.256
  774   2HD   LYS  50          2HD       LYS  50  -0.493   7.359   3.021
  775   1HE   LYS  50          1HE       LYS  50  -0.291   5.148   0.955
  776   2HE   LYS  50          2HE       LYS  50   0.874   5.575   2.217
  777   1HZ   LYS  50          1HZ       LYS  50  -0.119   4.038   3.418
  778   2HZ   LYS  50          2HZ       LYS  50  -1.448   4.983   3.510
  779   3HZ   LYS  50          3HZ       LYS  50  -1.337   3.842   2.347
  780    HA   PRO  51           HA       PRO  51  -6.710   7.186  -1.955
  781   1HB   PRO  51          1HB       PRO  51  -6.455   7.186  -4.673
  782   2HB   PRO  51          2HB       PRO  51  -6.288   8.639  -3.690
  783   1HG   PRO  51          1HG       PRO  51  -4.222   6.972  -4.977
  784   2HG   PRO  51          2HG       PRO  51  -4.094   8.675  -4.403
  785   1HD   PRO  51          1HD       PRO  51  -3.047   6.305  -3.187
  786   2HD   PRO  51          2HD       PRO  51  -3.035   7.935  -2.502
  787    H    LEU  52           H        LEU  52  -5.827   5.461  -4.806
  788    HA   LEU  52           HA       LEU  52  -7.448   3.245  -3.794
  789   1HB   LEU  52          1HB       LEU  52  -8.139   2.844  -5.907
  790   2HB   LEU  52          2HB       LEU  52  -7.933   4.604  -5.959
  791    HG   LEU  52           HG       LEU  52  -5.465   3.523  -6.764
  792   1HD1  LEU  52          1HD1      LEU  52  -6.663   2.265  -8.861
  793   2HD1  LEU  52          2HD1      LEU  52  -5.955   1.443  -7.450
  794   3HD1  LEU  52          3HD1      LEU  52  -7.706   1.759  -7.510
  795   1HD2  LEU  52          1HD2      LEU  52  -5.740   5.183  -8.205
  796   2HD2  LEU  52          2HD2      LEU  52  -7.030   4.282  -9.037
  797   3HD2  LEU  52          3HD2      LEU  52  -7.429   5.356  -7.674
  798    H    GLN  53           H        GLN  53  -4.835   3.517  -2.733
  799    HA   GLN  53           HA       GLN  53  -2.839   2.299  -4.094
  800   1HB   GLN  53          1HB       GLN  53  -3.532   2.102  -1.139
  801   2HB   GLN  53          2HB       GLN  53  -1.965   1.635  -1.822
  802   1HG   GLN  53          1HG       GLN  53  -3.238   4.401  -1.953
  803   2HG   GLN  53          2HG       GLN  53  -1.897   3.936  -0.896
  804   1HE2  GLN  53          1HE2      GLN  53  -0.559   2.253  -2.740
  805   2HE2  GLN  53          2HE2      GLN  53   0.161   3.230  -3.976
  806    H    GLU  54           H        GLU  54  -5.845   0.926  -3.010
  807    HA   GLU  54           HA       GLU  54  -5.351  -1.593  -2.368
  808   1HB   GLU  54          1HB       GLU  54  -7.472  -2.190  -3.595
  809   2HB   GLU  54          2HB       GLU  54  -7.617  -0.767  -2.550
  810   1HG   GLU  54          1HG       GLU  54  -8.087   0.579  -4.308
  811   2HG   GLU  54          2HG       GLU  54  -6.744  -0.059  -5.267
  812    H    ALA  55           H        ALA  55  -4.603  -0.069  -5.444
  813    HA   ALA  55           HA       ALA  55  -4.620  -1.895  -7.334
  814   1HB   ALA  55          1HB       ALA  55  -3.481  -0.055  -8.048
  815   2HB   ALA  55          2HB       ALA  55  -2.665   0.176  -6.483
  816   3HB   ALA  55          3HB       ALA  55  -2.048  -1.029  -7.639
  817    H    GLU  56           H        GLU  56  -1.735  -1.751  -5.121
  818    HA   GLU  56           HA       GLU  56  -1.799  -4.653  -5.108
  819   1HB   GLU  56          1HB       GLU  56   0.240  -2.937  -6.336
  820   2HB   GLU  56          2HB       GLU  56   0.933  -4.059  -5.154
  821   1HG   GLU  56          1HG       GLU  56   0.905  -5.548  -6.871
  822   2HG   GLU  56          2HG       GLU  56  -0.823  -5.699  -6.522
  823    H    CYS  57           H        CYS  57  -2.198  -2.026  -3.321
  824    HA   CYS  57           HA       CYS  57  -0.258  -2.542  -1.260
  825   1HB   CYS  57          1HB       CYS  57  -1.593  -0.307  -2.073
  826   2HB   CYS  57          2HB       CYS  57  -2.522  -0.767  -0.644
  827    H    THR  58           H        THR  58  -3.868  -2.654  -1.711
  828    HA   THR  58           HA       THR  58  -4.271  -3.997   0.780
  829    HB   THR  58           HB       THR  58  -5.841  -2.399  -0.606
  830    HG1  THR  58           HG1      THR  58  -6.578  -5.024   0.481
  831   1HG2  THR  58          1HG2      THR  58  -5.753  -3.930  -2.688
  832   2HG2  THR  58          2HG2      THR  58  -6.685  -5.110  -1.736
  833   3HG2  THR  58          3HG2      THR  58  -7.384  -3.516  -2.107
  834    H    PHE  59           H        PHE  59  -3.710  -4.974  -2.591
  835    HA   PHE  59           HA       PHE  59  -4.602  -7.631  -2.218
  836   1HB   PHE  59          1HB       PHE  59  -3.170  -5.896  -4.185
  837   2HB   PHE  59          2HB       PHE  59  -2.693  -7.595  -4.281
  838    HD1  PHE  59           HD1      PHE  59  -3.816  -8.814  -5.867
  839    HD2  PHE  59           HD2      PHE  59  -5.873  -5.655  -3.919
  840    HE1  PHE  59           HE1      PHE  59  -5.856  -9.292  -7.248
  841    HE2  PHE  59           HE2      PHE  59  -7.915  -6.134  -5.299
  842    HZ   PHE  59           HZ       PHE  59  -7.882  -7.946  -6.948
  Start of MODEL   37
    1   1H    GLU   1           H1       GLU   1  -9.091 -16.321  -3.053
    2    HA   GLU   1           HA       GLU   1  -8.945 -15.997  -5.950
    3   1HB   GLU   1          1HB       GLU   1 -10.473 -17.890  -4.202
    4   2HB   GLU   1          2HB       GLU   1 -11.268 -17.333  -5.685
    5   1HG   GLU   1          1HG       GLU   1  -9.492 -18.196  -7.056
    6   2HG   GLU   1          2HG       GLU   1  -8.442 -18.474  -5.658
    7    H    GLU   2           H        GLU   2 -11.477 -15.895  -3.332
    8    HA   GLU   2           HA       GLU   2 -12.665 -13.664  -4.693
    9   1HB   GLU   2          1HB       GLU   2 -13.943 -15.632  -3.672
   10   2HB   GLU   2          2HB       GLU   2 -13.583 -14.932  -2.084
   11   1HG   GLU   2          1HG       GLU   2 -15.557 -13.834  -2.429
   12   2HG   GLU   2          2HG       GLU   2 -14.552 -12.725  -3.376
   13    H    TYR   3           H        TYR   3 -13.557 -13.125  -1.582
   14    HA   TYR   3           HA       TYR   3 -11.624 -10.976  -1.305
   15   1HB   TYR   3          1HB       TYR   3 -13.841 -11.612   0.654
   16   2HB   TYR   3          2HB       TYR   3 -13.385 -10.037  -0.005
   17    HD1  TYR   3           HD1      TYR   3 -15.880 -12.475   0.022
   18    HD2  TYR   3           HD2      TYR   3 -13.823  -9.864  -2.672
   19    HE1  TYR   3           HE1      TYR   3 -17.831 -12.603  -1.604
   20    HE2  TYR   3           HE2      TYR   3 -15.781 -10.001  -4.288
   21    HH   TYR   3           HH       TYR   3 -17.952 -10.555  -4.439
   22    H    VAL   4           H        VAL   4 -10.120 -13.135  -0.932
   23    HA   VAL   4           HA       VAL   4  -9.993 -13.409   1.992
   24    HB   VAL   4           HB       VAL   4  -9.407 -15.427  -0.180
   25   1HG1  VAL   4          1HG1      VAL   4  -7.667 -15.527   1.559
   26   2HG1  VAL   4          2HG1      VAL   4  -8.925 -15.677   2.809
   27   3HG1  VAL   4          3HG1      VAL   4  -8.716 -16.965   1.597
   28   1HG2  VAL   4          1HG2      VAL   4 -11.206 -16.688   0.679
   29   2HG2  VAL   4          2HG2      VAL   4 -11.287 -15.721   2.171
   30   3HG2  VAL   4          3HG2      VAL   4 -11.808 -15.013   0.623
   31    H    GLY   5           H        GLY   5  -8.238 -13.192  -1.147
   32   1HA   GLY   5          1HA       GLY   5  -5.654 -13.005   0.060
   33   2HA   GLY   5          2HA       GLY   5  -6.085 -12.680  -1.608
   34    H    LEU   6           H        LEU   6  -8.191 -10.963   0.472
   35    HA   LEU   6           HA       LEU   6  -6.414  -8.637   0.517
   36   1HB   LEU   6          1HB       LEU   6  -7.891  -7.248  -0.523
   37   2HB   LEU   6          2HB       LEU   6  -8.042  -8.735  -1.474
   38    HG   LEU   6           HG       LEU   6  -9.974  -7.543   0.513
   39   1HD1  LEU   6          1HD1      LEU   6  -9.801  -7.104  -2.117
   40   2HD1  LEU   6          2HD1      LEU   6 -10.786  -8.586  -2.153
   41   3HD1  LEU   6          3HD1      LEU   6 -11.354  -7.163  -1.249
   42   1HD2  LEU   6          1HD2      LEU   6 -11.366  -9.626   0.095
   43   2HD2  LEU   6          2HD2      LEU   6  -9.871 -10.388  -0.499
   44   3HD2  LEU   6          3HD2      LEU   6  -9.967  -9.806   1.180
   45    H    SER   7           H        SER   7  -7.859 -10.871   2.324
   46    HA   SER   7           HA       SER   7  -9.223  -9.063   4.104
   47   1HB   SER   7          1HB       SER   7  -9.501 -11.782   3.435
   48   2HB   SER   7          2HB       SER   7  -8.895 -11.792   5.102
   49    HG   SER   7           HG       SER   7 -10.679 -10.582   5.768
   50    H    ALA   8           H        ALA   8  -8.698  -9.846   6.629
   51    HA   ALA   8           HA       ALA   8  -6.065  -8.886   7.060
   52   1HB   ALA   8          1HB       ALA   8  -7.068  -9.990   9.451
   53   2HB   ALA   8          2HB       ALA   8  -7.167  -8.292   8.928
   54   3HB   ALA   8          3HB       ALA   8  -8.500  -9.414   8.564
   55    H    ASN   9           H        ASN   9  -7.411 -11.984   6.340
   56    HA   ASN   9           HA       ASN   9  -5.278 -13.356   7.716
   57   1HB   ASN   9          1HB       ASN   9  -7.922 -14.019   7.131
   58   2HB   ASN   9          2HB       ASN   9  -7.028 -14.942   5.913
   59   1HD2  ASN   9          1HD2      ASN   9  -5.106 -16.147   6.745
   60   2HD2  ASN   9          2HD2      ASN   9  -5.254 -16.979   8.257
   61    H    GLN  10           H        GLN  10  -5.697 -11.667   4.859
   62    HA   GLN  10           HA       GLN  10  -4.733 -13.472   2.958
   63   1HB   GLN  10          1HB       GLN  10  -5.036 -11.751   1.515
   64   2HB   GLN  10          2HB       GLN  10  -5.828 -10.958   2.887
   65   1HG   GLN  10          1HG       GLN  10  -4.312  -9.308   2.377
   66   2HG   GLN  10          2HG       GLN  10  -3.262 -10.275   3.425
   67   1HE2  GLN  10          1HE2      GLN  10  -3.796  -8.971   0.346
   68   2HE2  GLN  10          2HE2      GLN  10  -2.488  -9.710  -0.518
   69    H    CYS  11           H        CYS  11  -3.183 -11.238   5.281
   70    HA   CYS  11           HA       CYS  11  -0.618 -11.401   4.120
   71   1HB   CYS  11          1HB       CYS  11  -1.178  -9.544   5.502
   72   2HB   CYS  11          2HB       CYS  11  -1.561 -10.589   6.873
   73    H    ALA  12           H        ALA  12  -2.594 -13.723   5.544
   74    HA   ALA  12           HA       ALA  12  -0.388 -15.116   6.861
   75   1HB   ALA  12          1HB       ALA  12  -2.959 -16.468   6.920
   76   2HB   ALA  12          2HB       ALA  12  -1.983 -15.841   8.270
   77   3HB   ALA  12          3HB       ALA  12  -3.133 -14.772   7.432
   78    H    VAL  13           H        VAL  13  -1.097 -14.656   3.798
   79    HA   VAL  13           HA       VAL  13  -1.904 -16.888   2.549
   80    HB   VAL  13           HB       VAL  13  -0.585 -14.563   1.886
   81   1HG1  VAL  13          1HG1      VAL  13   1.597 -15.714   2.156
   82   2HG1  VAL  13          2HG1      VAL  13   1.111 -16.882   0.904
   83   3HG1  VAL  13          3HG1      VAL  13   1.310 -15.163   0.487
   84   1HG2  VAL  13          1HG2      VAL  13  -1.899 -14.934   0.126
   85   2HG2  VAL  13          2HG2      VAL  13  -0.756 -16.166  -0.463
   86   3HG2  VAL  13          3HG2      VAL  13  -2.096 -16.636   0.610
   87    HA   PRO  14           HA       PRO  14   0.893 -20.078   3.363
   88   1HB   PRO  14          1HB       PRO  14   0.938 -21.490   1.025
   89   2HB   PRO  14          2HB       PRO  14  -0.365 -21.618   2.204
   90   1HG   PRO  14          1HG       PRO  14  -0.276 -20.194  -0.378
   91   2HG   PRO  14          2HG       PRO  14  -1.717 -20.719   0.565
   92   1HD   PRO  14          1HD       PRO  14  -0.631 -18.084   0.295
   93   2HD   PRO  14          2HD       PRO  14  -1.953 -18.576   1.362
   94    H    ALA  15           H        ALA  15   2.031 -17.529   2.447
   95    HA   ALA  15           HA       ALA  15   3.953 -16.717   1.680
   96   1HB   ALA  15          1HB       ALA  15   5.304 -19.274   2.538
   97   2HB   ALA  15          2HB       ALA  15   5.825 -17.587   2.768
   98   3HB   ALA  15          3HB       ALA  15   4.496 -18.250   3.749
   99    H    LYS  16           H        LYS  16   3.063 -16.946  -0.563
  100    HA   LYS  16           HA       LYS  16   4.881 -17.716  -2.366
  101   1HB   LYS  16          1HB       LYS  16   3.786 -19.936  -3.192
  102   2HB   LYS  16          2HB       LYS  16   5.016 -19.967  -1.916
  103   1HG   LYS  16          1HG       LYS  16   3.545 -20.913  -0.500
  104   2HG   LYS  16          2HG       LYS  16   2.421 -19.558  -0.706
  105   1HD   LYS  16          1HD       LYS  16   2.649 -21.855  -2.687
  106   2HD   LYS  16          2HD       LYS  16   1.521 -21.883  -1.321
  107   1HE   LYS  16          1HE       LYS  16   0.916 -19.450  -2.367
  108   2HE   LYS  16          2HE       LYS  16   1.451 -20.266  -3.844
  109   1HZ   LYS  16          1HZ       LYS  16  -0.972 -20.497  -2.627
  110   2HZ   LYS  16          2HZ       LYS  16  -0.410 -21.420  -3.851
  111   3HZ   LYS  16          3HZ       LYS  16  -0.229 -21.915  -2.305
  112    H    ASP  17           H        ASP  17   3.081 -15.665  -2.061
  113    HA   ASP  17           HA       ASP  17   1.728 -15.841  -4.538
  114   1HB   ASP  17          1HB       ASP  17   0.130 -16.898  -2.838
  115   2HB   ASP  17          2HB       ASP  17   0.024 -15.309  -2.067
  116    H    ARG  18           H        ARG  18   2.814 -14.278  -1.579
  117    HA   ARG  18           HA       ARG  18   1.788 -11.794  -1.768
  118   1HB   ARG  18          1HB       ARG  18   4.666 -12.522  -1.051
  119   2HB   ARG  18          2HB       ARG  18   3.836 -11.034  -0.561
  120   1HG   ARG  18          1HG       ARG  18   2.662 -12.091   1.087
  121   2HG   ARG  18          2HG       ARG  18   2.398 -13.552   0.116
  122   1HD   ARG  18          1HD       ARG  18   4.661 -14.332   0.598
  123   2HD   ARG  18          2HD       ARG  18   5.062 -12.817   1.421
  124    HE   ARG  18           HE       ARG  18   2.744 -14.259   2.524
  125   1HH1  ARG  18          1HH1      ARG  18   6.222 -13.752   2.693
  126   2HH1  ARG  18          2HH1      ARG  18   6.357 -14.336   4.318
  127   1HH2  ARG  18          1HH2      ARG  18   2.921 -15.028   4.669
  128   2HH2  ARG  18          2HH2      ARG  18   4.467 -15.066   5.450
  129    H    VAL  19           H        VAL  19   3.573  -9.786  -2.209
  130    HA   VAL  19           HA       VAL  19   4.367 -10.188  -5.011
  131    HB   VAL  19           HB       VAL  19   3.516  -7.641  -3.619
  132   1HG1  VAL  19          1HG1      VAL  19   3.240  -7.449  -6.424
  133   2HG1  VAL  19          2HG1      VAL  19   4.410  -6.607  -5.381
  134   3HG1  VAL  19          3HG1      VAL  19   4.844  -8.162  -6.129
  135   1HG2  VAL  19          1HG2      VAL  19   1.877  -9.759  -4.386
  136   2HG2  VAL  19          2HG2      VAL  19   1.372  -8.077  -4.090
  137   3HG2  VAL  19          3HG2      VAL  19   1.766  -8.612  -5.742
  138    H    ASP  20           H        ASP  20   5.813 -10.672  -2.327
  139    HA   ASP  20           HA       ASP  20   7.659 -10.051  -1.278
  140   1HB   ASP  20          1HB       ASP  20   8.765 -11.451  -2.752
  141   2HB   ASP  20          2HB       ASP  20   8.287 -10.516  -4.176
  142    H    CYS  21           H        CYS  21   7.198  -7.863  -0.521
  143    HA   CYS  21           HA       CYS  21   7.193  -5.591  -2.009
  144   1HB   CYS  21          1HB       CYS  21   6.945  -6.198   0.629
  145   2HB   CYS  21          2HB       CYS  21   8.472  -5.308   0.631
  146    H    GLY  22           H        GLY  22   9.926  -7.538  -0.766
  147   1HA   GLY  22          1HA       GLY  22  12.156  -7.369  -1.032
  148   2HA   GLY  22          2HA       GLY  22  11.769  -6.810  -2.646
  149    H    TYR  23           H        TYR  23  11.588  -5.468   0.737
  150    HA   TYR  23           HA       TYR  23  12.402  -2.883  -0.308
  151   1HB   TYR  23          1HB       TYR  23  10.963  -4.110   1.960
  152   2HB   TYR  23          2HB       TYR  23  12.172  -2.969   2.557
  153    HD1  TYR  23           HD1      TYR  23   8.974  -3.367   0.852
  154    HD2  TYR  23           HD2      TYR  23  12.022  -0.564   1.926
  155    HE1  TYR  23           HE1      TYR  23   7.380  -1.442   0.382
  156    HE2  TYR  23           HE2      TYR  23  10.418   1.352   1.453
  157    HH   TYR  23           HH       TYR  23   8.436   1.738   0.077
  158    HA   PRO  24           HA       PRO  24  16.510  -3.378   0.981
  159   1HB   PRO  24          1HB       PRO  24  17.322  -0.771   0.944
  160   2HB   PRO  24          2HB       PRO  24  17.237  -1.773  -0.503
  161   1HG   PRO  24          1HG       PRO  24  15.421   0.352   0.443
  162   2HG   PRO  24          2HG       PRO  24  15.600  -0.315  -1.220
  163   1HD   PRO  24          1HD       PRO  24  13.510  -0.803   0.677
  164   2HD   PRO  24          2HD       PRO  24  13.727  -1.605  -0.885
  165    H    HIS  25           H        HIS  25  14.151  -1.925   2.817
  166    HA   HIS  25           HA       HIS  25  16.016  -1.874   5.078
  167   1HB   HIS  25          1HB       HIS  25  13.760  -0.037   4.336
  168   2HB   HIS  25          2HB       HIS  25  14.227  -0.233   6.031
  169    HD1  HIS  25           HD1      HIS  25  14.545   2.465   4.412
  170    HD2  HIS  25           HD2      HIS  25  17.581  -0.356   5.066
  171    HE1  HIS  25           HE1      HIS  25  16.752   3.724   4.179
  172    HE2  HIS  25           HE2      HIS  25  18.579   1.951   4.645
  173    H    VAL  26           H        VAL  26  14.051  -3.921   3.681
  174    HA   VAL  26           HA       VAL  26  11.858  -4.492   5.078
  175    HB   VAL  26           HB       VAL  26  12.512  -5.882   3.305
  176   1HG1  VAL  26          1HG1      VAL  26  14.985  -6.639   4.898
  177   2HG1  VAL  26          2HG1      VAL  26  14.521  -7.298   3.311
  178   3HG1  VAL  26          3HG1      VAL  26  14.941  -5.576   3.471
  179   1HG2  VAL  26          1HG2      VAL  26  11.779  -7.864   4.118
  180   2HG2  VAL  26          2HG2      VAL  26  13.018  -7.924   5.394
  181   3HG2  VAL  26          3HG2      VAL  26  11.558  -6.931   5.617
  182    H    THR  27           H        THR  27  11.276  -4.810   7.166
  183    HA   THR  27           HA       THR  27  12.916  -6.215   8.994
  184    HB   THR  27           HB       THR  27  13.439  -3.375   8.662
  185    HG1  THR  27           HG1      THR  27  15.216  -4.186   9.783
  186   1HG2  THR  27          1HG2      THR  27  12.103  -4.261  11.246
  187   2HG2  THR  27          2HG2      THR  27  13.428  -3.073  11.294
  188   3HG2  THR  27          3HG2      THR  27  11.940  -2.712  10.384
  189    HA   PRO  28           HA       PRO  28   9.072  -6.547  10.867
  190   1HB   PRO  28          1HB       PRO  28   9.747  -7.329  13.395
  191   2HB   PRO  28          2HB       PRO  28   9.712  -8.433  12.023
  192   1HG   PRO  28          1HG       PRO  28  12.005  -7.180  13.392
  193   2HG   PRO  28          2HG       PRO  28  11.987  -8.642  12.340
  194   1HD   PRO  28          1HD       PRO  28  12.908  -6.004  11.708
  195   2HD   PRO  28          2HD       PRO  28  12.762  -7.367  10.590
  196    H    LYS  29           H        LYS  29   9.505  -3.963  10.505
  197    HA   LYS  29           HA       LYS  29   7.937  -2.797  12.431
  198   1HB   LYS  29          1HB       LYS  29  10.282  -3.332  13.650
  199   2HB   LYS  29          2HB       LYS  29  10.637  -1.716  13.012
  200   1HG   LYS  29          1HG       LYS  29   9.472  -0.850  14.732
  201   2HG   LYS  29          2HG       LYS  29   8.000  -1.579  14.068
  202   1HD   LYS  29          1HD       LYS  29   8.167  -2.374  16.309
  203   2HD   LYS  29          2HD       LYS  29   8.693  -3.733  15.300
  204   1HE   LYS  29          1HE       LYS  29  10.911  -3.529  15.957
  205   2HE   LYS  29          2HE       LYS  29  10.784  -1.789  16.262
  206   1HZ   LYS  29          1HZ       LYS  29  10.370  -3.955  18.026
  207   2HZ   LYS  29          2HZ       LYS  29  10.581  -2.372  18.366
  208   3HZ   LYS  29          3HZ       LYS  29   9.089  -2.943  18.029
  209    H    GLU  30           H        GLU  30  10.211  -2.796   9.806
  210    HA   GLU  30           HA       GLU  30   9.601  -0.018   9.236
  211   1HB   GLU  30          1HB       GLU  30  11.833  -1.831   8.678
  212   2HB   GLU  30          2HB       GLU  30  11.305  -0.972   7.220
  213   1HG   GLU  30          1HG       GLU  30  11.985   1.064   8.025
  214   2HG   GLU  30          2HG       GLU  30  11.525   0.688   9.693
  215    H    CYS  31           H        CYS  31   9.364  -3.352   7.873
  216    HA   CYS  31           HA       CYS  31   8.293  -2.695   5.428
  217   1HB   CYS  31          1HB       CYS  31   7.988  -5.102   7.203
  218   2HB   CYS  31          2HB       CYS  31   7.180  -5.005   5.636
  219    H    ASN  32           H        ASN  32   6.649  -3.469   8.581
  220    HA   ASN  32           HA       ASN  32   4.091  -2.998   7.577
  221   1HB   ASN  32          1HB       ASN  32   5.377  -3.458  10.219
  222   2HB   ASN  32          2HB       ASN  32   3.879  -2.519  10.308
  223   1HD2  ASN  32          1HD2      ASN  32   5.152  -5.269   8.425
  224   2HD2  ASN  32          2HD2      ASN  32   3.803  -6.332   8.651
  225    H    ASN  33           H        ASN  33   6.662  -0.891   7.957
  226    HA   ASN  33           HA       ASN  33   5.026   1.293   8.934
  227   1HB   ASN  33          1HB       ASN  33   7.485   0.714   9.712
  228   2HB   ASN  33          2HB       ASN  33   7.971   1.514   8.209
  229   1HD2  ASN  33          1HD2      ASN  33   9.019   2.814  10.014
  230   2HD2  ASN  33          2HD2      ASN  33   8.159   4.204  10.587
  231    H    ARG  34           H        ARG  34   6.828  -0.006   6.130
  232    HA   ARG  34           HA       ARG  34   6.555   2.400   4.641
  233   1HB   ARG  34          1HB       ARG  34   7.213  -0.324   3.473
  234   2HB   ARG  34          2HB       ARG  34   7.784   1.266   2.929
  235   1HG   ARG  34          1HG       ARG  34   8.602   0.990   5.639
  236   2HG   ARG  34          2HG       ARG  34   8.972  -0.557   4.858
  237   1HD   ARG  34          1HD       ARG  34  10.636   0.359   3.600
  238   2HD   ARG  34          2HD       ARG  34   9.690   1.804   3.218
  239    HE   ARG  34           HE       ARG  34  11.737   1.641   5.177
  240   1HH1  ARG  34          1HH1      ARG  34   8.435   2.829   4.916
  241   2HH1  ARG  34          2HH1      ARG  34   8.646   4.058   6.118
  242   1HH2  ARG  34          1HH2      ARG  34  12.016   3.263   6.762
  243   2HH2  ARG  34          2HH2      ARG  34  10.697   4.307   7.175
  244    H    GLY  35           H        GLY  35   4.719  -0.540   5.232
  245   1HA   GLY  35          1HA       GLY  35   2.343  -0.318   4.655
  246   2HA   GLY  35          2HA       GLY  35   2.849   0.200   3.059
  247    H    CYS  36           H        CYS  36   4.723  -2.295   4.739
  248    HA   CYS  36           HA       CYS  36   3.567  -4.254   2.891
  249   1HB   CYS  36          1HB       CYS  36   6.364  -4.229   4.024
  250   2HB   CYS  36          2HB       CYS  36   5.707  -5.376   2.852
  251    H    CYS  37           H        CYS  37   4.279  -6.625   3.921
  252    HA   CYS  37           HA       CYS  37   3.518  -6.485   6.748
  253   1HB   CYS  37          1HB       CYS  37   1.729  -7.268   5.090
  254   2HB   CYS  37          2HB       CYS  37   2.698  -8.735   4.922
  255    H    PHE  38           H        PHE  38   5.003  -7.482   8.082
  256    HA   PHE  38           HA       PHE  38   7.185  -8.885   6.800
  257   1HB   PHE  38          1HB       PHE  38   7.361  -7.066   8.614
  258   2HB   PHE  38          2HB       PHE  38   6.598  -8.193   9.740
  259    HD1  PHE  38           HD1      PHE  38   9.624  -7.503   7.760
  260    HD2  PHE  38           HD2      PHE  38   7.853  -9.983  10.714
  261    HE1  PHE  38           HE1      PHE  38  11.882  -8.443   8.326
  262    HE2  PHE  38           HE2      PHE  38  10.110 -10.923  11.279
  263    HZ   PHE  38           HZ       PHE  38  12.098 -10.141  10.078
  264    H    ASP  39           H        ASP  39   7.233 -11.069   6.601
  265    HA   ASP  39           HA       ASP  39   5.259 -12.587   7.981
  266   1HB   ASP  39          1HB       ASP  39   5.552 -13.554   5.927
  267   2HB   ASP  39          2HB       ASP  39   7.227 -12.995   5.783
  268    H    SER  40           H        SER  40   8.710 -13.523   7.412
  269    HA   SER  40           HA       SER  40  10.368 -13.890   8.824
  270   1HB   SER  40          1HB       SER  40   8.896 -12.284  10.437
  271   2HB   SER  40          2HB       SER  40   8.777 -13.795  11.355
  272    HG   SER  40           HG       SER  40  11.363 -13.288  10.465
  273    H    ARG  41           H        ARG  41   7.185 -15.339   8.991
  274    HA   ARG  41           HA       ARG  41   7.797 -17.529  10.569
  275   1HB   ARG  41          1HB       ARG  41   5.839 -17.583   8.244
  276   2HB   ARG  41          2HB       ARG  41   5.711 -18.444   9.787
  277   1HG   ARG  41          1HG       ARG  41   5.885 -15.770  10.553
  278   2HG   ARG  41          2HG       ARG  41   4.905 -15.694   9.077
  279   1HD   ARG  41          1HD       ARG  41   3.381 -15.989  10.915
  280   2HD   ARG  41          2HD       ARG  41   3.460 -17.554  10.090
  281    HE   ARG  41           HE       ARG  41   4.437 -18.464  12.010
  282   1HH1  ARG  41          1HH1      ARG  41   4.707 -14.958  12.141
  283   2HH1  ARG  41          2HH1      ARG  41   5.331 -14.939  13.756
  284   1HH2  ARG  41          1HH2      ARG  41   5.260 -18.439  14.141
  285   2HH2  ARG  41          2HH2      ARG  41   5.648 -16.933  14.902
  286    H    ILE  42           H        ILE  42   7.965 -16.944   7.005
  287    HA   ILE  42           HA       ILE  42   9.514 -19.432   6.795
  288    HB   ILE  42           HB       ILE  42   7.979 -18.307   4.490
  289   1HG1  ILE  42          1HG1      ILE  42   6.838 -19.832   6.817
  290   2HG1  ILE  42          2HG1      ILE  42   6.215 -18.369   6.036
  291   1HG2  ILE  42          1HG2      ILE  42   9.732 -20.259   4.500
  292   2HG2  ILE  42          2HG2      ILE  42   8.361 -21.210   5.121
  293   3HG2  ILE  42          3HG2      ILE  42   8.233 -20.387   3.549
  294   1HD1  ILE  42          1HD1      ILE  42   5.830 -21.213   5.331
  295   2HD1  ILE  42          2HD1      ILE  42   4.844 -19.793   4.904
  296   3HD1  ILE  42          3HD1      ILE  42   6.286 -20.199   3.942
  297    HA   PRO  43           HA       PRO  43  12.473 -16.391   5.653
  298   1HB   PRO  43          1HB       PRO  43  14.676 -17.969   6.010
  299   2HB   PRO  43          2HB       PRO  43  13.954 -17.013   7.304
  300   1HG   PRO  43          1HG       PRO  43  13.797 -19.910   6.772
  301   2HG   PRO  43          2HG       PRO  43  13.481 -19.033   8.310
  302   1HD   PRO  43          1HD       PRO  43  11.587 -20.165   6.485
  303   2HD   PRO  43          2HD       PRO  43  11.222 -19.173   7.903
  304    H    GLY  44           H        GLY  44  11.398 -19.089   4.124
  305   1HA   GLY  44          1HA       GLY  44  13.348 -18.952   1.955
  306   2HA   GLY  44          2HA       GLY  44  12.042 -20.105   2.150
  307    H    VAL  45           H        VAL  45  10.532 -17.280   2.917
  308    HA   VAL  45           HA       VAL  45   9.916 -16.681   0.106
  309    HB   VAL  45           HB       VAL  45   7.679 -16.709   0.516
  310   1HG1  VAL  45          1HG1      VAL  45   7.085 -18.702   1.755
  311   2HG1  VAL  45          2HG1      VAL  45   8.626 -18.981   0.909
  312   3HG1  VAL  45          3HG1      VAL  45   8.618 -18.645   2.659
  313   1HG2  VAL  45          1HG2      VAL  45   8.286 -15.238   2.764
  314   2HG2  VAL  45          2HG2      VAL  45   6.654 -15.753   2.273
  315   3HG2  VAL  45          3HG2      VAL  45   7.573 -16.716   3.455
  316    HA   PRO  46           HA       PRO  46  10.276 -12.479   1.144
  317   1HB   PRO  46          1HB       PRO  46   7.963 -11.209   0.437
  318   2HB   PRO  46          2HB       PRO  46   9.192 -11.692  -0.729
  319   1HG   PRO  46          1HG       PRO  46   6.584 -12.922  -0.104
  320   2HG   PRO  46          2HG       PRO  46   7.591 -13.115  -1.585
  321   1HD   PRO  46          1HD       PRO  46   7.234 -14.958   0.578
  322   2HD   PRO  46          2HD       PRO  46   8.358 -15.125  -0.776
  323    H    TRP  47           H        TRP  47  10.675 -11.662   3.091
  324    HA   TRP  47           HA       TRP  47   8.559 -12.025   5.051
  325   1HB   TRP  47          1HB       TRP  47  11.009 -10.710   5.925
  326   2HB   TRP  47          2HB       TRP  47  10.172 -12.119   6.579
  327    HD1  TRP  47           HD1      TRP  47  10.843 -14.549   5.364
  328    HE1  TRP  47           HE1      TRP  47  13.064 -15.421   4.236
  329    HE3  TRP  47           HE3      TRP  47  12.894  -9.955   4.625
  330    HZ2  TRP  47           HZ2      TRP  47  15.376 -14.121   3.184
  331    HZ3  TRP  47           HZ3      TRP  47  15.136  -9.844   3.541
  332    HH2  TRP  47           HH2      TRP  47  16.371 -11.831   2.829
  333    H    CYS  48           H        CYS  48   8.325 -10.130   2.723
  334    HA   CYS  48           HA       CYS  48   7.377  -7.922   4.200
  335   1HB   CYS  48          1HB       CYS  48   9.831  -7.440   4.160
  336   2HB   CYS  48          2HB       CYS  48   9.730  -7.316   2.401
  337    H    PHE  49           H        PHE  49   5.441  -7.819   3.103
  338    HA   PHE  49           HA       PHE  49   5.563  -7.411   0.238
  339   1HB   PHE  49          1HB       PHE  49   3.469  -9.150   0.362
  340   2HB   PHE  49          2HB       PHE  49   5.116  -9.722   0.082
  341    HD1  PHE  49           HD1      PHE  49   6.471 -10.286   2.263
  342    HD2  PHE  49           HD2      PHE  49   2.237 -10.079   2.068
  343    HE1  PHE  49           HE1      PHE  49   6.306 -11.718   4.317
  344    HE2  PHE  49           HE2      PHE  49   2.072 -11.511   4.123
  345    HZ   PHE  49           HZ       PHE  49   4.109 -12.315   5.223
  346    H    LYS  50           H        LYS  50   2.881  -7.433  -0.388
  347    HA   LYS  50           HA       LYS  50   1.731  -5.581   1.583
  348   1HB   LYS  50          1HB       LYS  50   0.632  -4.748  -0.742
  349   2HB   LYS  50          2HB       LYS  50   2.077  -4.029  -0.011
  350   1HG   LYS  50          1HG       LYS  50   2.478  -6.426  -1.758
  351   2HG   LYS  50          2HG       LYS  50   1.999  -4.928  -2.573
  352   1HD   LYS  50          1HD       LYS  50   4.428  -5.412  -0.808
  353   2HD   LYS  50          2HD       LYS  50   4.420  -4.992  -2.531
  354   1HE   LYS  50          1HE       LYS  50   3.845  -3.261  -0.123
  355   2HE   LYS  50          2HE       LYS  50   4.910  -2.928  -1.497
  356   1HZ   LYS  50          1HZ       LYS  50   2.584  -3.105  -2.701
  357   2HZ   LYS  50          2HZ       LYS  50   2.066  -2.572  -1.247
  358   3HZ   LYS  50          3HZ       LYS  50   3.155  -1.700  -2.095
  359    HA   PRO  51           HA       PRO  51  -1.061  -9.075   0.902
  360   1HB   PRO  51          1HB       PRO  51  -1.388  -9.786   3.518
  361   2HB   PRO  51          2HB       PRO  51  -0.213 -10.551   2.451
  362   1HG   PRO  51          1HG       PRO  51   0.181  -8.551   4.584
  363   2HG   PRO  51          2HG       PRO  51   1.393  -9.663   3.850
  364   1HD   PRO  51          1HD       PRO  51   1.056  -6.853   3.411
  365   2HD   PRO  51          2HD       PRO  51   2.158  -7.932   2.545
  366    H    LEU  52           H        LEU  52  -2.040  -8.291   4.078
  367    HA   LEU  52           HA       LEU  52  -4.415  -7.070   2.930
  368   1HB   LEU  52          1HB       LEU  52  -5.520  -7.675   4.814
  369   2HB   LEU  52          2HB       LEU  52  -4.321  -8.975   4.685
  370    HG   LEU  52           HG       LEU  52  -3.096  -7.031   6.276
  371   1HD1  LEU  52          1HD1      LEU  52  -4.718  -5.757   7.124
  372   2HD1  LEU  52          2HD1      LEU  52  -6.003  -6.831   6.520
  373   3HD1  LEU  52          3HD1      LEU  52  -5.193  -7.193   8.063
  374   1HD2  LEU  52          1HD2      LEU  52  -2.609  -8.951   7.272
  375   2HD2  LEU  52          2HD2      LEU  52  -4.238  -8.959   7.990
  376   3HD2  LEU  52          3HD2      LEU  52  -3.947  -9.773   6.434
  377    H    GLN  53           H        GLN  53  -1.895  -5.619   2.757
  378    HA   GLN  53           HA       GLN  53  -1.498  -3.847   4.785
  379   1HB   GLN  53          1HB       GLN  53  -1.223  -3.433   1.785
  380   2HB   GLN  53          2HB       GLN  53  -0.521  -2.357   3.005
  381   1HG   GLN  53          1HG       GLN  53   0.091  -5.314   2.598
  382   2HG   GLN  53          2HG       GLN  53   1.170  -3.965   2.218
  383   1HE2  GLN  53          1HE2      GLN  53  -0.171  -6.023   4.641
  384   2HE2  GLN  53          2HE2      GLN  53   0.767  -5.489   5.995
  385    H    GLU  54           H        GLU  54  -4.241  -4.169   2.693
  386    HA   GLU  54           HA       GLU  54  -5.134  -1.700   2.250
  387   1HB   GLU  54          1HB       GLU  54  -7.192  -2.661   1.910
  388   2HB   GLU  54          2HB       GLU  54  -6.220  -4.140   1.990
  389   1HG   GLU  54          1HG       GLU  54  -7.844  -4.706   3.519
  390   2HG   GLU  54          2HG       GLU  54  -6.752  -3.858   4.625
  391    H    ALA  55           H        ALA  55  -4.661  -3.226   5.381
  392    HA   ALA  55           HA       ALA  55  -6.371  -2.112   7.078
  393   1HB   ALA  55          1HB       ALA  55  -4.357  -3.510   7.617
  394   2HB   ALA  55          2HB       ALA  55  -3.350  -2.053   7.447
  395   3HB   ALA  55          3HB       ALA  55  -4.585  -2.137   8.726
  396    H    GLU  56           H        GLU  56  -3.273  -0.376   6.291
  397    HA   GLU  56           HA       GLU  56  -4.850   2.074   6.358
  398   1HB   GLU  56          1HB       GLU  56  -2.910   3.201   7.448
  399   2HB   GLU  56          2HB       GLU  56  -3.626   1.939   8.467
  400   1HG   GLU  56          1HG       GLU  56  -1.758   0.625   8.359
  401   2HG   GLU  56          2HG       GLU  56  -1.437   1.022   6.663
  402    H    CYS  57           H        CYS  57  -3.802   0.223   4.166
  403    HA   CYS  57           HA       CYS  57  -1.867   2.005   2.915
  404   1HB   CYS  57          1HB       CYS  57  -1.501  -0.497   3.100
  405   2HB   CYS  57          2HB       CYS  57  -2.781  -0.685   1.897
  406    H    THR  58           H        THR  58  -4.602  -0.065   1.696
  407    HA   THR  58           HA       THR  58  -5.226   1.501  -0.477
  408    HB   THR  58           HB       THR  58  -6.009  -0.897   0.381
  409    HG1  THR  58           HG1      THR  58  -7.798   1.046  -0.901
  410   1HG2  THR  58          1HG2      THR  58  -8.438  -0.775   1.063
  411   2HG2  THR  58          2HG2      THR  58  -7.350  -0.149   2.325
  412   3HG2  THR  58          3HG2      THR  58  -8.252   0.981   1.290
  413    H    PHE  59           H        PHE  59  -5.984   2.022   2.937
  414    HA   PHE  59           HA       PHE  59  -8.134   3.532   3.017
  415   1HB   PHE  59          1HB       PHE  59  -5.896   3.132   4.559
  416   2HB   PHE  59          2HB       PHE  59  -5.613   4.813   4.092
  417    HD1  PHE  59           HD1      PHE  59  -6.182   6.255   5.786
  418    HD2  PHE  59           HD2      PHE  59  -8.628   2.850   5.123
  419    HE1  PHE  59           HE1      PHE  59  -7.725   7.006   7.618
  420    HE2  PHE  59           HE2      PHE  59 -10.170   3.602   6.956
  421    HZ   PHE  59           HZ       PHE  59  -9.701   5.670   8.181
  422   1H    GLU   1           H1       GLU   1 -21.436  -0.078   0.037
  423    HA   GLU   1           HA       GLU   1 -22.638   0.210  -2.532
  424   1HB   GLU   1          1HB       GLU   1 -23.192   1.477   0.175
  425   2HB   GLU   1          2HB       GLU   1 -24.166   1.809  -1.268
  426   1HG   GLU   1          1HG       GLU   1 -25.007  -0.386  -1.351
  427   2HG   GLU   1          2HG       GLU   1 -23.670  -1.051  -0.400
  428    H    GLU   2           H        GLU   2 -21.208   2.539  -0.121
  429    HA   GLU   2           HA       GLU   2 -20.935   4.467  -2.220
  430   1HB   GLU   2          1HB       GLU   2 -19.991   5.892  -0.360
  431   2HB   GLU   2          2HB       GLU   2 -21.636   5.303  -0.067
  432   1HG   GLU   2          1HG       GLU   2 -20.984   4.086   1.734
  433   2HG   GLU   2          2HG       GLU   2 -19.552   3.452   0.908
  434    H    TYR   3           H        TYR   3 -19.461   2.805  -3.402
  435    HA   TYR   3           HA       TYR   3 -16.773   2.698  -2.310
  436   1HB   TYR   3          1HB       TYR   3 -18.389   1.581  -4.648
  437   2HB   TYR   3          2HB       TYR   3 -16.628   1.451  -4.691
  438    HD1  TYR   3           HD1      TYR   3 -16.026  -0.754  -4.285
  439    HD2  TYR   3           HD2      TYR   3 -19.147   0.996  -1.941
  440    HE1  TYR   3           HE1      TYR   3 -16.172  -2.872  -2.887
  441    HE2  TYR   3           HE2      TYR   3 -19.284  -1.128  -0.549
  442    HH   TYR   3           HH       TYR   3 -17.218  -3.917  -1.312
  443    H    VAL   4           H        VAL   4 -16.568   5.139  -2.446
  444    HA   VAL   4           HA       VAL   4 -15.817   5.880  -5.190
  445    HB   VAL   4           HB       VAL   4 -16.951   7.618  -2.989
  446   1HG1  VAL   4          1HG1      VAL   4 -16.453   9.464  -4.188
  447   2HG1  VAL   4          2HG1      VAL   4 -15.214   8.427  -4.935
  448   3HG1  VAL   4          3HG1      VAL   4 -16.781   8.669  -5.746
  449   1HG2  VAL   4          1HG2      VAL   4 -18.841   7.901  -4.667
  450   2HG2  VAL   4          2HG2      VAL   4 -18.153   6.511  -5.539
  451   3HG2  VAL   4          3HG2      VAL   4 -18.733   6.313  -3.868
  452    H    GLY   5           H        GLY   5 -15.237   6.544  -1.667
  453   1HA   GLY   5          1HA       GLY   5 -12.688   7.728  -2.117
  454   2HA   GLY   5          2HA       GLY   5 -13.370   7.210  -0.587
  455    H    LEU   6           H        LEU   6 -13.655   4.589  -2.695
  456    HA   LEU   6           HA       LEU   6 -10.975   3.600  -2.042
  457   1HB   LEU   6          1HB       LEU   6 -12.091   1.382  -1.593
  458   2HB   LEU   6          2HB       LEU   6 -12.222   2.632  -0.342
  459    HG   LEU   6           HG       LEU   6 -14.292   1.308  -0.688
  460   1HD1  LEU   6          1HD1      LEU   6 -14.054   3.941  -0.127
  461   2HD1  LEU   6          2HD1      LEU   6 -15.123   4.016  -1.548
  462   3HD1  LEU   6          3HD1      LEU   6 -15.599   3.057  -0.126
  463   1HD2  LEU   6          1HD2      LEU   6 -15.423   1.132  -2.648
  464   2HD2  LEU   6          2HD2      LEU   6 -14.901   2.731  -3.230
  465   3HD2  LEU   6          3HD2      LEU   6 -13.785   1.347  -3.311
  466    H    SER   7           H        SER   7 -12.898   4.622  -4.424
  467    HA   SER   7           HA       SER   7 -12.687   2.313  -6.115
  468   1HB   SER   7          1HB       SER   7 -13.707   3.910  -7.825
  469   2HB   SER   7          2HB       SER   7 -14.699   3.579  -6.395
  470    HG   SER   7           HG       SER   7 -12.930   5.806  -6.294
  471    H    ALA   8           H        ALA   8 -11.897   2.980  -8.543
  472    HA   ALA   8           HA       ALA   8  -9.137   3.609  -8.227
  473   1HB   ALA   8          1HB       ALA   8 -10.204   1.934  -9.837
  474   2HB   ALA   8          2HB       ALA   8 -10.713   3.335 -10.810
  475   3HB   ALA   8          3HB       ALA   8  -8.982   3.022 -10.539
  476    H    ASN   9           H        ASN   9 -11.878   5.533  -8.239
  477    HA   ASN   9           HA       ASN   9 -10.616   7.627  -9.790
  478   1HB   ASN   9          1HB       ASN   9 -13.291   6.812  -9.433
  479   2HB   ASN   9          2HB       ASN   9 -13.179   8.312  -8.500
  480   1HD2  ASN   9          1HD2      ASN   9 -11.970  10.108  -9.638
  481   2HD2  ASN   9          2HD2      ASN   9 -12.334  10.383 -11.308
  482    H    GLN  10           H        GLN  10 -10.711   6.398  -6.635
  483    HA   GLN  10           HA       GLN  10 -11.077   8.722  -5.139
  484   1HB   GLN  10          1HB       GLN  10 -10.925   7.279  -3.421
  485   2HB   GLN  10          2HB       GLN  10 -10.707   5.996  -4.624
  486   1HG   GLN  10          1HG       GLN  10  -8.268   6.285  -4.518
  487   2HG   GLN  10          2HG       GLN  10  -8.446   7.642  -3.394
  488   1HE2  GLN  10          1HE2      GLN  10  -8.365   7.235  -1.319
  489   2HE2  GLN  10          2HE2      GLN  10  -8.555   5.696  -0.547
  490    H    CYS  11           H        CYS  11  -8.225   7.191  -6.681
  491    HA   CYS  11           HA       CYS  11  -6.323   8.813  -5.399
  492   1HB   CYS  11          1HB       CYS  11  -5.632   6.755  -6.337
  493   2HB   CYS  11          2HB       CYS  11  -6.253   7.180  -7.935
  494    H    ALA  12           H        ALA  12  -8.851   9.583  -7.477
  495    HA   ALA  12           HA       ALA  12  -7.343  11.776  -8.722
  496   1HB   ALA  12          1HB       ALA  12  -8.289  10.687 -10.518
  497   2HB   ALA  12          2HB       ALA  12  -9.655  10.064  -9.561
  498   3HB   ALA  12          3HB       ALA  12  -9.645  11.761 -10.096
  499    H    VAL  13           H        VAL  13  -8.677  11.326  -5.899
  500    HA   VAL  13           HA       VAL  13 -10.924  12.759  -5.542
  501    HB   VAL  13           HB       VAL  13  -8.877  11.751  -3.981
  502   1HG1  VAL  13          1HG1      VAL  13  -7.697  13.889  -3.985
  503   2HG1  VAL  13          2HG1      VAL  13  -9.164  14.722  -3.418
  504   3HG1  VAL  13          3HG1      VAL  13  -8.347  13.542  -2.364
  505   1HG2  VAL  13          1HG2      VAL  13 -10.699  13.099  -2.264
  506   2HG2  VAL  13          2HG2      VAL  13 -11.608  12.600  -3.711
  507   3HG2  VAL  13          3HG2      VAL  13 -10.709  11.389  -2.763
  508    HA   PRO  14           HA       PRO  14 -10.152  16.907  -6.480
  509   1HB   PRO  14          1HB       PRO  14 -11.442  18.308  -4.522
  510   2HB   PRO  14          2HB       PRO  14 -12.276  17.569  -5.887
  511   1HG   PRO  14          1HG       PRO  14 -12.092  16.689  -3.077
  512   2HG   PRO  14          2HG       PRO  14 -13.304  16.222  -4.323
  513   1HD   PRO  14          1HD       PRO  14 -11.096  14.695  -3.327
  514   2HD   PRO  14          2HD       PRO  14 -12.163  14.255  -4.666
  515    H    ALA  15           H        ALA  15  -8.134  15.526  -4.812
  516    HA   ALA  15           HA       ALA  15  -6.324  16.020  -3.628
  517   1HB   ALA  15          1HB       ALA  15  -6.711  18.280  -5.540
  518   2HB   ALA  15          2HB       ALA  15  -5.489  18.507  -4.266
  519   3HB   ALA  15          3HB       ALA  15  -5.362  17.130  -5.387
  520    H    LYS  16           H        LYS  16  -7.856  15.910  -1.700
  521    HA   LYS  16           HA       LYS  16  -7.204  17.723   0.189
  522   1HB   LYS  16          1HB       LYS  16  -9.541  18.942   0.299
  523   2HB   LYS  16          2HB       LYS  16  -8.189  19.611  -0.632
  524   1HG   LYS  16          1HG       LYS  16  -9.346  19.413  -2.557
  525   2HG   LYS  16          2HG       LYS  16  -9.706  17.706  -2.242
  526   1HD   LYS  16          1HD       LYS  16 -11.829  18.215  -1.690
  527   2HD   LYS  16          2HD       LYS  16 -11.291  19.395  -0.482
  528   1HE   LYS  16          1HE       LYS  16 -11.298  21.169  -2.051
  529   2HE   LYS  16          2HE       LYS  16 -11.274  20.075  -3.443
  530   1HZ   LYS  16          1HZ       LYS  16 -13.498  19.408  -2.861
  531   2HZ   LYS  16          2HZ       LYS  16 -13.508  20.396  -1.560
  532   3HZ   LYS  16          3HZ       LYS  16 -13.441  21.027  -3.064
  533    H    ASP  17           H        ASP  17  -7.616  14.938  -0.166
  534    HA   ASP  17           HA       ASP  17  -9.274  14.500   2.085
  535   1HB   ASP  17          1HB       ASP  17 -10.846  14.527   0.033
  536   2HB   ASP  17          2HB       ASP  17 -10.043  13.032  -0.470
  537    H    ARG  18           H        ARG  18  -6.496  14.113   0.628
  538    HA   ARG  18           HA       ARG  18  -6.330  11.243   0.666
  539   1HB   ARG  18          1HB       ARG  18  -4.125  13.281   0.130
  540   2HB   ARG  18          2HB       ARG  18  -4.089  11.559  -0.284
  541   1HG   ARG  18          1HG       ARG  18  -5.408  11.848  -2.135
  542   2HG   ARG  18          2HG       ARG  18  -6.397  13.110  -1.377
  543   1HD   ARG  18          1HD       ARG  18  -4.739  14.789  -1.818
  544   2HD   ARG  18          2HD       ARG  18  -3.509  13.584  -2.232
  545    HE   ARG  18           HE       ARG  18  -5.861  13.417  -3.945
  546   1HH1  ARG  18          1HH1      ARG  18  -2.830  15.133  -3.446
  547   2HH1  ARG  18          2HH1      ARG  18  -2.675  15.603  -5.105
  548   1HH2  ARG  18          1HH2      ARG  18  -5.656  14.037  -6.135
  549   2HH2  ARG  18          2HH2      ARG  18  -4.294  14.976  -6.646
  550    H    VAL  19           H        VAL  19  -4.146  10.369   1.751
  551    HA   VAL  19           HA       VAL  19  -4.191  11.392   4.475
  552    HB   VAL  19           HB       VAL  19  -2.792   8.936   3.425
  553   1HG1  VAL  19          1HG1      VAL  19  -2.211   8.651   5.558
  554   2HG1  VAL  19          2HG1      VAL  19  -3.039  10.164   5.995
  555   3HG1  VAL  19          3HG1      VAL  19  -3.928   8.622   6.026
  556   1HG2  VAL  19          1HG2      VAL  19  -4.867   8.302   2.737
  557   2HG2  VAL  19          2HG2      VAL  19  -5.052   7.900   4.461
  558   3HG2  VAL  19          3HG2      VAL  19  -5.701   9.433   3.830
  559    H    ASP  20           H        ASP  20  -2.769  12.530   1.886
  560    HA   ASP  20           HA       ASP  20  -0.770  13.242   1.288
  561   1HB   ASP  20          1HB       ASP  20  -1.216  15.104   2.600
  562   2HB   ASP  20          2HB       ASP  20  -1.278  14.173   4.102
  563    H    CYS  21           H        CYS  21   0.267  11.068   1.033
  564    HA   CYS  21           HA       CYS  21   1.403   9.573   2.976
  565   1HB   CYS  21          1HB       CYS  21   1.247   9.287   0.387
  566   2HB   CYS  21          2HB       CYS  21   2.875   9.970   0.396
  567    H    GLY  22           H        GLY  22   2.589  12.590   1.426
  568   1HA   GLY  22          1HA       GLY  22   4.508  13.775   1.745
  569   2HA   GLY  22          2HA       GLY  22   3.961  13.701   3.409
  570    H    TYR  23           H        TYR  23   5.597  11.475   1.032
  571    HA   TYR  23           HA       TYR  23   7.213  10.438   3.221
  572   1HB   TYR  23          1HB       TYR  23   6.203   9.698   0.521
  573   2HB   TYR  23          2HB       TYR  23   7.913   9.291   0.712
  574    HD1  TYR  23           HD1      TYR  23   8.408   7.172   1.507
  575    HD2  TYR  23           HD2      TYR  23   4.687   8.968   2.616
  576    HE1  TYR  23           HE1      TYR  23   7.744   5.050   2.740
  577    HE2  TYR  23           HE2      TYR  23   4.035   6.840   3.845
  578    HH   TYR  23           HH       TYR  23   6.303   4.361   4.483
  579    HA   PRO  24           HA       PRO  24  10.784  12.563   2.025
  580   1HB   PRO  24          1HB       PRO  24  12.763  10.829   2.762
  581   2HB   PRO  24          2HB       PRO  24  11.926  11.879   3.904
  582   1HG   PRO  24          1HG       PRO  24  11.617   8.987   3.406
  583   2HG   PRO  24          2HG       PRO  24  11.133   9.934   4.859
  584   1HD   PRO  24          1HD       PRO  24   9.468   8.898   2.772
  585   2HD   PRO  24          2HD       PRO  24   8.965   9.960   4.094
  586    H    HIS  25           H        HIS  25   9.932   9.687   0.522
  587    HA   HIS  25           HA       HIS  25  11.931  10.245  -1.548
  588   1HB   HIS  25          1HB       HIS  25  11.690   7.946  -0.132
  589   2HB   HIS  25          2HB       HIS  25  10.631   7.585  -1.500
  590    HD1  HIS  25           HD1      HIS  25  13.246   6.002  -1.137
  591    HD2  HIS  25           HD2      HIS  25  12.935   9.493  -3.443
  592    HE1  HIS  25           HE1      HIS  25  15.171   5.929  -2.809
  593    HE2  HIS  25           HE2      HIS  25  14.896   8.072  -4.233
  594    H    VAL  26           H        VAL  26   8.857  10.952  -0.761
  595    HA   VAL  26           HA       VAL  26   7.099  10.045  -2.544
  596    HB   VAL  26           HB       VAL  26   6.455  11.664  -0.968
  597   1HG1  VAL  26          1HG1      VAL  26   8.826  12.810  -1.161
  598   2HG1  VAL  26          2HG1      VAL  26   7.964  13.912  -2.261
  599   3HG1  VAL  26          3HG1      VAL  26   7.415  13.724  -0.578
  600   1HG2  VAL  26          1HG2      VAL  26   4.913  12.719  -2.230
  601   2HG2  VAL  26          2HG2      VAL  26   6.138  13.506  -3.253
  602   3HG2  VAL  26          3HG2      VAL  26   5.652  11.825  -3.580
  603    H    THR  27           H        THR  27   7.177   9.632  -4.686
  604    HA   THR  27           HA       THR  27   7.920  11.660  -6.529
  605    HB   THR  27           HB       THR  27  10.069  10.161  -5.454
  606    HG1  THR  27           HG1      THR  27  11.054  11.260  -7.420
  607   1HG2  THR  27          1HG2      THR  27  10.138   8.255  -6.756
  608   2HG2  THR  27          2HG2      THR  27   8.952   8.900  -7.917
  609   3HG2  THR  27          3HG2      THR  27  10.666   9.369  -8.040
  610    HA   PRO  28           HA       PRO  28   5.479   9.189  -9.045
  611   1HB   PRO  28          1HB       PRO  28   6.342   9.816 -11.560
  612   2HB   PRO  28          2HB       PRO  28   5.259  10.847 -10.627
  613   1HG   PRO  28          1HG       PRO  28   8.146  11.126 -11.170
  614   2HG   PRO  28          2HG       PRO  28   6.974  12.390 -10.649
  615   1HD   PRO  28          1HD       PRO  28   8.973  11.062  -9.086
  616   2HD   PRO  28          2HD       PRO  28   7.739  12.181  -8.491
  617    H    LYS  29           H        LYS  29   7.267   7.603  -7.822
  618    HA   LYS  29           HA       LYS  29   7.312   5.413  -9.512
  619   1HB   LYS  29          1HB       LYS  29   9.160   7.091 -10.467
  620   2HB   LYS  29          2HB       LYS  29  10.151   6.269  -9.249
  621   1HG   LYS  29          1HG       LYS  29  10.381   4.539 -10.670
  622   2HG   LYS  29          2HG       LYS  29   8.636   4.243 -10.572
  623   1HD   LYS  29          1HD       LYS  29   9.056   6.488 -12.305
  624   2HD   LYS  29          2HD       LYS  29  10.183   5.215 -12.807
  625   1HE   LYS  29          1HE       LYS  29   8.303   3.609 -12.939
  626   2HE   LYS  29          2HE       LYS  29   7.173   4.863 -12.405
  627   1HZ   LYS  29          1HZ       LYS  29   7.510   4.406 -14.889
  628   2HZ   LYS  29          2HZ       LYS  29   7.391   5.954 -14.383
  629   3HZ   LYS  29          3HZ       LYS  29   8.853   5.322 -14.738
  630    H    GLU  30           H        GLU  30   8.344   7.252  -6.709
  631    HA   GLU  30           HA       GLU  30   9.214   4.837  -5.387
  632   1HB   GLU  30          1HB       GLU  30   9.600   7.732  -5.028
  633   2HB   GLU  30          2HB       GLU  30   9.310   6.881  -3.501
  634   1HG   GLU  30          1HG       GLU  30  11.724   6.990  -4.062
  635   2HG   GLU  30          2HG       GLU  30  11.153   5.314  -4.011
  636    H    CYS  31           H        CYS  31   6.679   7.402  -5.176
  637    HA   CYS  31           HA       CYS  31   5.449   6.565  -2.875
  638   1HB   CYS  31          1HB       CYS  31   4.347   7.860  -5.360
  639   2HB   CYS  31          2HB       CYS  31   3.362   7.567  -3.924
  640    H    ASN  32           H        ASN  32   4.657   5.693  -6.325
  641    HA   ASN  32           HA       ASN  32   2.729   3.842  -5.688
  642   1HB   ASN  32          1HB       ASN  32   4.442   4.491  -8.047
  643   2HB   ASN  32          2HB       ASN  32   3.768   2.854  -8.048
  644   1HD2  ASN  32          1HD2      ASN  32   2.370   5.744  -6.586
  645   2HD2  ASN  32          2HD2      ASN  32   0.970   5.864  -7.597
  646    H    ASN  33           H        ASN  33   6.132   3.806  -5.169
  647    HA   ASN  33           HA       ASN  33   6.414   0.971  -5.478
  648   1HB   ASN  33          1HB       ASN  33   8.181   3.018  -5.731
  649   2HB   ASN  33          2HB       ASN  33   8.488   2.611  -4.035
  650   1HD2  ASN  33          1HD2      ASN  33  10.618   2.097  -4.912
  651   2HD2  ASN  33          2HD2      ASN  33  10.922   0.517  -5.556
  652    H    ARG  34           H        ARG  34   6.056   3.497  -2.948
  653    HA   ARG  34           HA       ARG  34   6.537   1.640  -0.846
  654   1HB   ARG  34          1HB       ARG  34   5.243   4.364  -0.512
  655   2HB   ARG  34          2HB       ARG  34   6.309   3.514   0.619
  656   1HG   ARG  34          1HG       ARG  34   7.727   3.859  -1.850
  657   2HG   ARG  34          2HG       ARG  34   7.000   5.421  -1.434
  658   1HD   ARG  34          1HD       ARG  34   8.455   5.728   0.279
  659   2HD   ARG  34          2HD       ARG  34   8.188   4.095   0.910
  660    HE   ARG  34           HE       ARG  34   9.737   3.752  -1.397
  661   1HH1  ARG  34          1HH1      ARG  34  10.085   5.506   1.635
  662   2HH1  ARG  34          2HH1      ARG  34  11.813   5.392   1.649
  663   1HH2  ARG  34          1HH2      ARG  34  12.017   3.602  -1.378
  664   2HH2  ARG  34          2HH2      ARG  34  12.920   4.302  -0.075
  665    H    GLY  35           H        GLY  35   3.817   2.855  -2.728
  666   1HA   GLY  35          1HA       GLY  35   1.849   1.416  -2.676
  667   2HA   GLY  35          2HA       GLY  35   1.955   1.423  -0.927
  668    H    CYS  36           H        CYS  36   2.753   4.375  -2.716
  669    HA   CYS  36           HA       CYS  36   0.228   5.506  -1.754
  670   1HB   CYS  36          1HB       CYS  36   2.898   6.848  -2.193
  671   2HB   CYS  36          2HB       CYS  36   1.408   7.683  -1.742
  672    H    CYS  37           H        CYS  37  -0.363   7.560  -3.204
  673    HA   CYS  37           HA       CYS  37   0.063   6.752  -5.988
  674   1HB   CYS  37          1HB       CYS  37  -2.273   6.543  -4.921
  675   2HB   CYS  37          2HB       CYS  37  -2.331   8.304  -5.038
  676    H    PHE  38           H        PHE  38   1.121   8.268  -7.238
  677    HA   PHE  38           HA       PHE  38   1.660  10.836  -6.004
  678   1HB   PHE  38          1HB       PHE  38   3.421   9.332  -7.058
  679   2HB   PHE  38          2HB       PHE  38   2.590   9.484  -8.609
  680    HD1  PHE  38           HD1      PHE  38   2.894  11.418  -9.968
  681    HD2  PHE  38           HD2      PHE  38   4.553  11.292  -6.064
  682    HE1  PHE  38           HE1      PHE  38   4.256  13.463 -10.482
  683    HE2  PHE  38           HE2      PHE  38   5.915  13.337  -6.578
  684    HZ   PHE  38           HZ       PHE  38   5.750  14.398  -8.780
  685    H    ASP  39           H        ASP  39   0.462  12.613  -6.471
  686    HA   ASP  39           HA       ASP  39  -1.328  12.460  -8.700
  687   1HB   ASP  39          1HB       ASP  39  -2.191  13.378  -6.637
  688   2HB   ASP  39          2HB       ASP  39  -0.847  14.524  -6.509
  689    H    SER  40           H        SER  40   0.474  15.354  -7.477
  690    HA   SER  40           HA       SER  40   2.084  16.551  -8.417
  691   1HB   SER  40          1HB       SER  40   2.481  14.338  -9.882
  692   2HB   SER  40          2HB       SER  40   1.827  15.369 -11.167
  693    HG   SER  40           HG       SER  40   3.702  16.385 -11.247
  694    H    ARG  41           H        ARG  41  -1.097  15.917  -9.607
  695    HA   ARG  41           HA       ARG  41  -1.298  17.829 -11.581
  696   1HB   ARG  41          1HB       ARG  41  -3.383  16.776  -9.616
  697   2HB   ARG  41          2HB       ARG  41  -3.783  17.729 -11.057
  698   1HG   ARG  41          1HG       ARG  41  -2.117  15.713 -12.037
  699   2HG   ARG  41          2HG       ARG  41  -3.084  14.875 -10.809
  700   1HD   ARG  41          1HD       ARG  41  -4.691  14.719 -12.401
  701   2HD   ARG  41          2HD       ARG  41  -4.966  16.452 -12.160
  702    HE   ARG  41           HE       ARG  41  -2.792  16.218 -13.945
  703   1HH1  ARG  41          1HH1      ARG  41  -6.198  15.341 -13.887
  704   2HH1  ARG  41          2HH1      ARG  41  -6.390  15.460 -15.604
  705   1HH2  ARG  41          1HH2      ARG  41  -3.043  16.376 -16.211
  706   2HH2  ARG  41          2HH2      ARG  41  -4.584  16.053 -16.935
  707    H    ILE  42           H        ILE  42  -1.780  17.980  -8.003
  708    HA   ILE  42           HA       ILE  42  -1.830  20.908  -8.259
  709    HB   ILE  42           HB       ILE  42  -3.157  19.509  -5.979
  710   1HG1  ILE  42          1HG1      ILE  42  -4.263  19.768  -8.772
  711   2HG1  ILE  42          2HG1      ILE  42  -4.166  18.318  -7.759
  712   1HG2  ILE  42          1HG2      ILE  42  -2.719  22.124  -6.516
  713   2HG2  ILE  42          2HG2      ILE  42  -4.314  21.904  -7.274
  714   3HG2  ILE  42          3HG2      ILE  42  -4.086  21.516  -5.551
  715   1HD1  ILE  42          1HD1      ILE  42  -5.659  19.854  -6.120
  716   2HD1  ILE  42          2HD1      ILE  42  -6.106  20.608  -7.669
  717   3HD1  ILE  42          3HD1      ILE  42  -6.388  18.870  -7.412
  718    HA   PRO  43           HA       PRO  43   1.801  20.245  -5.887
  719   1HB   PRO  43          1HB       PRO  43   2.857  22.738  -6.246
  720   2HB   PRO  43          2HB       PRO  43   3.132  21.405  -7.366
  721   1HG   PRO  43          1HG       PRO  43   1.348  23.742  -7.600
  722   2HG   PRO  43          2HG       PRO  43   1.978  22.675  -8.906
  723   1HD   PRO  43          1HD       PRO  43  -0.648  22.733  -7.765
  724   2HD   PRO  43          2HD       PRO  43  -0.032  21.558  -8.933
  725    H    GLY  44           H        GLY  44  -0.896  22.013  -5.277
  726   1HA   GLY  44          1HA       GLY  44   0.148  23.240  -2.843
  727   2HA   GLY  44          2HA       GLY  44  -1.449  23.434  -3.537
  728    H    VAL  45           H        VAL  45  -1.065  20.197  -3.851
  729    HA   VAL  45           HA       VAL  45  -1.986  19.661  -1.111
  730    HB   VAL  45           HB       VAL  45  -3.722  18.377  -1.876
  731   1HG1  VAL  45          1HG1      VAL  45  -3.966  19.955  -4.335
  732   2HG1  VAL  45          2HG1      VAL  45  -4.989  19.935  -2.877
  733   3HG1  VAL  45          3HG1      VAL  45  -3.516  20.935  -2.918
  734   1HG2  VAL  45          1HG2      VAL  45  -2.497  18.200  -4.647
  735   2HG2  VAL  45          2HG2      VAL  45  -2.279  16.976  -3.375
  736   3HG2  VAL  45          3HG2      VAL  45  -3.903  17.305  -4.024
  737    HA   PRO  46           HA       PRO  46   0.689  16.239  -1.111
  738   1HB   PRO  46          1HB       PRO  46  -0.762  14.006  -0.506
  739   2HB   PRO  46          2HB       PRO  46  -0.280  15.199   0.699
  740   1HG   PRO  46          1HG       PRO  46  -2.900  14.748  -0.581
  741   2HG   PRO  46          2HG       PRO  46  -2.535  15.612   0.955
  742   1HD   PRO  46          1HD       PRO  46  -3.216  16.722  -1.594
  743   2HD   PRO  46          2HD       PRO  46  -2.711  17.618  -0.156
  744    H    TRP  47           H        TRP  47   1.904  15.623  -2.773
  745    HA   TRP  47           HA       TRP  47   0.458  14.523  -5.042
  746   1HB   TRP  47          1HB       TRP  47   3.338  14.707  -5.307
  747   2HB   TRP  47          2HB       TRP  47   2.056  15.408  -6.297
  748    HD1  TRP  47           HD1      TRP  47   1.097  17.886  -5.366
  749    HE1  TRP  47           HE1      TRP  47   2.292  19.885  -4.124
  750    HE3  TRP  47           HE3      TRP  47   5.082  15.182  -3.732
  751    HZ2  TRP  47           HZ2      TRP  47   4.714  20.106  -2.632
  752    HZ3  TRP  47           HZ3      TRP  47   6.816  16.365  -2.389
  753    HH2  TRP  47           HH2      TRP  47   6.679  18.741  -1.834
  754    H    CYS  48           H        CYS  48   0.667  13.057  -2.446
  755    HA   CYS  48           HA       CYS  48   1.403  10.566  -3.503
  756   1HB   CYS  48          1HB       CYS  48   3.672  11.448  -3.131
  757   2HB   CYS  48          2HB       CYS  48   3.306  11.653  -1.417
  758    H    PHE  49           H        PHE  49  -0.205   9.357  -2.566
  759    HA   PHE  49           HA       PHE  49  -0.548   9.494   0.291
  760   1HB   PHE  49          1HB       PHE  49  -3.172   9.656  -0.450
  761   2HB   PHE  49          2HB       PHE  49  -2.221  11.104  -0.102
  762    HD1  PHE  49           HD1      PHE  49  -0.979  12.141  -2.158
  763    HD2  PHE  49           HD2      PHE  49  -4.272   9.482  -2.466
  764    HE1  PHE  49           HE1      PHE  49  -1.442  12.983  -4.477
  765    HE2  PHE  49           HE2      PHE  49  -4.737  10.324  -4.785
  766    HZ   PHE  49           HZ       PHE  49  -3.316  12.065  -5.762
  767    H    LYS  50           H        LYS  50  -2.977   8.076   0.479
  768    HA   LYS  50           HA       LYS  50  -2.350   5.638  -1.038
  769   1HB   LYS  50          1HB       LYS  50  -3.652   5.129   1.494
  770   2HB   LYS  50          2HB       LYS  50  -2.148   4.455   0.839
  771   1HG   LYS  50          1HG       LYS  50  -2.174   7.282   1.889
  772   2HG   LYS  50          2HG       LYS  50  -2.129   5.942   3.049
  773   1HD   LYS  50          1HD       LYS  50  -0.122   5.040   1.830
  774   2HD   LYS  50          2HD       LYS  50  -0.141   6.477   0.791
  775   1HE   LYS  50          1HE       LYS  50   1.370   6.359   2.986
  776   2HE   LYS  50          2HE       LYS  50   0.599   7.876   2.503
  777   1HZ   LYS  50          1HZ       LYS  50   0.270   7.257   4.841
  778   2HZ   LYS  50          2HZ       LYS  50  -1.136   7.453   4.034
  779   3HZ   LYS  50          3HZ       LYS  50  -0.592   5.951   4.373
  780    HA   PRO  51           HA       PRO  51  -6.603   6.964  -1.865
  781   1HB   PRO  51          1HB       PRO  51  -6.437   7.047  -4.591
  782   2HB   PRO  51          2HB       PRO  51  -6.227   8.468  -3.567
  783   1HG   PRO  51          1HG       PRO  51  -4.217   6.829  -4.975
  784   2HG   PRO  51          2HG       PRO  51  -4.058   8.511  -4.353
  785   1HD   PRO  51          1HD       PRO  51  -2.990   6.094  -3.246
  786   2HD   PRO  51          2HD       PRO  51  -2.943   7.703  -2.513
  787    H    LEU  52           H        LEU  52  -6.198   5.475  -4.867
  788    HA   LEU  52           HA       LEU  52  -7.665   3.189  -3.834
  789   1HB   LEU  52          1HB       LEU  52  -8.480   2.895  -5.922
  790   2HB   LEU  52          2HB       LEU  52  -8.239   4.651  -5.909
  791    HG   LEU  52           HG       LEU  52  -5.845   3.525  -6.895
  792   1HD1  LEU  52          1HD1      LEU  52  -8.223   1.940  -7.662
  793   2HD1  LEU  52          2HD1      LEU  52  -7.158   2.444  -8.996
  794   3HD1  LEU  52          3HD1      LEU  52  -6.498   1.501  -7.638
  795   1HD2  LEU  52          1HD2      LEU  52  -6.106   5.243  -8.274
  796   2HD2  LEU  52          2HD2      LEU  52  -7.550   4.503  -9.004
  797   3HD2  LEU  52          3HD2      LEU  52  -7.709   5.526  -7.556
  798    H    GLN  53           H        GLN  53  -4.981   3.376  -2.923
  799    HA   GLN  53           HA       GLN  53  -3.097   2.172  -4.445
  800   1HB   GLN  53          1HB       GLN  53  -3.633   1.910  -1.464
  801   2HB   GLN  53          2HB       GLN  53  -2.132   1.370  -2.237
  802   1HG   GLN  53          1HG       GLN  53  -3.248   4.207  -2.259
  803   2HG   GLN  53          2HG       GLN  53  -1.894   3.648  -1.267
  804   1HE2  GLN  53          1HE2      GLN  53  -0.756   1.911  -3.213
  805   2HE2  GLN  53          2HE2      GLN  53  -0.023   2.870  -4.455
  806    H    GLU  54           H        GLU  54  -6.071   0.820  -3.266
  807    HA   GLU  54           HA       GLU  54  -5.569  -1.743  -2.760
  808   1HB   GLU  54          1HB       GLU  54  -7.799  -2.234  -3.469
  809   2HB   GLU  54          2HB       GLU  54  -7.823  -0.560  -2.889
  810   1HG   GLU  54          1HG       GLU  54  -7.756   0.287  -5.163
  811   2HG   GLU  54          2HG       GLU  54  -7.487  -1.334  -5.821
  812    H    ALA  55           H        ALA  55  -5.004  -0.074  -5.788
  813    HA   ALA  55           HA       ALA  55  -5.229  -1.783  -7.774
  814   1HB   ALA  55          1HB       ALA  55  -3.374   0.318  -7.030
  815   2HB   ALA  55          2HB       ALA  55  -2.535  -0.936  -7.973
  816   3HB   ALA  55          3HB       ALA  55  -3.975  -0.133  -8.644
  817    H    GLU  56           H        GLU  56  -2.228  -1.873  -5.716
  818    HA   GLU  56           HA       GLU  56  -2.381  -4.763  -5.885
  819   1HB   GLU  56          1HB       GLU  56  -0.244  -3.011  -7.004
  820   2HB   GLU  56          2HB       GLU  56   0.308  -4.457  -6.144
  821   1HG   GLU  56          1HG       GLU  56  -0.719  -5.907  -7.666
  822   2HG   GLU  56          2HG       GLU  56  -1.914  -4.707  -8.179
  823    H    CYS  57           H        CYS  57  -2.709  -2.383  -3.878
  824    HA   CYS  57           HA       CYS  57  -0.599  -3.046  -2.005
  825   1HB   CYS  57          1HB       CYS  57  -1.699  -0.686  -2.588
  826   2HB   CYS  57          2HB       CYS  57  -2.785  -1.165  -1.281
  827    H    THR  58           H        THR  58  -4.237  -2.828  -2.105
  828    HA   THR  58           HA       THR  58  -4.572  -4.309   0.283
  829    HB   THR  58           HB       THR  58  -6.150  -2.602  -0.884
  830    HG1  THR  58           HG1      THR  58  -7.974  -4.028  -0.113
  831   1HG2  THR  58          1HG2      THR  58  -6.733  -5.160  -2.460
  832   2HG2  THR  58          2HG2      THR  58  -7.898  -3.824  -2.302
  833   3HG2  THR  58          3HG2      THR  58  -6.343  -3.557  -3.127
  834    H    PHE  59           H        PHE  59  -4.057  -5.199  -3.091
  835    HA   PHE  59           HA       PHE  59  -5.177  -7.546  -3.459
  836   1HB   PHE  59          1HB       PHE  59  -2.640  -6.224  -4.071
  837   2HB   PHE  59          2HB       PHE  59  -2.350  -7.959  -3.903
  838    HD1  PHE  59           HD1      PHE  59  -5.396  -6.303  -5.228
  839    HD2  PHE  59           HD2      PHE  59  -1.927  -8.575  -6.127
  840    HE1  PHE  59           HE1      PHE  59  -6.232  -6.652  -7.569
  841    HE2  PHE  59           HE2      PHE  59  -2.762  -8.925  -8.467
  842    HZ   PHE  59           HZ       PHE  59  -4.905  -7.959  -9.161
  Start of MODEL   38
    1   1H    GLU   1           H1       GLU   1 -14.369 -14.367  -6.977
    2    HA   GLU   1           HA       GLU   1 -13.314 -15.155  -4.420
    3   1HB   GLU   1          1HB       GLU   1 -12.128 -14.932  -6.819
    4   2HB   GLU   1          2HB       GLU   1 -11.820 -13.289  -6.233
    5   1HG   GLU   1          1HG       GLU   1 -10.772 -14.216  -4.194
    6   2HG   GLU   1          2HG       GLU   1 -11.115 -15.862  -4.742
    7    H    GLU   2           H        GLU   2 -14.452 -13.982  -2.838
    8    HA   GLU   2           HA       GLU   2 -14.847 -11.186  -3.217
    9   1HB   GLU   2          1HB       GLU   2 -15.960 -11.264  -1.051
   10   2HB   GLU   2          2HB       GLU   2 -16.499 -12.640  -2.030
   11   1HG   GLU   2          1HG       GLU   2 -14.114 -13.302  -0.477
   12   2HG   GLU   2          2HG       GLU   2 -15.408 -12.717   0.579
   13    H    TYR   3           H        TYR   3 -14.364 -10.998  -0.078
   14    HA   TYR   3           HA       TYR   3 -11.620 -10.087  -0.392
   15   1HB   TYR   3          1HB       TYR   3 -12.345  -9.350   2.090
   16   2HB   TYR   3          2HB       TYR   3 -13.020  -8.488   0.704
   17    HD1  TYR   3           HD1      TYR   3 -13.701 -10.910   3.395
   18    HD2  TYR   3           HD2      TYR   3 -15.364  -8.754   0.094
   19    HE1  TYR   3           HE1      TYR   3 -16.046 -11.486   4.190
   20    HE2  TYR   3           HE2      TYR   3 -17.703  -9.339   0.900
   21    HH   TYR   3           HH       TYR   3 -18.892 -10.282   2.434
   22    H    VAL   4           H        VAL   4 -10.726 -12.326  -0.515
   23    HA   VAL   4           HA       VAL   4 -10.357 -13.355   2.203
   24    HB   VAL   4           HB       VAL   4 -11.149 -14.862  -0.280
   25   1HG1  VAL   4          1HG1      VAL   4 -10.631 -16.959   0.917
   26   2HG1  VAL   4          2HG1      VAL   4  -9.171 -15.992   0.600
   27   3HG1  VAL   4          3HG1      VAL   4  -9.885 -16.017   2.230
   28   1HG2  VAL   4          1HG2      VAL   4 -12.657 -15.960   1.546
   29   2HG2  VAL   4          2HG2      VAL   4 -12.259 -14.510   2.498
   30   3HG2  VAL   4          3HG2      VAL   4 -13.072 -14.344   0.923
   31    H    GLY   5           H        GLY   5  -9.255 -13.744  -1.244
   32   1HA   GLY   5          1HA       GLY   5  -6.619 -14.469  -0.560
   33   2HA   GLY   5          2HA       GLY   5  -7.190 -13.905  -2.118
   34    H    LEU   6           H        LEU   6  -8.213 -11.530  -0.028
   35    HA   LEU   6           HA       LEU   6  -5.650 -10.165   0.129
   36   1HB   LEU   6          1HB       LEU   6  -6.365  -8.243  -1.030
   37   2HB   LEU   6          2HB       LEU   6  -6.616  -9.640  -2.090
   38    HG   LEU   6           HG       LEU   6  -8.493  -8.294  -2.424
   39   1HD1  LEU   6          1HD1      LEU   6  -8.933 -10.744  -1.804
   40   2HD1  LEU   6          2HD1      LEU   6  -9.559 -10.107  -0.264
   41   3HD1  LEU   6          3HD1      LEU   6 -10.315  -9.622  -1.801
   42   1HD2  LEU   6          1HD2      LEU   6  -7.887  -7.079  -0.083
   43   2HD2  LEU   6          2HD2      LEU   6  -9.406  -6.830  -0.977
   44   3HD2  LEU   6          3HD2      LEU   6  -9.352  -7.973   0.388
   45    H    SER   7           H        SER   7  -7.931 -11.452   1.837
   46    HA   SER   7           HA       SER   7  -8.498  -9.048   3.383
   47   1HB   SER   7          1HB       SER   7 -10.559 -10.044   2.786
   48   2HB   SER   7          2HB       SER   7  -9.966 -11.687   3.086
   49    HG   SER   7           HG       SER   7 -11.412 -10.846   4.766
   50    H    ALA   8           H        ALA   8  -7.263  -8.812   5.206
   51    HA   ALA   8           HA       ALA   8  -5.567  -9.419   6.601
   52   1HB   ALA   8          1HB       ALA   8  -6.999 -11.232   8.208
   53   2HB   ALA   8          2HB       ALA   8  -6.959  -9.459   8.368
   54   3HB   ALA   8          3HB       ALA   8  -8.243 -10.236   7.413
   55    H    ASN   9           H        ASN   9  -7.325 -12.579   6.542
   56    HA   ASN   9           HA       ASN   9  -5.322 -14.215   6.907
   57   1HB   ASN   9          1HB       ASN   9  -7.888 -14.529   6.040
   58   2HB   ASN   9          2HB       ASN   9  -7.036 -14.993   4.559
   59   1HD2  ASN   9          1HD2      ASN   9  -5.031 -16.422   5.061
   60   2HD2  ASN   9          2HD2      ASN   9  -5.315 -17.783   6.095
   61    H    GLN  10           H        GLN  10  -5.837 -12.169   4.076
   62    HA   GLN  10           HA       GLN  10  -4.458 -13.519   2.153
   63   1HB   GLN  10          1HB       GLN  10  -4.903 -11.657   0.979
   64   2HB   GLN  10          2HB       GLN  10  -5.609 -10.977   2.456
   65   1HG   GLN  10          1HG       GLN  10  -3.455  -9.992   3.068
   66   2HG   GLN  10          2HG       GLN  10  -2.658 -10.772   1.693
   67   1HE2  GLN  10          1HE2      GLN  10  -2.484  -9.677  -0.110
   68   2HE2  GLN  10          2HE2      GLN  10  -3.368  -8.259  -0.563
   69    H    CYS  11           H        CYS  11  -3.215 -11.244   4.681
   70    HA   CYS  11           HA       CYS  11  -0.576 -11.261   3.826
   71   1HB   CYS  11          1HB       CYS  11  -1.289  -9.586   5.322
   72   2HB   CYS  11          2HB       CYS  11  -1.841 -10.764   6.517
   73    H    ALA  12           H        ALA  12  -2.542 -13.795   4.952
   74    HA   ALA  12           HA       ALA  12  -0.340 -15.212   6.238
   75   1HB   ALA  12          1HB       ALA  12  -2.852 -15.009   7.048
   76   2HB   ALA  12          2HB       ALA  12  -3.115 -16.321   5.874
   77   3HB   ALA  12          3HB       ALA  12  -1.971 -16.547   7.219
   78    H    VAL  13           H        VAL  13  -0.759 -14.490   3.215
   79    HA   VAL  13           HA       VAL  13  -1.433 -16.527   1.640
   80    HB   VAL  13           HB       VAL  13   0.313 -14.276   1.528
   81   1HG1  VAL  13          1HG1      VAL  13   2.238 -15.658   1.373
   82   2HG1  VAL  13          2HG1      VAL  13   1.425 -16.800   0.277
   83   3HG1  VAL  13          3HG1      VAL  13   1.851 -15.169  -0.294
   84   1HG2  VAL  13          1HG2      VAL  13  -0.398 -14.176  -0.762
   85   2HG2  VAL  13          2HG2      VAL  13  -0.835 -15.901  -0.762
   86   3HG2  VAL  13          3HG2      VAL  13  -1.777 -14.744   0.210
   87    HA   PRO  14           HA       PRO  14   1.086 -19.937   2.471
   88   1HB   PRO  14          1HB       PRO  14   1.296 -21.146   0.030
   89   2HB   PRO  14          2HB       PRO  14  -0.125 -21.296   1.060
   90   1HG   PRO  14          1HG       PRO  14   0.299 -19.667  -1.362
   91   2HG   PRO  14          2HG       PRO  14  -1.256 -20.183  -0.614
   92   1HD   PRO  14          1HD       PRO  14  -0.015 -17.603  -0.540
   93   2HD   PRO  14          2HD       PRO  14  -1.462 -18.103   0.345
   94    H    ALA  15           H        ALA  15   2.455 -17.413   1.966
   95    HA   ALA  15           HA       ALA  15   4.492 -16.656   1.513
   96   1HB   ALA  15          1HB       ALA  15   4.826 -18.354   3.401
   97   2HB   ALA  15          2HB       ALA  15   5.444 -19.466   2.155
   98   3HB   ALA  15          3HB       ALA  15   6.277 -17.923   2.463
   99    H    LYS  16           H        LYS  16   3.563 -16.667  -0.822
  100    HA   LYS  16           HA       LYS  16   5.480 -17.084  -2.624
  101   1HB   LYS  16          1HB       LYS  16   4.617 -19.281  -3.735
  102   2HB   LYS  16          2HB       LYS  16   5.800 -19.354  -2.417
  103   1HG   LYS  16          1HG       LYS  16   4.365 -20.516  -1.125
  104   2HG   LYS  16          2HG       LYS  16   3.087 -19.308  -1.349
  105   1HD   LYS  16          1HD       LYS  16   1.994 -20.911  -2.512
  106   2HD   LYS  16          2HD       LYS  16   3.164 -20.625  -3.813
  107   1HE   LYS  16          1HE       LYS  16   4.568 -22.428  -3.048
  108   2HE   LYS  16          2HE       LYS  16   3.671 -22.583  -1.529
  109   1HZ   LYS  16          1HZ       LYS  16   3.206 -23.936  -3.829
  110   2HZ   LYS  16          2HZ       LYS  16   2.209 -23.868  -2.539
  111   3HZ   LYS  16          3HZ       LYS  16   1.998 -22.839  -3.790
  112    H    ASP  17           H        ASP  17   3.383 -15.308  -2.068
  113    HA   ASP  17           HA       ASP  17   2.190 -15.252  -4.641
  114   1HB   ASP  17          1HB       ASP  17   0.652 -16.721  -3.220
  115   2HB   ASP  17          2HB       ASP  17   0.335 -15.298  -2.219
  116    H    ARG  18           H        ARG  18   3.867 -13.820  -2.351
  117    HA   ARG  18           HA       ARG  18   2.263 -11.463  -1.998
  118   1HB   ARG  18          1HB       ARG  18   5.120 -11.990  -1.070
  119   2HB   ARG  18          2HB       ARG  18   4.029 -10.734  -0.459
  120   1HG   ARG  18          1HG       ARG  18   2.863 -12.210   0.852
  121   2HG   ARG  18          2HG       ARG  18   3.002 -13.536  -0.316
  122   1HD   ARG  18          1HD       ARG  18   5.271 -14.004   0.386
  123   2HD   ARG  18          2HD       ARG  18   5.343 -12.533   1.365
  124    HE   ARG  18           HE       ARG  18   3.164 -14.294   2.162
  125   1HH1  ARG  18          1HH1      ARG  18   6.620 -13.724   2.505
  126   2HH1  ARG  18          2HH1      ARG  18   6.732 -14.537   4.031
  127   1HH2  ARG  18          1HH2      ARG  18   3.312 -15.366   4.175
  128   2HH2  ARG  18          2HH2      ARG  18   4.838 -15.478   4.987
  129    H    VAL  19           H        VAL  19   3.716  -9.279  -2.200
  130    HA   VAL  19           HA       VAL  19   4.822  -9.382  -4.908
  131    HB   VAL  19           HB       VAL  19   3.944  -6.974  -3.312
  132   1HG1  VAL  19          1HG1      VAL  19   3.724  -6.918  -6.237
  133   2HG1  VAL  19          2HG1      VAL  19   4.448  -5.738  -5.117
  134   3HG1  VAL  19          3HG1      VAL  19   5.393  -7.146  -5.660
  135   1HG2  VAL  19          1HG2      VAL  19   1.838  -7.704  -3.509
  136   2HG2  VAL  19          2HG2      VAL  19   2.009  -7.454  -5.263
  137   3HG2  VAL  19          3HG2      VAL  19   2.328  -9.056  -4.558
  138    H    ASP  20           H        ASP  20   6.102 -10.110  -2.160
  139    HA   ASP  20           HA       ASP  20   7.886  -9.599  -0.966
  140   1HB   ASP  20          1HB       ASP  20   9.093 -10.833  -2.506
  141   2HB   ASP  20          2HB       ASP  20   8.685  -9.762  -3.854
  142    H    CYS  21           H        CYS  21   7.272  -7.484  -0.062
  143    HA   CYS  21           HA       CYS  21   7.333  -5.083  -1.287
  144   1HB   CYS  21          1HB       CYS  21   6.735  -5.761   1.131
  145   2HB   CYS  21          2HB       CYS  21   8.420  -5.381   1.500
  146    H    GLY  22           H        GLY  22  10.063  -7.040   0.004
  147   1HA   GLY  22          1HA       GLY  22  12.303  -6.707  -0.035
  148   2HA   GLY  22          2HA       GLY  22  12.000  -6.316  -1.717
  149    H    TYR  23           H        TYR  23  11.563  -4.709   1.525
  150    HA   TYR  23           HA       TYR  23  12.282  -2.174   0.298
  151   1HB   TYR  23          1HB       TYR  23  10.910  -3.307   2.706
  152   2HB   TYR  23          2HB       TYR  23  11.879  -1.876   3.071
  153    HD1  TYR  23           HD1      TYR  23   9.878  -2.656   0.005
  154    HD2  TYR  23           HD2      TYR  23  10.298  -0.196   3.480
  155    HE1  TYR  23           HE1      TYR  23   7.978  -1.175  -0.806
  156    HE2  TYR  23           HE2      TYR  23   8.396   1.278   2.657
  157    HH   TYR  23           HH       TYR  23   6.593   1.261   1.238
  158    HA   PRO  24           HA       PRO  24  16.299  -2.166   1.903
  159   1HB   PRO  24          1HB       PRO  24  16.795   0.512   2.107
  160   2HB   PRO  24          2HB       PRO  24  16.904  -0.376   0.588
  161   1HG   PRO  24          1HG       PRO  24  14.803   1.445   1.575
  162   2HG   PRO  24          2HG       PRO  24  15.145   0.939  -0.119
  163   1HD   PRO  24          1HD       PRO  24  13.035   0.065   1.609
  164   2HD   PRO  24          2HD       PRO  24  13.424  -0.580   0.008
  165    H    HIS  25           H        HIS  25  13.691  -1.297   3.709
  166    HA   HIS  25           HA       HIS  25  15.371  -1.409   6.086
  167   1HB   HIS  25          1HB       HIS  25  13.555   0.806   5.273
  168   2HB   HIS  25          2HB       HIS  25  13.555   0.341   6.978
  169    HD1  HIS  25           HD1      HIS  25  15.278   1.492   8.373
  170    HD2  HIS  25           HD2      HIS  25  16.355   1.373   4.321
  171    HE1  HIS  25           HE1      HIS  25  17.454   2.809   8.173
  172    HE2  HIS  25           HE2      HIS  25  18.095   2.654   5.671
  173    H    VAL  26           H        VAL  26  14.126  -3.612   5.023
  174    HA   VAL  26           HA       VAL  26  11.462  -3.883   5.991
  175    HB   VAL  26           HB       VAL  26  11.978  -5.172   4.136
  176   1HG1  VAL  26          1HG1      VAL  26  14.167  -5.395   3.677
  177   2HG1  VAL  26          2HG1      VAL  26  14.623  -5.410   5.397
  178   3HG1  VAL  26          3HG1      VAL  26  14.065  -6.907   4.611
  179   1HG2  VAL  26          1HG2      VAL  26  10.977  -6.402   6.259
  180   2HG2  VAL  26          2HG2      VAL  26  11.358  -7.295   4.766
  181   3HG2  VAL  26          3HG2      VAL  26  12.486  -7.339   6.142
  182    H    THR  27           H        THR  27  10.763  -4.438   7.999
  183    HA   THR  27           HA       THR  27  12.340  -6.063   9.729
  184    HB   THR  27           HB       THR  27  12.812  -3.211   9.745
  185    HG1  THR  27           HG1      THR  27  14.499  -4.108  10.928
  186   1HG2  THR  27          1HG2      THR  27  12.344  -3.871  12.553
  187   2HG2  THR  27          2HG2      THR  27  11.807  -2.436  11.647
  188   3HG2  THR  27          3HG2      THR  27  10.809  -3.909  11.655
  189    HA   PRO  28           HA       PRO  28   8.418  -6.737  11.325
  190   1HB   PRO  28          1HB       PRO  28   8.981  -7.769  13.790
  191   2HB   PRO  28          2HB       PRO  28   9.071  -8.715  12.305
  192   1HG   PRO  28          1HG       PRO  28  11.230  -7.541  13.939
  193   2HG   PRO  28          2HG       PRO  28  11.332  -8.876  12.735
  194   1HD   PRO  28          1HD       PRO  28  12.174  -6.154  12.450
  195   2HD   PRO  28          2HD       PRO  28  12.149  -7.387  11.185
  196    H    LYS  29           H        LYS  29   8.773  -4.112  11.276
  197    HA   LYS  29           HA       LYS  29   7.048  -3.226  13.221
  198   1HB   LYS  29          1HB       LYS  29   9.280  -3.820  14.551
  199   2HB   LYS  29          2HB       LYS  29   9.712  -2.175  14.048
  200   1HG   LYS  29          1HG       LYS  29   8.402  -1.348  15.677
  201   2HG   LYS  29          2HG       LYS  29   6.985  -2.127  14.953
  202   1HD   LYS  29          1HD       LYS  29   8.291  -4.236  16.211
  203   2HD   LYS  29          2HD       LYS  29   8.564  -2.891  17.333
  204   1HE   LYS  29          1HE       LYS  29   5.805  -3.025  16.283
  205   2HE   LYS  29          2HE       LYS  29   6.267  -4.464  17.204
  206   1HZ   LYS  29          1HZ       LYS  29   5.372  -2.288  18.328
  207   2HZ   LYS  29          2HZ       LYS  29   6.453  -3.258  19.075
  208   3HZ   LYS  29          3HZ       LYS  29   6.958  -1.895  18.328
  209    H    GLU  30           H        GLU  30   9.522  -2.818  10.793
  210    HA   GLU  30           HA       GLU  30   8.800  -0.033  10.477
  211   1HB   GLU  30          1HB       GLU  30  11.135  -1.682   9.874
  212   2HB   GLU  30          2HB       GLU  30  10.654  -0.709   8.473
  213   1HG   GLU  30          1HG       GLU  30  12.238   0.549   9.839
  214   2HG   GLU  30          2HG       GLU  30  10.651   1.327   9.944
  215    H    CYS  31           H        CYS  31   8.855  -3.173   8.682
  216    HA   CYS  31           HA       CYS  31   7.849  -2.262   6.295
  217   1HB   CYS  31          1HB       CYS  31   7.807  -4.879   7.725
  218   2HB   CYS  31          2HB       CYS  31   6.811  -4.691   6.280
  219    H    ASN  32           H        ASN  32   6.107  -3.592   9.202
  220    HA   ASN  32           HA       ASN  32   3.576  -3.197   8.157
  221   1HB   ASN  32          1HB       ASN  32   4.800  -3.822  10.780
  222   2HB   ASN  32          2HB       ASN  32   3.266  -2.952  10.930
  223   1HD2  ASN  32          1HD2      ASN  32   4.667  -5.458   8.813
  224   2HD2  ASN  32          2HD2      ASN  32   3.358  -6.587   8.914
  225    H    ASN  33           H        ASN  33   5.969  -0.947   8.987
  226    HA   ASN  33           HA       ASN  33   4.064   1.014   9.945
  227   1HB   ASN  33          1HB       ASN  33   6.459   0.539  10.954
  228   2HB   ASN  33          2HB       ASN  33   7.044   1.508   9.593
  229   1HD2  ASN  33          1HD2      ASN  33   7.813   2.817  11.440
  230   2HD2  ASN  33          2HD2      ASN  33   6.774   4.044  12.084
  231    H    ARG  34           H        ARG  34   6.147   0.052   7.228
  232    HA   ARG  34           HA       ARG  34   5.939   2.583   5.945
  233   1HB   ARG  34          1HB       ARG  34   6.793  -0.006   4.608
  234   2HB   ARG  34          2HB       ARG  34   7.347   1.640   4.254
  235   1HG   ARG  34          1HG       ARG  34   8.021   1.320   6.930
  236   2HG   ARG  34          2HG       ARG  34   8.311  -0.300   6.270
  237   1HD   ARG  34          1HD       ARG  34  10.266   0.451   5.428
  238   2HD   ARG  34          2HD       ARG  34   9.368   1.550   4.369
  239    HE   ARG  34           HE       ARG  34   9.644   2.582   7.081
  240   1HH1  ARG  34          1HH1      ARG  34  11.283   2.264   3.982
  241   2HH1  ARG  34          2HH1      ARG  34  12.310   3.635   4.241
  242   1HH2  ARG  34          1HH2      ARG  34  11.000   4.390   7.422
  243   2HH2  ARG  34          2HH2      ARG  34  12.147   4.852   6.211
  244    H    GLY  35           H        GLY  35   4.227  -0.512   6.020
  245   1HA   GLY  35          1HA       GLY  35   1.879  -0.281   5.274
  246   2HA   GLY  35          2HA       GLY  35   2.510   0.398   3.787
  247    H    CYS  36           H        CYS  36   4.245  -2.215   5.468
  248    HA   CYS  36           HA       CYS  36   3.348  -4.026   3.344
  249   1HB   CYS  36          1HB       CYS  36   6.067  -3.837   4.643
  250   2HB   CYS  36          2HB       CYS  36   5.571  -5.115   3.530
  251    H    CYS  37           H        CYS  37   4.174  -6.445   4.260
  252    HA   CYS  37           HA       CYS  37   3.194  -6.577   7.016
  253   1HB   CYS  37          1HB       CYS  37   1.505  -7.248   5.241
  254   2HB   CYS  37          2HB       CYS  37   2.538  -8.644   4.920
  255    H    PHE  38           H        PHE  38   4.733  -7.513   8.318
  256    HA   PHE  38           HA       PHE  38   6.959  -8.836   7.036
  257   1HB   PHE  38          1HB       PHE  38   7.032  -7.078   8.929
  258   2HB   PHE  38          2HB       PHE  38   6.310  -8.290   9.992
  259    HD1  PHE  38           HD1      PHE  38   7.624 -10.155  10.798
  260    HD2  PHE  38           HD2      PHE  38   9.328  -7.289   8.172
  261    HE1  PHE  38           HE1      PHE  38   9.916 -11.023  11.338
  262    HE2  PHE  38           HE2      PHE  38  11.621  -8.157   8.712
  263    HZ   PHE  38           HZ       PHE  38  11.888 -10.014  10.289
  264    H    ASP  39           H        ASP  39   7.154 -11.016   6.840
  265    HA   ASP  39           HA       ASP  39   5.181 -12.618   8.180
  266   1HB   ASP  39          1HB       ASP  39   5.557 -13.088   5.838
  267   2HB   ASP  39          2HB       ASP  39   7.308 -13.204   6.077
  268    H    SER  40           H        SER  40   8.631 -13.392   7.364
  269    HA   SER  40           HA       SER  40  10.369 -13.791   8.669
  270   1HB   SER  40          1HB       SER  40   8.853 -12.427  10.488
  271   2HB   SER  40          2HB       SER  40   8.947 -14.010  11.277
  272    HG   SER  40           HG       SER  40  11.051 -13.717  11.665
  273    H    ARG  41           H        ARG  41   7.356 -15.439   8.557
  274    HA   ARG  41           HA       ARG  41   7.973 -17.691  10.052
  275   1HB   ARG  41          1HB       ARG  41   6.147 -17.345   7.630
  276   2HB   ARG  41          2HB       ARG  41   6.136 -18.772   8.679
  277   1HG   ARG  41          1HG       ARG  41   5.902 -16.778  10.533
  278   2HG   ARG  41          2HG       ARG  41   5.071 -16.025   9.161
  279   1HD   ARG  41          1HD       ARG  41   3.269 -17.179   9.967
  280   2HD   ARG  41          2HD       ARG  41   3.981 -18.542   9.089
  281    HE   ARG  41           HE       ARG  41   5.240 -18.589  11.568
  282   1HH1  ARG  41          1HH1      ARG  41   1.887 -18.640  10.501
  283   2HH1  ARG  41          2HH1      ARG  41   1.334 -19.554  11.865
  284   1HH2  ARG  41          1HH2      ARG  41   4.511 -19.795  13.367
  285   2HH2  ARG  41          2HH2      ARG  41   2.838 -20.215  13.506
  286    H    ILE  42           H        ILE  42   8.438 -16.829   6.574
  287    HA   ILE  42           HA       ILE  42  10.165 -19.196   6.347
  288    HB   ILE  42           HB       ILE  42   8.726 -18.030   3.996
  289   1HG1  ILE  42          1HG1      ILE  42   7.562 -19.834   6.105
  290   2HG1  ILE  42          2HG1      ILE  42   6.869 -18.365   5.396
  291   1HG2  ILE  42          1HG2      ILE  42   9.142 -20.089   2.976
  292   2HG2  ILE  42          2HG2      ILE  42  10.631 -19.750   3.891
  293   3HG2  ILE  42          3HG2      ILE  42   9.440 -20.909   4.529
  294   1HD1  ILE  42          1HD1      ILE  42   6.982 -21.164   4.313
  295   2HD1  ILE  42          2HD1      ILE  42   5.678 -19.958   4.207
  296   3HD1  ILE  42          3HD1      ILE  42   7.099 -19.828   3.143
  297    HA   PRO  43           HA       PRO  43  13.001 -15.932   5.624
  298   1HB   PRO  43          1HB       PRO  43  15.270 -17.426   5.909
  299   2HB   PRO  43          2HB       PRO  43  14.443 -16.661   7.265
  300   1HG   PRO  43          1HG       PRO  43  14.468 -19.484   6.410
  301   2HG   PRO  43          2HG       PRO  43  14.039 -18.802   8.020
  302   1HD   PRO  43          1HD       PRO  43  12.287 -19.814   5.995
  303   2HD   PRO  43          2HD       PRO  43  11.811 -19.007   7.493
  304    H    GLY  44           H        GLY  44  12.140 -18.492   3.759
  305   1HA   GLY  44          1HA       GLY  44  14.146 -17.936   1.696
  306   2HA   GLY  44          2HA       GLY  44  13.002 -19.263   1.735
  307    H    VAL  45           H        VAL  45  11.147 -16.710   2.728
  308    HA   VAL  45           HA       VAL  45  10.483 -15.953  -0.034
  309    HB   VAL  45           HB       VAL  45   8.254 -16.246   0.353
  310   1HG1  VAL  45          1HG1      VAL  45   7.895 -18.396   1.523
  311   2HG1  VAL  45          2HG1      VAL  45   9.314 -18.438   0.448
  312   3HG1  VAL  45          3HG1      VAL  45   9.535 -18.282   2.208
  313   1HG2  VAL  45          1HG2      VAL  45   8.203 -14.771   2.364
  314   2HG2  VAL  45          2HG2      VAL  45   7.126 -16.182   2.490
  315   3HG2  VAL  45          3HG2      VAL  45   8.679 -16.170   3.358
  316    HA   PRO  46           HA       PRO  46  10.380 -11.835   1.338
  317   1HB   PRO  46          1HB       PRO  46   7.964 -10.766   0.645
  318   2HB   PRO  46          2HB       PRO  46   9.272 -11.022  -0.509
  319   1HG   PRO  46          1HG       PRO  46   6.795 -12.566  -0.076
  320   2HG   PRO  46          2HG       PRO  46   7.859 -12.533  -1.529
  321   1HD   PRO  46          1HD       PRO  46   7.641 -14.569   0.474
  322   2HD   PRO  46          2HD       PRO  46   8.816 -14.510  -0.847
  323    H    TRP  47           H        TRP  47  10.676 -11.273   3.393
  324    HA   TRP  47           HA       TRP  47   8.497 -11.925   5.202
  325   1HB   TRP  47          1HB       TRP  47  10.787 -10.601   6.378
  326   2HB   TRP  47          2HB       TRP  47  10.063 -12.167   6.749
  327    HD1  TRP  47           HD1      TRP  47  11.107 -14.318   5.372
  328    HE1  TRP  47           HE1      TRP  47  13.433 -14.784   4.216
  329    HE3  TRP  47           HE3      TRP  47  12.554  -9.450   5.127
  330    HZ2  TRP  47           HZ2      TRP  47  15.569 -13.102   3.348
  331    HZ3  TRP  47           HZ3      TRP  47  14.775  -8.948   4.112
  332    HH2  TRP  47           HH2      TRP  47  16.263 -10.680   3.239
  333    H    CYS  48           H        CYS  48   8.228  -9.828   3.079
  334    HA   CYS  48           HA       CYS  48   7.085  -7.841   4.689
  335   1HB   CYS  48          1HB       CYS  48   9.375  -7.127   5.039
  336   2HB   CYS  48          2HB       CYS  48   9.650  -7.046   3.297
  337    H    PHE  49           H        PHE  49   5.244  -7.777   3.428
  338    HA   PHE  49           HA       PHE  49   5.622  -7.101   0.618
  339   1HB   PHE  49          1HB       PHE  49   3.445  -8.779   0.543
  340   2HB   PHE  49          2HB       PHE  49   5.090  -9.357   0.254
  341    HD1  PHE  49           HD1      PHE  49   6.382  -9.973   2.520
  342    HD2  PHE  49           HD2      PHE  49   2.167  -9.940   2.042
  343    HE1  PHE  49           HE1      PHE  49   6.150 -11.552   4.458
  344    HE2  PHE  49           HE2      PHE  49   1.934 -11.519   3.980
  345    HZ   PHE  49           HZ       PHE  49   3.929 -12.305   5.165
  346    H    LYS  50           H        LYS  50   2.923  -7.117  -0.155
  347    HA   LYS  50           HA       LYS  50   1.718  -5.261   1.778
  348   1HB   LYS  50          1HB       LYS  50   0.813  -4.507  -0.746
  349   2HB   LYS  50          2HB       LYS  50   1.965  -3.634   0.281
  350   1HG   LYS  50          1HG       LYS  50   2.927  -5.905  -1.461
  351   2HG   LYS  50          2HG       LYS  50   2.620  -4.324  -2.200
  352   1HD   LYS  50          1HD       LYS  50   4.553  -4.999   0.049
  353   2HD   LYS  50          2HD       LYS  50   4.959  -4.396  -1.567
  354   1HE   LYS  50          1HE       LYS  50   3.706  -2.930   0.768
  355   2HE   LYS  50          2HE       LYS  50   5.132  -2.476  -0.179
  356   1HZ   LYS  50          1HZ       LYS  50   2.391  -2.547  -1.236
  357   2HZ   LYS  50          2HZ       LYS  50   3.131  -1.195  -0.698
  358   3HZ   LYS  50          3HZ       LYS  50   3.717  -1.981  -2.004
  359    HA   PRO  51           HA       PRO  51  -1.084  -8.698   0.816
  360   1HB   PRO  51          1HB       PRO  51  -1.478  -9.588   3.369
  361   2HB   PRO  51          2HB       PRO  51  -0.292 -10.295   2.274
  362   1HG   PRO  51          1HG       PRO  51   0.088  -8.459   4.552
  363   2HG   PRO  51          2HG       PRO  51   1.297  -9.536   3.763
  364   1HD   PRO  51          1HD       PRO  51   1.015  -6.697   3.518
  365   2HD   PRO  51          2HD       PRO  51   2.118  -7.731   2.599
  366    H    LEU  52           H        LEU  52  -2.154  -8.177   4.005
  367    HA   LEU  52           HA       LEU  52  -4.488  -6.856   2.913
  368   1HB   LEU  52          1HB       LEU  52  -5.594  -7.507   4.793
  369   2HB   LEU  52          2HB       LEU  52  -4.430  -8.826   4.575
  370    HG   LEU  52           HG       LEU  52  -3.355  -6.745   6.286
  371   1HD1  LEU  52          1HD1      LEU  52  -5.250  -6.109   7.311
  372   2HD1  LEU  52          2HD1      LEU  52  -6.165  -7.524   6.736
  373   3HD1  LEU  52          3HD1      LEU  52  -5.101  -7.669   8.155
  374   1HD2  LEU  52          1HD2      LEU  52  -3.401  -9.612   6.043
  375   2HD2  LEU  52          2HD2      LEU  52  -2.268  -8.567   6.933
  376   3HD2  LEU  52          3HD2      LEU  52  -3.758  -9.139   7.720
  377    H    GLN  53           H        GLN  53  -2.027  -5.369   2.745
  378    HA   GLN  53           HA       GLN  53  -1.672  -3.669   4.888
  379   1HB   GLN  53          1HB       GLN  53  -1.199  -3.236   1.915
  380   2HB   GLN  53          2HB       GLN  53  -0.583  -2.157   3.179
  381   1HG   GLN  53          1HG       GLN  53   0.059  -5.115   2.819
  382   2HG   GLN  53          2HG       GLN  53   1.161  -3.764   2.513
  383   1HE2  GLN  53          1HE2      GLN  53   0.658  -2.132   4.646
  384   2HE2  GLN  53          2HE2      GLN  53   1.151  -2.880   6.129
  385    H    GLU  54           H        GLU  54  -4.247  -3.892   2.552
  386    HA   GLU  54           HA       GLU  54  -5.048  -1.337   2.232
  387   1HB   GLU  54          1HB       GLU  54  -7.281  -2.217   1.856
  388   2HB   GLU  54          2HB       GLU  54  -6.100  -3.371   1.210
  389   1HG   GLU  54          1HG       GLU  54  -6.996  -4.975   2.508
  390   2HG   GLU  54          2HG       GLU  54  -6.546  -4.060   3.955
  391    H    ALA  55           H        ALA  55  -4.897  -3.172   5.192
  392    HA   ALA  55           HA       ALA  55  -6.908  -2.231   6.729
  393   1HB   ALA  55          1HB       ALA  55  -5.328  -2.496   8.624
  394   2HB   ALA  55          2HB       ALA  55  -5.198  -3.838   7.462
  395   3HB   ALA  55          3HB       ALA  55  -3.972  -2.547   7.473
  396    H    GLU  56           H        GLU  56  -3.651  -0.618   6.512
  397    HA   GLU  56           HA       GLU  56  -5.092   1.883   6.937
  398   1HB   GLU  56          1HB       GLU  56  -2.797   0.706   8.355
  399   2HB   GLU  56          2HB       GLU  56  -2.508   2.376   7.837
  400   1HG   GLU  56          1HG       GLU  56  -5.165   2.267   8.876
  401   2HG   GLU  56          2HG       GLU  56  -4.141   1.395  10.025
  402    H    CYS  57           H        CYS  57  -4.054   0.261   4.484
  403    HA   CYS  57           HA       CYS  57  -2.138   2.197   3.460
  404   1HB   CYS  57          1HB       CYS  57  -1.488  -0.079   3.182
  405   2HB   CYS  57          2HB       CYS  57  -3.037  -0.505   2.451
  406    H    THR  58           H        THR  58  -4.592   0.313   1.621
  407    HA   THR  58           HA       THR  58  -5.299   2.275  -0.120
  408    HB   THR  58           HB       THR  58  -5.910  -0.229  -0.064
  409    HG1  THR  58           HG1      THR  58  -6.910   1.835  -1.267
  410   1HG2  THR  58          1HG2      THR  58  -7.034  -0.293   2.168
  411   2HG2  THR  58          2HG2      THR  58  -8.217   0.911   1.604
  412   3HG2  THR  58          3HG2      THR  58  -8.181  -0.712   0.874
  413    H    PHE  59           H        PHE  59  -6.369   1.890   3.252
  414    HA   PHE  59           HA       PHE  59  -8.595   3.256   3.486
  415   1HB   PHE  59          1HB       PHE  59  -6.847   2.477   5.242
  416   2HB   PHE  59          2HB       PHE  59  -6.022   4.019   4.985
  417    HD1  PHE  59           HD1      PHE  59  -6.667   5.895   6.213
  418    HD2  PHE  59           HD2      PHE  59  -9.285   2.561   6.015
  419    HE1  PHE  59           HE1      PHE  59  -8.149   6.957   7.938
  420    HE2  PHE  59           HE2      PHE  59 -10.768   3.623   7.740
  421    HZ   PHE  59           HZ       PHE  59 -10.182   5.809   8.680
  422   1H    GLU   1           H1       GLU   1 -22.725   8.836   1.302
  423    HA   GLU   1           HA       GLU   1 -22.270   7.728  -0.525
  424   1HB   GLU   1          1HB       GLU   1 -19.825   9.220   0.213
  425   2HB   GLU   1          2HB       GLU   1 -19.561   7.958  -1.004
  426   1HG   GLU   1          1HG       GLU   1 -20.927   9.000  -2.567
  427   2HG   GLU   1          2HG       GLU   1 -21.934   9.784  -1.340
  428    H    GLU   2           H        GLU   2 -21.343   5.775  -1.547
  429    HA   GLU   2           HA       GLU   2 -20.664   3.867   0.501
  430   1HB   GLU   2          1HB       GLU   2 -22.422   3.627  -1.447
  431   2HB   GLU   2          2HB       GLU   2 -21.014   3.160  -2.416
  432   1HG   GLU   2          1HG       GLU   2 -20.472   1.417  -0.698
  433   2HG   GLU   2          2HG       GLU   2 -21.945   1.851   0.183
  434    H    TYR   3           H        TYR   3 -19.450   2.299  -2.022
  435    HA   TYR   3           HA       TYR   3 -16.746   2.914  -1.326
  436   1HB   TYR   3          1HB       TYR   3 -16.391   1.079  -3.053
  437   2HB   TYR   3          2HB       TYR   3 -17.587   0.615  -1.840
  438    HD1  TYR   3           HD1      TYR   3 -16.994   1.394  -5.360
  439    HD2  TYR   3           HD2      TYR   3 -19.996   0.557  -2.429
  440    HE1  TYR   3           HE1      TYR   3 -18.675   0.919  -7.206
  441    HE2  TYR   3           HE2      TYR   3 -21.666   0.084  -4.285
  442    HH   TYR   3           HH       TYR   3 -22.006  -0.038  -6.409
  443    H    VAL   4           H        VAL   4 -17.215   5.313  -2.083
  444    HA   VAL   4           HA       VAL   4 -16.540   5.455  -4.940
  445    HB   VAL   4           HB       VAL   4 -17.622   7.593  -4.999
  446   1HG1  VAL   4          1HG1      VAL   4 -19.113   5.218  -3.996
  447   2HG1  VAL   4          2HG1      VAL   4 -19.984   6.769  -4.008
  448   3HG1  VAL   4          3HG1      VAL   4 -19.287   6.129  -5.515
  449   1HG2  VAL   4          1HG2      VAL   4 -17.123   8.517  -2.852
  450   2HG2  VAL   4          2HG2      VAL   4 -18.897   8.422  -2.978
  451   3HG2  VAL   4          3HG2      VAL   4 -18.007   7.219  -2.015
  452    H    GLY   5           H        GLY   5 -16.082   7.025  -1.700
  453   1HA   GLY   5          1HA       GLY   5 -13.818   8.536  -2.548
  454   2HA   GLY   5          2HA       GLY   5 -14.384   8.285  -0.908
  455    H    LEU   6           H        LEU   6 -14.115   5.251  -2.435
  456    HA   LEU   6           HA       LEU   6 -11.312   4.962  -1.643
  457   1HB   LEU   6          1HB       LEU   6 -13.014   2.678  -0.993
  458   2HB   LEU   6          2HB       LEU   6 -11.682   3.414  -0.085
  459    HG   LEU   6           HG       LEU   6 -13.269   5.197   0.657
  460   1HD1  LEU   6          1HD1      LEU   6 -15.754   3.927   0.309
  461   2HD1  LEU   6          2HD1      LEU   6 -15.198   5.457  -0.409
  462   3HD1  LEU   6          3HD1      LEU   6 -14.975   3.928  -1.292
  463   1HD2  LEU   6          1HD2      LEU   6 -12.834   2.713   1.695
  464   2HD2  LEU   6          2HD2      LEU   6 -13.746   4.012   2.500
  465   3HD2  LEU   6          3HD2      LEU   6 -14.610   2.748   1.592
  466    H    SER   7           H        SER   7 -13.328   5.066  -4.136
  467    HA   SER   7           HA       SER   7 -12.815   2.504  -5.274
  468   1HB   SER   7          1HB       SER   7 -14.044   3.331  -7.193
  469   2HB   SER   7          2HB       SER   7 -14.905   3.824  -5.724
  470    HG   SER   7           HG       SER   7 -14.240   5.401  -7.693
  471    H    ALA   8           H        ALA   8 -12.179   3.041  -7.945
  472    HA   ALA   8           HA       ALA   8  -9.391   3.576  -7.724
  473   1HB   ALA   8          1HB       ALA   8 -10.404   1.871  -9.236
  474   2HB   ALA   8          2HB       ALA   8 -11.152   3.183 -10.178
  475   3HB   ALA   8          3HB       ALA   8  -9.380   3.037 -10.109
  476    H    ASN   9           H        ASN   9 -12.083   5.594  -7.777
  477    HA   ASN   9           HA       ASN   9 -10.749   7.596  -9.389
  478   1HB   ASN   9          1HB       ASN   9 -13.354   6.916  -9.354
  479   2HB   ASN   9          2HB       ASN   9 -13.405   8.092  -8.031
  480   1HD2  ASN   9          1HD2      ASN   9 -12.901  10.245  -8.418
  481   2HD2  ASN   9          2HD2      ASN   9 -12.914  10.948 -10.001
  482    H    GLN  10           H        GLN  10 -10.905   6.470  -6.196
  483    HA   GLN  10           HA       GLN  10 -11.217   8.835  -4.765
  484   1HB   GLN  10          1HB       GLN  10 -11.043   7.455  -2.993
  485   2HB   GLN  10          2HB       GLN  10 -10.920   6.132  -4.167
  486   1HG   GLN  10          1HG       GLN  10  -8.462   6.336  -4.150
  487   2HG   GLN  10          2HG       GLN  10  -8.559   7.705  -3.031
  488   1HE2  GLN  10          1HE2      GLN  10  -8.764   7.364  -0.910
  489   2HE2  GLN  10          2HE2      GLN  10  -8.874   5.816  -0.140
  490    H    CYS  11           H        CYS  11  -8.378   7.212  -6.245
  491    HA   CYS  11           HA       CYS  11  -6.428   8.772  -5.015
  492   1HB   CYS  11          1HB       CYS  11  -5.788   6.756  -6.053
  493   2HB   CYS  11          2HB       CYS  11  -6.483   7.231  -7.606
  494    H    ALA  12           H        ALA  12  -8.971   9.631  -7.093
  495    HA   ALA  12           HA       ALA  12  -7.457  11.813  -8.324
  496   1HB   ALA  12          1HB       ALA  12  -9.032  10.133  -9.581
  497   2HB   ALA  12          2HB       ALA  12 -10.340  11.130  -8.902
  498   3HB   ALA  12          3HB       ALA  12  -9.121  11.869  -9.968
  499    H    VAL  13           H        VAL  13  -8.427  11.445  -5.386
  500    HA   VAL  13           HA       VAL  13 -10.536  12.916  -4.681
  501    HB   VAL  13           HB       VAL  13  -8.113  12.064  -3.519
  502   1HG1  VAL  13          1HG1      VAL  13  -8.713  14.980  -2.931
  503   2HG1  VAL  13          2HG1      VAL  13  -7.690  13.941  -1.909
  504   3HG1  VAL  13          3HG1      VAL  13  -7.207  14.292  -3.587
  505   1HG2  VAL  13          1HG2      VAL  13 -10.768  12.109  -2.885
  506   2HG2  VAL  13          2HG2      VAL  13  -9.467  11.641  -1.763
  507   3HG2  VAL  13          3HG2      VAL  13 -10.118  13.298  -1.731
  508    HA   PRO  14           HA       PRO  14  -9.997  16.993  -6.000
  509   1HB   PRO  14          1HB       PRO  14 -11.235  18.443  -4.044
  510   2HB   PRO  14          2HB       PRO  14 -12.112  17.598  -5.316
  511   1HG   PRO  14          1HG       PRO  14 -11.728  16.879  -2.480
  512   2HG   PRO  14          2HG       PRO  14 -12.988  16.294  -3.627
  513   1HD   PRO  14          1HD       PRO  14 -10.660  14.917  -2.688
  514   2HD   PRO  14          2HD       PRO  14 -11.782  14.362  -3.936
  515    H    ALA  15           H        ALA  15  -7.805  15.803  -4.448
  516    HA   ALA  15           HA       ALA  15  -5.939  16.432  -3.428
  517   1HB   ALA  15          1HB       ALA  15  -5.667  17.606  -5.571
  518   2HB   ALA  15          2HB       ALA  15  -6.523  19.023  -4.918
  519   3HB   ALA  15          3HB       ALA  15  -4.944  18.550  -4.247
  520    H    LYS  16           H        LYS  16  -7.339  16.251  -1.396
  521    HA   LYS  16           HA       LYS  16  -6.647  17.998   0.484
  522   1HB   LYS  16          1HB       LYS  16  -8.815  19.395   0.727
  523   2HB   LYS  16          2HB       LYS  16  -7.553  19.937  -0.393
  524   1HG   LYS  16          1HG       LYS  16  -8.924  19.701  -2.177
  525   2HG   LYS  16          2HG       LYS  16  -9.440  18.082  -1.673
  526   1HD   LYS  16          1HD       LYS  16 -11.085  19.044  -0.144
  527   2HD   LYS  16          2HD       LYS  16 -10.502  20.686  -0.477
  528   1HE   LYS  16          1HE       LYS  16 -11.076  20.126  -2.966
  529   2HE   LYS  16          2HE       LYS  16 -12.038  18.798  -2.297
  530   1HZ   LYS  16          1HZ       LYS  16 -12.798  21.389  -2.543
  531   2HZ   LYS  16          2HZ       LYS  16 -13.571  20.237  -1.683
  532   3HZ   LYS  16          3HZ       LYS  16 -12.505  21.229  -0.945
  533    H    ASP  17           H        ASP  17  -6.938  15.358   0.496
  534    HA   ASP  17           HA       ASP  17  -8.804  14.988   2.565
  535   1HB   ASP  17          1HB       ASP  17 -10.220  14.811   0.436
  536   2HB   ASP  17          2HB       ASP  17  -9.292  13.358   0.036
  537    H    ARG  18           H        ARG  18  -6.438  13.905   0.159
  538    HA   ARG  18           HA       ARG  18  -6.037  11.331   0.810
  539   1HB   ARG  18          1HB       ARG  18  -3.865  13.409   0.272
  540   2HB   ARG  18          2HB       ARG  18  -3.688  11.661   0.041
  541   1HG   ARG  18          1HG       ARG  18  -4.861  11.680  -1.919
  542   2HG   ARG  18          2HG       ARG  18  -6.023  12.889  -1.346
  543   1HD   ARG  18          1HD       ARG  18  -4.401  14.681  -1.734
  544   2HD   ARG  18          2HD       ARG  18  -3.143  13.511  -2.164
  545    HE   ARG  18           HE       ARG  18  -5.617  13.407  -3.778
  546   1HH1  ARG  18          1HH1      ARG  18  -2.323  14.611  -3.502
  547   2HH1  ARG  18          2HH1      ARG  18  -2.157  14.917  -5.198
  548   1HH2  ARG  18          1HH2      ARG  18  -5.398  13.810  -6.017
  549   2HH2  ARG  18          2HH2      ARG  18  -3.918  14.459  -6.639
  550    H    VAL  19           H        VAL  19  -3.635  10.693   1.904
  551    HA   VAL  19           HA       VAL  19  -3.764  11.868   4.596
  552    HB   VAL  19           HB       VAL  19  -2.786   9.100   3.929
  553   1HG1  VAL  19          1HG1      VAL  19  -2.262   9.159   6.102
  554   2HG1  VAL  19          2HG1      VAL  19  -3.119  10.700   6.338
  555   3HG1  VAL  19          3HG1      VAL  19  -4.009   9.162   6.444
  556   1HG2  VAL  19          1HG2      VAL  19  -5.635   9.882   4.640
  557   2HG2  VAL  19          2HG2      VAL  19  -5.079   9.287   3.057
  558   3HG2  VAL  19          3HG2      VAL  19  -5.008   8.224   4.483
  559    H    ASP  20           H        ASP  20  -2.200  12.555   2.000
  560    HA   ASP  20           HA       ASP  20  -0.118  12.853   1.334
  561   1HB   ASP  20          1HB       ASP  20  -0.117  14.831   2.514
  562   2HB   ASP  20          2HB       ASP  20  -0.445  14.038   4.062
  563    H    CYS  21           H        CYS  21   0.780  10.709   1.048
  564    HA   CYS  21           HA       CYS  21   1.563   9.023   3.063
  565   1HB   CYS  21          1HB       CYS  21   1.538   8.951   0.340
  566   2HB   CYS  21          2HB       CYS  21   3.274   8.972   0.667
  567    H    GLY  22           H        GLY  22   3.148  11.868   1.589
  568   1HA   GLY  22          1HA       GLY  22   5.012  13.007   2.119
  569   2HA   GLY  22          2HA       GLY  22   4.804  12.400   3.749
  570    H    TYR  23           H        TYR  23   5.727  10.972   0.526
  571    HA   TYR  23           HA       TYR  23   7.711   9.344   1.889
  572   1HB   TYR  23          1HB       TYR  23   5.916   9.073  -0.250
  573   2HB   TYR  23          2HB       TYR  23   7.428   9.406  -1.100
  574    HD1  TYR  23           HD1      TYR  23   7.014   7.501   2.080
  575    HD2  TYR  23           HD2      TYR  23   7.858   7.312  -2.110
  576    HE1  TYR  23           HE1      TYR  23   7.673   5.057   2.316
  577    HE2  TYR  23           HE2      TYR  23   8.514   4.868  -1.860
  578    HH   TYR  23           HH       TYR  23   8.032   3.174   1.176
  579    HA   PRO  24           HA       PRO  24  10.959  11.975   0.731
  580   1HB   PRO  24          1HB       PRO  24  13.067  10.320   1.258
  581   2HB   PRO  24          2HB       PRO  24  12.250  11.266   2.500
  582   1HG   PRO  24          1HG       PRO  24  12.060   8.388   1.873
  583   2HG   PRO  24          2HG       PRO  24  11.620   9.237   3.399
  584   1HD   PRO  24          1HD       PRO  24   9.883   8.213   1.366
  585   2HD   PRO  24          2HD       PRO  24   9.409   9.180   2.769
  586    H    HIS  25           H        HIS  25  10.055   9.240  -0.917
  587    HA   HIS  25           HA       HIS  25  11.849  10.036  -3.091
  588   1HB   HIS  25          1HB       HIS  25  11.384   7.385  -1.876
  589   2HB   HIS  25          2HB       HIS  25  11.373   7.415  -3.642
  590    HD1  HIS  25           HD1      HIS  25  13.619   6.403  -1.318
  591    HD2  HIS  25           HD2      HIS  25  13.878   9.457  -4.183
  592    HE1  HIS  25           HE1      HIS  25  16.108   6.812  -1.705
  593    HE2  HIS  25           HE2      HIS  25  16.204   8.660  -3.513
  594    H    VAL  26           H        VAL  26   9.129  10.975  -2.386
  595    HA   VAL  26           HA       VAL  26   7.109   9.714  -3.729
  596    HB   VAL  26           HB       VAL  26   6.509  11.490  -2.389
  597   1HG1  VAL  26          1HG1      VAL  26   8.044  13.024  -1.866
  598   2HG1  VAL  26          2HG1      VAL  26   8.978  12.670  -3.340
  599   3HG1  VAL  26          3HG1      VAL  26   7.652  13.858  -3.390
  600   1HG2  VAL  26          1HG2      VAL  26   5.144  12.812  -3.709
  601   2HG2  VAL  26          2HG2      VAL  26   6.378  13.013  -4.978
  602   3HG2  VAL  26          3HG2      VAL  26   5.508  11.468  -4.820
  603    H    THR  27           H        THR  27   6.790   9.139  -5.813
  604    HA   THR  27           HA       THR  27   7.387  10.865  -7.961
  605    HB   THR  27           HB       THR  27   9.601   9.330  -6.968
  606    HG1  THR  27           HG1      THR  27  10.526  10.616  -8.633
  607   1HG2  THR  27          1HG2      THR  27  10.109   8.338  -9.368
  608   2HG2  THR  27          2HG2      THR  27   9.145   7.366  -8.230
  609   3HG2  THR  27          3HG2      THR  27   8.337   8.280  -9.526
  610    HA   PRO  28           HA       PRO  28   4.557   8.197  -9.767
  611   1HB   PRO  28          1HB       PRO  28   4.924   8.698 -12.427
  612   2HB   PRO  28          2HB       PRO  28   3.992   9.752 -11.367
  613   1HG   PRO  28          1HG       PRO  28   6.719  10.077 -12.443
  614   2HG   PRO  28          2HG       PRO  28   5.615  11.337 -11.784
  615   1HD   PRO  28          1HD       PRO  28   7.913  10.157 -10.546
  616   2HD   PRO  28          2HD       PRO  28   6.766  11.276  -9.796
  617    H    LYS  29           H        LYS  29   6.578   6.725  -8.806
  618    HA   LYS  29           HA       LYS  29   6.421   4.470 -10.436
  619   1HB   LYS  29          1HB       LYS  29   7.904   5.757 -11.916
  620   2HB   LYS  29          2HB       LYS  29   9.097   5.886 -10.613
  621   1HG   LYS  29          1HG       LYS  29   9.850   3.785 -10.980
  622   2HG   LYS  29          2HG       LYS  29   8.211   3.113 -11.035
  623   1HD   LYS  29          1HD       LYS  29   8.149   4.309 -13.404
  624   2HD   LYS  29          2HD       LYS  29   9.914   4.218 -13.275
  625   1HE   LYS  29          1HE       LYS  29   9.918   1.980 -13.662
  626   2HE   LYS  29          2HE       LYS  29   8.580   1.688 -12.542
  627   1HZ   LYS  29          1HZ       LYS  29   8.448   1.581 -15.225
  628   2HZ   LYS  29          2HZ       LYS  29   7.163   1.696 -14.223
  629   3HZ   LYS  29          3HZ       LYS  29   7.787   3.039 -14.908
  630    H    GLU  30           H        GLU  30   7.676   6.385  -7.791
  631    HA   GLU  30           HA       GLU  30   8.700   3.990  -6.522
  632   1HB   GLU  30          1HB       GLU  30   9.263   6.859  -6.362
  633   2HB   GLU  30          2HB       GLU  30   9.063   6.139  -4.756
  634   1HG   GLU  30          1HG       GLU  30  11.019   5.001  -4.918
  635   2HG   GLU  30          2HG       GLU  30  10.680   4.466  -6.572
  636    H    CYS  31           H        CYS  31   6.303   6.658  -6.073
  637    HA   CYS  31           HA       CYS  31   5.344   5.766  -3.615
  638   1HB   CYS  31          1HB       CYS  31   4.277   7.535  -5.779
  639   2HB   CYS  31          2HB       CYS  31   3.229   7.063  -4.439
  640    H    ASN  32           H        ASN  32   4.082   5.346  -7.007
  641    HA   ASN  32           HA       ASN  32   2.023   3.654  -6.275
  642   1HB   ASN  32          1HB       ASN  32   3.469   4.382  -8.796
  643   2HB   ASN  32          2HB       ASN  32   2.552   2.870  -8.852
  644   1HD2  ASN  32          1HD2      ASN  32   2.065   5.999  -7.219
  645   2HD2  ASN  32          2HD2      ASN  32   0.497   6.344  -7.867
  646    H    ASN  33           H        ASN  33   5.362   3.208  -6.036
  647    HA   ASN  33           HA       ASN  33   5.208   0.377  -6.659
  648   1HB   ASN  33          1HB       ASN  33   7.114   1.416  -7.693
  649   2HB   ASN  33          2HB       ASN  33   7.531   2.311  -6.224
  650   1HD2  ASN  33          1HD2      ASN  33   9.406   1.590  -5.555
  651   2HD2  ASN  33          2HD2      ASN  33   9.872  -0.063  -5.336
  652    H    ARG  34           H        ARG  34   5.615   2.816  -4.101
  653    HA   ARG  34           HA       ARG  34   6.454   0.863  -2.189
  654   1HB   ARG  34          1HB       ARG  34   6.809   2.678  -0.727
  655   2HB   ARG  34          2HB       ARG  34   7.108   3.412  -2.312
  656   1HG   ARG  34          1HG       ARG  34   5.688   4.970  -1.300
  657   2HG   ARG  34          2HG       ARG  34   4.537   3.994  -2.227
  658   1HD   ARG  34          1HD       ARG  34   3.426   3.675  -0.281
  659   2HD   ARG  34          2HD       ARG  34   4.768   2.644   0.235
  660    HE   ARG  34           HE       ARG  34   5.520   5.336   0.729
  661   1HH1  ARG  34          1HH1      ARG  34   3.110   3.030   1.851
  662   2HH1  ARG  34          2HH1      ARG  34   2.982   3.738   3.428
  663   1HH2  ARG  34          1HH2      ARG  34   5.352   6.270   2.807
  664   2HH2  ARG  34          2HH2      ARG  34   4.266   5.593   3.975
  665    H    GLY  35           H        GLY  35   3.505   2.506  -3.285
  666   1HA   GLY  35          1HA       GLY  35   1.487   1.145  -2.773
  667   2HA   GLY  35          2HA       GLY  35   1.990   1.216  -1.095
  668    H    CYS  36           H        CYS  36   2.592   4.003  -3.201
  669    HA   CYS  36           HA       CYS  36   0.358   5.365  -1.880
  670   1HB   CYS  36          1HB       CYS  36   3.092   6.454  -2.557
  671   2HB   CYS  36          2HB       CYS  36   1.734   7.433  -1.994
  672    H    CYS  37           H        CYS  37  -0.246   7.445  -3.243
  673    HA   CYS  37           HA       CYS  37  -0.133   6.667  -6.067
  674   1HB   CYS  37          1HB       CYS  37  -2.366   6.600  -4.794
  675   2HB   CYS  37          2HB       CYS  37  -2.306   8.364  -4.862
  676    H    PHE  38           H        PHE  38   0.826   8.153  -7.438
  677    HA   PHE  38           HA       PHE  38   1.680  10.655  -6.222
  678   1HB   PHE  38          1HB       PHE  38   3.241   9.042  -7.427
  679   2HB   PHE  38          2HB       PHE  38   2.301   9.277  -8.905
  680    HD1  PHE  38           HD1      PHE  38   2.676  11.167 -10.287
  681    HD2  PHE  38           HD2      PHE  38   4.538  10.941  -6.481
  682    HE1  PHE  38           HE1      PHE  38   4.135  13.120 -10.884
  683    HE2  PHE  38           HE2      PHE  38   5.997  12.895  -7.079
  684    HZ   PHE  38           HZ       PHE  38   5.778  13.961  -9.274
  685    H    ASP  39           H        ASP  39   0.613  12.533  -6.613
  686    HA   ASP  39           HA       ASP  39  -1.392  12.506  -8.659
  687   1HB   ASP  39          1HB       ASP  39  -2.013  13.503  -6.560
  688   2HB   ASP  39          2HB       ASP  39  -0.555  14.507  -6.521
  689    H    SER  40           H        SER  40   0.699  15.282  -7.652
  690    HA   SER  40           HA       SER  40   2.330  16.318  -8.756
  691   1HB   SER  40          1HB       SER  40   2.439  14.116 -10.228
  692   2HB   SER  40          2HB       SER  40   1.624  15.124 -11.436
  693    HG   SER  40           HG       SER  40   4.001  16.025 -10.080
  694    H    ARG  41           H        ARG  41  -1.007  15.968  -9.614
  695    HA   ARG  41           HA       ARG  41  -1.253  17.918 -11.540
  696   1HB   ARG  41          1HB       ARG  41  -3.191  17.018  -9.361
  697   2HB   ARG  41          2HB       ARG  41  -3.666  18.037 -10.732
  698   1HG   ARG  41          1HG       ARG  41  -2.378  15.973 -12.010
  699   2HG   ARG  41          2HG       ARG  41  -3.076  15.119 -10.623
  700   1HD   ARG  41          1HD       ARG  41  -5.043  15.081 -11.731
  701   2HD   ARG  41          2HD       ARG  41  -5.125  16.842 -11.580
  702    HE   ARG  41           HE       ARG  41  -3.423  16.338 -13.757
  703   1HH1  ARG  41          1HH1      ARG  41  -6.763  15.619 -12.918
  704   2HH1  ARG  41          2HH1      ARG  41  -7.308  15.606 -14.562
  705   1HH2  ARG  41          1HH2      ARG  41  -4.140  16.321 -15.927
  706   2HH2  ARG  41          2HH2      ARG  41  -5.805  16.008 -16.286
  707    H    ILE  42           H        ILE  42  -1.666  18.101  -7.928
  708    HA   ILE  42           HA       ILE  42  -1.366  21.013  -8.173
  709    HB   ILE  42           HB       ILE  42  -2.546  19.774  -5.743
  710   1HG1  ILE  42          1HG1      ILE  42  -3.932  19.909  -8.419
  711   2HG1  ILE  42          2HG1      ILE  42  -3.755  18.509  -7.348
  712   1HG2  ILE  42          1HG2      ILE  42  -2.163  22.362  -6.732
  713   2HG2  ILE  42          2HG2      ILE  42  -3.908  22.053  -6.901
  714   3HG2  ILE  42          3HG2      ILE  42  -3.123  21.876  -5.314
  715   1HD1  ILE  42          1HD1      ILE  42  -5.923  19.150  -6.815
  716   2HD1  ILE  42          2HD1      ILE  42  -5.031  20.136  -5.633
  717   3HD1  ILE  42          3HD1      ILE  42  -5.609  20.870  -7.148
  718    HA   PRO  43           HA       PRO  43   2.392  20.232  -6.110
  719   1HB   PRO  43          1HB       PRO  43   3.335  22.795  -6.139
  720   2HB   PRO  43          2HB       PRO  43   3.546  21.675  -7.485
  721   1HG   PRO  43          1HG       PRO  43   1.678  23.938  -7.175
  722   2HG   PRO  43          2HG       PRO  43   2.217  23.126  -8.688
  723   1HD   PRO  43          1HD       PRO  43  -0.292  22.881  -7.331
  724   2HD   PRO  43          2HD       PRO  43   0.248  21.940  -8.728
  725    H    GLY  44           H        GLY  44  -0.208  22.078  -5.053
  726   1HA   GLY  44          1HA       GLY  44   1.031  22.704  -2.489
  727   2HA   GLY  44          2HA       GLY  44  -0.566  23.163  -3.048
  728    H    VAL  45           H        VAL  45  -0.525  20.031  -3.980
  729    HA   VAL  45           HA       VAL  45  -1.586  19.136  -1.393
  730    HB   VAL  45           HB       VAL  45  -2.778  19.277  -3.883
  731   1HG1  VAL  45          1HG1      VAL  45  -1.577  17.435  -4.816
  732   2HG1  VAL  45          2HG1      VAL  45  -1.841  16.441  -3.364
  733   3HG1  VAL  45          3HG1      VAL  45  -3.210  16.846  -4.426
  734   1HG2  VAL  45          1HG2      VAL  45  -3.381  18.309  -1.216
  735   2HG2  VAL  45          2HG2      VAL  45  -4.447  19.083  -2.413
  736   3HG2  VAL  45          3HG2      VAL  45  -4.196  17.321  -2.452
  737    HA   PRO  46           HA       PRO  46   1.269  15.888  -1.344
  738   1HB   PRO  46          1HB       PRO  46  -0.148  13.688  -0.562
  739   2HB   PRO  46          2HB       PRO  46   0.380  14.942   0.558
  740   1HG   PRO  46          1HG       PRO  46  -2.289  14.422  -0.586
  741   2HG   PRO  46          2HG       PRO  46  -1.864  15.366   0.886
  742   1HD   PRO  46          1HD       PRO  46  -2.655  16.342  -1.687
  743   2HD   PRO  46          2HD       PRO  46  -2.091  17.311  -0.319
  744    H    TRP  47           H        TRP  47   2.379  15.299  -3.093
  745    HA   TRP  47           HA       TRP  47   0.857  14.056  -5.217
  746   1HB   TRP  47          1HB       TRP  47   3.717  14.194  -5.622
  747   2HB   TRP  47          2HB       TRP  47   2.401  14.893  -6.565
  748    HD1  TRP  47           HD1      TRP  47   1.494  17.395  -5.576
  749    HE1  TRP  47           HE1      TRP  47   2.803  19.411  -4.486
  750    HE3  TRP  47           HE3      TRP  47   5.603  14.704  -4.264
  751    HZ2  TRP  47           HZ2      TRP  47   5.351  19.649  -3.225
  752    HZ3  TRP  47           HZ3      TRP  47   7.457  15.903  -3.106
  753    HH2  TRP  47           HH2      TRP  47   7.377  18.290  -2.584
  754    H    CYS  48           H        CYS  48   1.177  12.711  -2.559
  755    HA   CYS  48           HA       CYS  48   1.875  10.170  -3.545
  756   1HB   CYS  48          1HB       CYS  48   4.148  11.137  -3.210
  757   2HB   CYS  48          2HB       CYS  48   3.792  11.281  -1.487
  758    H    PHE  49           H        PHE  49  -0.049   9.382  -2.677
  759    HA   PHE  49           HA       PHE  49  -0.244   9.491   0.232
  760   1HB   PHE  49          1HB       PHE  49  -2.867   9.673  -0.528
  761   2HB   PHE  49          2HB       PHE  49  -1.889  11.111  -0.217
  762    HD1  PHE  49           HD1      PHE  49  -0.458  11.840  -2.395
  763    HD2  PHE  49           HD2      PHE  49  -4.108   9.676  -2.447
  764    HE1  PHE  49           HE1      PHE  49  -0.887  12.619  -4.742
  765    HE2  PHE  49           HE2      PHE  49  -4.537  10.456  -4.794
  766    HZ   PHE  49           HZ       PHE  49  -2.921  11.918  -5.914
  767    H    LYS  50           H        LYS  50  -2.670   8.124   0.527
  768    HA   LYS  50           HA       LYS  50  -2.193   5.643  -0.967
  769   1HB   LYS  50          1HB       LYS  50  -2.790   4.425   1.127
  770   2HB   LYS  50          2HB       LYS  50  -1.237   5.278   1.187
  771   1HG   LYS  50          1HG       LYS  50  -3.464   6.975   2.058
  772   2HG   LYS  50          2HG       LYS  50  -3.352   5.499   3.032
  773   1HD   LYS  50          1HD       LYS  50  -1.149   7.537   2.511
  774   2HD   LYS  50          2HD       LYS  50  -1.979   7.256   4.051
  775   1HE   LYS  50          1HE       LYS  50  -0.938   4.743   3.137
  776   2HE   LYS  50          2HE       LYS  50   0.361   5.937   2.988
  777   1HZ   LYS  50          1HZ       LYS  50  -1.165   5.216   5.382
  778   2HZ   LYS  50          2HZ       LYS  50   0.449   5.115   5.147
  779   3HZ   LYS  50          3HZ       LYS  50  -0.263   6.576   5.311
  780    HA   PRO  51           HA       PRO  51  -6.492   7.040  -1.344
  781   1HB   PRO  51          1HB       PRO  51  -6.609   7.152  -4.071
  782   2HB   PRO  51          2HB       PRO  51  -6.277   8.559  -3.062
  783   1HG   PRO  51          1HG       PRO  51  -4.444   6.915  -4.687
  784   2HG   PRO  51          2HG       PRO  51  -4.203   8.588  -4.068
  785   1HD   PRO  51          1HD       PRO  51  -3.052   6.150  -3.103
  786   2HD   PRO  51          2HD       PRO  51  -2.910   7.749  -2.362
  787    H    LEU  52           H        LEU  52  -6.212   5.496  -4.380
  788    HA   LEU  52           HA       LEU  52  -7.700   3.261  -3.249
  789   1HB   LEU  52          1HB       LEU  52  -8.643   2.969  -5.276
  790   2HB   LEU  52          2HB       LEU  52  -8.354   4.718  -5.310
  791    HG   LEU  52           HG       LEU  52  -6.050   3.533  -6.410
  792   1HD1  LEU  52          1HD1      LEU  52  -7.650   2.442  -8.382
  793   2HD1  LEU  52          2HD1      LEU  52  -6.683   1.543  -7.188
  794   3HD1  LEU  52          3HD1      LEU  52  -8.405   1.868  -6.874
  795   1HD2  LEU  52          1HD2      LEU  52  -6.385   5.277  -7.734
  796   2HD2  LEU  52          2HD2      LEU  52  -7.770   4.453  -8.487
  797   3HD2  LEU  52          3HD2      LEU  52  -8.019   5.486  -7.060
  798    H    GLN  53           H        GLN  53  -4.954   3.433  -2.505
  799    HA   GLN  53           HA       GLN  53  -3.182   2.181  -4.111
  800   1HB   GLN  53          1HB       GLN  53  -3.545   1.930  -1.102
  801   2HB   GLN  53          2HB       GLN  53  -2.089   1.402  -1.966
  802   1HG   GLN  53          1HG       GLN  53  -3.224   4.231  -1.897
  803   2HG   GLN  53          2HG       GLN  53  -1.795   3.674  -1.013
  804   1HE2  GLN  53          1HE2      GLN  53  -0.801   1.958  -3.060
  805   2HE2  GLN  53          2HE2      GLN  53  -0.167   2.935  -4.342
  806    H    GLU  54           H        GLU  54  -6.096   0.878  -2.730
  807    HA   GLU  54           HA       GLU  54  -5.607  -1.683  -2.230
  808   1HB   GLU  54          1HB       GLU  54  -7.875  -2.130  -2.739
  809   2HB   GLU  54          2HB       GLU  54  -7.850  -0.410  -2.315
  810   1HG   GLU  54          1HG       GLU  54  -7.420  -0.184  -4.965
  811   2HG   GLU  54          2HG       GLU  54  -8.281  -1.731  -4.980
  812    H    ALA  55           H        ALA  55  -5.218  -0.063  -5.322
  813    HA   ALA  55           HA       ALA  55  -5.554  -1.917  -7.210
  814   1HB   ALA  55          1HB       ALA  55  -3.465   0.185  -6.716
  815   2HB   ALA  55          2HB       ALA  55  -3.242  -0.924  -8.091
  816   3HB   ALA  55          3HB       ALA  55  -4.704   0.088  -7.991
  817    H    GLU  56           H        GLU  56  -2.145  -1.562  -6.129
  818    HA   GLU  56           HA       GLU  56  -2.049  -4.474  -6.070
  819   1HB   GLU  56          1HB       GLU  56  -0.659  -2.976  -7.746
  820   2HB   GLU  56          2HB       GLU  56   0.420  -2.760  -6.356
  821   1HG   GLU  56          1HG       GLU  56  -0.092  -5.500  -6.355
  822   2HG   GLU  56          2HG       GLU  56  -0.003  -5.120  -8.081
  823    H    CYS  57           H        CYS  57  -2.684  -2.269  -3.921
  824    HA   CYS  57           HA       CYS  57  -0.501  -2.768  -2.083
  825   1HB   CYS  57          1HB       CYS  57  -1.608  -0.505  -2.441
  826   2HB   CYS  57          2HB       CYS  57  -2.983  -1.147  -1.538
  827    H    THR  58           H        THR  58  -4.140  -2.792  -1.866
  828    HA   THR  58           HA       THR  58  -4.352  -4.417   0.330
  829    HB   THR  58           HB       THR  58  -6.139  -3.068  -0.954
  830    HG1  THR  58           HG1      THR  58  -7.628  -4.508   0.010
  831   1HG2  THR  58          1HG2      THR  58  -7.080  -5.484  -2.330
  832   2HG2  THR  58          2HG2      THR  58  -6.936  -3.826  -2.961
  833   3HG2  THR  58          3HG2      THR  58  -5.536  -4.924  -3.017
  834    H    PHE  59           H        PHE  59  -3.291  -5.274  -2.888
  835    HA   PHE  59           HA       PHE  59  -3.906  -8.054  -2.562
  836   1HB   PHE  59          1HB       PHE  59  -2.757  -6.130  -4.526
  837   2HB   PHE  59          2HB       PHE  59  -1.956  -7.704  -4.577
  838    HD1  PHE  59           HD1      PHE  59  -4.308  -9.452  -3.954
  839    HD2  PHE  59           HD2      PHE  59  -3.931  -6.109  -6.543
  840    HE1  PHE  59           HE1      PHE  59  -6.178 -10.340  -5.374
  841    HE2  PHE  59           HE2      PHE  59  -5.800  -6.998  -7.962
  842    HZ   PHE  59           HZ       PHE  59  -6.902  -9.103  -7.361
  Start of MODEL   39
    1   1H    GLU   1           H1       GLU   1 -17.524 -13.302  -3.419
    2    HA   GLU   1           HA       GLU   1 -15.006 -13.320  -2.461
    3   1HB   GLU   1          1HB       GLU   1 -16.335 -12.175  -4.877
    4   2HB   GLU   1          2HB       GLU   1 -14.669 -11.653  -4.570
    5   1HG   GLU   1          1HG       GLU   1 -13.834 -13.667  -5.184
    6   2HG   GLU   1          2HG       GLU   1 -15.017 -14.554  -4.212
    7    H    GLU   2           H        GLU   2 -15.936 -12.020  -0.355
    8    HA   GLU   2           HA       GLU   2 -15.578  -9.188  -0.757
    9   1HB   GLU   2          1HB       GLU   2 -17.265 -10.624   0.848
   10   2HB   GLU   2          2HB       GLU   2 -15.979 -10.230   2.002
   11   1HG   GLU   2          1HG       GLU   2 -17.508  -8.255   0.254
   12   2HG   GLU   2          2HG       GLU   2 -17.741  -8.485   1.994
   13    H    TYR   3           H        TYR   3 -14.653  -9.207   2.266
   14    HA   TYR   3           HA       TYR   3 -11.881  -8.988   1.647
   15   1HB   TYR   3          1HB       TYR   3 -11.942  -8.709   4.273
   16   2HB   TYR   3          2HB       TYR   3 -12.840  -7.521   3.321
   17    HD1  TYR   3           HD1      TYR   3 -14.180  -7.004   5.349
   18    HD2  TYR   3           HD2      TYR   3 -14.195 -10.901   3.582
   19    HE1  TYR   3           HE1      TYR   3 -16.289  -7.590   6.642
   20    HE2  TYR   3           HE2      TYR   3 -16.303 -11.474   4.882
   21    HH   TYR   3           HH       TYR   3 -18.086  -9.055   6.582
   22    H    VAL   4           H        VAL   4 -11.672 -11.300   0.822
   23    HA   VAL   4           HA       VAL   4 -11.060 -13.033   3.113
   24    HB   VAL   4           HB       VAL   4 -12.786 -14.253   2.379
   25   1HG1  VAL   4          1HG1      VAL   4 -12.496 -13.135  -0.429
   26   2HG1  VAL   4          2HG1      VAL   4 -13.860 -14.082   0.212
   27   3HG1  VAL   4          3HG1      VAL   4 -13.538 -12.448   0.840
   28   1HG2  VAL   4          1HG2      VAL   4 -12.161 -16.024   0.934
   29   2HG2  VAL   4          2HG2      VAL   4 -11.021 -14.995   0.034
   30   3HG2  VAL   4          3HG2      VAL   4 -10.652 -15.481   1.706
   31    H    GLY   5           H        GLY   5 -10.574 -12.809  -0.488
   32   1HA   GLY   5          1HA       GLY   5  -8.016 -14.014  -0.400
   33   2HA   GLY   5          2HA       GLY   5  -8.731 -13.138  -1.739
   34    H    LEU   6           H        LEU   6  -8.923 -11.131   0.982
   35    HA   LEU   6           HA       LEU   6  -6.221 -10.140   0.839
   36   1HB   LEU   6          1HB       LEU   6  -6.901  -7.883   0.189
   37   2HB   LEU   6          2HB       LEU   6  -7.100  -9.078  -1.105
   38    HG   LEU   6           HG       LEU   6  -8.927  -7.450  -1.049
   39   1HD1  LEU   6          1HD1      LEU   6 -10.519  -8.954  -1.619
   40   2HD1  LEU   6          2HD1      LEU   6  -9.155 -10.088  -1.475
   41   3HD1  LEU   6          3HD1      LEU   6 -10.312  -9.912  -0.134
   42   1HD2  LEU   6          1HD2      LEU   6 -10.413  -7.164   0.761
   43   2HD2  LEU   6          2HD2      LEU   6  -9.757  -8.573   1.630
   44   3HD2  LEU   6          3HD2      LEU   6  -8.778  -7.096   1.462
   45    H    SER   7           H        SER   7  -8.276 -11.364   2.738
   46    HA   SER   7           HA       SER   7  -9.058  -9.259   4.436
   47   1HB   SER   7          1HB       SER   7  -9.984 -11.707   4.157
   48   2HB   SER   7          2HB       SER   7  -8.757 -12.121   5.367
   49    HG   SER   7           HG       SER   7 -11.200 -10.831   5.662
   50    H    ALA   8           H        ALA   8  -8.377  -9.670   6.981
   51    HA   ALA   8           HA       ALA   8  -5.678  -8.886   7.105
   52   1HB   ALA   8          1HB       ALA   8  -7.218  -8.053   8.731
   53   2HB   ALA   8          2HB       ALA   8  -7.754  -9.693   9.169
   54   3HB   ALA   8          3HB       ALA   8  -6.120  -9.144   9.609
   55    H    ASN   9           H        ASN   9  -7.172 -11.956   6.741
   56    HA   ASN   9           HA       ASN   9  -5.102 -13.338   8.173
   57   1HB   ASN   9          1HB       ASN   9  -7.731 -13.933   7.645
   58   2HB   ASN   9          2HB       ASN   9  -6.941 -14.854   6.356
   59   1HD2  ASN   9          1HD2      ASN   9  -4.853 -15.984   7.187
   60   2HD2  ASN   9          2HD2      ASN   9  -5.030 -16.926   8.630
   61    H    GLN  10           H        GLN  10  -5.538 -11.860   5.141
   62    HA   GLN  10           HA       GLN  10  -4.474 -13.791   3.434
   63   1HB   GLN  10          1HB       GLN  10  -4.682 -12.188   1.813
   64   2HB   GLN  10          2HB       GLN  10  -5.699 -11.421   3.046
   65   1HG   GLN  10          1HG       GLN  10  -3.750 -10.093   3.811
   66   2HG   GLN  10          2HG       GLN  10  -2.730 -10.863   2.585
   67   1HE2  GLN  10          1HE2      GLN  10  -2.776 -10.178   0.529
   68   2HE2  GLN  10          2HE2      GLN  10  -3.729  -8.862  -0.070
   69    H    CYS  11           H        CYS  11  -3.029 -11.257   5.519
   70    HA   CYS  11           HA       CYS  11  -0.463 -11.357   4.441
   71   1HB   CYS  11          1HB       CYS  11  -1.091  -9.534   5.814
   72   2HB   CYS  11          2HB       CYS  11  -1.489 -10.589   7.174
   73    H    ALA  12           H        ALA  12  -2.326 -13.751   5.972
   74    HA   ALA  12           HA       ALA  12  -0.005 -15.046   7.190
   75   1HB   ALA  12          1HB       ALA  12  -1.484 -15.982   8.632
   76   2HB   ALA  12          2HB       ALA  12  -2.598 -14.719   8.057
   77   3HB   ALA  12          3HB       ALA  12  -2.655 -16.348   7.343
   78    H    VAL  13           H        VAL  13  -0.843 -14.665   4.167
   79    HA   VAL  13           HA       VAL  13  -1.683 -16.884   2.956
   80    HB   VAL  13           HB       VAL  13  -0.033 -14.647   2.330
   81   1HG1  VAL  13          1HG1      VAL  13   1.897 -15.977   2.052
   82   2HG1  VAL  13          2HG1      VAL  13   0.983 -17.297   1.284
   83   3HG1  VAL  13          3HG1      VAL  13   1.241 -15.768   0.411
   84   1HG2  VAL  13          1HG2      VAL  13  -2.294 -15.431   1.398
   85   2HG2  VAL  13          2HG2      VAL  13  -1.125 -14.746   0.243
   86   3HG2  VAL  13          3HG2      VAL  13  -1.348 -16.510   0.343
   87    HA   PRO  14           HA       PRO  14   1.019 -20.145   3.812
   88   1HB   PRO  14          1HB       PRO  14   0.928 -21.630   1.521
   89   2HB   PRO  14          2HB       PRO  14  -0.334 -21.674   2.749
   90   1HG   PRO  14          1HG       PRO  14  -0.290 -20.337   0.119
   91   2HG   PRO  14          2HG       PRO  14  -1.712 -20.779   1.130
   92   1HD   PRO  14          1HD       PRO  14  -0.544 -18.194   0.735
   93   2HD   PRO  14          2HD       PRO  14  -1.843 -18.604   1.862
   94    H    ALA  15           H        ALA  15   2.239 -17.684   2.840
   95    HA   ALA  15           HA       ALA  15   4.179 -16.963   2.039
   96   1HB   ALA  15          1HB       ALA  15   4.652 -18.952   3.907
   97   2HB   ALA  15          2HB       ALA  15   5.671 -19.455   2.538
   98   3HB   ALA  15          3HB       ALA  15   5.876 -17.838   3.253
   99    H    LYS  16           H        LYS  16   2.972 -17.189  -0.134
  100    HA   LYS  16           HA       LYS  16   4.634 -17.817  -2.123
  101   1HB   LYS  16          1HB       LYS  16   3.575 -20.092  -2.881
  102   2HB   LYS  16          2HB       LYS  16   4.957 -20.060  -1.773
  103   1HG   LYS  16          1HG       LYS  16   3.746 -21.053  -0.152
  104   2HG   LYS  16          2HG       LYS  16   2.455 -19.848  -0.288
  105   1HD   LYS  16          1HD       LYS  16   1.351 -21.834  -0.847
  106   2HD   LYS  16          2HD       LYS  16   1.783 -21.205  -2.447
  107   1HE   LYS  16          1HE       LYS  16   3.213 -22.929  -2.852
  108   2HE   LYS  16          2HE       LYS  16   3.890 -22.888  -1.217
  109   1HZ   LYS  16          1HZ       LYS  16   2.618 -24.594  -0.722
  110   2HZ   LYS  16          2HZ       LYS  16   1.257 -23.779  -1.109
  111   3HZ   LYS  16          3HZ       LYS  16   2.038 -24.651  -2.247
  112    H    ASP  17           H        ASP  17   2.650 -15.945  -1.470
  113    HA   ASP  17           HA       ASP  17   1.129 -16.102  -3.860
  114   1HB   ASP  17          1HB       ASP  17  -0.219 -17.392  -2.099
  115   2HB   ASP  17          2HB       ASP  17  -0.400 -15.860  -1.233
  116    H    ARG  18           H        ARG  18   3.090 -14.510  -1.898
  117    HA   ARG  18           HA       ARG  18   1.575 -12.085  -1.614
  118   1HB   ARG  18          1HB       ARG  18   4.513 -12.567  -0.954
  119   2HB   ARG  18          2HB       ARG  18   3.482 -11.270  -0.323
  120   1HG   ARG  18          1HG       ARG  18   2.503 -12.637   1.227
  121   2HG   ARG  18          2HG       ARG  18   2.482 -14.041   0.147
  122   1HD   ARG  18          1HD       ARG  18   4.771 -14.558   0.628
  123   2HD   ARG  18          2HD       ARG  18   5.060 -12.980   1.378
  124    HE   ARG  18           HE       ARG  18   2.979 -14.609   2.676
  125   1HH1  ARG  18          1HH1      ARG  18   6.395 -13.766   2.588
  126   2HH1  ARG  18          2HH1      ARG  18   6.695 -14.281   4.215
  127   1HH2  ARG  18          1HH2      ARG  18   3.374 -15.287   4.822
  128   2HH2  ARG  18          2HH2      ARG  18   4.965 -15.151   5.493
  129    H    VAL  19           H        VAL  19   2.894  -9.959  -2.239
  130    HA   VAL  19           HA       VAL  19   3.766 -10.360  -4.999
  131    HB   VAL  19           HB       VAL  19   3.060  -7.784  -3.592
  132   1HG1  VAL  19          1HG1      VAL  19   2.379  -7.583  -6.268
  133   2HG1  VAL  19          2HG1      VAL  19   3.856  -6.938  -5.512
  134   3HG1  VAL  19          3HG1      VAL  19   3.885  -8.531  -6.304
  135   1HG2  VAL  19          1HG2      VAL  19   0.850  -8.170  -4.979
  136   2HG2  VAL  19          2HG2      VAL  19   1.291  -9.885  -4.803
  137   3HG2  VAL  19          3HG2      VAL  19   1.042  -8.878  -3.357
  138    H    ASP  20           H        ASP  20   5.374 -10.917  -2.456
  139    HA   ASP  20           HA       ASP  20   7.248 -10.231  -1.457
  140   1HB   ASP  20          1HB       ASP  20   8.267 -11.695  -2.932
  141   2HB   ASP  20          2HB       ASP  20   7.738 -10.801  -4.364
  142    H    CYS  21           H        CYS  21   6.760  -7.998  -0.793
  143    HA   CYS  21           HA       CYS  21   6.746  -5.790  -2.356
  144   1HB   CYS  21          1HB       CYS  21   6.451  -6.217   0.249
  145   2HB   CYS  21          2HB       CYS  21   8.090  -5.562   0.293
  146    H    GLY  22           H        GLY  22   9.516  -7.679  -1.081
  147   1HA   GLY  22          1HA       GLY  22  11.728  -7.576  -1.470
  148   2HA   GLY  22          2HA       GLY  22  11.295  -7.007  -3.070
  149    H    TYR  23           H        TYR  23  11.258  -5.676   0.322
  150    HA   TYR  23           HA       TYR  23  12.063  -3.095  -0.743
  151   1HB   TYR  23          1HB       TYR  23  10.641  -4.287   1.523
  152   2HB   TYR  23          2HB       TYR  23  11.949  -3.280   2.152
  153    HD1  TYR  23           HD1      TYR  23  12.018  -0.834   1.512
  154    HD2  TYR  23           HD2      TYR  23   8.657  -3.335   0.646
  155    HE1  TYR  23           HE1      TYR  23  10.563   1.224   1.181
  156    HE2  TYR  23           HE2      TYR  23   7.213  -1.269   0.318
  157    HH   TYR  23           HH       TYR  23   8.592   1.980   0.751
  158    HA   PRO  24           HA       PRO  24  16.216  -3.684   0.354
  159   1HB   PRO  24          1HB       PRO  24  17.089  -1.100   0.194
  160   2HB   PRO  24          2HB       PRO  24  16.914  -2.147  -1.212
  161   1HG   PRO  24          1HG       PRO  24  15.195   0.052  -0.260
  162   2HG   PRO  24          2HG       PRO  24  15.283  -0.671  -1.907
  163   1HD   PRO  24          1HD       PRO  24  13.270  -1.045   0.096
  164   2HD   PRO  24          2HD       PRO  24  13.397  -1.902  -1.446
  165    H    HIS  25           H        HIS  25  13.972  -2.145   2.248
  166    HA   HIS  25           HA       HIS  25  15.906  -2.174   4.445
  167   1HB   HIS  25          1HB       HIS  25  14.819   0.111   3.399
  168   2HB   HIS  25          2HB       HIS  25  13.692  -0.252   4.712
  169    HD1  HIS  25           HD1      HIS  25  15.789   2.181   4.616
  170    HD2  HIS  25           HD2      HIS  25  16.234  -1.417   6.724
  171    HE1  HIS  25           HE1      HIS  25  17.435   2.659   6.505
  172    HE2  HIS  25           HE2      HIS  25  17.627   0.426   7.798
  173    H    VAL  26           H        VAL  26  14.147  -4.304   3.465
  174    HA   VAL  26           HA       VAL  26  11.736  -4.452   4.791
  175    HB   VAL  26           HB       VAL  26  12.184  -6.024   3.133
  176   1HG1  VAL  26          1HG1      VAL  26  14.489  -6.098   2.850
  177   2HG1  VAL  26          2HG1      VAL  26  14.795  -6.454   4.567
  178   3HG1  VAL  26          3HG1      VAL  26  14.141  -7.718   3.498
  179   1HG2  VAL  26          1HG2      VAL  26  11.677  -8.096   4.128
  180   2HG2  VAL  26          2HG2      VAL  26  12.614  -7.723   5.595
  181   3HG2  VAL  26          3HG2      VAL  26  11.073  -6.887   5.287
  182    H    THR  27           H        THR  27  11.123  -4.690   6.891
  183    HA   THR  27           HA       THR  27  12.717  -6.055   8.791
  184    HB   THR  27           HB       THR  27  13.317  -3.248   8.316
  185    HG1  THR  27           HG1      THR  27  15.029  -3.971   9.690
  186   1HG2  THR  27          1HG2      THR  27  11.854  -2.466  10.017
  187   2HG2  THR  27          2HG2      THR  27  11.979  -3.980  10.945
  188   3HG2  THR  27          3HG2      THR  27  13.337  -2.830  10.932
  189    HA   PRO  28           HA       PRO  28   8.845  -6.187  10.631
  190   1HB   PRO  28          1HB       PRO  28   9.483  -6.989  13.162
  191   2HB   PRO  28          2HB       PRO  28   9.386  -8.098  11.795
  192   1HG   PRO  28          1HG       PRO  28  11.748  -6.963  13.151
  193   2HG   PRO  28          2HG       PRO  28  11.647  -8.426  12.108
  194   1HD   PRO  28          1HD       PRO  28  12.707  -5.847  11.459
  195   2HD   PRO  28          2HD       PRO  28  12.484  -7.206  10.350
  196    H    LYS  29           H        LYS  29   9.278  -3.656  10.232
  197    HA   LYS  29           HA       LYS  29   7.846  -2.411  12.209
  198   1HB   LYS  29          1HB       LYS  29  10.132  -2.991  13.408
  199   2HB   LYS  29          2HB       LYS  29  10.665  -1.500  12.611
  200   1HG   LYS  29          1HG       LYS  29   9.623  -0.300  14.203
  201   2HG   LYS  29          2HG       LYS  29   8.067  -1.001  13.724
  202   1HD   LYS  29          1HD       LYS  29   8.701  -3.018  15.180
  203   2HD   LYS  29          2HD       LYS  29  10.030  -2.032  15.817
  204   1HE   LYS  29          1HE       LYS  29   8.587  -1.103  17.277
  205   2HE   LYS  29          2HE       LYS  29   7.674  -0.415  15.926
  206   1HZ   LYS  29          1HZ       LYS  29   7.059  -3.113  16.163
  207   2HZ   LYS  29          2HZ       LYS  29   6.916  -2.439  17.644
  208   3HZ   LYS  29          3HZ       LYS  29   6.074  -1.829  16.385
  209    H    GLU  30           H        GLU  30  10.080  -2.476   9.523
  210    HA   GLU  30           HA       GLU  30   9.437   0.282   8.903
  211   1HB   GLU  30          1HB       GLU  30  11.656  -1.551   8.306
  212   2HB   GLU  30          2HB       GLU  30  11.115  -0.646   6.881
  213   1HG   GLU  30          1HG       GLU  30  12.381   1.058   7.653
  214   2HG   GLU  30          2HG       GLU  30  11.161   1.282   8.916
  215    H    CYS  31           H        CYS  31   9.271  -3.067   7.545
  216    HA   CYS  31           HA       CYS  31   8.113  -2.436   5.136
  217   1HB   CYS  31          1HB       CYS  31   8.053  -4.853   6.899
  218   2HB   CYS  31          2HB       CYS  31   7.045  -4.802   5.449
  219    H    ASN  32           H        ASN  32   6.586  -3.272   8.329
  220    HA   ASN  32           HA       ASN  32   3.985  -2.927   7.407
  221   1HB   ASN  32          1HB       ASN  32   5.375  -3.258  10.018
  222   2HB   ASN  32          2HB       ASN  32   3.829  -2.404  10.130
  223   1HD2  ASN  32          1HD2      ASN  32   5.095  -5.051   8.107
  224   2HD2  ASN  32          2HD2      ASN  32   3.853  -6.207   8.455
  225    H    ASN  33           H        ASN  33   6.478  -0.698   7.708
  226    HA   ASN  33           HA       ASN  33   4.715   1.432   8.598
  227   1HB   ASN  33          1HB       ASN  33   7.120   0.997   9.559
  228   2HB   ASN  33          2HB       ASN  33   7.698   1.718   8.049
  229   1HD2  ASN  33          1HD2      ASN  33   8.632   3.281   9.539
  230   2HD2  ASN  33          2HD2      ASN  33   7.692   4.636  10.070
  231    H    ARG  34           H        ARG  34   6.560   0.063   5.895
  232    HA   ARG  34           HA       ARG  34   6.390   2.450   4.347
  233   1HB   ARG  34          1HB       ARG  34   7.071  -0.319   3.294
  234   2HB   ARG  34          2HB       ARG  34   7.640   1.245   2.686
  235   1HG   ARG  34          1HG       ARG  34   8.475   1.236   5.346
  236   2HG   ARG  34          2HG       ARG  34   8.713  -0.450   4.850
  237   1HD   ARG  34          1HD       ARG  34  10.403   0.094   3.403
  238   2HD   ARG  34          2HD       ARG  34   9.623   1.593   2.876
  239    HE   ARG  34           HE       ARG  34  10.386   2.101   5.502
  240   1HH1  ARG  34          1HH1      ARG  34  12.074   1.042   2.601
  241   2HH1  ARG  34          2HH1      ARG  34  13.582   1.758   3.062
  242   1HH2  ARG  34          1HH2      ARG  34  12.376   3.047   6.110
  243   2HH2  ARG  34          2HH2      ARG  34  13.755   2.906   5.071
  244    H    GLY  35           H        GLY  35   4.527  -0.485   4.923
  245   1HA   GLY  35          1HA       GLY  35   2.167  -0.255   4.273
  246   2HA   GLY  35          2HA       GLY  35   2.726   0.230   2.685
  247    H    CYS  36           H        CYS  36   4.503  -2.250   4.497
  248    HA   CYS  36           HA       CYS  36   3.347  -4.254   2.699
  249   1HB   CYS  36          1HB       CYS  36   6.201  -4.086   3.672
  250   2HB   CYS  36          2HB       CYS  36   5.524  -5.372   2.669
  251    H    CYS  37           H        CYS  37   4.221  -6.580   3.784
  252    HA   CYS  37           HA       CYS  37   3.562  -6.367   6.631
  253   1HB   CYS  37          1HB       CYS  37   1.682  -7.205   5.150
  254   2HB   CYS  37          2HB       CYS  37   2.666  -8.642   4.865
  255    H    PHE  38           H        PHE  38   5.150  -7.274   7.906
  256    HA   PHE  38           HA       PHE  38   7.290  -8.673   6.568
  257   1HB   PHE  38          1HB       PHE  38   7.483  -6.830   8.361
  258   2HB   PHE  38          2HB       PHE  38   6.801  -7.973   9.522
  259    HD1  PHE  38           HD1      PHE  38   8.147  -9.718  10.454
  260    HD2  PHE  38           HD2      PHE  38   9.720  -7.210   7.414
  261    HE1  PHE  38           HE1      PHE  38  10.453 -10.589  10.930
  262    HE2  PHE  38           HE2      PHE  38  12.026  -8.081   7.890
  263    HZ   PHE  38           HZ       PHE  38  12.364  -9.760   9.642
  264    H    ASP  39           H        ASP  39   7.431 -10.859   6.427
  265    HA   ASP  39           HA       ASP  39   5.532 -12.404   7.901
  266   1HB   ASP  39          1HB       ASP  39   5.718 -13.420   5.867
  267   2HB   ASP  39          2HB       ASP  39   7.338 -12.768   5.576
  268    H    SER  40           H        SER  40   8.979 -13.233   7.143
  269    HA   SER  40           HA       SER  40  10.716 -13.564   8.460
  270   1HB   SER  40          1HB       SER  40   9.276 -11.998  10.155
  271   2HB   SER  40          2HB       SER  40   9.288 -13.507  11.083
  272    HG   SER  40           HG       SER  40  11.499 -13.420  11.257
  273    H    ARG  41           H        ARG  41   7.585 -15.090   8.820
  274    HA   ARG  41           HA       ARG  41   8.312 -17.248  10.377
  275   1HB   ARG  41          1HB       ARG  41   6.290 -17.361   8.107
  276   2HB   ARG  41          2HB       ARG  41   6.240 -18.249   9.639
  277   1HG   ARG  41          1HG       ARG  41   6.269 -15.729  10.610
  278   2HG   ARG  41          2HG       ARG  41   5.517 -15.396   9.040
  279   1HD   ARG  41          1HD       ARG  41   3.649 -15.862  10.363
  280   2HD   ARG  41          2HD       ARG  41   3.975 -17.463   9.683
  281    HE   ARG  41           HE       ARG  41   4.558 -16.561  12.462
  282   1HH1  ARG  41          1HH1      ARG  41   4.585 -19.130  10.057
  283   2HH1  ARG  41          2HH1      ARG  41   4.823 -20.390  11.220
  284   1HH2  ARG  41          1HH2      ARG  41   4.871 -18.225  13.997
  285   2HH2  ARG  41          2HH2      ARG  41   4.987 -19.873  13.476
  286    H    ILE  42           H        ILE  42   8.373 -16.698   6.804
  287    HA   ILE  42           HA       ILE  42   9.979 -19.148   6.578
  288    HB   ILE  42           HB       ILE  42   8.328 -18.061   4.327
  289   1HG1  ILE  42          1HG1      ILE  42   7.358 -19.477   6.755
  290   2HG1  ILE  42          2HG1      ILE  42   6.537 -18.295   5.721
  291   1HG2  ILE  42          1HG2      ILE  42  10.166 -19.861   4.127
  292   2HG2  ILE  42          2HG2      ILE  42   8.993 -20.935   4.926
  293   3HG2  ILE  42          3HG2      ILE  42   8.584 -20.169   3.372
  294   1HD1  ILE  42          1HD1      ILE  42   6.854 -21.275   5.365
  295   2HD1  ILE  42          2HD1      ILE  42   5.405 -20.261   5.158
  296   3HD1  ILE  42          3HD1      ILE  42   6.684 -20.248   3.921
  297    HA   PRO  43           HA       PRO  43  12.856 -16.080   5.331
  298   1HB   PRO  43          1HB       PRO  43  15.084 -17.646   5.544
  299   2HB   PRO  43          2HB       PRO  43  14.418 -16.730   6.894
  300   1HG   PRO  43          1HG       PRO  43  14.255 -19.614   6.298
  301   2HG   PRO  43          2HG       PRO  43  14.007 -18.778   7.872
  302   1HD   PRO  43          1HD       PRO  43  12.036 -19.878   6.112
  303   2HD   PRO  43          2HD       PRO  43  11.733 -18.925   7.570
  304    H    GLY  44           H        GLY  44  11.780 -18.804   3.810
  305   1HA   GLY  44          1HA       GLY  44  13.583 -18.496   1.525
  306   2HA   GLY  44          2HA       GLY  44  12.405 -19.767   1.790
  307    H    VAL  45           H        VAL  45  10.790 -16.996   2.693
  308    HA   VAL  45           HA       VAL  45   9.858 -16.515  -0.053
  309    HB   VAL  45           HB       VAL  45   7.676 -16.639   0.590
  310   1HG1  VAL  45          1HG1      VAL  45   8.498 -18.867   0.830
  311   2HG1  VAL  45          2HG1      VAL  45   9.148 -18.526   2.451
  312   3HG1  VAL  45          3HG1      VAL  45   7.388 -18.577   2.190
  313   1HG2  VAL  45          1HG2      VAL  45   8.401 -16.242   3.510
  314   2HG2  VAL  45          2HG2      VAL  45   7.934 -14.928   2.404
  315   3HG2  VAL  45          3HG2      VAL  45   6.775 -16.225   2.784
  316    HA   PRO  46           HA       PRO  46  10.125 -12.275   0.834
  317   1HB   PRO  46          1HB       PRO  46   7.715 -11.134   0.238
  318   2HB   PRO  46          2HB       PRO  46   8.890 -11.602  -0.991
  319   1HG   PRO  46          1HG       PRO  46   6.387 -12.926  -0.161
  320   2HG   PRO  46          2HG       PRO  46   7.308 -13.123  -1.696
  321   1HD   PRO  46          1HD       PRO  46   7.173 -14.906   0.541
  322   2HD   PRO  46          2HD       PRO  46   8.216 -15.069  -0.875
  323    H    TRP  47           H        TRP  47  10.628 -11.444   2.751
  324    HA   TRP  47           HA       TRP  47   8.640 -11.802   4.837
  325   1HB   TRP  47          1HB       TRP  47  11.096 -10.385   5.520
  326   2HB   TRP  47          2HB       TRP  47  10.344 -11.796   6.269
  327    HD1  TRP  47           HD1      TRP  47  10.929 -14.237   4.936
  328    HE1  TRP  47           HE1      TRP  47  13.132 -15.086   3.757
  329    HE3  TRP  47           HE3      TRP  47  12.991  -9.632   4.299
  330    HZ2  TRP  47           HZ2      TRP  47  15.438 -13.766   2.714
  331    HZ3  TRP  47           HZ3      TRP  47  15.220  -9.501   3.192
  332    HH2  TRP  47           HH2      TRP  47  16.437 -11.471   2.411
  333    H    CYS  48           H        CYS  48   8.186  -9.986   2.489
  334    HA   CYS  48           HA       CYS  48   7.252  -7.772   3.956
  335   1HB   CYS  48          1HB       CYS  48   9.683  -7.208   3.778
  336   2HB   CYS  48          2HB       CYS  48   9.485  -7.126   2.026
  337    H    PHE  49           H        PHE  49   5.250  -7.904   2.964
  338    HA   PHE  49           HA       PHE  49   5.232  -7.579   0.067
  339   1HB   PHE  49          1HB       PHE  49   3.113  -9.274   0.477
  340   2HB   PHE  49          2HB       PHE  49   4.722  -9.872   0.061
  341    HD1  PHE  49           HD1      PHE  49   6.296 -10.203   2.200
  342    HD2  PHE  49           HD2      PHE  49   2.052 -10.232   2.266
  343    HE1  PHE  49           HE1      PHE  49   6.337 -11.526   4.333
  344    HE2  PHE  49           HE2      PHE  49   2.093 -11.555   4.398
  345    HZ   PHE  49           HZ       PHE  49   4.236 -12.186   5.407
  346    H    LYS  50           H        LYS  50   2.491  -7.652  -0.376
  347    HA   LYS  50           HA       LYS  50   1.483  -5.631   1.501
  348   1HB   LYS  50          1HB       LYS  50   0.310  -5.199  -1.026
  349   2HB   LYS  50          2HB       LYS  50   1.433  -4.146  -0.149
  350   1HG   LYS  50          1HG       LYS  50   2.516  -6.497  -1.689
  351   2HG   LYS  50          2HG       LYS  50   2.018  -5.053  -2.588
  352   1HD   LYS  50          1HD       LYS  50   4.144  -5.305  -0.434
  353   2HD   LYS  50          2HD       LYS  50   4.358  -4.772  -2.110
  354   1HE   LYS  50          1HE       LYS  50   3.097  -3.301   0.220
  355   2HE   LYS  50          2HE       LYS  50   4.405  -2.757  -0.843
  356   1HZ   LYS  50          1HZ       LYS  50   1.591  -2.578  -1.194
  357   2HZ   LYS  50          2HZ       LYS  50   2.784  -1.723  -1.910
  358   3HZ   LYS  50          3HZ       LYS  50   2.346  -3.175  -2.514
  359    HA   PRO  51           HA       PRO  51  -1.359  -9.151   1.229
  360   1HB   PRO  51          1HB       PRO  51  -1.476  -9.737   3.895
  361   2HB   PRO  51          2HB       PRO  51  -0.396 -10.562   2.773
  362   1HG   PRO  51          1HG       PRO  51   0.185  -8.470   4.770
  363   2HG   PRO  51          2HG       PRO  51   1.323  -9.627   3.993
  364   1HD   PRO  51          1HD       PRO  51   0.972  -6.838   3.450
  365   2HD   PRO  51          2HD       PRO  51   1.991  -7.967   2.549
  366    H    LEU  52           H        LEU  52  -2.109  -8.268   4.428
  367    HA   LEU  52           HA       LEU  52  -4.556  -7.078   3.429
  368   1HB   LEU  52          1HB       LEU  52  -5.466  -7.499   5.486
  369   2HB   LEU  52          2HB       LEU  52  -4.369  -8.869   5.246
  370    HG   LEU  52           HG       LEU  52  -2.929  -6.831   6.618
  371   1HD1  LEU  52          1HD1      LEU  52  -4.544  -5.707   7.691
  372   2HD1  LEU  52          2HD1      LEU  52  -5.773  -6.952   7.366
  373   3HD1  LEU  52          3HD1      LEU  52  -4.639  -7.155   8.723
  374   1HD2  LEU  52          1HD2      LEU  52  -3.557  -9.643   6.839
  375   2HD2  LEU  52          2HD2      LEU  52  -2.134  -8.743   7.416
  376   3HD2  LEU  52          3HD2      LEU  52  -3.585  -8.862   8.439
  377    H    GLN  53           H        GLN  53  -2.066  -5.645   2.941
  378    HA   GLN  53           HA       GLN  53  -1.542  -3.736   4.833
  379   1HB   GLN  53          1HB       GLN  53  -1.383  -3.598   1.800
  380   2HB   GLN  53          2HB       GLN  53  -0.663  -2.388   2.876
  381   1HG   GLN  53          1HG       GLN  53   0.012  -5.351   2.689
  382   2HG   GLN  53          2HG       GLN  53   1.062  -3.995   2.254
  383   1HE2  GLN  53          1HE2      GLN  53  -0.167  -6.026   4.730
  384   2HE2  GLN  53          2HE2      GLN  53   0.714  -5.384   6.076
  385    H    GLU  54           H        GLU  54  -4.341  -4.166   2.799
  386    HA   GLU  54           HA       GLU  54  -5.226  -1.709   2.270
  387   1HB   GLU  54          1HB       GLU  54  -7.361  -2.630   2.100
  388   2HB   GLU  54          2HB       GLU  54  -6.337  -4.072   1.986
  389   1HG   GLU  54          1HG       GLU  54  -7.667  -4.875   3.647
  390   2HG   GLU  54          2HG       GLU  54  -6.689  -3.858   4.717
  391    H    ALA  55           H        ALA  55  -4.722  -3.115   5.449
  392    HA   ALA  55           HA       ALA  55  -6.427  -1.916   7.108
  393   1HB   ALA  55          1HB       ALA  55  -3.727  -2.918   7.207
  394   2HB   ALA  55          2HB       ALA  55  -3.839  -1.455   8.214
  395   3HB   ALA  55          3HB       ALA  55  -4.932  -2.827   8.514
  396    H    GLU  56           H        GLU  56  -3.315  -0.293   6.137
  397    HA   GLU  56           HA       GLU  56  -4.820   2.189   6.084
  398   1HB   GLU  56          1HB       GLU  56  -2.692   1.447   7.963
  399   2HB   GLU  56          2HB       GLU  56  -2.326   2.948   7.096
  400   1HG   GLU  56          1HG       GLU  56  -4.623   3.782   7.726
  401   2HG   GLU  56          2HG       GLU  56  -4.844   2.328   8.709
  402    H    CYS  57           H        CYS  57  -3.718   0.250   4.041
  403    HA   CYS  57           HA       CYS  57  -1.662   1.947   2.846
  404   1HB   CYS  57          1HB       CYS  57  -1.372  -0.586   3.246
  405   2HB   CYS  57          2HB       CYS  57  -2.433  -0.782   1.849
  406    H    THR  58           H        THR  58  -4.648   0.021   2.041
  407    HA   THR  58           HA       THR  58  -5.026   1.327  -0.451
  408    HB   THR  58           HB       THR  58  -5.832  -1.018   0.512
  409    HG1  THR  58           HG1      THR  58  -6.283   0.193  -1.599
  410   1HG2  THR  58          1HG2      THR  58  -7.243  -0.062   2.362
  411   2HG2  THR  58          2HG2      THR  58  -8.182   0.843   1.151
  412   3HG2  THR  58          3HG2      THR  58  -8.230  -0.936   1.167
  413    H    PHE  59           H        PHE  59  -6.223   1.880   2.880
  414    HA   PHE  59           HA       PHE  59  -8.293   3.475   2.623
  415   1HB   PHE  59          1HB       PHE  59  -6.561   2.943   4.585
  416   2HB   PHE  59          2HB       PHE  59  -5.819   4.476   4.115
  417    HD1  PHE  59           HD1      PHE  59  -6.564   6.416   5.130
  418    HD2  PHE  59           HD2      PHE  59  -9.136   3.041   5.049
  419    HE1  PHE  59           HE1      PHE  59  -8.215   7.639   6.572
  420    HE2  PHE  59           HE2      PHE  59 -10.786   4.263   6.491
  421    HZ   PHE  59           HZ       PHE  59 -10.306   6.548   7.235
  422   1H    GLU   1           H1       GLU   1 -23.827   1.211  -1.980
  423    HA   GLU   1           HA       GLU   1 -21.186   0.243  -1.390
  424   1HB   GLU   1          1HB       GLU   1 -22.857   0.533  -3.890
  425   2HB   GLU   1          2HB       GLU   1 -21.118   0.215  -4.016
  426   1HG   GLU   1          1HG       GLU   1 -21.621  -1.972  -3.769
  427   2HG   GLU   1          2HG       GLU   1 -22.019  -1.618  -2.081
  428    H    GLU   2           H        GLU   2 -20.590   2.362  -0.316
  429    HA   GLU   2           HA       GLU   2 -20.359   4.603  -2.067
  430   1HB   GLU   2          1HB       GLU   2 -19.389   5.734  -0.109
  431   2HB   GLU   2          2HB       GLU   2 -20.890   4.902   0.331
  432   1HG   GLU   2          1HG       GLU   2 -19.047   2.933   0.807
  433   2HG   GLU   2          2HG       GLU   2 -18.078   4.367   1.175
  434    H    TYR   3           H        TYR   3 -19.025   3.190  -3.643
  435    HA   TYR   3           HA       TYR   3 -16.291   2.749  -2.797
  436   1HB   TYR   3          1HB       TYR   3 -17.829   2.491  -5.451
  437   2HB   TYR   3          2HB       TYR   3 -16.210   1.840  -5.180
  438    HD1  TYR   3           HD1      TYR   3 -17.490   1.217  -2.141
  439    HD2  TYR   3           HD2      TYR   3 -18.195   0.030  -6.190
  440    HE1  TYR   3           HE1      TYR   3 -18.519  -0.963  -1.331
  441    HE2  TYR   3           HE2      TYR   3 -19.221  -2.145  -5.367
  442    HH   TYR   3           HH       TYR   3 -20.241  -2.606  -2.293
  443    H    VAL   4           H        VAL   4 -15.881   5.104  -2.355
  444    HA   VAL   4           HA       VAL   4 -15.173   6.433  -4.876
  445    HB   VAL   4           HB       VAL   4 -15.589   8.494  -3.142
  446   1HG1  VAL   4          1HG1      VAL   4 -17.001   7.287  -5.429
  447   2HG1  VAL   4          2HG1      VAL   4 -18.022   8.327  -4.407
  448   3HG1  VAL   4          3HG1      VAL   4 -16.531   8.977  -5.130
  449   1HG2  VAL   4          1HG2      VAL   4 -17.833   6.514  -2.627
  450   2HG2  VAL   4          2HG2      VAL   4 -16.560   6.943  -1.458
  451   3HG2  VAL   4          3HG2      VAL   4 -17.713   8.181  -2.014
  452    H    GLY   5           H        GLY   5 -14.675   6.555  -1.272
  453   1HA   GLY   5          1HA       GLY   5 -12.064   7.645  -1.488
  454   2HA   GLY   5          2HA       GLY   5 -12.813   6.947  -0.065
  455    H    LEU   6           H        LEU   6 -13.049   4.746  -2.673
  456    HA   LEU   6           HA       LEU   6 -10.424   3.605  -2.295
  457   1HB   LEU   6          1HB       LEU   6 -11.404   1.396  -1.669
  458   2HB   LEU   6          2HB       LEU   6 -11.410   2.637  -0.403
  459    HG   LEU   6           HG       LEU   6 -13.459   1.326  -0.375
  460   1HD1  LEU   6          1HD1      LEU   6 -13.310   3.984  -0.105
  461   2HD1  LEU   6          2HD1      LEU   6 -14.467   3.906  -1.456
  462   3HD1  LEU   6          3HD1      LEU   6 -14.830   3.074   0.075
  463   1HD2  LEU   6          1HD2      LEU   6 -15.024   1.250  -2.193
  464   2HD2  LEU   6          2HD2      LEU   6 -14.020   2.349  -3.170
  465   3HD2  LEU   6          3HD2      LEU   6 -13.435   0.711  -2.789
  466    H    SER   7           H        SER   7 -11.990   4.894  -4.456
  467    HA   SER   7           HA       SER   7 -12.488   2.584  -6.145
  468   1HB   SER   7          1HB       SER   7 -13.814   3.989  -7.520
  469   2HB   SER   7          2HB       SER   7 -14.220   4.466  -5.861
  470    HG   SER   7           HG       SER   7 -13.872   6.322  -7.206
  471    H    ALA   8           H        ALA   8 -11.877   3.138  -8.619
  472    HA   ALA   8           HA       ALA   8  -9.054   3.475  -8.620
  473   1HB   ALA   8          1HB       ALA   8 -11.223   2.744 -10.519
  474   2HB   ALA   8          2HB       ALA   8  -9.780   3.488 -11.246
  475   3HB   ALA   8          3HB       ALA   8  -9.621   2.008 -10.271
  476    H    ASN   9           H        ASN   9 -11.550   5.691  -8.334
  477    HA   ASN   9           HA       ASN   9 -10.232   7.648 -10.012
  478   1HB   ASN   9          1HB       ASN   9 -12.925   7.123  -9.450
  479   2HB   ASN   9          2HB       ASN   9 -12.587   8.549  -8.457
  480   1HD2  ASN   9          1HD2      ASN   9 -11.683  10.419  -9.477
  481   2HD2  ASN   9          2HD2      ASN   9 -12.016  10.776 -11.140
  482    H    GLN  10           H        GLN  10 -10.023   6.391  -6.912
  483    HA   GLN  10           HA       GLN  10 -10.067   8.689  -5.333
  484   1HB   GLN  10          1HB       GLN  10  -9.480   5.866  -5.041
  485   2HB   GLN  10          2HB       GLN  10  -8.280   6.822  -4.151
  486   1HG   GLN  10          1HG       GLN  10 -10.987   7.872  -3.789
  487   2HG   GLN  10          2HG       GLN  10 -10.896   6.170  -3.315
  488   1HE2  GLN  10          1HE2      GLN  10  -8.658   5.714  -2.171
  489   2HE2  GLN  10          2HE2      GLN  10  -8.298   6.756  -0.835
  490    H    CYS  11           H        CYS  11  -7.555   7.091  -7.314
  491    HA   CYS  11           HA       CYS  11  -5.390   8.522  -6.240
  492   1HB   CYS  11          1HB       CYS  11  -5.874   6.863  -8.667
  493   2HB   CYS  11          2HB       CYS  11  -4.439   7.894  -8.631
  494    H    ALA  12           H        ALA  12  -8.119   9.468  -8.058
  495    HA   ALA  12           HA       ALA  12  -6.672  11.808  -9.097
  496   1HB   ALA  12          1HB       ALA  12  -9.286  11.180 -10.306
  497   2HB   ALA  12          2HB       ALA  12  -7.733  11.573 -11.083
  498   3HB   ALA  12          3HB       ALA  12  -8.066   9.908 -10.549
  499    H    VAL  13           H        VAL  13  -7.961  11.143  -6.387
  500    HA   VAL  13           HA       VAL  13 -10.383  12.262  -5.996
  501    HB   VAL  13           HB       VAL  13  -8.235  11.445  -4.458
  502   1HG1  VAL  13          1HG1      VAL  13  -7.335  13.717  -4.364
  503   2HG1  VAL  13          2HG1      VAL  13  -8.895  14.327  -3.761
  504   3HG1  VAL  13          3HG1      VAL  13  -7.929  13.211  -2.765
  505   1HG2  VAL  13          1HG2      VAL  13 -10.004  10.813  -3.259
  506   2HG2  VAL  13          2HG2      VAL  13 -10.231  12.493  -2.715
  507   3HG2  VAL  13          3HG2      VAL  13 -11.047  11.916  -4.188
  508    HA   PRO  14           HA       PRO  14 -10.117  16.509  -6.753
  509   1HB   PRO  14          1HB       PRO  14 -11.591  17.654  -4.758
  510   2HB   PRO  14          2HB       PRO  14 -12.313  16.879  -6.166
  511   1HG   PRO  14          1HG       PRO  14 -12.050  15.908  -3.393
  512   2HG   PRO  14          2HG       PRO  14 -13.183  15.350  -4.676
  513   1HD   PRO  14          1HD       PRO  14 -10.813  14.065  -3.711
  514   2HD   PRO  14          2HD       PRO  14 -11.805  13.555  -5.083
  515    H    ALA  15           H        ALA  15  -7.972  15.307  -5.091
  516    HA   ALA  15           HA       ALA  15  -6.283  15.961  -3.798
  517   1HB   ALA  15          1HB       ALA  15  -5.638  17.103  -5.805
  518   2HB   ALA  15          2HB       ALA  15  -6.789  18.427  -5.503
  519   3HB   ALA  15          3HB       ALA  15  -5.355  18.240  -4.465
  520    H    LYS  16           H        LYS  16  -7.948  15.758  -1.960
  521    HA   LYS  16           HA       LYS  16  -7.506  17.556  -0.028
  522   1HB   LYS  16          1HB       LYS  16  -9.789  18.818  -0.060
  523   2HB   LYS  16          2HB       LYS  16  -8.412  19.444  -0.984
  524   1HG   LYS  16          1HG       LYS  16  -9.611  19.290  -2.882
  525   2HG   LYS  16          2HG       LYS  16  -9.831  17.549  -2.633
  526   1HD   LYS  16          1HD       LYS  16 -11.525  19.538  -1.111
  527   2HD   LYS  16          2HD       LYS  16 -11.940  19.134  -2.786
  528   1HE   LYS  16          1HE       LYS  16 -12.927  17.236  -2.081
  529   2HE   LYS  16          2HE       LYS  16 -11.400  16.678  -1.379
  530   1HZ   LYS  16          1HZ       LYS  16 -13.674  17.571  -0.070
  531   2HZ   LYS  16          2HZ       LYS  16 -12.282  17.028   0.588
  532   3HZ   LYS  16          3HZ       LYS  16 -12.471  18.620   0.276
  533    H    ASP  17           H        ASP  17  -7.844  14.791  -0.373
  534    HA   ASP  17           HA       ASP  17  -9.741  14.344   1.681
  535   1HB   ASP  17          1HB       ASP  17 -11.056  14.307  -0.545
  536   2HB   ASP  17          2HB       ASP  17 -10.174  12.817  -0.918
  537    H    ARG  18           H        ARG  18  -6.812  13.982   0.461
  538    HA   ARG  18           HA       ARG  18  -6.588  11.125   0.602
  539   1HB   ARG  18          1HB       ARG  18  -4.406  13.228   0.248
  540   2HB   ARG  18          2HB       ARG  18  -4.244  11.494  -0.075
  541   1HG   ARG  18          1HG       ARG  18  -5.368  11.633  -2.071
  542   2HG   ARG  18          2HG       ARG  18  -6.474  12.893  -1.495
  543   1HD   ARG  18          1HD       ARG  18  -4.837  14.611  -1.844
  544   2HD   ARG  18          2HD       ARG  18  -3.525  13.440  -2.040
  545    HE   ARG  18           HE       ARG  18  -5.627  13.051  -4.007
  546   1HH1  ARG  18          1HH1      ARG  18  -2.817  15.027  -3.246
  547   2HH1  ARG  18          2HH1      ARG  18  -2.499  15.438  -4.898
  548   1HH2  ARG  18          1HH2      ARG  18  -5.208  13.594  -6.188
  549   2HH2  ARG  18          2HH2      ARG  18  -3.868  14.618  -6.582
  550    H    VAL  19           H        VAL  19  -4.288  10.501   1.852
  551    HA   VAL  19           HA       VAL  19  -4.640  11.616   4.546
  552    HB   VAL  19           HB       VAL  19  -3.448   8.952   3.777
  553   1HG1  VAL  19          1HG1      VAL  19  -3.361  10.343   6.163
  554   2HG1  VAL  19          2HG1      VAL  19  -4.746   9.249   6.392
  555   3HG1  VAL  19          3HG1      VAL  19  -3.148   8.587   5.971
  556   1HG2  VAL  19          1HG2      VAL  19  -5.525   8.357   3.150
  557   2HG2  VAL  19          2HG2      VAL  19  -5.896   8.374   4.890
  558   3HG2  VAL  19          3HG2      VAL  19  -6.265   9.798   3.887
  559    H    ASP  20           H        ASP  20  -2.985  12.577   2.117
  560    HA   ASP  20           HA       ASP  20  -0.887  13.054   1.600
  561   1HB   ASP  20          1HB       ASP  20  -1.201  14.985   2.836
  562   2HB   ASP  20          2HB       ASP  20  -1.487  14.107   4.347
  563    H    CYS  21           H        CYS  21   0.070  10.879   1.395
  564    HA   CYS  21           HA       CYS  21   0.895   9.259   3.400
  565   1HB   CYS  21          1HB       CYS  21   1.096   9.262   0.690
  566   2HB   CYS  21          2HB       CYS  21   2.792   9.442   1.151
  567    H    GLY  22           H        GLY  22   2.423  12.222   2.069
  568   1HA   GLY  22          1HA       GLY  22   4.213  13.424   2.712
  569   2HA   GLY  22          2HA       GLY  22   3.749  12.978   4.342
  570    H    TYR  23           H        TYR  23   5.250  11.313   1.469
  571    HA   TYR  23           HA       TYR  23   6.980   9.854   3.291
  572   1HB   TYR  23          1HB       TYR  23   5.817   9.697   0.579
  573   2HB   TYR  23          2HB       TYR  23   7.553   9.380   0.519
  574    HD1  TYR  23           HD1      TYR  23   4.286   8.090   1.424
  575    HD2  TYR  23           HD2      TYR  23   8.496   7.474   1.869
  576    HE1  TYR  23           HE1      TYR  23   3.865   5.693   2.162
  577    HE2  TYR  23           HE2      TYR  23   8.061   5.079   2.605
  578    HH   TYR  23           HH       TYR  23   4.786   3.929   3.153
  579    HA   PRO  24           HA       PRO  24  10.367  12.455   2.546
  580   1HB   PRO  24          1HB       PRO  24  12.385  10.844   3.441
  581   2HB   PRO  24          2HB       PRO  24  11.376  11.813   4.514
  582   1HG   PRO  24          1HG       PRO  24  11.312   8.917   3.951
  583   2HG   PRO  24          2HG       PRO  24  10.634   9.801   5.364
  584   1HD   PRO  24          1HD       PRO  24   9.241   8.697   3.118
  585   2HD   PRO  24          2HD       PRO  24   8.548   9.695   4.402
  586    H    HIS  25           H        HIS  25   9.638   9.817   0.762
  587    HA   HIS  25           HA       HIS  25  11.847  10.463  -1.048
  588   1HB   HIS  25          1HB       HIS  25  11.661   8.110   0.276
  589   2HB   HIS  25          2HB       HIS  25  10.729   7.722  -1.176
  590    HD1  HIS  25           HD1      HIS  25  13.113   6.087  -1.108
  591    HD2  HIS  25           HD2      HIS  25  13.332  10.057  -2.446
  592    HE1  HIS  25           HE1      HIS  25  15.237   6.252  -2.514
  593    HE2  HIS  25           HE2      HIS  25  15.288   8.700  -3.353
  594    H    VAL  26           H        VAL  26   8.766  11.116  -0.549
  595    HA   VAL  26           HA       VAL  26   7.124  10.136  -2.397
  596    HB   VAL  26           HB       VAL  26   6.334  11.811  -0.988
  597   1HG1  VAL  26          1HG1      VAL  26   7.699  14.193  -1.924
  598   2HG1  VAL  26          2HG1      VAL  26   7.550  13.543  -0.273
  599   3HG1  VAL  26          3HG1      VAL  26   8.865  12.984  -1.334
  600   1HG2  VAL  26          1HG2      VAL  26   6.471  13.425  -3.527
  601   2HG2  VAL  26          2HG2      VAL  26   5.594  11.877  -3.490
  602   3HG2  VAL  26          3HG2      VAL  26   5.113  13.198  -2.399
  603    H    THR  27           H        THR  27   7.144   9.769  -4.552
  604    HA   THR  27           HA       THR  27   8.152  11.673  -6.389
  605    HB   THR  27           HB       THR  27  10.081   9.882  -5.211
  606    HG1  THR  27           HG1      THR  27  10.861  11.824  -5.985
  607   1HG2  THR  27          1HG2      THR  27  10.978   9.157  -7.583
  608   2HG2  THR  27          2HG2      THR  27   9.749   8.134  -6.800
  609   3HG2  THR  27          3HG2      THR  27   9.274   9.275  -8.082
  610    HA   PRO  28           HA       PRO  28   5.588   9.359  -8.932
  611   1HB   PRO  28          1HB       PRO  28   6.506   9.990 -11.425
  612   2HB   PRO  28          2HB       PRO  28   5.459  11.052 -10.487
  613   1HG   PRO  28          1HG       PRO  28   8.362  11.214 -10.994
  614   2HG   PRO  28          2HG       PRO  28   7.240  12.519 -10.463
  615   1HD   PRO  28          1HD       PRO  28   9.161  11.079  -8.901
  616   2HD   PRO  28          2HD       PRO  28   7.970  12.240  -8.301
  617    H    LYS  29           H        LYS  29   7.354   7.703  -7.718
  618    HA   LYS  29           HA       LYS  29   7.283   5.514  -9.399
  619   1HB   LYS  29          1HB       LYS  29   9.142   7.120 -10.438
  620   2HB   LYS  29          2HB       LYS  29  10.155   6.292  -9.242
  621   1HG   LYS  29          1HG       LYS  29  10.062   4.312 -10.367
  622   2HG   LYS  29          2HG       LYS  29   8.349   4.503 -10.780
  623   1HD   LYS  29          1HD       LYS  29   8.932   6.050 -12.591
  624   2HD   LYS  29          2HD       LYS  29  10.646   5.990 -12.139
  625   1HE   LYS  29          1HE       LYS  29  10.810   4.312 -13.655
  626   2HE   LYS  29          2HE       LYS  29   9.989   3.297 -12.460
  627   1HZ   LYS  29          1HZ       LYS  29   7.908   3.935 -13.465
  628   2HZ   LYS  29          2HZ       LYS  29   8.671   4.878 -14.557
  629   3HZ   LYS  29          3HZ       LYS  29   8.888   3.260 -14.584
  630    H    GLU  30           H        GLU  30   8.150   7.292  -6.585
  631    HA   GLU  30           HA       GLU  30   9.130   4.883  -5.298
  632   1HB   GLU  30          1HB       GLU  30   9.530   7.777  -4.927
  633   2HB   GLU  30          2HB       GLU  30   9.255   6.915  -3.404
  634   1HG   GLU  30          1HG       GLU  30  11.526   6.599  -3.568
  635   2HG   GLU  30          2HG       GLU  30  11.020   5.205  -4.536
  636    H    CYS  31           H        CYS  31   6.611   7.462  -5.051
  637    HA   CYS  31           HA       CYS  31   5.397   6.597  -2.744
  638   1HB   CYS  31          1HB       CYS  31   4.287   7.965  -5.187
  639   2HB   CYS  31          2HB       CYS  31   3.319   7.660  -3.743
  640    H    ASN  32           H        ASN  32   4.605   5.798  -6.210
  641    HA   ASN  32           HA       ASN  32   2.638   3.969  -5.600
  642   1HB   ASN  32          1HB       ASN  32   4.354   4.631  -7.957
  643   2HB   ASN  32          2HB       ASN  32   3.625   3.018  -7.989
  644   1HD2  ASN  32          1HD2      ASN  32   2.588   6.210  -6.791
  645   2HD2  ASN  32          2HD2      ASN  32   1.099   6.302  -7.670
  646    H    ASN  33           H        ASN  33   6.022   3.875  -5.055
  647    HA   ASN  33           HA       ASN  33   6.249   1.034  -5.428
  648   1HB   ASN  33          1HB       ASN  33   8.059   3.020  -5.740
  649   2HB   ASN  33          2HB       ASN  33   8.388   2.649  -4.042
  650   1HD2  ASN  33          1HD2      ASN  33  10.493   2.091  -4.992
  651   2HD2  ASN  33          2HD2      ASN  33  10.755   0.483  -5.584
  652    H    ARG  34           H        ARG  34   5.916   3.543  -2.897
  653    HA   ARG  34           HA       ARG  34   6.444   1.674  -0.806
  654   1HB   ARG  34          1HB       ARG  34   5.218   4.433  -0.465
  655   2HB   ARG  34          2HB       ARG  34   6.245   3.550   0.678
  656   1HG   ARG  34          1HG       ARG  34   7.680   3.851  -1.796
  657   2HG   ARG  34          2HG       ARG  34   7.027   5.437  -1.348
  658   1HD   ARG  34          1HD       ARG  34   8.500   5.647   0.362
  659   2HD   ARG  34          2HD       ARG  34   8.158   4.019   0.967
  660    HE   ARG  34           HE       ARG  34   9.689   3.683  -1.373
  661   1HH1  ARG  34          1HH1      ARG  34  10.106   5.207   1.771
  662   2HH1  ARG  34          2HH1      ARG  34  11.823   4.975   1.799
  663   1HH2  ARG  34          1HH2      ARG  34  11.953   3.375  -1.337
  664   2HH2  ARG  34          2HH2      ARG  34  12.880   3.925   0.019
  665    H    GLY  35           H        GLY  35   3.712   2.930  -2.637
  666   1HA   GLY  35          1HA       GLY  35   1.725   1.510  -2.535
  667   2HA   GLY  35          2HA       GLY  35   1.857   1.550  -0.788
  668    H    CYS  36           H        CYS  36   2.655   4.442  -2.685
  669    HA   CYS  36           HA       CYS  36   0.103   5.596  -1.818
  670   1HB   CYS  36          1HB       CYS  36   2.754   7.032  -1.995
  671   2HB   CYS  36          2HB       CYS  36   1.216   7.712  -1.456
  672    H    CYS  37           H        CYS  37  -0.538   7.522  -3.258
  673    HA   CYS  37           HA       CYS  37   0.270   6.908  -6.003
  674   1HB   CYS  37          1HB       CYS  37  -2.243   6.937  -4.893
  675   2HB   CYS  37          2HB       CYS  37  -2.145   8.528  -5.652
  676    H    PHE  38           H        PHE  38   1.416   8.488  -7.084
  677    HA   PHE  38           HA       PHE  38   1.850  10.984  -5.691
  678   1HB   PHE  38          1HB       PHE  38   3.604   9.454  -6.837
  679   2HB   PHE  38          2HB       PHE  38   2.898   9.936  -8.384
  680    HD1  PHE  38           HD1      PHE  38   4.793  11.104  -5.449
  681    HD2  PHE  38           HD2      PHE  38   3.378  12.078  -9.329
  682    HE1  PHE  38           HE1      PHE  38   6.298  13.111  -5.493
  683    HE2  PHE  38           HE2      PHE  38   4.883  14.086  -9.374
  684    HZ   PHE  38           HZ       PHE  38   6.325  14.578  -7.454
  685    H    ASP  39           H        ASP  39   0.681  12.795  -6.098
  686    HA   ASP  39           HA       ASP  39  -1.117  12.787  -8.289
  687   1HB   ASP  39          1HB       ASP  39  -2.086  13.965  -6.581
  688   2HB   ASP  39          2HB       ASP  39  -0.530  14.482  -5.911
  689    H    SER  40           H        SER  40   0.939  15.574  -7.235
  690    HA   SER  40           HA       SER  40   2.562  16.655  -8.273
  691   1HB   SER  40          1HB       SER  40   2.934  14.390  -9.564
  692   2HB   SER  40          2HB       SER  40   2.143  15.232 -10.908
  693    HG   SER  40           HG       SER  40   3.785  16.927 -10.656
  694    H    ARG  41           H        ARG  41  -0.627  16.019  -9.567
  695    HA   ARG  41           HA       ARG  41  -0.680  18.004 -11.508
  696   1HB   ARG  41          1HB       ARG  41  -3.088  17.145  -9.865
  697   2HB   ARG  41          2HB       ARG  41  -3.051  17.618 -11.573
  698   1HG   ARG  41          1HG       ARG  41  -1.307  15.485 -11.542
  699   2HG   ARG  41          2HG       ARG  41  -2.472  14.994 -10.301
  700   1HD   ARG  41          1HD       ARG  41  -3.506  14.156 -12.205
  701   2HD   ARG  41          2HD       ARG  41  -4.245  15.762 -12.151
  702    HE   ARG  41           HE       ARG  41  -3.184  16.211 -14.172
  703   1HH1  ARG  41          1HH1      ARG  41  -1.324  13.758 -12.467
  704   2HH1  ARG  41          2HH1      ARG  41  -0.167  13.566 -13.741
  705   1HH2  ARG  41          1HH2      ARG  41  -1.657  15.959 -15.854
  706   2HH2  ARG  41          2HH2      ARG  41  -0.358  14.827 -15.681
  707    H    ILE  42           H        ILE  42  -1.457  17.946  -7.986
  708    HA   ILE  42           HA       ILE  42  -1.652  20.877  -8.101
  709    HB   ILE  42           HB       ILE  42  -3.031  19.301  -5.976
  710   1HG1  ILE  42          1HG1      ILE  42  -4.014  19.643  -8.810
  711   2HG1  ILE  42          2HG1      ILE  42  -3.812  18.132  -7.904
  712   1HG2  ILE  42          1HG2      ILE  42  -2.727  21.915  -6.240
  713   2HG2  ILE  42          2HG2      ILE  42  -4.130  21.732  -7.319
  714   3HG2  ILE  42          3HG2      ILE  42  -4.238  21.207  -5.622
  715   1HD1  ILE  42          1HD1      ILE  42  -6.063  20.014  -7.944
  716   2HD1  ILE  42          2HD1      ILE  42  -5.998  18.344  -7.329
  717   3HD1  ILE  42          3HD1      ILE  42  -5.499  19.697  -6.286
  718    HA   PRO  43           HA       PRO  43   1.865  20.252  -5.540
  719   1HB   PRO  43          1HB       PRO  43   2.871  22.779  -5.794
  720   2HB   PRO  43          2HB       PRO  43   3.255  21.472  -6.912
  721   1HG   PRO  43          1HG       PRO  43   1.426  23.765  -7.229
  722   2HG   PRO  43          2HG       PRO  43   2.167  22.736  -8.506
  723   1HD   PRO  43          1HD       PRO  43  -0.528  22.703  -7.535
  724   2HD   PRO  43          2HD       PRO  43   0.196  21.565  -8.679
  725    H    GLY  44           H        GLY  44  -0.904  21.979  -5.095
  726   1HA   GLY  44          1HA       GLY  44  -0.059  23.189  -2.582
  727   2HA   GLY  44          2HA       GLY  44  -1.617  23.333  -3.370
  728    H    VAL  45           H        VAL  45  -1.068  20.109  -3.676
  729    HA   VAL  45           HA       VAL  45  -2.161  19.518  -1.012
  730    HB   VAL  45           HB       VAL  45  -3.762  18.140  -1.909
  731   1HG1  VAL  45          1HG1      VAL  45  -3.593  20.727  -2.939
  732   2HG1  VAL  45          2HG1      VAL  45  -3.974  19.715  -4.352
  733   3HG1  VAL  45          3HG1      VAL  45  -5.032  19.678  -2.921
  734   1HG2  VAL  45          1HG2      VAL  45  -3.740  17.125  -4.103
  735   2HG2  VAL  45          2HG2      VAL  45  -2.317  18.081  -4.578
  736   3HG2  VAL  45          3HG2      VAL  45  -2.170  16.832  -3.317
  737    HA   PRO  46           HA       PRO  46   0.665  16.225  -0.816
  738   1HB   PRO  46          1HB       PRO  46  -0.720  13.920  -0.332
  739   2HB   PRO  46          2HB       PRO  46  -0.390  15.127   0.911
  740   1HG   PRO  46          1HG       PRO  46  -2.878  14.560  -0.570
  741   2HG   PRO  46          2HG       PRO  46  -2.675  15.431   0.993
  742   1HD   PRO  46          1HD       PRO  46  -3.210  16.526  -1.598
  743   2HD   PRO  46          2HD       PRO  46  -2.860  17.433  -0.121
  744    H    TRP  47           H        TRP  47   2.056  15.569  -2.317
  745    HA   TRP  47           HA       TRP  47   0.849  14.494  -4.735
  746   1HB   TRP  47          1HB       TRP  47   3.754  14.735  -4.649
  747   2HB   TRP  47          2HB       TRP  47   2.591  15.341  -5.831
  748    HD1  TRP  47           HD1      TRP  47   1.361  17.784  -5.066
  749    HE1  TRP  47           HE1      TRP  47   2.316  19.888  -3.792
  750    HE3  TRP  47           HE3      TRP  47   5.325  15.376  -2.982
  751    HZ2  TRP  47           HZ2      TRP  47   4.571  20.300  -2.092
  752    HZ3  TRP  47           HZ3      TRP  47   6.855  16.703  -1.527
  753    HH2  TRP  47           HH2      TRP  47   6.529  19.081  -1.071
  754    H    CYS  48           H        CYS  48   0.888  13.039  -2.084
  755    HA   CYS  48           HA       CYS  48   1.722  10.549  -3.102
  756   1HB   CYS  48          1HB       CYS  48   3.923  11.579  -2.436
  757   2HB   CYS  48          2HB       CYS  48   3.363  11.527  -0.762
  758    H    PHE  49           H        PHE  49  -0.189   9.584  -2.457
  759    HA   PHE  49           HA       PHE  49  -0.732   9.583   0.399
  760   1HB   PHE  49          1HB       PHE  49  -3.262   9.807  -0.593
  761   2HB   PHE  49          2HB       PHE  49  -2.324  11.234  -0.141
  762    HD1  PHE  49           HD1      PHE  49  -0.744  12.104  -2.128
  763    HD2  PHE  49           HD2      PHE  49  -4.290   9.830  -2.638
  764    HE1  PHE  49           HE1      PHE  49  -0.965  12.975  -4.472
  765    HE2  PHE  49           HE2      PHE  49  -4.511  10.701  -4.982
  766    HZ   PHE  49           HZ       PHE  49  -2.845  12.262  -5.871
  767    H    LYS  50           H        LYS  50  -3.102   8.162   0.437
  768    HA   LYS  50           HA       LYS  50  -2.452   5.778  -1.152
  769   1HB   LYS  50          1HB       LYS  50  -3.685   4.781   1.066
  770   2HB   LYS  50          2HB       LYS  50  -1.933   4.833   0.812
  771   1HG   LYS  50          1HG       LYS  50  -3.242   7.289   1.920
  772   2HG   LYS  50          2HG       LYS  50  -3.128   5.889   3.000
  773   1HD   LYS  50          1HD       LYS  50  -0.865   7.349   1.583
  774   2HD   LYS  50          2HD       LYS  50  -1.143   7.251   3.331
  775   1HE   LYS  50          1HE       LYS  50  -0.100   5.156   1.424
  776   2HE   LYS  50          2HE       LYS  50   0.543   5.639   3.001
  777   1HZ   LYS  50          1HZ       LYS  50  -1.606   3.818   2.370
  778   2HZ   LYS  50          2HZ       LYS  50  -0.482   3.733   3.551
  779   3HZ   LYS  50          3HZ       LYS  50  -1.779   4.710   3.726
  780    HA   PRO  51           HA       PRO  51  -6.685   7.158  -2.001
  781   1HB   PRO  51          1HB       PRO  51  -6.470   7.357  -4.716
  782   2HB   PRO  51          2HB       PRO  51  -6.272   8.731  -3.631
  783   1HG   PRO  51          1HG       PRO  51  -4.243   7.146  -5.071
  784   2HG   PRO  51          2HG       PRO  51  -4.090   8.800  -4.374
  785   1HD   PRO  51          1HD       PRO  51  -3.050   6.335  -3.353
  786   2HD   PRO  51          2HD       PRO  51  -3.010   7.910  -2.550
  787    H    LEU  52           H        LEU  52  -5.853   5.636  -4.982
  788    HA   LEU  52           HA       LEU  52  -7.517   3.388  -4.134
  789   1HB   LEU  52          1HB       LEU  52  -8.268   3.235  -6.223
  790   2HB   LEU  52          2HB       LEU  52  -7.791   4.942  -6.278
  791    HG   LEU  52           HG       LEU  52  -5.494   3.696  -7.088
  792   1HD1  LEU  52          1HD1      LEU  52  -7.372   1.648  -7.186
  793   2HD1  LEU  52          2HD1      LEU  52  -7.261   2.222  -8.868
  794   3HD1  LEU  52          3HD1      LEU  52  -5.794   1.693  -8.009
  795   1HD2  LEU  52          1HD2      LEU  52  -5.785   4.967  -8.907
  796   2HD2  LEU  52          2HD2      LEU  52  -7.352   4.219  -9.302
  797   3HD2  LEU  52          3HD2      LEU  52  -7.268   5.525  -8.096
  798    H    GLN  53           H        GLN  53  -4.888   3.574  -3.034
  799    HA   GLN  53           HA       GLN  53  -2.924   2.351  -4.448
  800   1HB   GLN  53          1HB       GLN  53  -3.602   2.104  -1.493
  801   2HB   GLN  53          2HB       GLN  53  -2.053   1.608  -2.197
  802   1HG   GLN  53          1HG       GLN  53  -3.249   4.413  -2.248
  803   2HG   GLN  53          2HG       GLN  53  -1.904   3.884  -1.226
  804   1HE2  GLN  53          1HE2      GLN  53  -0.594   2.236  -3.082
  805   2HE2  GLN  53          2HE2      GLN  53   0.117   3.214  -4.322
  806    H    GLU  54           H        GLU  54  -5.949   1.021  -3.332
  807    HA   GLU  54           HA       GLU  54  -5.513  -1.520  -2.767
  808   1HB   GLU  54          1HB       GLU  54  -7.664  -2.045  -3.924
  809   2HB   GLU  54          2HB       GLU  54  -7.758  -0.579  -2.932
  810   1HG   GLU  54          1HG       GLU  54  -8.119   0.751  -4.742
  811   2HG   GLU  54          2HG       GLU  54  -6.908  -0.083  -5.727
  812    H    ALA  55           H        ALA  55  -4.798   0.050  -5.836
  813    HA   ALA  55           HA       ALA  55  -4.865  -1.732  -7.757
  814   1HB   ALA  55          1HB       ALA  55  -2.839   0.264  -6.884
  815   2HB   ALA  55          2HB       ALA  55  -2.287  -0.921  -8.092
  816   3HB   ALA  55          3HB       ALA  55  -3.697   0.108  -8.434
  817    H    GLU  56           H        GLU  56  -2.028  -1.720  -5.475
  818    HA   GLU  56           HA       GLU  56  -2.145  -4.611  -5.538
  819   1HB   GLU  56          1HB       GLU  56  -0.150  -3.001  -6.899
  820   2HB   GLU  56          2HB       GLU  56   0.622  -3.984  -5.643
  821   1HG   GLU  56          1HG       GLU  56   0.077  -5.972  -6.684
  822   2HG   GLU  56          2HG       GLU  56  -1.423  -5.337  -7.376
  823    H    CYS  57           H        CYS  57  -2.531  -2.093  -3.685
  824    HA   CYS  57           HA       CYS  57  -0.522  -2.653  -1.683
  825   1HB   CYS  57          1HB       CYS  57  -1.863  -0.370  -2.445
  826   2HB   CYS  57          2HB       CYS  57  -2.676  -0.818  -0.943
  827    H    THR  58           H        THR  58  -4.146  -2.595  -2.034
  828    HA   THR  58           HA       THR  58  -4.659  -3.826   0.437
  829    HB   THR  58           HB       THR  58  -6.202  -2.456  -1.153
  830    HG1  THR  58           HG1      THR  58  -6.895  -5.091  -0.056
  831   1HG2  THR  58          1HG2      THR  58  -6.767  -5.252  -2.249
  832   2HG2  THR  58          2HG2      THR  58  -7.496  -3.713  -2.765
  833   3HG2  THR  58          3HG2      THR  58  -5.793  -4.063  -3.147
  834    H    PHE  59           H        PHE  59  -4.174  -5.168  -2.870
  835    HA   PHE  59           HA       PHE  59  -4.833  -7.791  -2.183
  836   1HB   PHE  59          1HB       PHE  59  -3.339  -6.250  -4.296
  837   2HB   PHE  59          2HB       PHE  59  -2.963  -7.975  -4.222
  838    HD1  PHE  59           HD1      PHE  59  -6.024  -5.825  -4.101
  839    HD2  PHE  59           HD2      PHE  59  -4.143  -9.278  -5.695
  840    HE1  PHE  59           HE1      PHE  59  -8.077  -6.316  -5.460
  841    HE2  PHE  59           HE2      PHE  59  -6.195  -9.769  -7.054
  842    HZ   PHE  59           HZ       PHE  59  -8.138  -8.283  -6.920
  Start of MODEL   40
    1   1H    GLU   1           H1       GLU   1 -15.661 -15.112  -2.596
    2    HA   GLU   1           HA       GLU   1 -15.613 -12.849  -4.430
    3   1HB   GLU   1          1HB       GLU   1 -17.759 -14.517  -3.258
    4   2HB   GLU   1          2HB       GLU   1 -18.107 -12.779  -3.251
    5   1HG   GLU   1          1HG       GLU   1 -17.847 -12.629  -5.629
    6   2HG   GLU   1          2HG       GLU   1 -17.105 -14.232  -5.734
    7    H    GLU   2           H        GLU   2 -15.554 -13.892  -1.044
    8    HA   GLU   2           HA       GLU   2 -15.885 -11.172  -0.148
    9   1HB   GLU   2          1HB       GLU   2 -15.749 -13.871   1.190
   10   2HB   GLU   2          2HB       GLU   2 -15.492 -12.409   2.156
   11   1HG   GLU   2          1HG       GLU   2 -17.688 -11.788   2.015
   12   2HG   GLU   2          2HG       GLU   2 -17.846 -12.315   0.333
   13    H    TYR   3           H        TYR   3 -13.972 -10.157  -0.956
   14    HA   TYR   3           HA       TYR   3 -11.458 -10.946  -1.073
   15   1HB   TYR   3          1HB       TYR   3 -12.422  -8.408   0.373
   16   2HB   TYR   3          2HB       TYR   3 -10.921  -8.555  -0.547
   17    HD1  TYR   3           HD1      TYR   3 -11.162  -9.064  -3.087
   18    HD2  TYR   3           HD2      TYR   3 -14.360  -7.606  -0.647
   19    HE1  TYR   3           HE1      TYR   3 -12.381  -8.241  -5.162
   20    HE2  TYR   3           HE2      TYR   3 -15.567  -6.789  -2.730
   21    HH   TYR   3           HH       TYR   3 -14.455  -7.641  -5.908
   22    H    VAL   4           H        VAL   4 -10.910 -12.625   0.421
   23    HA   VAL   4           HA       VAL   4 -10.639 -11.723   3.199
   24    HB   VAL   4           HB       VAL   4 -10.404 -14.162   3.664
   25   1HG1  VAL   4          1HG1      VAL   4 -12.581 -14.089   4.143
   26   2HG1  VAL   4          2HG1      VAL   4 -12.718 -12.636   3.122
   27   3HG1  VAL   4          3HG1      VAL   4 -13.010 -14.246   2.423
   28   1HG2  VAL   4          1HG2      VAL   4  -9.658 -14.858   1.412
   29   2HG2  VAL   4          2HG2      VAL   4 -11.071 -15.786   1.969
   30   3HG2  VAL   4          3HG2      VAL   4 -11.275 -14.485   0.772
   31    H    GLY   5           H        GLY   5  -8.936 -13.329   0.445
   32   1HA   GLY   5          1HA       GLY   5  -6.425 -13.449   1.800
   33   2HA   GLY   5          2HA       GLY   5  -6.737 -13.721   0.098
   34    H    LEU   6           H        LEU   6  -8.155 -10.759   1.032
   35    HA   LEU   6           HA       LEU   6  -5.732  -9.302   0.234
   36   1HB   LEU   6          1HB       LEU   6  -8.463  -8.317  -0.444
   37   2HB   LEU   6          2HB       LEU   6  -6.908  -7.960  -1.213
   38    HG   LEU   6           HG       LEU   6  -6.903 -10.261  -2.156
   39   1HD1  LEU   6          1HD1      LEU   6  -9.452 -11.174  -2.124
   40   2HD1  LEU   6          2HD1      LEU   6  -8.176 -11.725  -1.012
   41   3HD1  LEU   6          3HD1      LEU   6  -9.337 -10.480  -0.489
   42   1HD2  LEU   6          1HD2      LEU   6  -8.970  -9.819  -3.694
   43   2HD2  LEU   6          2HD2      LEU   6  -9.052  -8.274  -2.814
   44   3HD2  LEU   6          3HD2      LEU   6  -7.579  -8.708  -3.717
   45    H    SER   7           H        SER   7  -8.057  -9.951   2.628
   46    HA   SER   7           HA       SER   7  -7.663  -7.299   3.767
   47   1HB   SER   7          1HB       SER   7  -9.718  -9.361   4.629
   48   2HB   SER   7          2HB       SER   7  -9.685  -7.637   5.042
   49    HG   SER   7           HG       SER   7 -10.421  -8.931   2.595
   50    H    ALA   8           H        ALA   8  -8.496  -8.246   6.470
   51    HA   ALA   8           HA       ALA   8  -6.011  -8.837   7.525
   52   1HB   ALA   8          1HB       ALA   8  -8.823  -9.285   8.598
   53   2HB   ALA   8          2HB       ALA   8  -7.344  -9.409   9.581
   54   3HB   ALA   8          3HB       ALA   8  -7.793  -7.854   8.842
   55    H    ASN   9           H        ASN   9  -4.988 -10.751   8.221
   56    HA   ASN   9           HA       ASN   9  -4.925 -12.975   8.641
   57   1HB   ASN   9          1HB       ASN   9  -7.471 -13.107   8.093
   58   2HB   ASN   9          2HB       ASN   9  -6.973 -13.501   6.441
   59   1HD2  ASN   9          1HD2      ASN   9  -5.125 -15.191   6.405
   60   2HD2  ASN   9          2HD2      ASN   9  -5.378 -16.614   7.360
   61    H    GLN  10           H        GLN  10  -5.427 -11.515   5.400
   62    HA   GLN  10           HA       GLN  10  -4.090 -13.358   3.877
   63   1HB   GLN  10          1HB       GLN  10  -4.633 -11.907   2.256
   64   2HB   GLN  10          2HB       GLN  10  -5.263 -10.822   3.508
   65   1HG   GLN  10          1HG       GLN  10  -3.084  -9.728   3.701
   66   2HG   GLN  10          2HG       GLN  10  -2.355 -10.882   2.575
   67   1HE2  GLN  10          1HE2      GLN  10  -2.373 -10.457   0.486
   68   2HE2  GLN  10          2HE2      GLN  10  -3.247  -9.185  -0.301
   69    H    CYS  11           H        CYS  11  -2.875 -10.751   5.990
   70    HA   CYS  11           HA       CYS  11  -0.300 -10.569   5.037
   71   1HB   CYS  11          1HB       CYS  11  -1.692  -9.968   7.566
   72   2HB   CYS  11          2HB       CYS  11   0.057 -10.178   7.698
   73    H    ALA  12           H        ALA  12  -1.983 -13.236   6.419
   74    HA   ALA  12           HA       ALA  12   0.543 -14.508   7.213
   75   1HB   ALA  12          1HB       ALA  12  -1.492 -16.134   8.118
   76   2HB   ALA  12          2HB       ALA  12  -0.680 -14.878   9.084
   77   3HB   ALA  12          3HB       ALA  12  -2.218 -14.516   8.264
   78    H    VAL  13           H        VAL  13  -0.458 -14.065   4.420
   79    HA   VAL  13           HA       VAL  13  -1.744 -16.136   3.275
   80    HB   VAL  13           HB       VAL  13  -0.187 -13.997   2.469
   81   1HG1  VAL  13          1HG1      VAL  13   0.979 -16.545   1.295
   82   2HG1  VAL  13          2HG1      VAL  13   1.327 -14.888   0.746
   83   3HG1  VAL  13          3HG1      VAL  13   1.817 -15.407   2.377
   84   1HG2  VAL  13          1HG2      VAL  13  -0.948 -15.468   0.150
   85   2HG2  VAL  13          2HG2      VAL  13  -2.178 -15.763   1.404
   86   3HG2  VAL  13          3HG2      VAL  13  -1.783 -14.096   0.917
   87    HA   PRO  14           HA       PRO  14   0.702 -19.685   3.597
   88   1HB   PRO  14          1HB       PRO  14   0.498 -20.894   1.156
   89   2HB   PRO  14          2HB       PRO  14  -0.770 -20.969   2.377
   90   1HG   PRO  14          1HG       PRO  14  -0.604 -19.354  -0.087
   91   2HG   PRO  14          2HG       PRO  14  -2.063 -19.788   0.875
   92   1HD   PRO  14          1HD       PRO  14  -0.683 -17.282   0.765
   93   2HD   PRO  14          2HD       PRO  14  -2.015 -17.705   1.848
   94    H    ALA  15           H        ALA  15   2.070 -17.191   2.749
   95    HA   ALA  15           HA       ALA  15   4.037 -16.550   1.932
   96   1HB   ALA  15          1HB       ALA  15   4.388 -18.494   3.861
   97   2HB   ALA  15          2HB       ALA  15   5.401 -19.101   2.529
   98   3HB   ALA  15          3HB       ALA  15   5.681 -17.471   3.190
   99    H    LYS  16           H        LYS  16   2.895 -16.762  -0.269
  100    HA   LYS  16           HA       LYS  16   4.578 -17.509  -2.198
  101   1HB   LYS  16          1HB       LYS  16   3.431 -19.749  -2.939
  102   2HB   LYS  16          2HB       LYS  16   4.786 -19.756  -1.799
  103   1HG   LYS  16          1HG       LYS  16   3.492 -20.698  -0.215
  104   2HG   LYS  16          2HG       LYS  16   2.297 -19.396  -0.348
  105   1HD   LYS  16          1HD       LYS  16   2.468 -21.817  -2.191
  106   2HD   LYS  16          2HD       LYS  16   1.348 -21.678  -0.824
  107   1HE   LYS  16          1HE       LYS  16   0.666 -19.412  -2.033
  108   2HE   LYS  16          2HE       LYS  16   1.359 -20.197  -3.461
  109   1HZ   LYS  16          1HZ       LYS  16  -0.160 -21.959  -3.214
  110   2HZ   LYS  16          2HZ       LYS  16  -0.665 -21.453  -1.746
  111   3HZ   LYS  16          3HZ       LYS  16  -1.037 -20.588  -3.080
  112    H    ASP  17           H        ASP  17   2.680 -15.528  -1.655
  113    HA   ASP  17           HA       ASP  17   1.225 -15.655  -4.079
  114   1HB   ASP  17          1HB       ASP  17  -0.215 -16.865  -2.303
  115   2HB   ASP  17          2HB       ASP  17  -0.409 -15.281  -1.538
  116    H    ARG  18           H        ARG  18   3.201 -14.116  -2.123
  117    HA   ARG  18           HA       ARG  18   1.775 -11.641  -1.843
  118   1HB   ARG  18          1HB       ARG  18   4.688 -12.282  -1.197
  119   2HB   ARG  18          2HB       ARG  18   3.776 -10.874  -0.625
  120   1HG   ARG  18          1HG       ARG  18   2.660 -12.089   0.969
  121   2HG   ARG  18          2HG       ARG  18   2.582 -13.552  -0.030
  122   1HD   ARG  18          1HD       ARG  18   4.864 -14.124   0.499
  123   2HD   ARG  18          2HD       ARG  18   5.169 -12.543   1.236
  124    HE   ARG  18           HE       ARG  18   2.990 -14.062   2.490
  125   1HH1  ARG  18          1HH1      ARG  18   6.453 -13.434   2.478
  126   2HH1  ARG  18          2HH1      ARG  18   6.681 -13.959   4.114
  127   1HH2  ARG  18          1HH2      ARG  18   3.292 -14.754   4.646
  128   2HH2  ARG  18          2HH2      ARG  18   4.872 -14.714   5.355
  129    H    VAL  19           H        VAL  19   3.237  -9.570  -2.458
  130    HA   VAL  19           HA       VAL  19   4.057 -10.014  -5.234
  131    HB   VAL  19           HB       VAL  19   3.448  -7.379  -3.908
  132   1HG1  VAL  19          1HG1      VAL  19   4.244  -6.739  -5.925
  133   2HG1  VAL  19          2HG1      VAL  19   3.982  -8.340  -6.654
  134   3HG1  VAL  19          3HG1      VAL  19   2.624  -7.200  -6.499
  135   1HG2  VAL  19          1HG2      VAL  19   1.500  -8.771  -3.510
  136   2HG2  VAL  19          2HG2      VAL  19   1.136  -7.589  -4.791
  137   3HG2  VAL  19          3HG2      VAL  19   1.478  -9.284  -5.215
  138    H    ASP  20           H        ASP  20   5.611 -10.497  -2.600
  139    HA   ASP  20           HA       ASP  20   7.505  -9.871  -1.634
  140   1HB   ASP  20          1HB       ASP  20   8.524 -11.334  -3.109
  141   2HB   ASP  20          2HB       ASP  20   8.006 -10.430  -4.542
  142    H    CYS  21           H        CYS  21   7.070  -7.647  -0.942
  143    HA   CYS  21           HA       CYS  21   7.077  -5.426  -2.506
  144   1HB   CYS  21          1HB       CYS  21   6.776  -5.891   0.113
  145   2HB   CYS  21          2HB       CYS  21   8.390  -5.174   0.145
  146    H    GLY  22           H        GLY  22   9.801  -7.367  -1.224
  147   1HA   GLY  22          1HA       GLY  22  12.020  -7.289  -1.582
  148   2HA   GLY  22          2HA       GLY  22  11.619  -6.676  -3.175
  149    H    TYR  23           H        TYR  23  11.518  -5.406   0.241
  150    HA   TYR  23           HA       TYR  23  12.409  -2.827  -0.758
  151   1HB   TYR  23          1HB       TYR  23  10.931  -4.048   1.482
  152   2HB   TYR  23          2HB       TYR  23  12.194  -2.983   2.110
  153    HD1  TYR  23           HD1      TYR  23   8.929  -3.182   0.570
  154    HD2  TYR  23           HD2      TYR  23  12.202  -0.551   1.389
  155    HE1  TYR  23           HE1      TYR  23   7.425  -1.172   0.163
  156    HE2  TYR  23           HE2      TYR  23  10.688   1.450   0.979
  157    HH   TYR  23           HH       TYR  23   8.698   2.130   0.510
  158    HA   PRO  24           HA       PRO  24  16.509  -3.528   0.470
  159   1HB   PRO  24          1HB       PRO  24  17.447  -0.966   0.349
  160   2HB   PRO  24          2HB       PRO  24  17.296  -2.003  -1.066
  161   1HG   PRO  24          1HG       PRO  24  15.598   0.233  -0.165
  162   2HG   PRO  24          2HG       PRO  24  15.726  -0.486  -1.810
  163   1HD   PRO  24          1HD       PRO  24  13.638  -0.816   0.121
  164   2HD   PRO  24          2HD       PRO  24  13.796  -1.673  -1.418
  165    H    HIS  25           H        HIS  25  14.209  -2.162   2.336
  166    HA   HIS  25           HA       HIS  25  16.112  -2.053   4.558
  167   1HB   HIS  25          1HB       HIS  25  14.003  -0.099   3.743
  168   2HB   HIS  25          2HB       HIS  25  14.313  -0.335   5.467
  169    HD1  HIS  25           HD1      HIS  25  17.032  -0.071   6.100
  170    HD2  HIS  25           HD2      HIS  25  15.626   1.754   2.595
  171    HE1  HIS  25           HE1      HIS  25  18.757   1.701   5.476
  172    HE2  HIS  25           HE2      HIS  25  17.867   2.751   3.285
  173    H    VAL  26           H        VAL  26  14.023  -4.017   3.203
  174    HA   VAL  26           HA       VAL  26  11.831  -4.467   4.645
  175    HB   VAL  26           HB       VAL  26  12.316  -5.922   2.899
  176   1HG1  VAL  26          1HG1      VAL  26  14.396  -6.479   2.323
  177   2HG1  VAL  26          2HG1      VAL  26  14.994  -5.739   3.827
  178   3HG1  VAL  26          3HG1      VAL  26  14.567  -7.467   3.794
  179   1HG2  VAL  26          1HG2      VAL  26  11.864  -8.033   3.771
  180   2HG2  VAL  26          2HG2      VAL  26  12.916  -7.790   5.185
  181   3HG2  VAL  26          3HG2      VAL  26  11.349  -6.953   5.088
  182    H    THR  27           H        THR  27  11.280  -4.727   6.749
  183    HA   THR  27           HA       THR  27  12.925  -6.184   8.552
  184    HB   THR  27           HB       THR  27  13.501  -3.376   8.196
  185    HG1  THR  27           HG1      THR  27  15.221  -4.185   9.406
  186   1HG2  THR  27          1HG2      THR  27  13.259  -3.572  11.066
  187   2HG2  THR  27          2HG2      THR  27  12.546  -2.343   9.993
  188   3HG2  THR  27          3HG2      THR  27  11.643  -3.832  10.365
  189    HA   PRO  28           HA       PRO  28   9.113  -6.498  10.491
  190   1HB   PRO  28          1HB       PRO  28   9.819  -7.217  13.030
  191   2HB   PRO  28          2HB       PRO  28   9.780  -8.351  11.682
  192   1HG   PRO  28          1HG       PRO  28  12.076  -7.048  13.001
  193   2HG   PRO  28          2HG       PRO  28  12.060  -8.533  11.983
  194   1HD   PRO  28          1HD       PRO  28  12.952  -5.904  11.282
  195   2HD   PRO  28          2HD       PRO  28  12.807  -7.292  10.197
  196    H    LYS  29           H        LYS  29   9.610  -3.899  10.082
  197    HA   LYS  29           HA       LYS  29   8.001  -2.688  11.941
  198   1HB   LYS  29          1HB       LYS  29  10.322  -3.247  13.229
  199   2HB   LYS  29          2HB       LYS  29  10.673  -1.619  12.623
  200   1HG   LYS  29          1HG       LYS  29   9.375  -0.740  14.236
  201   2HG   LYS  29          2HG       LYS  29   7.974  -1.646  13.638
  202   1HD   LYS  29          1HD       LYS  29   9.347  -3.619  14.952
  203   2HD   LYS  29          2HD       LYS  29   9.790  -2.213  15.937
  204   1HE   LYS  29          1HE       LYS  29   7.511  -1.738  16.458
  205   2HE   LYS  29          2HE       LYS  29   6.902  -2.786  15.166
  206   1HZ   LYS  29          1HZ       LYS  29   7.605  -4.662  16.371
  207   2HZ   LYS  29          2HZ       LYS  29   8.437  -3.777  17.462
  208   3HZ   LYS  29          3HZ       LYS  29   6.805  -3.720  17.438
  209    H    GLU  30           H        GLU  30  10.370  -2.750   9.403
  210    HA   GLU  30           HA       GLU  30   9.924   0.043   8.814
  211   1HB   GLU  30          1HB       GLU  30  11.965  -1.971   8.177
  212   2HB   GLU  30          2HB       GLU  30  11.503  -1.006   6.764
  213   1HG   GLU  30          1HG       GLU  30  12.597   0.804   7.558
  214   2HG   GLU  30          2HG       GLU  30  11.817   0.674   9.142
  215    H    CYS  31           H        CYS  31   9.419  -3.251   7.410
  216    HA   CYS  31           HA       CYS  31   8.341  -2.485   5.005
  217   1HB   CYS  31          1HB       CYS  31   7.779  -4.882   6.745
  218   2HB   CYS  31          2HB       CYS  31   7.128  -4.697   5.114
  219    H    ASN  32           H        ASN  32   6.643  -3.304   8.126
  220    HA   ASN  32           HA       ASN  32   4.129  -2.646   7.232
  221   1HB   ASN  32          1HB       ASN  32   5.485  -2.953   9.889
  222   2HB   ASN  32          2HB       ASN  32   3.938  -2.094   9.908
  223   1HD2  ASN  32          1HD2      ASN  32   5.378  -4.890   8.226
  224   2HD2  ASN  32          2HD2      ASN  32   4.082  -6.005   8.506
  225    H    ASN  33           H        ASN  33   6.868  -0.667   7.685
  226    HA   ASN  33           HA       ASN  33   5.350   1.631   8.541
  227   1HB   ASN  33          1HB       ASN  33   7.871   0.875   9.151
  228   2HB   ASN  33          2HB       ASN  33   8.245   1.825   7.705
  229   1HD2  ASN  33          1HD2      ASN  33   9.421   3.032   9.431
  230   2HD2  ASN  33          2HD2      ASN  33   8.594   4.320  10.242
  231    H    ARG  34           H        ARG  34   7.102   0.217   5.740
  232    HA   ARG  34           HA       ARG  34   6.826   2.581   4.191
  233   1HB   ARG  34          1HB       ARG  34   7.428  -0.161   3.050
  234   2HB   ARG  34          2HB       ARG  34   8.049   1.411   2.516
  235   1HG   ARG  34          1HG       ARG  34   8.854   1.126   5.219
  236   2HG   ARG  34          2HG       ARG  34   9.156  -0.451   4.467
  237   1HD   ARG  34          1HD       ARG  34  10.858   0.366   3.192
  238   2HD   ARG  34          2HD       ARG  34   9.983   1.852   2.791
  239    HE   ARG  34           HE       ARG  34  10.809   1.862   5.560
  240   1HH1  ARG  34          1HH1      ARG  34  12.053   2.288   2.296
  241   2HH1  ARG  34          2HH1      ARG  34  13.361   3.310   2.791
  242   1HH2  ARG  34          1HH2      ARG  34  12.535   3.209   6.213
  243   2HH2  ARG  34          2HH2      ARG  34  13.638   3.836   5.034
  244    H    GLY  35           H        GLY  35   4.942  -0.287   4.912
  245   1HA   GLY  35          1HA       GLY  35   2.572  -0.061   4.345
  246   2HA   GLY  35          2HA       GLY  35   3.065   0.400   2.728
  247    H    CYS  36           H        CYS  36   5.006  -2.038   4.365
  248    HA   CYS  36           HA       CYS  36   3.670  -4.082   2.742
  249   1HB   CYS  36          1HB       CYS  36   6.612  -3.922   3.402
  250   2HB   CYS  36          2HB       CYS  36   5.820  -5.169   2.435
  251    H    CYS  37           H        CYS  37   3.805  -6.307   3.717
  252    HA   CYS  37           HA       CYS  37   3.742  -6.082   6.623
  253   1HB   CYS  37          1HB       CYS  37   1.885  -7.089   4.963
  254   2HB   CYS  37          2HB       CYS  37   2.813  -8.558   5.279
  255    H    PHE  38           H        PHE  38   5.396  -6.992   7.811
  256    HA   PHE  38           HA       PHE  38   7.432  -8.431   6.347
  257   1HB   PHE  38          1HB       PHE  38   7.735  -6.532   8.090
  258   2HB   PHE  38          2HB       PHE  38   7.196  -7.681   9.319
  259    HD1  PHE  38           HD1      PHE  38   9.880  -6.852   6.943
  260    HD2  PHE  38           HD2      PHE  38   8.667  -9.397  10.114
  261    HE1  PHE  38           HE1      PHE  38  12.242  -7.662   7.196
  262    HE2  PHE  38           HE2      PHE  38  11.029 -10.208  10.368
  263    HZ   PHE  38           HZ       PHE  38  12.788  -9.331   8.905
  264    H    ASP  39           H        ASP  39   7.459 -10.620   6.206
  265    HA   ASP  39           HA       ASP  39   5.668 -12.114   7.814
  266   1HB   ASP  39          1HB       ASP  39   5.856 -13.160   5.784
  267   2HB   ASP  39          2HB       ASP  39   7.509 -12.588   5.519
  268    H    SER  40           H        SER  40   9.095 -13.007   7.062
  269    HA   SER  40           HA       SER  40  10.850 -13.260   8.382
  270   1HB   SER  40          1HB       SER  40   9.651 -11.553   9.966
  271   2HB   SER  40          2HB       SER  40   9.232 -12.982  10.926
  272    HG   SER  40           HG       SER  40  11.702 -13.416  10.669
  273    H    ARG  41           H        ARG  41   7.723 -14.780   8.835
  274    HA   ARG  41           HA       ARG  41   8.514 -16.892  10.441
  275   1HB   ARG  41          1HB       ARG  41   6.382 -17.057   8.278
  276   2HB   ARG  41          2HB       ARG  41   6.404 -17.900   9.836
  277   1HG   ARG  41          1HG       ARG  41   6.555 -15.227  10.577
  278   2HG   ARG  41          2HG       ARG  41   5.485 -15.167   9.165
  279   1HD   ARG  41          1HD       ARG  41   4.257 -15.486  11.327
  280   2HD   ARG  41          2HD       ARG  41   3.983 -16.818  10.194
  281    HE   ARG  41           HE       ARG  41   5.133 -18.257  11.652
  282   1HH1  ARG  41          1HH1      ARG  41   5.698 -14.916  12.604
  283   2HH1  ARG  41          2HH1      ARG  41   6.476 -15.336  14.092
  284   1HH2  ARG  41          1HH2      ARG  41   6.160 -18.812  13.617
  285   2HH2  ARG  41          2HH2      ARG  41   6.740 -17.568  14.673
  286    H    ILE  42           H        ILE  42   8.339 -16.473   6.847
  287    HA   ILE  42           HA       ILE  42   9.900 -18.951   6.603
  288    HB   ILE  42           HB       ILE  42   8.256 -17.816   4.375
  289   1HG1  ILE  42          1HG1      ILE  42   7.249 -19.216   6.818
  290   2HG1  ILE  42          2HG1      ILE  42   6.521 -17.890   5.894
  291   1HG2  ILE  42          1HG2      ILE  42   8.790 -20.707   5.040
  292   2HG2  ILE  42          2HG2      ILE  42   8.350 -19.973   3.480
  293   3HG2  ILE  42          3HG2      ILE  42   9.973 -19.712   4.159
  294   1HD1  ILE  42          1HD1      ILE  42   6.468 -20.854   5.386
  295   2HD1  ILE  42          2HD1      ILE  42   5.172 -19.648   5.200
  296   3HD1  ILE  42          3HD1      ILE  42   6.458 -19.770   3.975
  297    HA   PRO  43           HA       PRO  43  12.860 -15.995   5.271
  298   1HB   PRO  43          1HB       PRO  43  15.036 -17.634   5.479
  299   2HB   PRO  43          2HB       PRO  43  14.424 -16.670   6.822
  300   1HG   PRO  43          1HG       PRO  43  14.153 -19.558   6.283
  301   2HG   PRO  43          2HG       PRO  43  13.960 -18.683   7.846
  302   1HD   PRO  43          1HD       PRO  43  11.924 -19.749   6.137
  303   2HD   PRO  43          2HD       PRO  43  11.678 -18.759   7.580
  304    H    GLY  44           H        GLY  44  11.635 -18.673   3.805
  305   1HA   GLY  44          1HA       GLY  44  13.424 -18.491   1.494
  306   2HA   GLY  44          2HA       GLY  44  12.197 -19.704   1.797
  307    H    VAL  45           H        VAL  45  10.688 -16.883   2.683
  308    HA   VAL  45           HA       VAL  45   9.744 -16.395  -0.058
  309    HB   VAL  45           HB       VAL  45   7.572 -16.416   0.622
  310   1HG1  VAL  45          1HG1      VAL  45   8.969 -18.310   2.537
  311   2HG1  VAL  45          2HG1      VAL  45   7.213 -18.308   2.240
  312   3HG1  VAL  45          3HG1      VAL  45   8.341 -18.672   0.911
  313   1HG2  VAL  45          1HG2      VAL  45   6.726 -15.907   2.816
  314   2HG2  VAL  45          2HG2      VAL  45   8.359 -15.981   3.520
  315   3HG2  VAL  45          3HG2      VAL  45   7.935 -14.674   2.389
  316    HA   PRO  46           HA       PRO  46  10.224 -12.157   0.733
  317   1HB   PRO  46          1HB       PRO  46   7.866 -10.921   0.126
  318   2HB   PRO  46          2HB       PRO  46   9.010 -11.468  -1.097
  319   1HG   PRO  46          1HG       PRO  46   6.453 -12.655  -0.225
  320   2HG   PRO  46          2HG       PRO  46   7.354 -12.930  -1.760
  321   1HD   PRO  46          1HD       PRO  46   7.151 -14.654   0.517
  322   2HD   PRO  46          2HD       PRO  46   8.178 -14.897  -0.902
  323    H    TRP  47           H        TRP  47  10.786 -11.341   2.642
  324    HA   TRP  47           HA       TRP  47   8.793 -11.548   4.740
  325   1HB   TRP  47          1HB       TRP  47  11.316 -10.242   5.392
  326   2HB   TRP  47          2HB       TRP  47  10.504 -11.608   6.160
  327    HD1  TRP  47           HD1      TRP  47  10.976 -14.089   4.857
  328    HE1  TRP  47           HE1      TRP  47  13.133 -15.050   3.679
  329    HE3  TRP  47           HE3      TRP  47  13.233  -9.588   4.148
  330    HZ2  TRP  47           HZ2      TRP  47  15.488 -13.846   2.607
  331    HZ3  TRP  47           HZ3      TRP  47  15.460  -9.569   3.029
  332    HH2  TRP  47           HH2      TRP  47  16.586 -11.602   2.268
  333    H    CYS  48           H        CYS  48   8.386  -9.764   2.373
  334    HA   CYS  48           HA       CYS  48   7.582  -7.479   3.796
  335   1HB   CYS  48          1HB       CYS  48  10.080  -7.096   3.533
  336   2HB   CYS  48          2HB       CYS  48   9.775  -6.910   1.805
  337    H    PHE  49           H        PHE  49   5.561  -7.659   2.819
  338    HA   PHE  49           HA       PHE  49   5.529  -7.282  -0.070
  339   1HB   PHE  49          1HB       PHE  49   3.434  -8.996   0.278
  340   2HB   PHE  49          2HB       PHE  49   5.056  -9.589  -0.092
  341    HD1  PHE  49           HD1      PHE  49   6.560  -9.862   2.135
  342    HD2  PHE  49           HD2      PHE  49   2.322 -10.034   1.986
  343    HE1  PHE  49           HE1      PHE  49   6.539 -11.198   4.259
  344    HE2  PHE  49           HE2      PHE  49   2.302 -11.369   4.111
  345    HZ   PHE  49           HZ       PHE  49   4.411 -11.934   5.223
  346    H    LYS  50           H        LYS  50   2.807  -7.329  -0.529
  347    HA   LYS  50           HA       LYS  50   1.783  -5.369   1.406
  348   1HB   LYS  50          1HB       LYS  50   0.563  -4.701  -0.950
  349   2HB   LYS  50          2HB       LYS  50   1.966  -3.875  -0.250
  350   1HG   LYS  50          1HG       LYS  50   2.485  -6.324  -1.895
  351   2HG   LYS  50          2HG       LYS  50   1.957  -4.875  -2.767
  352   1HD   LYS  50          1HD       LYS  50   4.391  -5.213  -0.975
  353   2HD   LYS  50          2HD       LYS  50   4.375  -4.835  -2.707
  354   1HE   LYS  50          1HE       LYS  50   3.719  -3.070  -0.344
  355   2HE   LYS  50          2HE       LYS  50   4.782  -2.730  -1.719
  356   1HZ   LYS  50          1HZ       LYS  50   2.989  -1.586  -2.363
  357   2HZ   LYS  50          2HZ       LYS  50   2.468  -3.027  -2.928
  358   3HZ   LYS  50          3HZ       LYS  50   1.926  -2.470  -1.492
  359    HA   PRO  51           HA       PRO  51  -1.051  -8.887   1.012
  360   1HB   PRO  51          1HB       PRO  51  -1.169  -9.565   3.656
  361   2HB   PRO  51          2HB       PRO  51  -0.088 -10.349   2.507
  362   1HG   PRO  51          1HG       PRO  51   0.488  -8.327   4.576
  363   2HG   PRO  51          2HG       PRO  51   1.630  -9.454   3.759
  364   1HD   PRO  51          1HD       PRO  51   1.274  -6.648   3.313
  365   2HD   PRO  51          2HD       PRO  51   2.297  -7.745   2.375
  366    H    LEU  52           H        LEU  52  -1.782  -8.081   4.244
  367    HA   LEU  52           HA       LEU  52  -4.224  -6.841   3.272
  368   1HB   LEU  52          1HB       LEU  52  -5.210  -7.582   5.122
  369   2HB   LEU  52          2HB       LEU  52  -3.860  -8.729   5.116
  370    HG   LEU  52           HG       LEU  52  -2.835  -6.641   6.572
  371   1HD1  LEU  52          1HD1      LEU  52  -4.388  -5.351   7.488
  372   2HD1  LEU  52          2HD1      LEU  52  -5.617  -6.157   6.484
  373   3HD1  LEU  52          3HD1      LEU  52  -5.254  -6.775   8.113
  374   1HD2  LEU  52          1HD2      LEU  52  -4.248  -8.510   8.290
  375   2HD2  LEU  52          2HD2      LEU  52  -3.439  -9.334   6.937
  376   3HD2  LEU  52          3HD2      LEU  52  -2.502  -8.287   8.029
  377    H    GLN  53           H        GLN  53  -1.851  -5.342   2.802
  378    HA   GLN  53           HA       GLN  53  -1.179  -3.601   4.796
  379   1HB   GLN  53          1HB       GLN  53  -1.330  -3.113   1.796
  380   2HB   GLN  53          2HB       GLN  53  -0.443  -2.088   2.938
  381   1HG   GLN  53          1HG       GLN  53   0.072  -5.015   2.274
  382   2HG   GLN  53          2HG       GLN  53   1.130  -3.641   1.913
  383   1HE2  GLN  53          1HE2      GLN  53  -0.296  -5.627   4.443
  384   2HE2  GLN  53          2HE2      GLN  53   0.884  -5.328   5.675
  385    H    GLU  54           H        GLU  54  -4.158  -3.887   3.008
  386    HA   GLU  54           HA       GLU  54  -5.106  -1.407   2.791
  387   1HB   GLU  54          1HB       GLU  54  -7.253  -2.338   2.771
  388   2HB   GLU  54          2HB       GLU  54  -6.230  -3.732   2.380
  389   1HG   GLU  54          1HG       GLU  54  -7.583  -4.637   4.036
  390   2HG   GLU  54          2HG       GLU  54  -6.230  -4.061   5.025
  391    H    ALA  55           H        ALA  55  -4.245  -3.059   5.758
  392    HA   ALA  55           HA       ALA  55  -5.812  -2.031   7.674
  393   1HB   ALA  55          1HB       ALA  55  -4.202  -3.157   8.771
  394   2HB   ALA  55          2HB       ALA  55  -3.059  -2.953   7.423
  395   3HB   ALA  55          3HB       ALA  55  -3.202  -1.689   8.666
  396    H    GLU  56           H        GLU  56  -2.764  -0.338   6.630
  397    HA   GLU  56           HA       GLU  56  -4.192   2.141   7.205
  398   1HB   GLU  56          1HB       GLU  56  -1.267   1.428   7.613
  399   2HB   GLU  56          2HB       GLU  56  -1.877   3.090   7.707
  400   1HG   GLU  56          1HG       GLU  56  -3.626   1.968   9.386
  401   2HG   GLU  56          2HG       GLU  56  -2.350   0.754   9.557
  402    H    CYS  57           H        CYS  57  -3.704   0.365   4.676
  403    HA   CYS  57           HA       CYS  57  -2.245   2.308   3.074
  404   1HB   CYS  57          1HB       CYS  57  -1.444   0.152   2.693
  405   2HB   CYS  57          2HB       CYS  57  -3.062  -0.553   2.634
  406    H    THR  58           H        THR  58  -4.874   0.138   1.957
  407    HA   THR  58           HA       THR  58  -6.154   1.823   0.319
  408    HB   THR  58           HB       THR  58  -6.576  -0.705   1.291
  409    HG1  THR  58           HG1      THR  58  -8.664  -0.343  -0.022
  410   1HG2  THR  58          1HG2      THR  58  -8.675  -0.881   2.402
  411   2HG2  THR  58          2HG2      THR  58  -7.892   0.467   3.263
  412   3HG2  THR  58          3HG2      THR  58  -9.118   0.799   2.016
  413    H    PHE  59           H        PHE  59  -6.275   1.917   3.872
  414    HA   PHE  59           HA       PHE  59  -8.424   3.277   4.511
  415   1HB   PHE  59          1HB       PHE  59  -5.997   2.827   5.631
  416   2HB   PHE  59          2HB       PHE  59  -5.742   4.525   5.222
  417    HD1  PHE  59           HD1      PHE  59  -7.773   6.096   5.981
  418    HD2  PHE  59           HD2      PHE  59  -6.800   2.350   7.722
  419    HE1  PHE  59           HE1      PHE  59  -8.959   6.768   8.088
  420    HE2  PHE  59           HE2      PHE  59  -7.987   3.022   9.830
  421    HZ   PHE  59           HZ       PHE  59  -9.052   5.223   9.988
  422   1H    GLU   1           H1       GLU   1 -22.758  -1.850  -3.386
  423    HA   GLU   1           HA       GLU   1 -19.914  -2.413  -3.047
  424   1HB   GLU   1          1HB       GLU   1 -21.793  -2.941  -5.300
  425   2HB   GLU   1          2HB       GLU   1 -20.178  -2.369  -5.755
  426   1HG   GLU   1          1HG       GLU   1 -19.548  -4.536  -5.561
  427   2HG   GLU   1          2HG       GLU   1 -19.626  -4.285  -3.811
  428    H    GLU   2           H        GLU   2 -20.274  -0.110  -2.004
  429    HA   GLU   2           HA       GLU   2 -20.507   1.933  -4.018
  430   1HB   GLU   2          1HB       GLU   2 -20.232   2.006  -0.994
  431   2HB   GLU   2          2HB       GLU   2 -20.280   3.472  -1.988
  432   1HG   GLU   2          1HG       GLU   2 -22.507   3.046  -2.694
  433   2HG   GLU   2          2HG       GLU   2 -22.443   1.348  -2.199
  434    H    TYR   3           H        TYR   3 -18.487   1.157  -5.142
  435    HA   TYR   3           HA       TYR   3 -16.016   1.626  -3.707
  436   1HB   TYR   3          1HB       TYR   3 -17.038   0.558  -6.359
  437   2HB   TYR   3          2HB       TYR   3 -15.358   1.104  -6.313
  438    HD1  TYR   3           HD1      TYR   3 -17.668  -1.007  -4.224
  439    HD2  TYR   3           HD2      TYR   3 -13.775  -0.540  -5.937
  440    HE1  TYR   3           HE1      TYR   3 -16.971  -3.259  -3.272
  441    HE2  TYR   3           HE2      TYR   3 -13.092  -2.794  -4.980
  442    HH   TYR   3           HH       TYR   3 -13.682  -4.281  -3.286
  443    H    VAL   4           H        VAL   4 -16.268   3.944  -3.305
  444    HA   VAL   4           HA       VAL   4 -15.755   5.497  -5.746
  445    HB   VAL   4           HB       VAL   4 -17.283   6.355  -3.281
  446   1HG1  VAL   4          1HG1      VAL   4 -17.802   8.133  -5.367
  447   2HG1  VAL   4          2HG1      VAL   4 -16.761   8.425  -3.953
  448   3HG1  VAL   4          3HG1      VAL   4 -16.052   7.832  -5.474
  449   1HG2  VAL   4          1HG2      VAL   4 -18.532   4.725  -4.658
  450   2HG2  VAL   4          2HG2      VAL   4 -19.272   6.344  -4.694
  451   3HG2  VAL   4          3HG2      VAL   4 -18.310   5.772  -6.080
  452    H    GLY   5           H        GLY   5 -15.486   5.627  -2.118
  453   1HA   GLY   5          1HA       GLY   5 -13.230   7.358  -2.187
  454   2HA   GLY   5          2HA       GLY   5 -13.864   6.485  -0.805
  455    H    LEU   6           H        LEU   6 -13.401   4.301  -3.390
  456    HA   LEU   6           HA       LEU   6 -10.603   3.830  -2.783
  457   1HB   LEU   6          1HB       LEU   6 -11.076   1.430  -2.325
  458   2HB   LEU   6          2HB       LEU   6 -11.550   2.562  -1.047
  459    HG   LEU   6           HG       LEU   6 -13.871   2.327  -1.619
  460   1HD1  LEU   6          1HD1      LEU   6 -14.411   0.513  -3.439
  461   2HD1  LEU   6          2HD1      LEU   6 -14.090   2.202  -3.903
  462   3HD1  LEU   6          3HD1      LEU   6 -12.812   0.973  -4.073
  463   1HD2  LEU   6          1HD2      LEU   6 -14.263   0.084  -0.961
  464   2HD2  LEU   6          2HD2      LEU   6 -12.718  -0.467  -1.651
  465   3HD2  LEU   6          3HD2      LEU   6 -12.726   0.571  -0.206
  466    H    SER   7           H        SER   7 -12.607   4.649  -5.031
  467    HA   SER   7           HA       SER   7 -12.322   2.448  -6.832
  468   1HB   SER   7          1HB       SER   7 -14.233   4.282  -6.620
  469   2HB   SER   7          2HB       SER   7 -13.187   5.196  -7.721
  470    HG   SER   7           HG       SER   7 -14.043   2.478  -8.218
  471    H    ALA   8           H        ALA   8 -11.458   3.043  -9.173
  472    HA   ALA   8           HA       ALA   8  -8.748   3.785  -8.856
  473   1HB   ALA   8          1HB       ALA   8  -9.640   2.111 -10.490
  474   2HB   ALA   8          2HB       ALA   8 -10.398   3.445 -11.393
  475   3HB   ALA   8          3HB       ALA   8  -8.626   3.360 -11.251
  476    H    ASN   9           H        ASN   9 -11.576   5.635  -8.938
  477    HA   ASN   9           HA       ASN   9 -10.351   7.787 -10.419
  478   1HB   ASN   9          1HB       ASN   9 -13.007   6.915 -10.017
  479   2HB   ASN   9          2HB       ASN   9 -12.902   8.413  -9.080
  480   1HD2  ASN   9          1HD2      ASN   9 -11.822  10.258 -10.210
  481   2HD2  ASN   9          2HD2      ASN   9 -12.197  10.525 -11.880
  482    H    GLN  10           H        GLN  10 -10.453   6.515  -7.257
  483    HA   GLN  10           HA       GLN  10 -10.775   8.854  -5.764
  484   1HB   GLN  10          1HB       GLN  10 -10.576   6.150  -5.233
  485   2HB   GLN  10          2HB       GLN  10  -9.057   6.768  -4.561
  486   1HG   GLN  10          1HG       GLN  10 -11.099   8.605  -3.803
  487   2HG   GLN  10          2HG       GLN  10 -11.757   6.988  -3.511
  488   1HE2  GLN  10          1HE2      GLN  10  -9.316   5.661  -3.020
  489   2HE2  GLN  10          2HE2      GLN  10  -8.680   6.181  -1.496
  490    H    CYS  11           H        CYS  11  -8.007   7.306  -7.390
  491    HA   CYS  11           HA       CYS  11  -6.054   8.863  -6.048
  492   1HB   CYS  11          1HB       CYS  11  -5.414   6.756  -6.924
  493   2HB   CYS  11          2HB       CYS  11  -5.982   7.167  -8.544
  494    H    ALA  12           H        ALA  12  -8.547   9.721  -8.072
  495    HA   ALA  12           HA       ALA  12  -6.954  11.814  -9.387
  496   1HB   ALA  12          1HB       ALA  12  -9.549  11.579 -10.549
  497   2HB   ALA  12          2HB       ALA  12  -7.978  11.171 -11.278
  498   3HB   ALA  12          3HB       ALA  12  -8.894   9.933 -10.384
  499    H    VAL  13           H        VAL  13  -8.426  11.406  -6.592
  500    HA   VAL  13           HA       VAL  13 -10.614  12.986  -6.378
  501    HB   VAL  13           HB       VAL  13  -8.803  11.762  -4.693
  502   1HG1  VAL  13          1HG1      VAL  13  -8.224  13.443  -2.989
  503   2HG1  VAL  13          2HG1      VAL  13  -7.442  13.793  -4.549
  504   3HG1  VAL  13          3HG1      VAL  13  -8.869  14.727  -4.038
  505   1HG2  VAL  13          1HG2      VAL  13 -11.457  12.842  -4.614
  506   2HG2  VAL  13          2HG2      VAL  13 -10.743  11.548  -3.620
  507   3HG2  VAL  13          3HG2      VAL  13 -10.631  13.242  -3.089
  508    HA   PRO  14           HA       PRO  14  -9.432  17.077  -7.118
  509   1HB   PRO  14          1HB       PRO  14 -10.785  18.527  -5.239
  510   2HB   PRO  14          2HB       PRO  14 -11.543  17.895  -6.699
  511   1HG   PRO  14          1HG       PRO  14 -11.691  16.932  -3.914
  512   2HG   PRO  14          2HG       PRO  14 -12.814  16.596  -5.279
  513   1HD   PRO  14          1HD       PRO  14 -10.835  14.872  -4.137
  514   2HD   PRO  14          2HD       PRO  14 -11.805  14.552  -5.581
  515    H    ALA  15           H        ALA  15  -7.679  15.500  -5.341
  516    HA   ALA  15           HA       ALA  15  -6.015  15.816  -3.891
  517   1HB   ALA  15          1HB       ALA  15  -4.998  18.326  -4.628
  518   2HB   ALA  15          2HB       ALA  15  -4.563  16.752  -5.335
  519   3HB   ALA  15          3HB       ALA  15  -5.844  17.739  -6.079
  520    H    LYS  16           H        LYS  16  -8.092  16.147  -2.363
  521    HA   LYS  16           HA       LYS  16  -7.307  18.003  -0.443
  522   1HB   LYS  16          1HB       LYS  16  -9.395  19.470  -0.589
  523   2HB   LYS  16          2HB       LYS  16  -8.068  19.813  -1.713
  524   1HG   LYS  16          1HG       LYS  16  -9.546  19.612  -3.401
  525   2HG   LYS  16          2HG       LYS  16  -9.695  17.888  -3.017
  526   1HD   LYS  16          1HD       LYS  16 -11.265  19.926  -1.435
  527   2HD   LYS  16          2HD       LYS  16 -11.841  19.448  -3.041
  528   1HE   LYS  16          1HE       LYS  16 -12.656  17.513  -2.218
  529   2HE   LYS  16          2HE       LYS  16 -11.091  17.088  -1.511
  530   1HZ   LYS  16          1HZ       LYS  16 -12.879  19.022  -0.239
  531   2HZ   LYS  16          2HZ       LYS  16 -13.029  17.419   0.035
  532   3HZ   LYS  16          3HZ       LYS  16 -11.645  18.191   0.432
  533    H    ASP  17           H        ASP  17  -7.997  15.190  -0.807
  534    HA   ASP  17           HA       ASP  17  -9.808  15.030   1.377
  535   1HB   ASP  17          1HB       ASP  17 -11.253  15.108  -0.741
  536   2HB   ASP  17          2HB       ASP  17 -10.538  13.551  -1.188
  537    H    ARG  18           H        ARG  18  -6.983  14.324   0.196
  538    HA   ARG  18           HA       ARG  18  -7.059  11.468   0.211
  539   1HB   ARG  18          1HB       ARG  18  -4.696  13.399   0.095
  540   2HB   ARG  18          2HB       ARG  18  -4.604  11.658  -0.218
  541   1HG   ARG  18          1HG       ARG  18  -5.523  11.862  -2.304
  542   2HG   ARG  18          2HG       ARG  18  -6.642  13.145  -1.813
  543   1HD   ARG  18          1HD       ARG  18  -4.907  14.816  -1.966
  544   2HD   ARG  18          2HD       ARG  18  -3.641  13.591  -2.137
  545    HE   ARG  18           HE       ARG  18  -5.655  13.385  -4.224
  546   1HH1  ARG  18          1HH1      ARG  18  -2.780  15.161  -3.244
  547   2HH1  ARG  18          2HH1      ARG  18  -2.350  15.609  -4.861
  548   1HH2  ARG  18          1HH2      ARG  18  -5.088  13.975  -6.358
  549   2HH2  ARG  18          2HH2      ARG  18  -3.672  14.931  -6.644
  550    H    VAL  19           H        VAL  19  -4.939  10.516   1.561
  551    HA   VAL  19           HA       VAL  19  -5.361  11.495   4.297
  552    HB   VAL  19           HB       VAL  19  -4.630   8.764   3.224
  553   1HG1  VAL  19          1HG1      VAL  19  -3.568   8.507   5.194
  554   2HG1  VAL  19          2HG1      VAL  19  -4.327   9.952   5.905
  555   3HG1  VAL  19          3HG1      VAL  19  -5.207   8.405   5.882
  556   1HG2  VAL  19          1HG2      VAL  19  -6.950   8.863   4.942
  557   2HG2  VAL  19          2HG2      VAL  19  -7.133  10.014   3.597
  558   3HG2  VAL  19          3HG2      VAL  19  -6.811   8.296   3.261
  559    H    ASP  20           H        ASP  20  -3.440  12.400   2.041
  560    HA   ASP  20           HA       ASP  20  -1.267  12.656   1.694
  561   1HB   ASP  20          1HB       ASP  20  -1.479  14.558   2.998
  562   2HB   ASP  20          2HB       ASP  20  -1.957  13.654   4.442
  563    H    CYS  21           H        CYS  21  -0.367  10.510   1.417
  564    HA   CYS  21           HA       CYS  21   0.088   8.705   3.438
  565   1HB   CYS  21          1HB       CYS  21   0.474   8.801   0.719
  566   2HB   CYS  21          2HB       CYS  21   2.125   8.673   1.334
  567    H    GLY  22           H        GLY  22   1.865  11.607   2.385
  568   1HA   GLY  22          1HA       GLY  22   3.702  12.639   3.173
  569   2HA   GLY  22          2HA       GLY  22   3.218  12.023   4.740
  570    H    TYR  23           H        TYR  23   4.554  10.550   1.686
  571    HA   TYR  23           HA       TYR  23   6.209   8.803   3.286
  572   1HB   TYR  23          1HB       TYR  23   4.865   8.740   0.839
  573   2HB   TYR  23          2HB       TYR  23   6.510   9.091   0.305
  574    HD1  TYR  23           HD1      TYR  23   5.377   6.938   3.145
  575    HD2  TYR  23           HD2      TYR  23   7.205   7.096  -0.719
  576    HE1  TYR  23           HE1      TYR  23   5.947   4.465   3.305
  577    HE2  TYR  23           HE2      TYR  23   7.768   4.623  -0.546
  578    HH   TYR  23           HH       TYR  23   6.556   2.680   2.112
  579    HA   PRO  24           HA       PRO  24   9.759  11.268   2.974
  580   1HB   PRO  24          1HB       PRO  24  11.660   9.419   3.631
  581   2HB   PRO  24          2HB       PRO  24  10.691  10.271   4.829
  582   1HG   PRO  24          1HG       PRO  24  10.468   7.506   3.828
  583   2HG   PRO  24          2HG       PRO  24   9.815   8.203   5.355
  584   1HD   PRO  24          1HD       PRO  24   8.401   7.542   2.954
  585   2HD   PRO  24          2HD       PRO  24   7.745   8.375   4.370
  586    H    HIS  25           H        HIS  25   9.129   8.660   0.946
  587    HA   HIS  25           HA       HIS  25  11.256   9.632  -0.820
  588   1HB   HIS  25          1HB       HIS  25  10.871   7.033   0.229
  589   2HB   HIS  25          2HB       HIS  25  10.443   6.954  -1.484
  590    HD1  HIS  25           HD1      HIS  25  13.267   6.597   0.681
  591    HD2  HIS  25           HD2      HIS  25  12.672   8.295  -3.108
  592    HE1  HIS  25           HE1      HIS  25  15.571   6.742  -0.407
  593    HE2  HIS  25           HE2      HIS  25  15.134   7.742  -2.753
  594    H    VAL  26           H        VAL  26   8.439  10.572  -0.446
  595    HA   VAL  26           HA       VAL  26   6.618   9.615  -2.183
  596    HB   VAL  26           HB       VAL  26   5.940  11.387  -0.890
  597   1HG1  VAL  26          1HG1      VAL  26   8.638  12.364  -1.331
  598   2HG1  VAL  26          2HG1      VAL  26   7.447  13.675  -1.509
  599   3HG1  VAL  26          3HG1      VAL  26   7.501  12.718  -0.008
  600   1HG2  VAL  26          1HG2      VAL  26   6.389  13.109  -3.292
  601   2HG2  VAL  26          2HG2      VAL  26   5.484  11.592  -3.512
  602   3HG2  VAL  26          3HG2      VAL  26   4.906  12.813  -2.352
  603    H    THR  27           H        THR  27   6.755   8.983  -4.269
  604    HA   THR  27           HA       THR  27   7.680  10.758  -6.269
  605    HB   THR  27           HB       THR  27   9.698   9.211  -4.952
  606    HG1  THR  27           HG1      THR  27  10.866  10.520  -6.411
  607   1HG2  THR  27          1HG2      THR  27  10.572   8.195  -7.233
  608   2HG2  THR  27          2HG2      THR  27   9.432   7.239  -6.257
  609   3HG2  THR  27          3HG2      THR  27   8.847   8.148  -7.672
  610    HA   PRO  28           HA       PRO  28   5.148   8.146  -8.541
  611   1HB   PRO  28          1HB       PRO  28   5.906   8.729 -11.099
  612   2HB   PRO  28          2HB       PRO  28   4.821   9.750 -10.160
  613   1HG   PRO  28          1HG       PRO  28   7.677  10.109 -10.806
  614   2HG   PRO  28          2HG       PRO  28   6.480  11.348 -10.283
  615   1HD   PRO  28          1HD       PRO  28   8.573  10.134  -8.750
  616   2HD   PRO  28          2HD       PRO  28   7.321  11.227  -8.146
  617    H    LYS  29           H        LYS  29   7.024   6.655  -7.334
  618    HA   LYS  29           HA       LYS  29   7.152   4.473  -9.098
  619   1HB   LYS  29          1HB       LYS  29   8.907   5.794 -10.168
  620   2HB   LYS  29          2HB       LYS  29   9.793   5.893  -8.636
  621   1HG   LYS  29          1HG       LYS  29  10.692   3.853  -8.961
  622   2HG   LYS  29          2HG       LYS  29   9.102   3.124  -9.239
  623   1HD   LYS  29          1HD       LYS  29   9.357   4.365 -11.597
  624   2HD   LYS  29          2HD       LYS  29  11.084   4.238 -11.218
  625   1HE   LYS  29          1HE       LYS  29  10.603   2.258 -12.421
  626   2HE   LYS  29          2HE       LYS  29  10.583   1.726 -10.732
  627   1HZ   LYS  29          1HZ       LYS  29   8.102   2.292 -10.942
  628   2HZ   LYS  29          2HZ       LYS  29   8.351   2.151 -12.550
  629   3HZ   LYS  29          3HZ       LYS  29   8.650   0.884 -11.564
  630    H    GLU  30           H        GLU  30   7.901   6.214  -6.139
  631    HA   GLU  30           HA       GLU  30   8.560   3.709  -4.838
  632   1HB   GLU  30          1HB       GLU  30   9.253   6.513  -4.436
  633   2HB   GLU  30          2HB       GLU  30   8.662   5.786  -2.932
  634   1HG   GLU  30          1HG       GLU  30  10.456   3.966  -4.335
  635   2HG   GLU  30          2HG       GLU  30  11.246   5.528  -4.078
  636    H    CYS  31           H        CYS  31   6.242   6.477  -4.723
  637    HA   CYS  31           HA       CYS  31   4.794   5.564  -2.531
  638   1HB   CYS  31          1HB       CYS  31   4.248   7.437  -4.794
  639   2HB   CYS  31          2HB       CYS  31   2.923   6.963  -3.729
  640    H    ASN  32           H        ASN  32   4.179   5.284  -6.112
  641    HA   ASN  32           HA       ASN  32   1.967   3.644  -5.821
  642   1HB   ASN  32          1HB       ASN  32   3.855   4.411  -8.017
  643   2HB   ASN  32          2HB       ASN  32   2.915   2.938  -8.296
  644   1HD2  ASN  32          1HD2      ASN  32   2.300   6.065  -6.701
  645   2HD2  ASN  32          2HD2      ASN  32   0.865   6.480  -7.577
  646    H    ASN  33           H        ASN  33   5.189   3.075  -5.002
  647    HA   ASN  33           HA       ASN  33   5.097   0.284  -5.789
  648   1HB   ASN  33          1HB       ASN  33   7.196   1.304  -6.356
  649   2HB   ASN  33          2HB       ASN  33   7.318   2.126  -4.793
  650   1HD2  ASN  33          1HD2      ASN  33   9.030   1.328  -3.827
  651   2HD2  ASN  33          2HD2      ASN  33   9.403  -0.346  -3.580
  652    H    ARG  34           H        ARG  34   5.030   2.572  -3.063
  653    HA   ARG  34           HA       ARG  34   5.416   0.491  -1.140
  654   1HB   ARG  34          1HB       ARG  34   5.519   2.211   0.467
  655   2HB   ARG  34          2HB       ARG  34   6.149   3.017  -0.980
  656   1HG   ARG  34          1HG       ARG  34   4.599   4.579  -0.214
  657   2HG   ARG  34          2HG       ARG  34   3.606   3.664  -1.364
  658   1HD   ARG  34          1HD       ARG  34   2.160   3.337   0.347
  659   2HD   ARG  34          2HD       ARG  34   3.356   2.234   1.046
  660    HE   ARG  34           HE       ARG  34   3.848   5.055   1.665
  661   1HH1  ARG  34          1HH1      ARG  34   2.136   2.145   2.656
  662   2HH1  ARG  34          2HH1      ARG  34   1.974   2.649   4.306
  663   1HH2  ARG  34          1HH2      ARG  34   3.635   5.720   3.841
  664   2HH2  ARG  34          2HH2      ARG  34   2.833   4.695   4.984
  665    H    GLY  35           H        GLY  35   2.795   2.322  -2.690
  666   1HA   GLY  35          1HA       GLY  35   0.678   0.998  -2.674
  667   2HA   GLY  35          2HA       GLY  35   0.832   0.980  -0.928
  668    H    CYS  36           H        CYS  36   1.938   3.835  -2.701
  669    HA   CYS  36           HA       CYS  36  -0.467   5.226  -1.768
  670   1HB   CYS  36          1HB       CYS  36   2.366   6.254  -1.944
  671   2HB   CYS  36          2HB       CYS  36   0.956   7.242  -1.553
  672    H    CYS  37           H        CYS  37  -0.586   7.472  -3.125
  673    HA   CYS  37           HA       CYS  37  -0.042   6.765  -5.917
  674   1HB   CYS  37          1HB       CYS  37  -2.487   6.681  -5.054
  675   2HB   CYS  37          2HB       CYS  37  -2.399   8.445  -5.118
  676    H    PHE  38           H        PHE  38   1.266   8.263  -6.922
  677    HA   PHE  38           HA       PHE  38   1.835  10.705  -5.469
  678   1HB   PHE  38          1HB       PHE  38   3.610   9.175  -6.426
  679   2HB   PHE  38          2HB       PHE  38   2.936   9.421  -8.042
  680    HD1  PHE  38           HD1      PHE  38   4.617  11.141  -5.223
  681    HD2  PHE  38           HD2      PHE  38   3.591  11.275  -9.337
  682    HE1  PHE  38           HE1      PHE  38   6.124  13.123  -5.533
  683    HE2  PHE  38           HE2      PHE  38   5.099  13.257  -9.649
  684    HZ   PHE  38           HZ       PHE  38   6.347  14.157  -7.743
  685    H    ASP  39           H        ASP  39   0.905  12.633  -5.957
  686    HA   ASP  39           HA       ASP  39  -0.690  12.745  -8.342
  687   1HB   ASP  39          1HB       ASP  39  -1.669  13.607  -6.300
  688   2HB   ASP  39          2HB       ASP  39  -0.269  14.647  -5.996
  689    H    SER  40           H        SER  40   1.181  15.417  -6.771
  690    HA   SER  40           HA       SER  40   2.968  16.527  -7.470
  691   1HB   SER  40          1HB       SER  40   3.324  14.367  -9.045
  692   2HB   SER  40          2HB       SER  40   2.927  15.549 -10.304
  693    HG   SER  40           HG       SER  40   4.890  16.358 -10.094
  694    H    ARG  41           H        ARG  41  -0.118  16.227  -8.979
  695    HA   ARG  41           HA       ARG  41   0.046  18.274 -10.835
  696   1HB   ARG  41          1HB       ARG  41  -2.360  17.320  -9.215
  697   2HB   ARG  41          2HB       ARG  41  -2.454  18.272 -10.705
  698   1HG   ARG  41          1HG       ARG  41  -0.903  16.232 -11.580
  699   2HG   ARG  41          2HG       ARG  41  -1.790  15.374 -10.308
  700   1HD   ARG  41          1HD       ARG  41  -3.504  15.153 -11.763
  701   2HD   ARG  41          2HD       ARG  41  -3.738  16.907 -11.694
  702    HE   ARG  41           HE       ARG  41  -2.728  17.087 -13.802
  703   1HH1  ARG  41          1HH1      ARG  41  -2.044  13.910 -12.453
  704   2HH1  ARG  41          2HH1      ARG  41  -1.330  13.303 -13.911
  705   1HH2  ARG  41          1HH2      ARG  41  -1.789  16.288 -15.726
  706   2HH2  ARG  41          2HH2      ARG  41  -1.184  14.665 -15.784
  707    H    ILE  42           H        ILE  42  -0.825  18.193  -7.333
  708    HA   ILE  42           HA       ILE  42  -0.711  21.128  -7.359
  709    HB   ILE  42           HB       ILE  42  -2.305  19.664  -5.312
  710   1HG1  ILE  42          1HG1      ILE  42  -3.122  20.068  -8.183
  711   2HG1  ILE  42          2HG1      ILE  42  -3.182  18.582  -7.221
  712   1HG2  ILE  42          1HG2      ILE  42  -3.556  21.685  -5.214
  713   2HG2  ILE  42          2HG2      ILE  42  -1.834  22.134  -5.240
  714   3HG2  ILE  42          3HG2      ILE  42  -2.818  22.295  -6.714
  715   1HD1  ILE  42          1HD1      ILE  42  -4.986  21.008  -7.128
  716   2HD1  ILE  42          2HD1      ILE  42  -5.423  19.283  -7.189
  717   3HD1  ILE  42          3HD1      ILE  42  -4.805  19.992  -5.678
  718    HA   PRO  43           HA       PRO  43   2.636  20.125  -4.711
  719   1HB   PRO  43          1HB       PRO  43   3.799  22.596  -4.736
  720   2HB   PRO  43          2HB       PRO  43   4.140  21.359  -5.943
  721   1HG   PRO  43          1HG       PRO  43   2.460  23.777  -6.129
  722   2HG   PRO  43          2HG       PRO  43   3.183  22.806  -7.462
  723   1HD   PRO  43          1HD       PRO  43   0.460  22.865  -6.576
  724   2HD   PRO  43          2HD       PRO  43   1.153  21.775  -7.784
  725    H    GLY  44           H        GLY  44  -0.035  21.995  -4.215
  726   1HA   GLY  44          1HA       GLY  44   0.808  22.878  -1.556
  727   2HA   GLY  44          2HA       GLY  44  -0.667  23.302  -2.403
  728    H    VAL  45           H        VAL  45  -0.444  20.064  -3.010
  729    HA   VAL  45           HA       VAL  45  -1.827  19.368  -0.510
  730    HB   VAL  45           HB       VAL  45  -3.489  18.305  -1.652
  731   1HG1  VAL  45          1HG1      VAL  45  -3.714  20.661  -2.146
  732   2HG1  VAL  45          2HG1      VAL  45  -2.617  20.516  -3.541
  733   3HG1  VAL  45          3HG1      VAL  45  -4.210  19.724  -3.576
  734   1HG2  VAL  45          1HG2      VAL  45  -1.770  18.144  -4.149
  735   2HG2  VAL  45          2HG2      VAL  45  -1.956  16.840  -2.951
  736   3HG2  VAL  45          3HG2      VAL  45  -3.361  17.391  -3.894
  737    HA   PRO  46           HA       PRO  46   0.650  15.807  -0.370
  738   1HB   PRO  46          1HB       PRO  46  -0.997  13.645  -0.107
  739   2HB   PRO  46          2HB       PRO  46  -0.617  14.735   1.225
  740   1HG   PRO  46          1HG       PRO  46  -3.058  14.530  -0.421
  741   2HG   PRO  46          2HG       PRO  46  -2.857  15.282   1.203
  742   1HD   PRO  46          1HD       PRO  46  -3.117  16.575  -1.338
  743   2HD   PRO  46          2HD       PRO  46  -2.761  17.354   0.209
  744    H    TRP  47           H        TRP  47   2.040  15.243  -1.910
  745    HA   TRP  47           HA       TRP  47   0.860  14.360  -4.411
  746   1HB   TRP  47          1HB       TRP  47   3.762  14.369  -4.251
  747   2HB   TRP  47          2HB       TRP  47   2.678  15.180  -5.384
  748    HD1  TRP  47           HD1      TRP  47   1.626  17.633  -4.371
  749    HE1  TRP  47           HE1      TRP  47   2.753  19.523  -2.914
  750    HE3  TRP  47           HE3      TRP  47   5.394  14.730  -2.573
  751    HZ2  TRP  47           HZ2      TRP  47   5.043  19.590  -1.212
  752    HZ3  TRP  47           HZ3      TRP  47   7.033  15.785  -1.019
  753    HH2  TRP  47           HH2      TRP  47   6.901  18.128  -0.335
  754    H    CYS  48           H        CYS  48   0.644  12.744  -1.893
  755    HA   CYS  48           HA       CYS  48   1.343  10.268  -3.008
  756   1HB   CYS  48          1HB       CYS  48   3.600  10.943  -2.325
  757   2HB   CYS  48          2HB       CYS  48   3.048  11.118  -0.658
  758    H    PHE  49           H        PHE  49  -0.619   9.365  -2.442
  759    HA   PHE  49           HA       PHE  49  -1.275   9.365   0.398
  760   1HB   PHE  49          1HB       PHE  49  -3.746   9.588  -0.779
  761   2HB   PHE  49          2HB       PHE  49  -2.845  10.999  -0.215
  762    HD1  PHE  49           HD1      PHE  49  -1.121  11.928  -2.038
  763    HD2  PHE  49           HD2      PHE  49  -4.591   9.647  -2.906
  764    HE1  PHE  49           HE1      PHE  49  -1.148  12.857  -4.370
  765    HE2  PHE  49           HE2      PHE  49  -4.619  10.575  -5.237
  766    HZ   PHE  49           HZ       PHE  49  -2.896  12.168  -5.942
  767    H    LYS  50           H        LYS  50  -3.725   8.007   0.238
  768    HA   LYS  50           HA       LYS  50  -2.980   5.569  -1.221
  769   1HB   LYS  50          1HB       LYS  50  -4.073   4.340   0.696
  770   2HB   LYS  50          2HB       LYS  50  -2.500   5.081   1.039
  771   1HG   LYS  50          1HG       LYS  50  -4.747   6.907   1.540
  772   2HG   LYS  50          2HG       LYS  50  -4.859   5.429   2.512
  773   1HD   LYS  50          1HD       LYS  50  -2.480   7.326   2.343
  774   2HD   LYS  50          2HD       LYS  50  -3.586   7.166   3.719
  775   1HE   LYS  50          1HE       LYS  50  -2.691   4.548   3.217
  776   2HE   LYS  50          2HE       LYS  50  -1.247   5.546   2.992
  777   1HZ   LYS  50          1HZ       LYS  50  -2.974   5.396   5.356
  778   2HZ   LYS  50          2HZ       LYS  50  -1.391   5.009   5.249
  779   3HZ   LYS  50          3HZ       LYS  50  -1.858   6.571   5.159
  780    HA   PRO  51           HA       PRO  51  -7.100   7.020  -2.450
  781   1HB   PRO  51          1HB       PRO  51  -6.644   7.210  -5.136
  782   2HB   PRO  51          2HB       PRO  51  -6.527   8.584  -4.039
  783   1HG   PRO  51          1HG       PRO  51  -4.399   6.971  -5.293
  784   2HG   PRO  51          2HG       PRO  51  -4.287   8.624  -4.587
  785   1HD   PRO  51          1HD       PRO  51  -3.371   6.149  -3.476
  786   2HD   PRO  51          2HD       PRO  51  -3.382   7.725  -2.675
  787    H    LEU  52           H        LEU  52  -5.981   5.458  -5.324
  788    HA   LEU  52           HA       LEU  52  -7.716   3.211  -4.594
  789   1HB   LEU  52          1HB       LEU  52  -8.332   3.021  -6.743
  790   2HB   LEU  52          2HB       LEU  52  -8.009   4.762  -6.694
  791    HG   LEU  52           HG       LEU  52  -5.579   3.525  -7.423
  792   1HD1  LEU  52          1HD1      LEU  52  -7.919   2.028  -8.412
  793   2HD1  LEU  52          2HD1      LEU  52  -6.755   2.524  -9.665
  794   3HD1  LEU  52          3HD1      LEU  52  -6.210   1.548  -8.279
  795   1HD2  LEU  52          1HD2      LEU  52  -5.600   5.219  -8.861
  796   2HD2  LEU  52          2HD2      LEU  52  -7.055   4.599  -9.676
  797   3HD2  LEU  52          3HD2      LEU  52  -7.214   5.636  -8.238
  798    H    GLN  53           H        GLN  53  -4.924   3.661  -3.612
  799    HA   GLN  53           HA       GLN  53  -3.064   2.270  -5.006
  800   1HB   GLN  53          1HB       GLN  53  -2.511   1.594  -2.371
  801   2HB   GLN  53          2HB       GLN  53  -1.999   3.085  -3.179
  802   1HG   GLN  53          1HG       GLN  53  -3.185   3.428  -0.972
  803   2HG   GLN  53          2HG       GLN  53  -3.930   4.285  -2.330
  804   1HE2  GLN  53          1HE2      GLN  53  -4.040   0.825  -1.637
  805   2HE2  GLN  53          2HE2      GLN  53  -5.740   0.700  -1.338
  806    H    GLU  54           H        GLU  54  -6.027   1.088  -3.743
  807    HA   GLU  54           HA       GLU  54  -5.439  -1.396  -2.844
  808   1HB   GLU  54          1HB       GLU  54  -7.724  -2.028  -3.680
  809   2HB   GLU  54          2HB       GLU  54  -7.697  -0.513  -2.760
  810   1HG   GLU  54          1HG       GLU  54  -8.800   0.374  -4.529
  811   2HG   GLU  54          2HG       GLU  54  -7.240   0.349  -5.367
  812    H    ALA  55           H        ALA  55  -4.930  -0.101  -6.022
  813    HA   ALA  55           HA       ALA  55  -5.310  -1.996  -7.820
  814   1HB   ALA  55          1HB       ALA  55  -3.269   0.048  -7.323
  815   2HB   ALA  55          2HB       ALA  55  -2.647  -1.308  -8.295
  816   3HB   ALA  55          3HB       ALA  55  -4.080  -0.405  -8.842
  817    H    GLU  56           H        GLU  56  -2.235  -1.984  -5.873
  818    HA   GLU  56           HA       GLU  56  -2.473  -4.879  -5.795
  819   1HB   GLU  56          1HB       GLU  56  -0.493  -3.341  -7.252
  820   2HB   GLU  56          2HB       GLU  56   0.302  -4.315  -6.003
  821   1HG   GLU  56          1HG       GLU  56  -0.429  -6.332  -6.934
  822   2HG   GLU  56          2HG       GLU  56  -1.819  -5.590  -7.738
  823    H    CYS  57           H        CYS  57  -2.742  -2.319  -3.978
  824    HA   CYS  57           HA       CYS  57  -0.713  -2.985  -2.007
  825   1HB   CYS  57          1HB       CYS  57  -1.118  -0.626  -2.645
  826   2HB   CYS  57          2HB       CYS  57  -2.749  -0.749  -1.979
  827    H    THR  58           H        THR  58  -4.163  -1.933  -1.644
  828    HA   THR  58           HA       THR  58  -4.691  -3.346   0.639
  829    HB   THR  58           HB       THR  58  -6.026  -1.573  -0.928
  830    HG1  THR  58           HG1      THR  58  -7.884  -2.342   0.500
  831   1HG2  THR  58          1HG2      THR  58  -6.675  -3.361  -2.608
  832   2HG2  THR  58          2HG2      THR  58  -7.484  -4.243  -1.291
  833   3HG2  THR  58          3HG2      THR  58  -8.079  -2.640  -1.787
  834    H    PHE  59           H        PHE  59  -4.337  -4.570  -2.635
  835    HA   PHE  59           HA       PHE  59  -5.797  -6.744  -2.835
  836   1HB   PHE  59          1HB       PHE  59  -3.027  -5.913  -3.439
  837   2HB   PHE  59          2HB       PHE  59  -3.123  -7.668  -3.254
  838    HD1  PHE  59           HD1      PHE  59  -5.594  -5.279  -4.693
  839    HD2  PHE  59           HD2      PHE  59  -2.942  -8.513  -5.409
  840    HE1  PHE  59           HE1      PHE  59  -6.456  -5.464  -7.042
  841    HE2  PHE  59           HE2      PHE  59  -3.804  -8.699  -7.759
  842    HZ   PHE  59           HZ       PHE  59  -5.551  -7.173  -8.547
  Start of MODEL   41
    1   1H    GLU   1           H1       GLU   1 -15.169 -14.658  -0.374
    2    HA   GLU   1           HA       GLU   1 -12.673 -15.815  -1.206
    3   1HB   GLU   1          1HB       GLU   1 -15.245 -16.267  -1.967
    4   2HB   GLU   1          2HB       GLU   1 -14.752 -15.130  -3.235
    5   1HG   GLU   1          1HG       GLU   1 -12.698 -16.603  -3.582
    6   2HG   GLU   1          2HG       GLU   1 -13.446 -17.788  -2.500
    7    H    GLU   2           H        GLU   2 -14.635 -12.830  -1.688
    8    HA   GLU   2           HA       GLU   2 -12.577 -11.758  -3.387
    9   1HB   GLU   2          1HB       GLU   2 -15.380 -11.049  -2.656
   10   2HB   GLU   2          2HB       GLU   2 -14.319  -9.692  -3.073
   11   1HG   GLU   2          1HG       GLU   2 -13.676 -11.337  -5.101
   12   2HG   GLU   2          2HG       GLU   2 -15.296 -11.970  -4.779
   13    H    TYR   3           H        TYR   3 -13.623 -11.707  -0.031
   14    HA   TYR   3           HA       TYR   3 -12.078  -9.305   0.532
   15   1HB   TYR   3          1HB       TYR   3 -12.993 -10.126   2.914
   16   2HB   TYR   3          2HB       TYR   3 -14.134  -9.429   1.759
   17    HD1  TYR   3           HD1      TYR   3 -15.819 -10.810   0.688
   18    HD2  TYR   3           HD2      TYR   3 -12.951 -12.540   3.350
   19    HE1  TYR   3           HE1      TYR   3 -17.202 -12.940   0.804
   20    HE2  TYR   3           HE2      TYR   3 -14.344 -14.664   3.457
   21    HH   TYR   3           HH       TYR   3 -15.976 -15.816   2.079
   22    H    VAL   4           H        VAL   4 -10.082 -10.597  -0.285
   23    HA   VAL   4           HA       VAL   4  -8.947 -11.944   2.061
   24    HB   VAL   4           HB       VAL   4  -8.833 -12.799  -0.834
   25   1HG1  VAL   4          1HG1      VAL   4  -6.869 -13.168   1.314
   26   2HG1  VAL   4          2HG1      VAL   4  -7.430 -14.700   0.603
   27   3HG1  VAL   4          3HG1      VAL   4  -6.719 -13.442  -0.438
   28   1HG2  VAL   4          1HG2      VAL   4 -10.623 -13.975  -0.121
   29   2HG2  VAL   4          2HG2      VAL   4  -9.406 -15.017   0.653
   30   3HG2  VAL   4          3HG2      VAL   4 -10.219 -13.748   1.598
   31    H    GLY   5           H        GLY   5  -8.303 -10.353  -1.137
   32   1HA   GLY   5          1HA       GLY   5  -5.607  -9.717  -0.542
   33   2HA   GLY   5          2HA       GLY   5  -6.602  -9.042  -1.816
   34    H    LEU   6           H        LEU   6  -8.344  -8.686   1.055
   35    HA   LEU   6           HA       LEU   6  -6.994  -6.267   1.901
   36   1HB   LEU   6          1HB       LEU   6  -9.059  -4.938   1.676
   37   2HB   LEU   6          2HB       LEU   6  -8.293  -5.372   0.138
   38    HG   LEU   6           HG       LEU   6 -10.864  -5.460   0.348
   39   1HD1  LEU   6          1HD1      LEU   6  -9.806  -6.251  -1.625
   40   2HD1  LEU   6          2HD1      LEU   6  -9.213  -7.717  -0.806
   41   3HD1  LEU   6          3HD1      LEU   6 -10.955  -7.512  -1.114
   42   1HD2  LEU   6          1HD2      LEU   6 -10.859  -6.711   2.500
   43   2HD2  LEU   6          2HD2      LEU   6 -11.844  -7.469   1.225
   44   3HD2  LEU   6          3HD2      LEU   6 -10.242  -8.134   1.626
   45    H    SER   7           H        SER   7  -7.779  -9.101   2.824
   46    HA   SER   7           HA       SER   7  -9.468  -8.289   5.049
   47   1HB   SER   7          1HB       SER   7  -9.500 -10.557   3.370
   48   2HB   SER   7          2HB       SER   7  -8.904 -11.148   4.930
   49    HG   SER   7           HG       SER   7 -10.900  -9.621   5.626
   50    H    ALA   8           H        ALA   8  -8.737  -8.538   7.209
   51    HA   ALA   8           HA       ALA   8  -5.940  -8.469   7.568
   52   1HB   ALA   8          1HB       ALA   8  -6.687  -7.453   9.425
   53   2HB   ALA   8          2HB       ALA   8  -8.349  -7.975   9.065
   54   3HB   ALA   8          3HB       ALA   8  -7.279  -9.020  10.028
   55    H    ASN   9           H        ASN   9  -5.924 -10.667   6.167
   56    HA   ASN   9           HA       ASN   9  -5.320 -12.667   8.132
   57   1HB   ASN   9          1HB       ASN   9  -7.803 -12.793   6.919
   58   2HB   ASN   9          2HB       ASN   9  -6.835 -13.787   5.818
   59   1HD2  ASN   9          1HD2      ASN   9  -5.250 -15.273   7.056
   60   2HD2  ASN   9          2HD2      ASN   9  -5.930 -16.207   8.347
   61    H    GLN  10           H        GLN  10  -5.277 -11.226   4.903
   62    HA   GLN  10           HA       GLN  10  -3.855 -13.148   3.537
   63   1HB   GLN  10          1HB       GLN  10  -4.984 -11.177   2.527
   64   2HB   GLN  10          2HB       GLN  10  -3.727 -10.119   3.189
   65   1HG   GLN  10          1HG       GLN  10  -2.099 -10.927   1.725
   66   2HG   GLN  10          2HG       GLN  10  -2.903 -12.488   1.507
   67   1HE2  GLN  10          1HE2      GLN  10  -2.703  -9.153   0.569
   68   2HE2  GLN  10          2HE2      GLN  10  -3.728  -9.215  -0.826
   69    H    CYS  11           H        CYS  11  -2.840 -10.687   5.900
   70    HA   CYS  11           HA       CYS  11  -0.127 -10.661   5.296
   71   1HB   CYS  11          1HB       CYS  11  -1.801  -9.950   7.649
   72   2HB   CYS  11          2HB       CYS  11  -0.062 -10.125   7.904
   73    H    ALA  12           H        ALA  12  -2.145 -13.204   6.303
   74    HA   ALA  12           HA       ALA  12   0.144 -14.624   7.486
   75   1HB   ALA  12          1HB       ALA  12  -1.532 -15.928   8.759
   76   2HB   ALA  12          2HB       ALA  12  -1.636 -14.190   9.131
   77   3HB   ALA  12          3HB       ALA  12  -2.833 -14.943   8.049
   78    H    VAL  13           H        VAL  13  -0.852 -14.192   4.605
   79    HA   VAL  13           HA       VAL  13  -2.177 -16.289   3.552
   80    HB   VAL  13           HB       VAL  13  -0.607 -14.204   2.647
   81   1HG1  VAL  13          1HG1      VAL  13   1.378 -15.675   2.631
   82   2HG1  VAL  13          2HG1      VAL  13   0.531 -16.792   1.534
   83   3HG1  VAL  13          3HG1      VAL  13   0.926 -15.143   0.995
   84   1HG2  VAL  13          1HG2      VAL  13  -1.380 -15.777   0.398
   85   2HG2  VAL  13          2HG2      VAL  13  -2.611 -15.997   1.664
   86   3HG2  VAL  13          3HG2      VAL  13  -2.199 -14.361   1.097
   87    HA   PRO  14           HA       PRO  14   0.217 -19.857   4.014
   88   1HB   PRO  14          1HB       PRO  14  -0.060 -21.180   1.639
   89   2HB   PRO  14          2HB       PRO  14  -1.301 -21.174   2.889
   90   1HG   PRO  14          1HG       PRO  14  -1.163 -19.684   0.347
   91   2HG   PRO  14          2HG       PRO  14  -2.607 -20.045   1.359
   92   1HD   PRO  14          1HD       PRO  14  -1.190 -17.572   1.097
   93   2HD   PRO  14          2HD       PRO  14  -2.505 -17.919   2.225
   94    H    ALA  15           H        ALA  15   1.618 -17.440   3.050
   95    HA   ALA  15           HA       ALA  15   3.571 -16.871   2.142
   96   1HB   ALA  15          1HB       ALA  15   4.509 -19.576   3.158
   97   2HB   ALA  15          2HB       ALA  15   5.435 -18.059   3.054
   98   3HB   ALA  15          3HB       ALA  15   4.120 -18.220   4.242
   99    H    LYS  16           H        LYS  16   2.371 -17.201  -0.020
  100    HA   LYS  16           HA       LYS  16   4.046 -18.140  -1.909
  101   1HB   LYS  16          1HB       LYS  16   2.798 -20.316  -2.563
  102   2HB   LYS  16          2HB       LYS  16   4.052 -20.375  -1.314
  103   1HG   LYS  16          1HG       LYS  16   2.534 -21.247   0.101
  104   2HG   LYS  16          2HG       LYS  16   1.608 -19.738   0.015
  105   1HD   LYS  16          1HD       LYS  16   0.086 -21.449  -0.622
  106   2HD   LYS  16          2HD       LYS  16   0.570 -20.695  -2.151
  107   1HE   LYS  16          1HE       LYS  16   1.621 -22.584  -2.877
  108   2HE   LYS  16          2HE       LYS  16   2.318 -22.937  -1.289
  109   1HZ   LYS  16          1HZ       LYS  16  -0.521 -23.339  -1.908
  110   2HZ   LYS  16          2HZ       LYS  16   0.599 -24.508  -2.119
  111   3HZ   LYS  16          3HZ       LYS  16   0.313 -23.913  -0.626
  112    H    ASP  17           H        ASP  17   2.258 -16.005  -1.418
  113    HA   ASP  17           HA       ASP  17   0.831 -16.115  -3.866
  114   1HB   ASP  17          1HB       ASP  17  -0.712 -17.157  -2.080
  115   2HB   ASP  17          2HB       ASP  17  -0.786 -15.549  -1.346
  116    H    ARG  18           H        ARG  18   2.882 -14.649  -1.914
  117    HA   ARG  18           HA       ARG  18   1.635 -12.069  -1.763
  118   1HB   ARG  18          1HB       ARG  18   4.480 -12.887  -1.027
  119   2HB   ARG  18          2HB       ARG  18   3.657 -11.399  -0.526
  120   1HG   ARG  18          1HG       ARG  18   2.409 -12.480   1.075
  121   2HG   ARG  18          2HG       ARG  18   2.282 -13.979   0.135
  122   1HD   ARG  18          1HD       ARG  18   4.497 -14.663   0.774
  123   2HD   ARG  18          2HD       ARG  18   4.892 -13.062   1.421
  124    HE   ARG  18           HE       ARG  18   2.595 -14.378   2.704
  125   1HH1  ARG  18          1HH1      ARG  18   6.079 -13.890   2.764
  126   2HH1  ARG  18          2HH1      ARG  18   6.237 -14.304   4.438
  127   1HH2  ARG  18          1HH2      ARG  18   2.802 -14.925   4.913
  128   2HH2  ARG  18          2HH2      ARG  18   4.361 -14.897   5.669
  129    H    VAL  19           H        VAL  19   3.276 -10.136  -2.411
  130    HA   VAL  19           HA       VAL  19   4.146 -10.758  -5.140
  131    HB   VAL  19           HB       VAL  19   3.619  -8.025  -3.996
  132   1HG1  VAL  19          1HG1      VAL  19   4.155  -7.343  -6.047
  133   2HG1  VAL  19          2HG1      VAL  19   4.502  -9.026  -6.513
  134   3HG1  VAL  19          3HG1      VAL  19   2.867  -8.357  -6.740
  135   1HG2  VAL  19          1HG2      VAL  19   1.577  -9.870  -5.281
  136   2HG2  VAL  19          2HG2      VAL  19   1.606  -9.365  -3.575
  137   3HG2  VAL  19          3HG2      VAL  19   1.320  -8.162  -4.856
  138    H    ASP  20           H        ASP  20   5.570 -11.160  -2.419
  139    HA   ASP  20           HA       ASP  20   7.452 -10.578  -1.411
  140   1HB   ASP  20          1HB       ASP  20   8.487 -12.130  -2.770
  141   2HB   ASP  20          2HB       ASP  20   8.031 -11.295  -4.264
  142    H    CYS  21           H        CYS  21   7.075  -8.310  -0.829
  143    HA   CYS  21           HA       CYS  21   7.239  -6.161  -2.486
  144   1HB   CYS  21          1HB       CYS  21   6.790  -6.495   0.130
  145   2HB   CYS  21          2HB       CYS  21   8.429  -5.846   0.218
  146    H    GLY  22           H        GLY  22   9.819  -8.143  -0.986
  147   1HA   GLY  22          1HA       GLY  22  12.058  -8.143  -1.210
  148   2HA   GLY  22          2HA       GLY  22  11.757  -7.640  -2.861
  149    H    TYR  23           H        TYR  23  11.614  -6.158   0.464
  150    HA   TYR  23           HA       TYR  23  12.566  -3.657  -0.667
  151   1HB   TYR  23          1HB       TYR  23  11.043  -4.718   1.620
  152   2HB   TYR  23          2HB       TYR  23  12.333  -3.663   2.209
  153    HD1  TYR  23           HD1      TYR  23   9.127  -3.844   0.479
  154    HD2  TYR  23           HD2      TYR  23  12.370  -1.264   1.540
  155    HE1  TYR  23           HE1      TYR  23   7.688  -1.812  -0.036
  156    HE2  TYR  23           HE2      TYR  23  10.921   0.759   1.022
  157    HH   TYR  23           HH       TYR  23   7.712   0.366  -0.385
  158    HA   PRO  24           HA       PRO  24  16.642  -4.325   0.644
  159   1HB   PRO  24          1HB       PRO  24  17.591  -1.766   0.526
  160   2HB   PRO  24          2HB       PRO  24  17.452  -2.809  -0.888
  161   1HG   PRO  24          1HG       PRO  24  15.752  -0.563  -0.013
  162   2HG   PRO  24          2HG       PRO  24  15.895  -1.290  -1.654
  163   1HD   PRO  24          1HD       PRO  24  13.784  -1.607   0.255
  164   2HD   PRO  24          2HD       PRO  24  13.956  -2.467  -1.280
  165    H    HIS  25           H        HIS  25  14.345  -2.795   2.451
  166    HA   HIS  25           HA       HIS  25  16.206  -2.777   4.712
  167   1HB   HIS  25          1HB       HIS  25  14.621  -0.623   3.641
  168   2HB   HIS  25          2HB       HIS  25  14.097  -0.991   5.288
  169    HD1  HIS  25           HD1      HIS  25  16.280   1.213   3.643
  170    HD2  HIS  25           HD2      HIS  25  16.734  -1.308   6.964
  171    HE1  HIS  25           HE1      HIS  25  18.264   2.123   4.965
  172    HE2  HIS  25           HE2      HIS  25  18.460   0.565   7.023
  173    H    VAL  26           H        VAL  26  14.090  -4.685   3.356
  174    HA   VAL  26           HA       VAL  26  11.836  -5.019   4.732
  175    HB   VAL  26           HB       VAL  26  12.311  -6.544   3.054
  176   1HG1  VAL  26          1HG1      VAL  26  14.967  -6.341   3.922
  177   2HG1  VAL  26          2HG1      VAL  26  14.549  -8.060   4.124
  178   3HG1  VAL  26          3HG1      VAL  26  14.357  -7.278   2.536
  179   1HG2  VAL  26          1HG2      VAL  26  11.259  -7.499   5.218
  180   2HG2  VAL  26          2HG2      VAL  26  11.832  -8.641   3.979
  181   3HG2  VAL  26          3HG2      VAL  26  12.815  -8.334   5.431
  182    H    THR  27           H        THR  27  11.205  -5.199   6.822
  183    HA   THR  27           HA       THR  27  12.725  -6.666   8.721
  184    HB   THR  27           HB       THR  27  13.435  -3.896   8.307
  185    HG1  THR  27           HG1      THR  27  15.108  -4.888   9.371
  186   1HG2  THR  27          1HG2      THR  27  12.522  -2.771  10.072
  187   2HG2  THR  27          2HG2      THR  27  11.480  -4.177  10.397
  188   3HG2  THR  27          3HG2      THR  27  13.072  -4.049  11.183
  189    HA   PRO  28           HA       PRO  28   8.830  -6.760  10.513
  190   1HB   PRO  28          1HB       PRO  28   9.412  -7.509  13.074
  191   2HB   PRO  28          2HB       PRO  28   9.351  -8.644  11.728
  192   1HG   PRO  28          1HG       PRO  28  11.673  -7.473  13.115
  193   2HG   PRO  28          2HG       PRO  28  11.605  -8.957  12.101
  194   1HD   PRO  28          1HD       PRO  28  12.670  -6.387  11.424
  195   2HD   PRO  28          2HD       PRO  28  12.479  -7.769  10.337
  196    H    LYS  29           H        LYS  29   9.465  -4.200  10.109
  197    HA   LYS  29           HA       LYS  29   7.896  -2.908  11.967
  198   1HB   LYS  29          1HB       LYS  29  10.066  -3.539  13.332
  199   2HB   LYS  29          2HB       LYS  29  10.710  -2.081  12.556
  200   1HG   LYS  29          1HG       LYS  29   9.492  -0.744  13.905
  201   2HG   LYS  29          2HG       LYS  29   7.999  -1.636  13.568
  202   1HD   LYS  29          1HD       LYS  29   9.953  -3.036  15.316
  203   2HD   LYS  29          2HD       LYS  29   9.254  -1.565  16.015
  204   1HE   LYS  29          1HE       LYS  29   7.307  -2.634  16.415
  205   2HE   LYS  29          2HE       LYS  29   7.172  -3.135  14.722
  206   1HZ   LYS  29          1HZ       LYS  29   7.345  -5.096  15.858
  207   2HZ   LYS  29          2HZ       LYS  29   8.903  -4.857  15.428
  208   3HZ   LYS  29          3HZ       LYS  29   8.418  -4.534  16.954
  209    H    GLU  30           H        GLU  30  10.280  -3.068   9.426
  210    HA   GLU  30           HA       GLU  30   9.851  -0.283   8.776
  211   1HB   GLU  30          1HB       GLU  30  11.924  -2.280   8.261
  212   2HB   GLU  30          2HB       GLU  30  11.464  -1.425   6.778
  213   1HG   GLU  30          1HG       GLU  30  13.113  -0.018   7.629
  214   2HG   GLU  30          2HG       GLU  30  11.662   0.726   8.318
  215    H    CYS  31           H        CYS  31   9.362  -3.607   7.444
  216    HA   CYS  31           HA       CYS  31   8.330  -2.895   5.000
  217   1HB   CYS  31          1HB       CYS  31   7.797  -5.256   6.791
  218   2HB   CYS  31          2HB       CYS  31   7.083  -5.110   5.183
  219    H    ASN  32           H        ASN  32   6.586  -3.632   8.115
  220    HA   ASN  32           HA       ASN  32   4.084  -3.002   7.164
  221   1HB   ASN  32          1HB       ASN  32   5.397  -3.243   9.849
  222   2HB   ASN  32          2HB       ASN  32   3.849  -2.389   9.821
  223   1HD2  ASN  32          1HD2      ASN  32   5.341  -5.233   8.270
  224   2HD2  ASN  32          2HD2      ASN  32   4.036  -6.339   8.542
  225    H    ASN  33           H        ASN  33   6.816  -1.012   7.615
  226    HA   ASN  33           HA       ASN  33   5.245   1.310   8.331
  227   1HB   ASN  33          1HB       ASN  33   7.560   0.726   9.351
  228   2HB   ASN  33          2HB       ASN  33   8.251   1.216   7.796
  229   1HD2  ASN  33          1HD2      ASN  33   9.253   2.647   9.588
  230   2HD2  ASN  33          2HD2      ASN  33   8.527   4.204   9.814
  231    H    ARG  34           H        ARG  34   7.061  -0.269   5.696
  232    HA   ARG  34           HA       ARG  34   7.009   2.069   4.066
  233   1HB   ARG  34          1HB       ARG  34   7.619  -0.757   3.126
  234   2HB   ARG  34          2HB       ARG  34   8.248   0.764   2.473
  235   1HG   ARG  34          1HG       ARG  34   8.996   0.771   5.189
  236   2HG   ARG  34          2HG       ARG  34   9.274  -0.898   4.656
  237   1HD   ARG  34          1HD       ARG  34  10.962  -0.289   3.219
  238   2HD   ARG  34          2HD       ARG  34  10.202   1.252   2.791
  239    HE   ARG  34           HE       ARG  34  11.088   1.248   5.548
  240   1HH1  ARG  34          1HH1      ARG  34  12.259   1.556   2.244
  241   2HH1  ARG  34          2HH1      ARG  34  13.645   2.496   2.688
  242   1HH2  ARG  34          1HH2      ARG  34  12.916   2.488   6.134
  243   2HH2  ARG  34          2HH2      ARG  34  14.021   3.029   4.916
  244    H    GLY  35           H        GLY  35   4.984  -0.708   4.755
  245   1HA   GLY  35          1HA       GLY  35   2.666  -0.413   4.015
  246   2HA   GLY  35          2HA       GLY  35   3.290  -0.054   2.417
  247    H    CYS  36           H        CYS  36   5.102  -2.453   4.196
  248    HA   CYS  36           HA       CYS  36   3.726  -4.545   2.672
  249   1HB   CYS  36          1HB       CYS  36   6.657  -4.536   3.373
  250   2HB   CYS  36          2HB       CYS  36   5.802  -5.663   2.318
  251    H    CYS  37           H        CYS  37   3.830  -6.727   3.756
  252    HA   CYS  37           HA       CYS  37   3.788  -6.355   6.651
  253   1HB   CYS  37          1HB       CYS  37   1.900  -7.411   4.998
  254   2HB   CYS  37          2HB       CYS  37   2.740  -8.869   5.533
  255    H    PHE  38           H        PHE  38   5.386  -7.325   7.877
  256    HA   PHE  38           HA       PHE  38   7.332  -8.926   6.445
  257   1HB   PHE  38          1HB       PHE  38   7.807  -6.952   8.040
  258   2HB   PHE  38          2HB       PHE  38   7.193  -7.953   9.360
  259    HD1  PHE  38           HD1      PHE  38   8.499  -9.822  10.195
  260    HD2  PHE  38           HD2      PHE  38   9.948  -7.416   7.013
  261    HE1  PHE  38           HE1      PHE  38  10.794 -10.789  10.508
  262    HE2  PHE  38           HE2      PHE  38  12.243  -8.383   7.327
  263    HZ   PHE  38           HZ       PHE  38  12.638 -10.057   9.070
  264    H    ASP  39           H        ASP  39   7.217 -11.115   6.423
  265    HA   ASP  39           HA       ASP  39   5.433 -12.398   8.231
  266   1HB   ASP  39          1HB       ASP  39   5.541 -13.226   5.970
  267   2HB   ASP  39          2HB       ASP  39   7.305 -13.380   6.036
  268    H    SER  40           H        SER  40   8.729 -13.526   7.227
  269    HA   SER  40           HA       SER  40  10.577 -13.794   8.428
  270   1HB   SER  40          1HB       SER  40   9.373 -12.122  10.147
  271   2HB   SER  40          2HB       SER  40   9.261 -13.598  11.122
  272    HG   SER  40           HG       SER  40  11.281 -13.176  11.673
  273    H    ARG  41           H        ARG  41   7.492 -15.300   8.835
  274    HA   ARG  41           HA       ARG  41   8.108 -17.374  10.516
  275   1HB   ARG  41          1HB       ARG  41   6.209 -17.168   8.146
  276   2HB   ARG  41          2HB       ARG  41   6.246 -18.596   9.193
  277   1HG   ARG  41          1HG       ARG  41   6.141 -16.362  10.932
  278   2HG   ARG  41          2HG       ARG  41   4.987 -16.000   9.638
  279   1HD   ARG  41          1HD       ARG  41   3.803 -17.204  11.370
  280   2HD   ARG  41          2HD       ARG  41   3.995 -18.318  10.007
  281    HE   ARG  41           HE       ARG  41   6.239 -18.710  11.659
  282   1HH1  ARG  41          1HH1      ARG  41   2.748 -19.013  11.965
  283   2HH1  ARG  41          2HH1      ARG  41   2.832 -20.273  13.151
  284   1HH2  ARG  41          1HH2      ARG  41   6.352 -20.371  13.223
  285   2HH2  ARG  41          2HH2      ARG  41   4.897 -21.051  13.871
  286    H    ILE  42           H        ILE  42   8.067 -17.355   6.867
  287    HA   ILE  42           HA       ILE  42   9.905 -19.640   6.965
  288    HB   ILE  42           HB       ILE  42   8.588 -18.988   4.422
  289   1HG1  ILE  42          1HG1      ILE  42   6.952 -19.913   6.791
  290   2HG1  ILE  42          2HG1      ILE  42   6.752 -18.394   5.903
  291   1HG2  ILE  42          1HG2      ILE  42   8.202 -21.652   5.516
  292   2HG2  ILE  42          2HG2      ILE  42   9.032 -21.131   4.030
  293   3HG2  ILE  42          3HG2      ILE  42   9.908 -21.149   5.581
  294   1HD1  ILE  42          1HD1      ILE  42   6.270 -21.232   4.909
  295   2HD1  ILE  42          2HD1      ILE  42   5.091 -19.907   5.048
  296   3HD1  ILE  42          3HD1      ILE  42   6.367 -19.834   3.811
  297    HA   PRO  43           HA       PRO  43  12.855 -16.813   5.475
  298   1HB   PRO  43          1HB       PRO  43  14.958 -18.545   5.306
  299   2HB   PRO  43          2HB       PRO  43  14.506 -17.722   6.797
  300   1HG   PRO  43          1HG       PRO  43  14.055 -20.514   5.960
  301   2HG   PRO  43          2HG       PRO  43  14.031 -19.822   7.622
  302   1HD   PRO  43          1HD       PRO  43  11.812 -20.604   5.988
  303   2HD   PRO  43          2HD       PRO  43  11.734 -19.780   7.551
  304    H    GLY  44           H        GLY  44  11.618 -19.494   3.862
  305   1HA   GLY  44          1HA       GLY  44  13.125 -18.962   1.424
  306   2HA   GLY  44          2HA       GLY  44  11.959 -20.239   1.706
  307    H    VAL  45           H        VAL  45  10.333 -17.740   3.022
  308    HA   VAL  45           HA       VAL  45   9.089 -17.058   0.454
  309    HB   VAL  45           HB       VAL  45   8.036 -18.153   2.769
  310   1HG1  VAL  45          1HG1      VAL  45   6.401 -16.359   3.505
  311   2HG1  VAL  45          2HG1      VAL  45   8.086 -16.134   4.033
  312   3HG1  VAL  45          3HG1      VAL  45   7.444 -15.183   2.672
  313   1HG2  VAL  45          1HG2      VAL  45   6.526 -18.589   1.187
  314   2HG2  VAL  45          2HG2      VAL  45   5.898 -16.934   1.381
  315   3HG2  VAL  45          3HG2      VAL  45   7.153 -17.273   0.165
  316    HA   PRO  46           HA       PRO  46   9.953 -12.872   1.105
  317   1HB   PRO  46          1HB       PRO  46   7.679 -11.555   0.356
  318   2HB   PRO  46          2HB       PRO  46   8.841 -12.205  -0.799
  319   1HG   PRO  46          1HG       PRO  46   6.200 -13.237   0.022
  320   2HG   PRO  46          2HG       PRO  46   7.143 -13.616  -1.466
  321   1HD   PRO  46          1HD       PRO  46   6.776 -15.231   0.870
  322   2HD   PRO  46          2HD       PRO  46   7.841 -15.581  -0.497
  323    H    TRP  47           H        TRP  47  10.494 -12.091   3.039
  324    HA   TRP  47           HA       TRP  47   8.409 -12.086   5.047
  325   1HB   TRP  47          1HB       TRP  47  10.917 -10.875   5.822
  326   2HB   TRP  47          2HB       TRP  47  10.066 -12.261   6.503
  327    HD1  TRP  47           HD1      TRP  47  10.587 -14.696   5.108
  328    HE1  TRP  47           HE1      TRP  47  12.811 -15.626   4.034
  329    HE3  TRP  47           HE3      TRP  47  12.926 -10.193   4.764
  330    HZ2  TRP  47           HZ2      TRP  47  15.243 -14.402   3.180
  331    HZ3  TRP  47           HZ3      TRP  47  15.224 -10.149   3.799
  332    HH2  TRP  47           HH2      TRP  47  16.381 -12.157   3.021
  333    H    CYS  48           H        CYS  48   8.186 -10.372   2.605
  334    HA   CYS  48           HA       CYS  48   7.456  -7.995   3.919
  335   1HB   CYS  48          1HB       CYS  48   9.973  -7.748   3.728
  336   2HB   CYS  48          2HB       CYS  48   9.738  -7.626   1.982
  337    H    PHE  49           H        PHE  49   5.451  -8.191   2.889
  338    HA   PHE  49           HA       PHE  49   5.510  -7.836   0.000
  339   1HB   PHE  49          1HB       PHE  49   3.426  -9.545   0.223
  340   2HB   PHE  49          2HB       PHE  49   5.068 -10.162   0.015
  341    HD1  PHE  49           HD1      PHE  49   6.368 -10.424   2.355
  342    HD2  PHE  49           HD2      PHE  49   2.154 -10.506   1.865
  343    HE1  PHE  49           HE1      PHE  49   6.144 -11.708   4.500
  344    HE2  PHE  49           HE2      PHE  49   1.930 -11.791   4.010
  345    HZ   PHE  49           HZ       PHE  49   3.927 -12.377   5.301
  346    H    LYS  50           H        LYS  50   2.797  -7.887  -0.535
  347    HA   LYS  50           HA       LYS  50   1.749  -5.873   1.331
  348   1HB   LYS  50          1HB       LYS  50   0.606  -5.555  -1.256
  349   2HB   LYS  50          2HB       LYS  50   1.610  -4.419  -0.340
  350   1HG   LYS  50          1HG       LYS  50   2.862  -6.724  -1.848
  351   2HG   LYS  50          2HG       LYS  50   2.416  -5.241  -2.708
  352   1HD   LYS  50          1HD       LYS  50   4.378  -5.571  -0.410
  353   2HD   LYS  50          2HD       LYS  50   4.727  -5.001  -2.053
  354   1HE   LYS  50          1HE       LYS  50   3.277  -3.576   0.196
  355   2HE   LYS  50          2HE       LYS  50   4.680  -3.021  -0.729
  356   1HZ   LYS  50          1HZ       LYS  50   2.489  -2.025  -1.312
  357   2HZ   LYS  50          2HZ       LYS  50   3.320  -2.646  -2.573
  358   3HZ   LYS  50          3HZ       LYS  50   2.052  -3.464  -1.949
  359    HA   PRO  51           HA       PRO  51  -1.071  -9.412   1.142
  360   1HB   PRO  51          1HB       PRO  51  -1.207  -9.912   3.824
  361   2HB   PRO  51          2HB       PRO  51  -0.112 -10.765   2.739
  362   1HG   PRO  51          1HG       PRO  51   0.435  -8.607   4.673
  363   2HG   PRO  51          2HG       PRO  51   1.590  -9.777   3.942
  364   1HD   PRO  51          1HD       PRO  51   1.221  -7.009   3.308
  365   2HD   PRO  51          2HD       PRO  51   2.258  -8.159   2.452
  366    H    LEU  52           H        LEU  52  -1.782  -8.318   4.311
  367    HA   LEU  52           HA       LEU  52  -4.245  -7.193   3.241
  368   1HB   LEU  52          1HB       LEU  52  -5.234  -7.822   5.126
  369   2HB   LEU  52          2HB       LEU  52  -3.858  -8.933   5.236
  370    HG   LEU  52           HG       LEU  52  -2.897  -6.716   6.526
  371   1HD1  LEU  52          1HD1      LEU  52  -5.271  -6.684   8.079
  372   2HD1  LEU  52          2HD1      LEU  52  -4.504  -5.346   7.193
  373   3HD1  LEU  52          3HD1      LEU  52  -5.731  -6.356   6.391
  374   1HD2  LEU  52          1HD2      LEU  52  -2.546  -8.262   8.080
  375   2HD2  LEU  52          2HD2      LEU  52  -4.289  -8.400   8.413
  376   3HD2  LEU  52          3HD2      LEU  52  -3.549  -9.381   7.126
  377    H    GLN  53           H        GLN  53  -1.710  -5.796   2.807
  378    HA   GLN  53           HA       GLN  53  -1.170  -3.877   4.653
  379   1HB   GLN  53          1HB       GLN  53  -1.099  -3.727   1.617
  380   2HB   GLN  53          2HB       GLN  53  -0.344  -2.523   2.676
  381   1HG   GLN  53          1HG       GLN  53   0.297  -5.501   2.558
  382   2HG   GLN  53          2HG       GLN  53   1.317  -4.196   1.932
  383   1HE2  GLN  53          1HE2      GLN  53   1.049  -2.319   3.928
  384   2HE2  GLN  53          2HE2      GLN  53   1.784  -2.879   5.392
  385    H    GLU  54           H        GLU  54  -4.016  -4.274   2.662
  386    HA   GLU  54           HA       GLU  54  -4.932  -1.855   2.145
  387   1HB   GLU  54          1HB       GLU  54  -7.084  -2.760   2.146
  388   2HB   GLU  54          2HB       GLU  54  -6.077  -4.213   2.019
  389   1HG   GLU  54          1HG       GLU  54  -7.481  -4.865   3.734
  390   2HG   GLU  54          2HG       GLU  54  -6.215  -4.090   4.698
  391    H    ALA  55           H        ALA  55  -4.366  -3.197   5.366
  392    HA   ALA  55           HA       ALA  55  -5.920  -1.904   7.062
  393   1HB   ALA  55          1HB       ALA  55  -3.122  -2.766   7.017
  394   2HB   ALA  55          2HB       ALA  55  -3.384  -1.397   8.124
  395   3HB   ALA  55          3HB       ALA  55  -4.330  -2.892   8.318
  396    H    GLU  56           H        GLU  56  -2.852  -0.311   5.924
  397    HA   GLU  56           HA       GLU  56  -4.371   2.155   5.772
  398   1HB   GLU  56          1HB       GLU  56  -2.060   1.557   7.564
  399   2HB   GLU  56          2HB       GLU  56  -2.044   3.139   6.767
  400   1HG   GLU  56          1HG       GLU  56  -3.866   3.893   7.948
  401   2HG   GLU  56          2HG       GLU  56  -4.645   2.303   7.989
  402    H    CYS  57           H        CYS  57  -3.259   0.142   3.817
  403    HA   CYS  57           HA       CYS  57  -1.218   1.805   2.550
  404   1HB   CYS  57          1HB       CYS  57  -0.917  -0.720   3.084
  405   2HB   CYS  57          2HB       CYS  57  -1.922  -0.971   1.654
  406    H    THR  58           H        THR  58  -4.256  -0.098   1.958
  407    HA   THR  58           HA       THR  58  -4.623   1.119  -0.625
  408    HB   THR  58           HB       THR  58  -5.260  -1.293   0.277
  409    HG1  THR  58           HG1      THR  58  -5.803  -0.297  -1.827
  410   1HG2  THR  58          1HG2      THR  58  -7.711  -1.355   0.879
  411   2HG2  THR  58          2HG2      THR  58  -6.724  -0.595   2.151
  412   3HG2  THR  58          3HG2      THR  58  -7.684   0.417   1.046
  413    H    PHE  59           H        PHE  59  -5.926   1.512   2.695
  414    HA   PHE  59           HA       PHE  59  -8.093   2.970   2.413
  415   1HB   PHE  59          1HB       PHE  59  -6.614   2.499   4.476
  416   2HB   PHE  59          2HB       PHE  59  -5.627   3.888   4.007
  417    HD1  PHE  59           HD1      PHE  59  -9.195   3.020   4.695
  418    HD2  PHE  59           HD2      PHE  59  -6.111   5.920   4.981
  419    HE1  PHE  59           HE1      PHE  59 -10.733   4.528   5.985
  420    HE2  PHE  59           HE2      PHE  59  -7.648   7.428   6.271
  421    HZ   PHE  59           HZ       PHE  59  -9.941   6.714   6.757
  422   1H    GLU   1           H1       GLU   1 -17.508  -5.323  -1.182
  423    HA   GLU   1           HA       GLU   1 -19.281  -3.599   0.366
  424   1HB   GLU   1          1HB       GLU   1 -16.648  -4.345   1.018
  425   2HB   GLU   1          2HB       GLU   1 -16.499  -2.698   0.379
  426   1HG   GLU   1          1HG       GLU   1 -17.176  -1.963   2.402
  427   2HG   GLU   1          2HG       GLU   1 -18.779  -2.618   2.038
  428    H    GLU   2           H        GLU   2 -19.114  -1.239  -0.239
  429    HA   GLU   2           HA       GLU   2 -18.954  -1.077  -3.092
  430   1HB   GLU   2          1HB       GLU   2 -19.945   0.717  -0.880
  431   2HB   GLU   2          2HB       GLU   2 -19.693   1.387  -2.501
  432   1HG   GLU   2          1HG       GLU   2 -21.734   0.600  -3.045
  433   2HG   GLU   2          2HG       GLU   2 -21.083  -1.041  -2.914
  434    H    TYR   3           H        TYR   3 -16.537  -1.497  -3.070
  435    HA   TYR   3           HA       TYR   3 -14.922   0.683  -2.065
  436   1HB   TYR   3          1HB       TYR   3 -14.682  -2.079  -3.269
  437   2HB   TYR   3          2HB       TYR   3 -13.300  -1.012  -3.536
  438    HD1  TYR   3           HD1      TYR   3 -12.616   0.304  -1.223
  439    HD2  TYR   3           HD2      TYR   3 -14.503  -3.526  -1.490
  440    HE1  TYR   3           HE1      TYR   3 -11.733  -0.300   1.084
  441    HE2  TYR   3           HE2      TYR   3 -13.614  -4.118   0.817
  442    HH   TYR   3           HH       TYR   3 -11.346  -3.113   2.183
  443    H    VAL   4           H        VAL   4 -15.941   2.363  -3.470
  444    HA   VAL   4           HA       VAL   4 -14.866   2.191  -6.202
  445    HB   VAL   4           HB       VAL   4 -16.697   3.638  -6.880
  446   1HG1  VAL   4          1HG1      VAL   4 -17.126   0.959  -5.696
  447   2HG1  VAL   4          2HG1      VAL   4 -18.604   1.903  -5.999
  448   3HG1  VAL   4          3HG1      VAL   4 -17.476   1.565  -7.333
  449   1HG2  VAL   4          1HG2      VAL   4 -17.183   4.954  -4.979
  450   2HG2  VAL   4          2HG2      VAL   4 -18.626   3.941  -5.223
  451   3HG2  VAL   4          3HG2      VAL   4 -17.451   3.526  -3.952
  452    H    GLY   5           H        GLY   5 -15.751   4.441  -3.493
  453   1HA   GLY   5          1HA       GLY   5 -14.196   6.595  -4.517
  454   2HA   GLY   5          2HA       GLY   5 -14.904   6.452  -2.920
  455    H    LEU   6           H        LEU   6 -13.177   3.605  -3.421
  456    HA   LEU   6           HA       LEU   6 -10.680   4.780  -2.433
  457   1HB   LEU   6          1HB       LEU   6 -11.408   2.195  -1.271
  458   2HB   LEU   6          2HB       LEU   6 -10.664   3.623  -0.527
  459    HG   LEU   6           HG       LEU   6 -12.997   4.649  -0.534
  460   1HD1  LEU   6          1HD1      LEU   6 -14.724   3.583  -1.426
  461   2HD1  LEU   6          2HD1      LEU   6 -13.603   2.332  -2.015
  462   3HD1  LEU   6          3HD1      LEU   6 -14.403   2.139  -0.436
  463   1HD2  LEU   6          1HD2      LEU   6 -12.284   2.255   1.166
  464   2HD2  LEU   6          2HD2      LEU   6 -12.081   3.985   1.537
  465   3HD2  LEU   6          3HD2      LEU   6 -13.711   3.273   1.477
  466    H    SER   7           H        SER   7 -12.063   3.408  -4.980
  467    HA   SER   7           HA       SER   7  -9.971   1.412  -5.319
  468   1HB   SER   7          1HB       SER   7 -12.775   1.481  -5.979
  469   2HB   SER   7          2HB       SER   7 -11.847   1.313  -7.478
  470    HG   SER   7           HG       SER   7 -11.449  -0.332  -5.129
  471    H    ALA   8           H        ALA   8 -10.049   1.313  -8.193
  472    HA   ALA   8           HA       ALA   8  -8.243   3.324  -8.829
  473   1HB   ALA   8          1HB       ALA   8  -9.638   1.100 -10.142
  474   2HB   ALA   8          2HB       ALA   8  -9.335   2.466 -11.243
  475   3HB   ALA   8          3HB       ALA   8  -7.980   1.703 -10.377
  476    H    ASN   9           H        ASN   9  -9.158   5.349  -8.130
  477    HA   ASN   9           HA       ASN   9 -10.214   6.866 -10.063
  478   1HB   ASN   9          1HB       ASN   9 -12.309   5.742 -10.165
  479   2HB   ASN   9          2HB       ASN   9 -12.389   5.522  -8.410
  480   1HD2  ASN   9          1HD2      ASN   9 -11.573   8.391 -10.329
  481   2HD2  ASN   9          2HD2      ASN   9 -12.867   9.406  -9.782
  482    H    GLN  10           H        GLN  10 -10.117   5.937  -6.626
  483    HA   GLN  10           HA       GLN  10 -10.750   8.437  -5.565
  484   1HB   GLN  10          1HB       GLN  10 -10.824   6.280  -4.321
  485   2HB   GLN  10          2HB       GLN  10  -9.052   6.218  -4.340
  486   1HG   GLN  10          1HG       GLN  10  -9.007   8.404  -3.123
  487   2HG   GLN  10          2HG       GLN  10 -10.776   8.386  -3.050
  488   1HE2  GLN  10          1HE2      GLN  10  -8.254   5.905  -2.638
  489   2HE2  GLN  10          2HE2      GLN  10  -8.722   5.376  -1.056
  490    H    CYS  11           H        CYS  11  -7.784   7.010  -6.889
  491    HA   CYS  11           HA       CYS  11  -5.970   8.765  -5.686
  492   1HB   CYS  11          1HB       CYS  11  -5.223   6.716  -6.655
  493   2HB   CYS  11          2HB       CYS  11  -5.834   7.169  -8.249
  494    H    ALA  12           H        ALA  12  -8.557   9.340  -7.789
  495    HA   ALA  12           HA       ALA  12  -7.206  11.633  -9.030
  496   1HB   ALA  12          1HB       ALA  12  -8.881   9.586 -10.074
  497   2HB   ALA  12          2HB       ALA  12  -9.836  11.088 -10.091
  498   3HB   ALA  12          3HB       ALA  12  -8.260  11.025 -10.916
  499    H    VAL  13           H        VAL  13  -8.534  11.083  -6.207
  500    HA   VAL  13           HA       VAL  13 -10.860  12.359  -5.845
  501    HB   VAL  13           HB       VAL  13  -8.665  11.583  -4.299
  502   1HG1  VAL  13          1HG1      VAL  13  -7.799  13.841  -4.228
  503   2HG1  VAL  13          2HG1      VAL  13  -9.393  14.481  -3.761
  504   3HG1  VAL  13          3HG1      VAL  13  -8.490  13.436  -2.638
  505   1HG2  VAL  13          1HG2      VAL  13 -10.333  11.028  -2.917
  506   2HG2  VAL  13          2HG2      VAL  13 -10.831  12.726  -2.723
  507   3HG2  VAL  13          3HG2      VAL  13 -11.446  11.770  -4.092
  508    HA   PRO  14           HA       PRO  14 -10.410  16.521  -6.914
  509   1HB   PRO  14          1HB       PRO  14 -11.991  17.818  -5.102
  510   2HB   PRO  14          2HB       PRO  14 -12.631  16.975  -6.512
  511   1HG   PRO  14          1HG       PRO  14 -12.593  16.167  -3.675
  512   2HG   PRO  14          2HG       PRO  14 -13.646  15.557  -5.002
  513   1HD   PRO  14          1HD       PRO  14 -11.386  14.280  -3.792
  514   2HD   PRO  14          2HD       PRO  14 -12.290  13.711  -5.201
  515    H    ALA  15           H        ALA  15  -8.369  15.405  -5.130
  516    HA   ALA  15           HA       ALA  15  -6.711  16.097  -3.828
  517   1HB   ALA  15          1HB       ALA  15  -6.434  17.432  -5.990
  518   2HB   ALA  15          2HB       ALA  15  -7.134  18.815  -5.116
  519   3HB   ALA  15          3HB       ALA  15  -5.608  18.089  -4.556
  520    H    LYS  16           H        LYS  16  -8.338  15.779  -2.003
  521    HA   LYS  16           HA       LYS  16  -8.026  17.554  -0.033
  522   1HB   LYS  16          1HB       LYS  16 -10.386  18.686  -0.076
  523   2HB   LYS  16          2HB       LYS  16  -9.020  19.416  -0.937
  524   1HG   LYS  16          1HG       LYS  16 -10.071  19.182  -2.919
  525   2HG   LYS  16          2HG       LYS  16 -10.378  17.461  -2.629
  526   1HD   LYS  16          1HD       LYS  16 -12.554  18.221  -2.698
  527   2HD   LYS  16          2HD       LYS  16 -12.246  18.472  -0.972
  528   1HE   LYS  16          1HE       LYS  16 -11.549  20.840  -1.528
  529   2HE   LYS  16          2HE       LYS  16 -12.061  20.556  -3.198
  530   1HZ   LYS  16          1HZ       LYS  16 -14.238  19.883  -2.120
  531   2HZ   LYS  16          2HZ       LYS  16 -13.693  20.638  -0.778
  532   3HZ   LYS  16          3HZ       LYS  16 -13.884  21.477  -2.166
  533    H    ASP  17           H        ASP  17  -8.084  14.863  -0.170
  534    HA   ASP  17           HA       ASP  17 -10.116  14.278   1.700
  535   1HB   ASP  17          1HB       ASP  17 -11.255  14.021  -0.583
  536   2HB   ASP  17          2HB       ASP  17 -10.151  12.673  -0.892
  537    H    ARG  18           H        ARG  18  -7.384  13.503  -0.414
  538    HA   ARG  18           HA       ARG  18  -6.808  10.960   0.212
  539   1HB   ARG  18          1HB       ARG  18  -4.810  13.261   0.035
  540   2HB   ARG  18          2HB       ARG  18  -4.423  11.551  -0.220
  541   1HG   ARG  18          1HG       ARG  18  -5.318  11.539  -2.320
  542   2HG   ARG  18          2HG       ARG  18  -6.669  12.596  -1.875
  543   1HD   ARG  18          1HD       ARG  18  -5.204  14.561  -1.979
  544   2HD   ARG  18          2HD       ARG  18  -3.791  13.541  -2.281
  545    HE   ARG  18           HE       ARG  18  -6.020  13.277  -4.206
  546   1HH1  ARG  18          1HH1      ARG  18  -2.918  14.763  -3.464
  547   2HH1  ARG  18          2HH1      ARG  18  -2.569  15.160  -5.114
  548   1HH2  ARG  18          1HH2      ARG  18  -5.560  13.799  -6.382
  549   2HH2  ARG  18          2HH2      ARG  18  -4.081  14.607  -6.785
  550    H    VAL  19           H        VAL  19  -4.558  10.466   1.610
  551    HA   VAL  19           HA       VAL  19  -5.139  11.523   4.290
  552    HB   VAL  19           HB       VAL  19  -3.948   8.848   3.538
  553   1HG1  VAL  19          1HG1      VAL  19  -5.040   8.663   6.076
  554   2HG1  VAL  19          2HG1      VAL  19  -3.314   8.875   5.691
  555   3HG1  VAL  19          3HG1      VAL  19  -4.325  10.293   6.062
  556   1HG2  VAL  19          1HG2      VAL  19  -6.369   8.252   4.626
  557   2HG2  VAL  19          2HG2      VAL  19  -6.759   9.753   3.752
  558   3HG2  VAL  19          3HG2      VAL  19  -6.057   8.370   2.878
  559    H    ASP  20           H        ASP  20  -3.332  12.500   1.984
  560    HA   ASP  20           HA       ASP  20  -1.213  13.002   1.608
  561   1HB   ASP  20          1HB       ASP  20  -1.565  14.905   2.860
  562   2HB   ASP  20          2HB       ASP  20  -1.994  14.003   4.322
  563    H    CYS  21           H        CYS  21  -0.112  10.942   1.365
  564    HA   CYS  21           HA       CYS  21   0.564   9.235   3.393
  565   1HB   CYS  21          1HB       CYS  21   0.819   9.175   0.745
  566   2HB   CYS  21          2HB       CYS  21   2.493   9.565   1.150
  567    H    GLY  22           H        GLY  22   2.052  12.284   2.274
  568   1HA   GLY  22          1HA       GLY  22   3.720  13.547   3.093
  569   2HA   GLY  22          2HA       GLY  22   3.349  12.844   4.656
  570    H    TYR  23           H        TYR  23   4.781  11.584   1.550
  571    HA   TYR  23           HA       TYR  23   6.728  10.111   3.120
  572   1HB   TYR  23          1HB       TYR  23   5.243   9.748   0.768
  573   2HB   TYR  23          2HB       TYR  23   6.813  10.236   0.120
  574    HD1  TYR  23           HD1      TYR  23   7.724   8.285  -0.796
  575    HD2  TYR  23           HD2      TYR  23   6.001   8.141   3.117
  576    HE1  TYR  23           HE1      TYR  23   8.557   5.900  -0.509
  577    HE2  TYR  23           HE2      TYR  23   6.840   5.756   3.391
  578    HH   TYR  23           HH       TYR  23   7.521   3.936   2.138
  579    HA   PRO  24           HA       PRO  24   9.813  13.090   2.435
  580   1HB   PRO  24          1HB       PRO  24  11.964  11.669   3.334
  581   2HB   PRO  24          2HB       PRO  24  10.872  12.541   4.405
  582   1HG   PRO  24          1HG       PRO  24  11.070   9.652   3.841
  583   2HG   PRO  24          2HG       PRO  24  10.312  10.471   5.255
  584   1HD   PRO  24          1HD       PRO  24   9.028   9.246   3.007
  585   2HD   PRO  24          2HD       PRO  24   8.246  10.179   4.289
  586    H    HIS  25           H        HIS  25   9.373  10.342   0.686
  587    HA   HIS  25           HA       HIS  25  11.492  11.212  -1.140
  588   1HB   HIS  25          1HB       HIS  25  10.729   8.459  -0.231
  589   2HB   HIS  25          2HB       HIS  25  11.405   8.690  -1.848
  590    HD1  HIS  25           HD1      HIS  25  13.920   9.304  -2.016
  591    HD2  HIS  25           HD2      HIS  25  12.520   8.906   1.917
  592    HE1  HIS  25           HE1      HIS  25  15.989   9.248  -0.524
  593    HE2  HIS  25           HE2      HIS  25  15.063   9.057   1.886
  594    H    VAL  26           H        VAL  26   8.519  11.865  -0.781
  595    HA   VAL  26           HA       VAL  26   6.874  10.633  -2.525
  596    HB   VAL  26           HB       VAL  26   5.998  12.349  -1.238
  597   1HG1  VAL  26          1HG1      VAL  26   7.268  14.037  -0.528
  598   2HG1  VAL  26          2HG1      VAL  26   8.502  13.646  -1.750
  599   3HG1  VAL  26          3HG1      VAL  26   7.183  14.774  -2.145
  600   1HG2  VAL  26          1HG2      VAL  26   4.735  13.574  -2.733
  601   2HG2  VAL  26          2HG2      VAL  26   6.117  13.901  -3.805
  602   3HG2  VAL  26          3HG2      VAL  26   5.359  12.290  -3.795
  603    H    THR  27           H        THR  27   6.901  10.140  -4.657
  604    HA   THR  27           HA       THR  27   7.868  11.972  -6.597
  605    HB   THR  27           HB       THR  27   9.769  10.112  -5.373
  606    HG1  THR  27           HG1      THR  27   9.639  12.137  -7.487
  607   1HG2  THR  27          1HG2      THR  27  10.347   8.729  -7.106
  608   2HG2  THR  27          2HG2      THR  27   8.764   9.117  -7.820
  609   3HG2  THR  27          3HG2      THR  27  10.204  10.054  -8.285
  610    HA   PRO  28           HA       PRO  28   5.238   9.528  -8.946
  611   1HB   PRO  28          1HB       PRO  28   5.972  10.230 -11.481
  612   2HB   PRO  28          2HB       PRO  28   4.916  11.219 -10.475
  613   1HG   PRO  28          1HG       PRO  28   7.769  11.563 -11.143
  614   2HG   PRO  28          2HG       PRO  28   6.601  12.793 -10.538
  615   1HD   PRO  28          1HD       PRO  28   8.693  11.467  -9.101
  616   2HD   PRO  28          2HD       PRO  28   7.469  12.548  -8.423
  617    H    LYS  29           H        LYS  29   7.163   7.976  -7.847
  618    HA   LYS  29           HA       LYS  29   7.150   5.817  -9.592
  619   1HB   LYS  29          1HB       LYS  29   8.714   7.099 -10.939
  620   2HB   LYS  29          2HB       LYS  29   9.798   7.296  -9.552
  621   1HG   LYS  29          1HG       LYS  29  10.639   5.199  -9.781
  622   2HG   LYS  29          2HG       LYS  29   9.046   4.481 -10.071
  623   1HD   LYS  29          1HD       LYS  29   9.730   6.125 -12.330
  624   2HD   LYS  29          2HD       LYS  29  11.120   5.083 -11.975
  625   1HE   LYS  29          1HE       LYS  29   9.902   3.120 -12.358
  626   2HE   LYS  29          2HE       LYS  29   8.343   3.884 -12.013
  627   1HZ   LYS  29          1HZ       LYS  29   8.173   4.528 -14.114
  628   2HZ   LYS  29          2HZ       LYS  29   9.729   5.009 -14.236
  629   3HZ   LYS  29          3HZ       LYS  29   9.341   3.437 -14.450
  630    H    GLU  30           H        GLU  30   8.254   7.607  -6.788
  631    HA   GLU  30           HA       GLU  30   9.254   5.190  -5.569
  632   1HB   GLU  30          1HB       GLU  30   9.686   8.034  -5.242
  633   2HB   GLU  30          2HB       GLU  30   9.240   7.321  -3.683
  634   1HG   GLU  30          1HG       GLU  30  11.543   6.993  -3.683
  635   2HG   GLU  30          2HG       GLU  30  11.005   5.460  -4.386
  636    H    CYS  31           H        CYS  31   6.630   7.644  -5.195
  637    HA   CYS  31           HA       CYS  31   5.530   6.573  -2.881
  638   1HB   CYS  31          1HB       CYS  31   4.531   8.331  -5.080
  639   2HB   CYS  31          2HB       CYS  31   3.380   7.689  -3.907
  640    H    ASN  32           H        ASN  32   4.524   6.205  -6.367
  641    HA   ASN  32           HA       ASN  32   2.611   4.297  -5.881
  642   1HB   ASN  32          1HB       ASN  32   4.219   5.216  -8.235
  643   2HB   ASN  32          2HB       ASN  32   3.438   3.638  -8.411
  644   1HD2  ASN  32          1HD2      ASN  32   2.643   6.782  -6.925
  645   2HD2  ASN  32          2HD2      ASN  32   1.085   6.981  -7.656
  646    H    ASN  33           H        ASN  33   5.983   4.142  -5.436
  647    HA   ASN  33           HA       ASN  33   6.117   1.324  -6.096
  648   1HB   ASN  33          1HB       ASN  33   8.011   2.529  -6.933
  649   2HB   ASN  33          2HB       ASN  33   8.204   3.446  -5.432
  650   1HD2  ASN  33          1HD2      ASN  33   9.978   2.887  -4.444
  651   2HD2  ASN  33          2HD2      ASN  33  10.608   1.287  -4.234
  652    H    ARG  34           H        ARG  34   6.027   3.696  -3.458
  653    HA   ARG  34           HA       ARG  34   6.869   1.751  -1.526
  654   1HB   ARG  34          1HB       ARG  34   7.126   3.534  -0.069
  655   2HB   ARG  34          2HB       ARG  34   7.240   4.422  -1.600
  656   1HG   ARG  34          1HG       ARG  34   5.631   5.708  -0.587
  657   2HG   ARG  34          2HG       ARG  34   4.550   4.480  -1.271
  658   1HD   ARG  34          1HD       ARG  34   5.465   3.429   1.203
  659   2HD   ARG  34          2HD       ARG  34   5.082   5.127   1.525
  660    HE   ARG  34           HE       ARG  34   2.946   4.113  -0.003
  661   1HH1  ARG  34          1HH1      ARG  34   4.420   3.428   3.117
  662   2HH1  ARG  34          2HH1      ARG  34   2.951   2.847   3.827
  663   1HH2  ARG  34          1HH2      ARG  34   1.007   3.348   0.933
  664   2HH2  ARG  34          2HH2      ARG  34   0.996   2.802   2.577
  665    H    GLY  35           H        GLY  35   3.935   3.122  -2.916
  666   1HA   GLY  35          1HA       GLY  35   1.980   1.651  -2.587
  667   2HA   GLY  35          2HA       GLY  35   2.317   1.725  -0.869
  668    H    CYS  36           H        CYS  36   2.951   4.609  -2.798
  669    HA   CYS  36           HA       CYS  36   0.476   5.766  -1.732
  670   1HB   CYS  36          1HB       CYS  36   3.183   7.068  -2.030
  671   2HB   CYS  36          2HB       CYS  36   1.699   7.921  -1.598
  672    H    CYS  37           H        CYS  37  -0.211   7.761  -3.100
  673    HA   CYS  37           HA       CYS  37   0.352   7.144  -5.907
  674   1HB   CYS  37          1HB       CYS  37  -1.998   6.817  -4.973
  675   2HB   CYS  37          2HB       CYS  37  -2.096   8.578  -4.891
  676    H    PHE  38           H        PHE  38   1.341   8.760  -7.100
  677    HA   PHE  38           HA       PHE  38   1.822  11.270  -5.712
  678   1HB   PHE  38          1HB       PHE  38   3.636   9.813  -6.783
  679   2HB   PHE  38          2HB       PHE  38   2.874  10.094  -8.353
  680    HD1  PHE  38           HD1      PHE  38   3.213  12.149  -9.522
  681    HD2  PHE  38           HD2      PHE  38   4.742  11.663  -5.593
  682    HE1  PHE  38           HE1      PHE  38   4.594  14.227  -9.803
  683    HE2  PHE  38           HE2      PHE  38   6.122  13.741  -5.873
  684    HZ   PHE  38           HZ       PHE  38   6.031  14.997  -7.975
  685    H    ASP  39           H        ASP  39   0.633  13.058  -6.163
  686    HA   ASP  39           HA       ASP  39  -1.093  12.957  -8.445
  687   1HB   ASP  39          1HB       ASP  39  -2.041  13.805  -6.400
  688   2HB   ASP  39          2HB       ASP  39  -0.697  14.935  -6.161
  689    H    SER  40           H        SER  40   0.656  15.822  -7.080
  690    HA   SER  40           HA       SER  40   2.287  17.053  -7.941
  691   1HB   SER  40          1HB       SER  40   2.747  14.913  -9.464
  692   2HB   SER  40          2HB       SER  40   2.060  15.944 -10.732
  693    HG   SER  40           HG       SER  40   4.470  16.239  -9.225
  694    H    ARG  41           H        ARG  41  -0.877  16.473  -9.188
  695    HA   ARG  41           HA       ARG  41  -1.068  18.431 -11.108
  696   1HB   ARG  41          1HB       ARG  41  -3.122  17.297  -9.161
  697   2HB   ARG  41          2HB       ARG  41  -3.565  18.381 -10.493
  698   1HG   ARG  41          1HG       ARG  41  -1.987  16.476 -11.750
  699   2HG   ARG  41          2HG       ARG  41  -2.844  15.510 -10.536
  700   1HD   ARG  41          1HD       ARG  41  -4.279  15.470 -12.417
  701   2HD   ARG  41          2HD       ARG  41  -4.991  16.728 -11.394
  702    HE   ARG  41           HE       ARG  41  -3.015  17.742 -13.305
  703   1HH1  ARG  41          1HH1      ARG  41  -6.401  16.904 -12.839
  704   2HH1  ARG  41          2HH1      ARG  41  -6.963  17.936 -14.110
  705   1HH2  ARG  41          1HH2      ARG  41  -3.757  19.103 -14.983
  706   2HH2  ARG  41          2HH2      ARG  41  -5.450  19.195 -15.340
  707    H    ILE  42           H        ILE  42  -1.865  18.530  -7.558
  708    HA   ILE  42           HA       ILE  42  -1.701  21.459  -7.743
  709    HB   ILE  42           HB       ILE  42  -3.155  20.233  -5.485
  710   1HG1  ILE  42          1HG1      ILE  42  -4.245  20.151  -8.305
  711   2HG1  ILE  42          2HG1      ILE  42  -3.931  18.764  -7.249
  712   1HG2  ILE  42          1HG2      ILE  42  -4.375  22.189  -5.524
  713   2HG2  ILE  42          2HG2      ILE  42  -2.800  22.737  -6.143
  714   3HG2  ILE  42          3HG2      ILE  42  -4.142  22.433  -7.271
  715   1HD1  ILE  42          1HD1      ILE  42  -6.073  20.899  -7.025
  716   2HD1  ILE  42          2HD1      ILE  42  -6.254  19.128  -7.007
  717   3HD1  ILE  42          3HD1      ILE  42  -5.572  19.967  -5.593
  718    HA   PRO  43           HA       PRO  43   1.721  20.850  -5.126
  719   1HB   PRO  43          1HB       PRO  43   2.443  23.472  -4.868
  720   2HB   PRO  43          2HB       PRO  43   2.943  22.463  -6.223
  721   1HG   PRO  43          1HG       PRO  43   0.870  24.558  -6.081
  722   2HG   PRO  43          2HG       PRO  43   1.696  23.891  -7.536
  723   1HD   PRO  43          1HD       PRO  43  -0.960  23.373  -6.599
  724   2HD   PRO  43          2HD       PRO  43  -0.141  22.570  -7.946
  725    H    GLY  44           H        GLY  44  -1.139  22.473  -4.387
  726   1HA   GLY  44          1HA       GLY  44  -0.359  23.001  -1.632
  727   2HA   GLY  44          2HA       GLY  44  -1.888  23.373  -2.405
  728    H    VAL  45           H        VAL  45  -1.458  20.325  -3.486
  729    HA   VAL  45           HA       VAL  45  -2.819  19.189  -1.146
  730    HB   VAL  45           HB       VAL  45  -3.604  19.384  -3.791
  731   1HG1  VAL  45          1HG1      VAL  45  -2.517  16.606  -3.251
  732   2HG1  VAL  45          2HG1      VAL  45  -3.735  16.958  -4.500
  733   3HG1  VAL  45          3HG1      VAL  45  -2.119  17.698  -4.599
  734   1HG2  VAL  45          1HG2      VAL  45  -4.552  18.264  -1.304
  735   2HG2  VAL  45          2HG2      VAL  45  -5.478  18.952  -2.660
  736   3HG2  VAL  45          3HG2      VAL  45  -5.038  17.227  -2.667
  737    HA   PRO  46           HA       PRO  46   0.274  16.189  -0.775
  738   1HB   PRO  46          1HB       PRO  46  -1.051  13.847  -0.304
  739   2HB   PRO  46          2HB       PRO  46  -0.807  15.083   0.930
  740   1HG   PRO  46          1HG       PRO  46  -3.220  14.411  -0.629
  741   2HG   PRO  46          2HG       PRO  46  -3.102  15.312   0.924
  742   1HD   PRO  46          1HD       PRO  46  -3.578  16.349  -1.702
  743   2HD   PRO  46          2HD       PRO  46  -3.312  17.290  -0.228
  744    H    TRP  47           H        TRP  47   1.696  15.732  -2.324
  745    HA   TRP  47           HA       TRP  47   0.619  14.497  -4.714
  746   1HB   TRP  47          1HB       TRP  47   3.487  14.871  -4.656
  747   2HB   TRP  47          2HB       TRP  47   2.279  15.508  -5.774
  748    HD1  TRP  47           HD1      TRP  47   0.987  17.864  -4.800
  749    HE1  TRP  47           HE1      TRP  47   1.949  19.932  -3.473
  750    HE3  TRP  47           HE3      TRP  47   5.143  15.493  -3.084
  751    HZ2  TRP  47           HZ2      TRP  47   4.289  20.334  -1.890
  752    HZ3  TRP  47           HZ3      TRP  47   6.716  16.794  -1.653
  753    HH2  TRP  47           HH2      TRP  47   6.343  19.134  -1.052
  754    H    CYS  48           H        CYS  48   0.654  13.065  -2.072
  755    HA   CYS  48           HA       CYS  48   1.681  10.627  -3.028
  756   1HB   CYS  48          1HB       CYS  48   3.797  11.770  -2.324
  757   2HB   CYS  48          2HB       CYS  48   3.192  11.755  -0.666
  758    H    PHE  49           H        PHE  49  -0.295   9.689  -2.476
  759    HA   PHE  49           HA       PHE  49  -0.904   9.663   0.380
  760   1HB   PHE  49          1HB       PHE  49  -3.394   9.657  -0.757
  761   2HB   PHE  49          2HB       PHE  49  -2.599  11.159  -0.271
  762    HD1  PHE  49           HD1      PHE  49  -0.929  12.071  -2.197
  763    HD2  PHE  49           HD2      PHE  49  -4.343   9.634  -2.836
  764    HE1  PHE  49           HE1      PHE  49  -1.076  12.895  -4.563
  765    HE2  PHE  49           HE2      PHE  49  -4.489  10.458  -5.201
  766    HZ   PHE  49           HZ       PHE  49  -2.854  12.079  -6.038
  767    H    LYS  50           H        LYS  50  -3.205   8.089   0.309
  768    HA   LYS  50           HA       LYS  50  -2.304   5.705  -1.151
  769   1HB   LYS  50          1HB       LYS  50  -3.178   4.406   0.828
  770   2HB   LYS  50          2HB       LYS  50  -1.669   5.297   1.088
  771   1HG   LYS  50          1HG       LYS  50  -3.974   6.971   1.688
  772   2HG   LYS  50          2HG       LYS  50  -4.063   5.460   2.609
  773   1HD   LYS  50          1HD       LYS  50  -1.725   7.412   2.519
  774   2HD   LYS  50          2HD       LYS  50  -2.825   7.165   3.887
  775   1HE   LYS  50          1HE       LYS  50  -1.668   4.635   3.015
  776   2HE   LYS  50          2HE       LYS  50  -0.388   5.806   3.361
  777   1HZ   LYS  50          1HZ       LYS  50  -2.612   5.207   5.182
  778   2HZ   LYS  50          2HZ       LYS  50  -1.134   4.522   5.290
  779   3HZ   LYS  50          3HZ       LYS  50  -1.306   6.131   5.508
  780    HA   PRO  51           HA       PRO  51  -6.594   6.760  -2.182
  781   1HB   PRO  51          1HB       PRO  51  -6.294   6.943  -4.890
  782   2HB   PRO  51          2HB       PRO  51  -6.243   8.341  -3.818
  783   1HG   PRO  51          1HG       PRO  51  -4.044   6.901  -5.159
  784   2HG   PRO  51          2HG       PRO  51  -4.047   8.569  -4.481
  785   1HD   PRO  51          1HD       PRO  51  -2.858   6.204  -3.387
  786   2HD   PRO  51          2HD       PRO  51  -2.971   7.787  -2.607
  787    H    LEU  52           H        LEU  52  -5.690   5.326  -5.155
  788    HA   LEU  52           HA       LEU  52  -7.143   2.945  -4.310
  789   1HB   LEU  52          1HB       LEU  52  -7.702   2.610  -6.485
  790   2HB   LEU  52          2HB       LEU  52  -7.649   4.380  -6.401
  791    HG   LEU  52           HG       LEU  52  -5.064   3.526  -7.168
  792   1HD1  LEU  52          1HD1      LEU  52  -6.095   2.439  -9.435
  793   2HD1  LEU  52          2HD1      LEU  52  -5.429   1.503  -8.076
  794   3HD1  LEU  52          3HD1      LEU  52  -7.186   1.757  -8.206
  795   1HD2  LEU  52          1HD2      LEU  52  -6.954   5.430  -7.892
  796   2HD2  LEU  52          2HD2      LEU  52  -5.326   5.225  -8.583
  797   3HD2  LEU  52          3HD2      LEU  52  -6.729   4.458  -9.367
  798    H    GLN  53           H        GLN  53  -4.505   3.410  -3.215
  799    HA   GLN  53           HA       GLN  53  -2.441   2.323  -4.550
  800   1HB   GLN  53          1HB       GLN  53  -3.186   2.001  -1.620
  801   2HB   GLN  53          2HB       GLN  53  -1.587   1.609  -2.275
  802   1HG   GLN  53          1HG       GLN  53  -2.959   4.331  -2.368
  803   2HG   GLN  53          2HG       GLN  53  -1.629   3.887  -1.287
  804   1HE2  GLN  53          1HE2      GLN  53  -0.200   2.290  -3.158
  805   2HE2  GLN  53          2HE2      GLN  53   0.521   3.328  -4.342
  806    H    GLU  54           H        GLU  54  -5.365   0.727  -3.481
  807    HA   GLU  54           HA       GLU  54  -4.757  -1.769  -2.945
  808   1HB   GLU  54          1HB       GLU  54  -6.841  -2.444  -3.932
  809   2HB   GLU  54          2HB       GLU  54  -7.060  -0.786  -3.347
  810   1HG   GLU  54          1HG       GLU  54  -7.772  -0.264  -5.423
  811   2HG   GLU  54          2HG       GLU  54  -6.108  -0.485  -5.983
  812    H    ALA  55           H        ALA  55  -4.036  -0.125  -5.974
  813    HA   ALA  55           HA       ALA  55  -3.874  -1.913  -7.893
  814   1HB   ALA  55          1HB       ALA  55  -1.411  -0.866  -8.205
  815   2HB   ALA  55          2HB       ALA  55  -2.894   0.078  -8.485
  816   3HB   ALA  55          3HB       ALA  55  -2.019   0.231  -6.942
  817    H    GLU  56           H        GLU  56  -1.127  -1.616  -5.522
  818    HA   GLU  56           HA       GLU  56  -0.921  -4.510  -5.658
  819   1HB   GLU  56          1HB       GLU  56   0.995  -2.573  -6.684
  820   2HB   GLU  56          2HB       GLU  56   1.737  -3.576  -5.425
  821   1HG   GLU  56          1HG       GLU  56   1.511  -5.520  -6.660
  822   2HG   GLU  56          2HG       GLU  56   0.054  -4.963  -7.496
  823    H    CYS  57           H        CYS  57  -1.774  -2.112  -3.759
  824    HA   CYS  57           HA       CYS  57   0.056  -2.534  -1.574
  825   1HB   CYS  57          1HB       CYS  57  -1.838  -0.532  -2.349
  826   2HB   CYS  57          2HB       CYS  57  -2.226  -1.092  -0.720
  827    H    THR  58           H        THR  58  -3.554  -2.766  -2.057
  828    HA   THR  58           HA       THR  58  -3.909  -4.435   0.201
  829    HB   THR  58           HB       THR  58  -5.529  -2.823  -1.191
  830    HG1  THR  58           HG1      THR  58  -6.935  -3.826   0.219
  831   1HG2  THR  58          1HG2      THR  58  -7.115  -4.223  -2.546
  832   2HG2  THR  58          2HG2      THR  58  -5.509  -4.137  -3.307
  833   3HG2  THR  58          3HG2      THR  58  -5.992  -5.597  -2.411
  834    H    PHE  59           H        PHE  59  -3.847  -5.125  -3.355
  835    HA   PHE  59           HA       PHE  59  -4.429  -7.676  -3.502
  836   1HB   PHE  59          1HB       PHE  59  -2.553  -5.799  -4.744
  837   2HB   PHE  59          2HB       PHE  59  -1.846  -7.418  -4.768
  838    HD1  PHE  59           HD1      PHE  59  -2.177  -8.543  -6.738
  839    HD2  PHE  59           HD2      PHE  59  -5.228  -5.930  -5.370
  840    HE1  PHE  59           HE1      PHE  59  -3.563  -9.105  -8.754
  841    HE2  PHE  59           HE2      PHE  59  -6.614  -6.492  -7.385
  842    HZ   PHE  59           HZ       PHE  59  -5.765  -8.073  -9.053
  Start of MODEL   42
    1   1H    GLU   1           H1       GLU   1 -10.713 -14.578  -3.662
    2    HA   GLU   1           HA       GLU   1 -12.183 -13.011  -4.855
    3   1HB   GLU   1          1HB       GLU   1 -13.117 -15.411  -3.326
    4   2HB   GLU   1          2HB       GLU   1 -14.355 -14.434  -4.135
    5   1HG   GLU   1          1HG       GLU   1 -12.579 -14.602  -6.155
    6   2HG   GLU   1          2HG       GLU   1 -12.134 -16.090  -5.306
    7    H    GLU   2           H        GLU   2 -13.279 -13.733  -1.455
    8    HA   GLU   2           HA       GLU   2 -14.825 -11.302  -1.539
    9   1HB   GLU   2          1HB       GLU   2 -15.576 -13.609  -0.585
   10   2HB   GLU   2          2HB       GLU   2 -14.624 -13.166   0.843
   11   1HG   GLU   2          1HG       GLU   2 -16.588 -12.200   1.502
   12   2HG   GLU   2          2HG       GLU   2 -16.046 -10.861   0.478
   13    H    TYR   3           H        TYR   3 -14.373 -11.451   1.630
   14    HA   TYR   3           HA       TYR   3 -12.207  -9.514   1.557
   15   1HB   TYR   3          1HB       TYR   3 -13.060  -9.535   4.103
   16   2HB   TYR   3          2HB       TYR   3 -14.082  -8.801   2.864
   17    HD1  TYR   3           HD1      TYR   3 -16.276  -9.152   3.597
   18    HD2  TYR   3           HD2      TYR   3 -13.509 -12.414   3.668
   19    HE1  TYR   3           HE1      TYR   3 -18.155 -10.741   4.237
   20    HE2  TYR   3           HE2      TYR   3 -15.396 -13.991   4.308
   21    HH   TYR   3           HH       TYR   3 -18.718 -12.935   4.271
   22    H    VAL   4           H        VAL   4 -10.812 -11.595   0.959
   23    HA   VAL   4           HA       VAL   4  -9.838 -12.669   3.517
   24    HB   VAL   4           HB       VAL   4 -10.986 -14.361   2.180
   25   1HG1  VAL   4          1HG1      VAL   4 -10.477 -13.232  -0.041
   26   2HG1  VAL   4          2HG1      VAL   4  -8.867 -13.984   0.050
   27   3HG1  VAL   4          3HG1      VAL   4 -10.324 -15.004  -0.008
   28   1HG2  VAL   4          1HG2      VAL   4  -9.322 -16.050   2.323
   29   2HG2  VAL   4          2HG2      VAL   4  -8.006 -14.885   2.047
   30   3HG2  VAL   4          3HG2      VAL   4  -8.915 -14.856   3.577
   31    H    GLY   5           H        GLY   5  -8.961 -11.891   0.079
   32   1HA   GLY   5          1HA       GLY   5  -6.169 -11.817   0.599
   33   2HA   GLY   5          2HA       GLY   5  -7.005 -11.227  -0.823
   34    H    LEU   6           H        LEU   6  -8.534  -9.863   1.875
   35    HA   LEU   6           HA       LEU   6  -6.692  -7.586   1.927
   36   1HB   LEU   6          1HB       LEU   6  -8.741  -6.124   1.928
   37   2HB   LEU   6          2HB       LEU   6  -8.265  -6.848   0.381
   38    HG   LEU   6           HG       LEU   6 -10.701  -6.823   0.726
   39   1HD1  LEU   6          1HD1      LEU   6 -10.272  -9.717   0.864
   40   2HD1  LEU   6          2HD1      LEU   6 -10.922  -8.708  -0.451
   41   3HD1  LEU   6          3HD1      LEU   6  -9.162  -8.886  -0.252
   42   1HD2  LEU   6          1HD2      LEU   6 -11.795  -7.654   2.524
   43   2HD2  LEU   6          2HD2      LEU   6 -10.613  -8.958   2.787
   44   3HD2  LEU   6          3HD2      LEU   6 -10.246  -7.303   3.329
   45    H    SER   7           H        SER   7  -8.007 -10.076   3.590
   46    HA   SER   7           HA       SER   7  -8.872  -8.579   5.874
   47   1HB   SER   7          1HB       SER   7  -9.346 -10.749   6.866
   48   2HB   SER   7          2HB       SER   7  -9.957 -10.733   5.201
   49    HG   SER   7           HG       SER   7  -7.461 -11.630   5.017
   50    H    ALA   8           H        ALA   8  -7.884  -9.236   8.108
   51    HA   ALA   8           HA       ALA   8  -5.099  -8.690   7.982
   52   1HB   ALA   8          1HB       ALA   8  -5.258  -8.542  10.354
   53   2HB   ALA   8          2HB       ALA   8  -6.815  -7.940   9.737
   54   3HB   ALA   8          3HB       ALA   8  -6.697  -9.587  10.401
   55    H    ASN   9           H        ASN   9  -6.864 -11.500   7.422
   56    HA   ASN   9           HA       ASN   9  -4.970 -13.221   8.741
   57   1HB   ASN   9          1HB       ASN   9  -7.691 -13.431   7.990
   58   2HB   ASN   9          2HB       ASN   9  -6.848 -14.553   6.912
   59   1HD2  ASN   9          1HD2      ASN   9  -5.130 -15.900   8.044
   60   2HD2  ASN   9          2HD2      ASN   9  -5.564 -16.626   9.555
   61    H    GLN  10           H        GLN  10  -5.440 -11.560   5.754
   62    HA   GLN  10           HA       GLN  10  -4.490 -13.478   3.968
   63   1HB   GLN  10          1HB       GLN  10  -4.936 -11.877   2.450
   64   2HB   GLN  10          2HB       GLN  10  -5.532 -10.900   3.804
   65   1HG   GLN  10          1HG       GLN  10  -3.274  -9.924   4.086
   66   2HG   GLN  10          2HG       GLN  10  -2.661 -10.919   2.756
   67   1HE2  GLN  10          1HE2      GLN  10  -2.704 -10.114   0.795
   68   2HE2  GLN  10          2HE2      GLN  10  -3.605  -8.740   0.251
   69    H    CYS  11           H        CYS  11  -2.893 -10.963   5.985
   70    HA   CYS  11           HA       CYS  11  -0.363 -11.226   4.829
   71   1HB   CYS  11          1HB       CYS  11  -0.815  -9.294   6.082
   72   2HB   CYS  11          2HB       CYS  11  -1.317 -10.215   7.503
   73    H    ALA  12           H        ALA  12  -2.273 -13.479   6.448
   74    HA   ALA  12           HA       ALA  12   0.066 -14.836   7.596
   75   1HB   ALA  12          1HB       ALA  12  -2.151 -14.150   8.919
   76   2HB   ALA  12          2HB       ALA  12  -2.755 -15.660   8.198
   77   3HB   ALA  12          3HB       ALA  12  -1.314 -15.687   9.241
   78    H    VAL  13           H        VAL  13  -1.149 -14.617   4.700
   79    HA   VAL  13           HA       VAL  13  -2.356 -16.882   3.883
   80    HB   VAL  13           HB       VAL  13  -1.000 -14.749   2.739
   81   1HG1  VAL  13          1HG1      VAL  13   0.223 -17.359   1.785
   82   2HG1  VAL  13          2HG1      VAL  13   0.376 -15.793   0.952
   83   3HG1  VAL  13          3HG1      VAL  13   1.069 -16.008   2.578
   84   1HG2  VAL  13          1HG2      VAL  13  -3.004 -16.651   2.064
   85   2HG2  VAL  13          2HG2      VAL  13  -2.675 -15.075   1.306
   86   3HG2  VAL  13          3HG2      VAL  13  -1.886 -16.544   0.683
   87    HA   PRO  14           HA       PRO  14   0.358 -20.204   4.401
   88   1HB   PRO  14          1HB       PRO  14   0.011 -21.721   2.155
   89   2HB   PRO  14          2HB       PRO  14  -1.126 -21.717   3.500
   90   1HG   PRO  14          1HG       PRO  14  -1.310 -20.419   0.859
   91   2HG   PRO  14          2HG       PRO  14  -2.636 -20.814   2.010
   92   1HD   PRO  14          1HD       PRO  14  -1.456 -18.264   1.460
   93   2HD   PRO  14          2HD       PRO  14  -2.648 -18.626   2.715
   94    H    ALA  15           H        ALA  15   1.482 -17.767   3.179
   95    HA   ALA  15           HA       ALA  15   3.356 -17.107   2.195
   96   1HB   ALA  15          1HB       ALA  15   4.159 -18.550   4.156
   97   2HB   ALA  15          2HB       ALA  15   4.498 -19.816   2.952
   98   3HB   ALA  15          3HB       ALA  15   5.339 -18.251   2.857
   99    H    LYS  16           H        LYS  16   2.030 -17.304   0.134
  100    HA   LYS  16           HA       LYS  16   3.503 -18.137  -1.946
  101   1HB   LYS  16          1HB       LYS  16   2.149 -20.293  -2.569
  102   2HB   LYS  16          2HB       LYS  16   3.595 -20.395  -1.549
  103   1HG   LYS  16          1HG       LYS  16   2.392 -21.171   0.196
  104   2HG   LYS  16          2HG       LYS  16   1.200 -19.868   0.053
  105   1HD   LYS  16          1HD       LYS  16  -0.123 -21.725  -0.391
  106   2HD   LYS  16          2HD       LYS  16   0.372 -21.298  -2.039
  107   1HE   LYS  16          1HE       LYS  16   2.299 -22.936  -1.768
  108   2HE   LYS  16          2HE       LYS  16   1.571 -23.454  -0.240
  109   1HZ   LYS  16          1HZ       LYS  16   0.901 -24.824  -2.095
  110   2HZ   LYS  16          2HZ       LYS  16  -0.394 -24.056  -1.460
  111   3HZ   LYS  16          3HZ       LYS  16   0.254 -23.537  -2.867
  112    H    ASP  17           H        ASP  17   1.786 -16.040  -1.217
  113    HA   ASP  17           HA       ASP  17   0.082 -16.094  -3.492
  114   1HB   ASP  17          1HB       ASP  17  -1.249 -17.129  -1.538
  115   2HB   ASP  17          2HB       ASP  17  -1.200 -15.528  -0.787
  116    H    ARG  18           H        ARG  18   2.358 -14.685  -1.705
  117    HA   ARG  18           HA       ARG  18   1.179 -12.076  -1.469
  118   1HB   ARG  18          1HB       ARG  18   4.058 -12.933  -0.937
  119   2HB   ARG  18          2HB       ARG  18   3.276 -11.453  -0.356
  120   1HG   ARG  18          1HG       ARG  18   2.223 -12.540   1.352
  121   2HG   ARG  18          2HG       ARG  18   1.877 -13.978   0.374
  122   1HD   ARG  18          1HD       ARG  18   4.126 -14.817   0.698
  123   2HD   ARG  18          2HD       ARG  18   4.659 -13.297   1.436
  124    HE   ARG  18           HE       ARG  18   2.433 -14.723   2.776
  125   1HH1  ARG  18          1HH1      ARG  18   5.876 -14.008   2.687
  126   2HH1  ARG  18          2HH1      ARG  18   6.148 -14.484   4.330
  127   1HH2  ARG  18          1HH2      ARG  18   2.790 -15.351   4.943
  128   2HH2  ARG  18          2HH2      ARG  18   4.381 -15.253   5.622
  129    H    VAL  19           H        VAL  19   2.859 -10.194  -2.217
  130    HA   VAL  19           HA       VAL  19   3.508 -10.835  -5.005
  131    HB   VAL  19           HB       VAL  19   3.081  -8.110  -3.784
  132   1HG1  VAL  19          1HG1      VAL  19   3.899  -7.538  -5.802
  133   2HG1  VAL  19          2HG1      VAL  19   3.647  -9.167  -6.475
  134   3HG1  VAL  19          3HG1      VAL  19   2.295  -8.011  -6.413
  135   1HG2  VAL  19          1HG2      VAL  19   1.066 -10.106  -4.794
  136   2HG2  VAL  19          2HG2      VAL  19   1.000  -9.054  -3.361
  137   3HG2  VAL  19          3HG2      VAL  19   0.776  -8.359  -4.984
  138    H    ASP  20           H        ASP  20   5.104 -11.281  -2.390
  139    HA   ASP  20           HA       ASP  20   7.067 -10.759  -1.516
  140   1HB   ASP  20          1HB       ASP  20   7.960 -12.328  -2.955
  141   2HB   ASP  20          2HB       ASP  20   7.429 -11.466  -4.408
  142    H    CYS  21           H        CYS  21   6.834  -8.495  -0.880
  143    HA   CYS  21           HA       CYS  21   6.915  -6.330  -2.526
  144   1HB   CYS  21          1HB       CYS  21   6.632  -6.648   0.090
  145   2HB   CYS  21          2HB       CYS  21   8.323  -6.139   0.096
  146    H    GLY  22           H        GLY  22   9.556  -8.398  -1.265
  147   1HA   GLY  22          1HA       GLY  22  11.769  -8.451  -1.670
  148   2HA   GLY  22          2HA       GLY  22  11.341  -7.946  -3.293
  149    H    TYR  23           H        TYR  23  11.574  -6.476   0.032
  150    HA   TYR  23           HA       TYR  23  12.458  -3.989  -1.188
  151   1HB   TYR  23          1HB       TYR  23  11.130  -5.014   1.226
  152   2HB   TYR  23          2HB       TYR  23  12.507  -4.016   1.701
  153    HD1  TYR  23           HD1      TYR  23  12.600  -1.615   0.928
  154    HD2  TYR  23           HD2      TYR  23   9.123  -4.051   0.406
  155    HE1  TYR  23           HE1      TYR  23  11.186   0.467   0.566
  156    HE2  TYR  23           HE2      TYR  23   7.721  -1.962   0.046
  157    HH   TYR  23           HH       TYR  23   8.413   0.533  -0.867
  158    HA   PRO  24           HA       PRO  24  16.626  -4.797  -0.301
  159   1HB   PRO  24          1HB       PRO  24  17.642  -2.281  -0.620
  160   2HB   PRO  24          2HB       PRO  24  17.323  -3.370  -1.968
  161   1HG   PRO  24          1HG       PRO  24  15.799  -1.030  -1.016
  162   2HG   PRO  24          2HG       PRO  24  15.747  -1.821  -2.632
  163   1HD   PRO  24          1HD       PRO  24  13.835  -1.988  -0.507
  164   2HD   PRO  24          2HD       PRO  24  13.819  -2.911  -2.016
  165    H    HIS  25           H        HIS  25  14.590  -3.068   1.655
  166    HA   HIS  25           HA       HIS  25  16.672  -3.051   3.715
  167   1HB   HIS  25          1HB       HIS  25  14.559  -1.006   3.083
  168   2HB   HIS  25          2HB       HIS  25  15.252  -1.130   4.705
  169    HD1  HIS  25           HD1      HIS  25  15.844   0.308   1.369
  170    HD2  HIS  25           HD2      HIS  25  18.154  -0.652   4.736
  171    HE1  HIS  25           HE1      HIS  25  18.051   1.561   1.103
  172    HE2  HIS  25           HE2      HIS  25  19.407   0.975   3.227
  173    H    VAL  26           H        VAL  26  14.465  -5.003   2.709
  174    HA   VAL  26           HA       VAL  26  12.315  -5.193   4.288
  175    HB   VAL  26           HB       VAL  26  12.684  -6.800   2.623
  176   1HG1  VAL  26          1HG1      VAL  26  15.246  -7.514   4.082
  177   2HG1  VAL  26          2HG1      VAL  26  14.554  -8.476   2.753
  178   3HG1  VAL  26          3HG1      VAL  26  15.079  -6.800   2.460
  179   1HG2  VAL  26          1HG2      VAL  26  11.781  -7.532   5.046
  180   2HG2  VAL  26          2HG2      VAL  26  11.891  -8.660   3.674
  181   3HG2  VAL  26          3HG2      VAL  26  13.167  -8.642   4.916
  182    H    THR  27           H        THR  27  11.830  -5.388   6.428
  183    HA   THR  27           HA       THR  27  13.563  -6.697   8.253
  184    HB   THR  27           HB       THR  27  14.006  -3.851   7.712
  185    HG1  THR  27           HG1      THR  27  14.998  -5.998   9.441
  186   1HG2  THR  27          1HG2      THR  27  12.404  -4.178   9.979
  187   2HG2  THR  27          2HG2      THR  27  14.050  -4.312  10.643
  188   3HG2  THR  27          3HG2      THR  27  13.571  -2.856   9.740
  189    HA   PRO  28           HA       PRO  28   9.815  -6.878  10.332
  190   1HB   PRO  28          1HB       PRO  28  10.626  -7.585  12.843
  191   2HB   PRO  28          2HB       PRO  28  10.480  -8.736  11.517
  192   1HG   PRO  28          1HG       PRO  28  12.883  -7.496  12.696
  193   2HG   PRO  28          2HG       PRO  28  12.765  -8.992  11.703
  194   1HD   PRO  28          1HD       PRO  28  13.707  -6.404  10.918
  195   2HD   PRO  28          2HD       PRO  28  13.461  -7.802   9.864
  196    H    LYS  29           H        LYS  29  10.359  -4.307   9.856
  197    HA   LYS  29           HA       LYS  29   8.909  -3.028  11.810
  198   1HB   LYS  29          1HB       LYS  29  11.090  -3.602  13.097
  199   2HB   LYS  29          2HB       LYS  29  11.790  -2.248  12.191
  200   1HG   LYS  29          1HG       LYS  29  10.817  -0.794  13.607
  201   2HG   LYS  29          2HG       LYS  29   9.215  -1.432  13.203
  202   1HD   LYS  29          1HD       LYS  29   9.107  -2.163  15.337
  203   2HD   LYS  29          2HD       LYS  29  10.318  -3.380  14.901
  204   1HE   LYS  29          1HE       LYS  29  12.045  -1.462  15.382
  205   2HE   LYS  29          2HE       LYS  29  10.711  -0.691  16.252
  206   1HZ   LYS  29          1HZ       LYS  29  11.656  -1.966  17.854
  207   2HZ   LYS  29          2HZ       LYS  29  10.547  -3.031  17.303
  208   3HZ   LYS  29          3HZ       LYS  29  12.108  -3.166  16.843
  209    H    GLU  30           H        GLU  30  11.101  -3.172   9.106
  210    HA   GLU  30           HA       GLU  30  10.571  -0.398   8.471
  211   1HB   GLU  30          1HB       GLU  30  12.708  -2.271   7.938
  212   2HB   GLU  30          2HB       GLU  30  12.096  -1.632   6.402
  213   1HG   GLU  30          1HG       GLU  30  13.652   0.000   6.945
  214   2HG   GLU  30          2HG       GLU  30  12.217   0.693   7.715
  215    H    CYS  31           H        CYS  31  10.041  -3.752   7.259
  216    HA   CYS  31           HA       CYS  31   8.858  -3.087   4.853
  217   1HB   CYS  31          1HB       CYS  31   8.618  -5.449   6.689
  218   2HB   CYS  31          2HB       CYS  31   7.650  -5.347   5.214
  219    H    ASN  32           H        ASN  32   7.419  -3.707   8.135
  220    HA   ASN  32           HA       ASN  32   4.812  -3.189   7.317
  221   1HB   ASN  32          1HB       ASN  32   6.064  -2.882  10.090
  222   2HB   ASN  32          2HB       ASN  32   4.333  -3.043   9.765
  223   1HD2  ASN  32          1HD2      ASN  32   4.226  -4.960   7.869
  224   2HD2  ASN  32          2HD2      ASN  32   4.810  -6.479   8.462
  225    H    ASN  33           H        ASN  33   7.490  -1.154   7.460
  226    HA   ASN  33           HA       ASN  33   5.929   1.135   8.335
  227   1HB   ASN  33          1HB       ASN  33   8.234   0.668   9.328
  228   2HB   ASN  33          2HB       ASN  33   8.928   0.992   7.732
  229   1HD2  ASN  33          1HD2      ASN  33  10.015   2.567   9.298
  230   2HD2  ASN  33          2HD2      ASN  33   9.329   4.153   9.411
  231    H    ARG  34           H        ARG  34   7.544  -0.463   5.611
  232    HA   ARG  34           HA       ARG  34   7.513   1.881   3.990
  233   1HB   ARG  34          1HB       ARG  34   7.938  -1.000   3.093
  234   2HB   ARG  34          2HB       ARG  34   8.508   0.467   2.278
  235   1HG   ARG  34          1HG       ARG  34   9.540   0.611   4.905
  236   2HG   ARG  34          2HG       ARG  34   9.759  -1.080   4.420
  237   1HD   ARG  34          1HD       ARG  34  11.309  -0.544   2.820
  238   2HD   ARG  34          2HD       ARG  34  10.474   0.943   2.346
  239    HE   ARG  34           HE       ARG  34  11.501   1.379   4.941
  240   1HH1  ARG  34          1HH1      ARG  34  12.775   0.699   1.733
  241   2HH1  ARG  34          2HH1      ARG  34  14.271   1.525   2.012
  242   1HH2  ARG  34          1HH2      ARG  34  13.475   2.469   5.310
  243   2HH2  ARG  34          2HH2      ARG  34  14.672   2.539   4.060
  244    H    GLY  35           H        GLY  35   5.400  -0.811   4.779
  245   1HA   GLY  35          1HA       GLY  35   3.055  -0.414   4.209
  246   2HA   GLY  35          2HA       GLY  35   3.580  -0.017   2.584
  247    H    CYS  36           H        CYS  36   5.259  -2.593   4.337
  248    HA   CYS  36           HA       CYS  36   3.822  -4.534   2.677
  249   1HB   CYS  36          1HB       CYS  36   6.731  -4.627   3.482
  250   2HB   CYS  36          2HB       CYS  36   5.877  -5.819   2.499
  251    H    CYS  37           H        CYS  37   4.556  -6.901   3.766
  252    HA   CYS  37           HA       CYS  37   4.094  -6.570   6.639
  253   1HB   CYS  37          1HB       CYS  37   2.095  -7.324   5.223
  254   2HB   CYS  37          2HB       CYS  37   2.955  -8.856   5.045
  255    H    PHE  38           H        PHE  38   5.655  -7.590   7.866
  256    HA   PHE  38           HA       PHE  38   7.590  -9.206   6.439
  257   1HB   PHE  38          1HB       PHE  38   8.127  -7.299   8.060
  258   2HB   PHE  38          2HB       PHE  38   7.389  -8.244   9.356
  259    HD1  PHE  38           HD1      PHE  38   8.574 -10.055  10.376
  260    HD2  PHE  38           HD2      PHE  38  10.241  -8.032   7.039
  261    HE1  PHE  38           HE1      PHE  38  10.785 -11.159  10.811
  262    HE2  PHE  38           HE2      PHE  38  12.453  -9.136   7.475
  263    HZ   PHE  38           HZ       PHE  38  12.699 -10.686   9.356
  264    H    ASP  39           H        ASP  39   7.540 -11.401   6.434
  265    HA   ASP  39           HA       ASP  39   5.686 -12.670   8.223
  266   1HB   ASP  39          1HB       ASP  39   5.657 -13.401   5.920
  267   2HB   ASP  39          2HB       ASP  39   7.408 -13.653   5.908
  268    H    SER  40           H        SER  40   8.881 -13.878   7.006
  269    HA   SER  40           HA       SER  40  10.770 -14.284   8.091
  270   1HB   SER  40          1HB       SER  40   9.738 -12.610   9.923
  271   2HB   SER  40          2HB       SER  40   9.627 -14.109  10.863
  272    HG   SER  40           HG       SER  40  12.002 -12.988   9.636
  273    H    ARG  41           H        ARG  41   7.649 -15.660   8.609
  274    HA   ARG  41           HA       ARG  41   8.254 -17.809  10.206
  275   1HB   ARG  41          1HB       ARG  41   6.238 -17.452   7.952
  276   2HB   ARG  41          2HB       ARG  41   6.262 -18.899   8.975
  277   1HG   ARG  41          1HG       ARG  41   6.352 -16.789  10.803
  278   2HG   ARG  41          2HG       ARG  41   5.248 -16.192   9.551
  279   1HD   ARG  41          1HD       ARG  41   3.653 -17.404  10.617
  280   2HD   ARG  41          2HD       ARG  41   4.423 -18.837   9.918
  281    HE   ARG  41           HE       ARG  41   5.755 -18.019  12.354
  282   1HH1  ARG  41          1HH1      ARG  41   2.876 -19.661  11.171
  283   2HH1  ARG  41          2HH1      ARG  41   2.671 -20.608  12.606
  284   1HH2  ARG  41          1HH2      ARG  41   5.484 -19.268  14.248
  285   2HH2  ARG  41          2HH2      ARG  41   4.164 -20.383  14.368
  286    H    ILE  42           H        ILE  42   8.162 -17.556   6.575
  287    HA   ILE  42           HA       ILE  42   9.865 -19.949   6.502
  288    HB   ILE  42           HB       ILE  42   8.317 -19.165   4.107
  289   1HG1  ILE  42          1HG1      ILE  42   7.008 -20.282   6.591
  290   2HG1  ILE  42          2HG1      ILE  42   6.608 -18.771   5.755
  291   1HG2  ILE  42          1HG2      ILE  42   9.753 -21.420   5.089
  292   2HG2  ILE  42          2HG2      ILE  42   8.057 -21.902   4.848
  293   3HG2  ILE  42          3HG2      ILE  42   8.980 -21.190   3.503
  294   1HD1  ILE  42          1HD1      ILE  42   6.051 -21.627   4.949
  295   2HD1  ILE  42          2HD1      ILE  42   4.970 -20.213   4.913
  296   3HD1  ILE  42          3HD1      ILE  42   6.240 -20.394   3.680
  297    HA   PRO  43           HA       PRO  43  12.760 -17.144   4.865
  298   1HB   PRO  43          1HB       PRO  43  14.823 -18.907   4.550
  299   2HB   PRO  43          2HB       PRO  43  14.477 -18.091   6.073
  300   1HG   PRO  43          1HG       PRO  43  13.930 -20.868   5.242
  301   2HG   PRO  43          2HG       PRO  43  14.023 -20.192   6.908
  302   1HD   PRO  43          1HD       PRO  43  11.695 -20.923   5.408
  303   2HD   PRO  43          2HD       PRO  43  11.726 -20.114   6.980
  304    H    GLY  44           H        GLY  44  11.370 -19.778   3.308
  305   1HA   GLY  44          1HA       GLY  44  12.737 -19.262   0.787
  306   2HA   GLY  44          2HA       GLY  44  11.556 -20.510   1.130
  307    H    VAL  45           H        VAL  45  10.080 -17.984   2.562
  308    HA   VAL  45           HA       VAL  45   8.711 -17.231   0.079
  309    HB   VAL  45           HB       VAL  45   7.755 -18.355   2.419
  310   1HG1  VAL  45          1HG1      VAL  45   7.937 -16.350   3.712
  311   2HG1  VAL  45          2HG1      VAL  45   7.202 -15.374   2.418
  312   3HG1  VAL  45          3HG1      VAL  45   6.217 -16.560   3.306
  313   1HG2  VAL  45          1HG2      VAL  45   6.147 -18.715   0.916
  314   2HG2  VAL  45          2HG2      VAL  45   5.579 -17.048   1.173
  315   3HG2  VAL  45          3HG2      VAL  45   6.759 -17.398  -0.113
  316    HA   PRO  46           HA       PRO  46   9.689 -13.076   0.770
  317   1HB   PRO  46          1HB       PRO  46   7.401 -11.699   0.195
  318   2HB   PRO  46          2HB       PRO  46   8.477 -12.344  -1.045
  319   1HG   PRO  46          1HG       PRO  46   5.872 -13.344  -0.085
  320   2HG   PRO  46          2HG       PRO  46   6.712 -13.706  -1.636
  321   1HD   PRO  46          1HD       PRO  46   6.456 -15.369   0.681
  322   2HD   PRO  46          2HD       PRO  46   7.427 -15.706  -0.757
  323    H    TRP  47           H        TRP  47  10.369 -12.366   2.688
  324    HA   TRP  47           HA       TRP  47   8.410 -12.360   4.818
  325   1HB   TRP  47          1HB       TRP  47  10.980 -11.226   5.481
  326   2HB   TRP  47          2HB       TRP  47  10.148 -12.626   6.160
  327    HD1  TRP  47           HD1      TRP  47  10.562 -15.018   4.670
  328    HE1  TRP  47           HE1      TRP  47  12.701 -15.934   3.426
  329    HE3  TRP  47           HE3      TRP  47  12.918 -10.526   4.303
  330    HZ2  TRP  47           HZ2      TRP  47  15.086 -14.706   2.449
  331    HZ3  TRP  47           HZ3      TRP  47  15.148 -10.472   3.191
  332    HH2  TRP  47           HH2      TRP  47  16.232 -12.466   2.281
  333    H    CYS  48           H        CYS  48   8.062 -10.583   2.446
  334    HA   CYS  48           HA       CYS  48   7.474  -8.225   3.853
  335   1HB   CYS  48          1HB       CYS  48   9.955  -7.978   3.575
  336   2HB   CYS  48          2HB       CYS  48   9.695  -7.907   1.830
  337    H    PHE  49           H        PHE  49   5.410  -8.372   2.930
  338    HA   PHE  49           HA       PHE  49   5.333  -7.995   0.035
  339   1HB   PHE  49          1HB       PHE  49   3.132  -9.549   0.464
  340   2HB   PHE  49          2HB       PHE  49   4.699 -10.264   0.073
  341    HD1  PHE  49           HD1      PHE  49   6.229 -10.610   2.269
  342    HD2  PHE  49           HD2      PHE  49   1.988 -10.464   2.220
  343    HE1  PHE  49           HE1      PHE  49   6.160 -11.899   4.420
  344    HE2  PHE  49           HE2      PHE  49   1.919 -11.754   4.372
  345    HZ   PHE  49           HZ       PHE  49   4.005 -12.457   5.447
  346    H    LYS  50           H        LYS  50   2.588  -7.876  -0.335
  347    HA   LYS  50           HA       LYS  50   1.789  -5.772   1.555
  348   1HB   LYS  50          1HB       LYS  50   0.540  -5.392  -0.975
  349   2HB   LYS  50          2HB       LYS  50   1.661  -4.320  -0.119
  350   1HG   LYS  50          1HG       LYS  50   2.701  -6.712  -1.647
  351   2HG   LYS  50          2HG       LYS  50   2.284  -5.227  -2.522
  352   1HD   LYS  50          1HD       LYS  50   4.384  -5.653  -0.377
  353   2HD   LYS  50          2HD       LYS  50   4.608  -5.015  -2.016
  354   1HE   LYS  50          1HE       LYS  50   3.378  -3.663   0.407
  355   2HE   LYS  50          2HE       LYS  50   4.734  -3.104  -0.587
  356   1HZ   LYS  50          1HZ       LYS  50   3.253  -1.995  -1.751
  357   2HZ   LYS  50          2HZ       LYS  50   2.569  -3.390  -2.251
  358   3HZ   LYS  50          3HZ       LYS  50   2.000  -2.633  -0.921
  359    HA   PRO  51           HA       PRO  51  -1.276  -9.111   1.530
  360   1HB   PRO  51          1HB       PRO  51  -1.291  -9.617   4.214
  361   2HB   PRO  51          2HB       PRO  51  -0.324 -10.538   3.065
  362   1HG   PRO  51          1HG       PRO  51   0.486  -8.432   4.967
  363   2HG   PRO  51          2HG       PRO  51   1.511  -9.681   4.170
  364   1HD   PRO  51          1HD       PRO  51   1.303  -6.890   3.562
  365   2HD   PRO  51          2HD       PRO  51   2.205  -8.105   2.646
  366    H    LEU  52           H        LEU  52  -1.791  -8.080   4.736
  367    HA   LEU  52           HA       LEU  52  -4.203  -6.750   3.815
  368   1HB   LEU  52          1HB       LEU  52  -5.086  -7.157   5.858
  369   2HB   LEU  52          2HB       LEU  52  -3.986  -8.536   5.687
  370    HG   LEU  52           HG       LEU  52  -2.611  -6.360   6.969
  371   1HD1  LEU  52          1HD1      LEU  52  -5.420  -6.746   7.803
  372   2HD1  LEU  52          2HD1      LEU  52  -4.217  -6.752   9.115
  373   3HD1  LEU  52          3HD1      LEU  52  -4.331  -5.355   8.018
  374   1HD2  LEU  52          1HD2      LEU  52  -2.949  -8.330   8.859
  375   2HD2  LEU  52          2HD2      LEU  52  -3.121  -9.222   7.329
  376   3HD2  LEU  52          3HD2      LEU  52  -1.655  -8.264   7.640
  377    H    GLN  53           H        GLN  53  -1.652  -5.498   3.200
  378    HA   GLN  53           HA       GLN  53  -0.879  -3.626   5.030
  379   1HB   GLN  53          1HB       GLN  53  -0.943  -3.488   1.993
  380   2HB   GLN  53          2HB       GLN  53  -0.065  -2.330   3.008
  381   1HG   GLN  53          1HG       GLN  53   0.385  -5.342   2.865
  382   2HG   GLN  53          2HG       GLN  53   1.456  -4.098   2.204
  383   1HE2  GLN  53          1HE2      GLN  53   1.432  -2.220   4.190
  384   2HE2  GLN  53          2HE2      GLN  53   2.173  -2.833   5.631
  385    H    GLU  54           H        GLU  54  -3.873  -3.887   3.296
  386    HA   GLU  54           HA       GLU  54  -4.641  -1.384   2.785
  387   1HB   GLU  54          1HB       GLU  54  -6.840  -2.159   2.858
  388   2HB   GLU  54          2HB       GLU  54  -5.929  -3.668   2.671
  389   1HG   GLU  54          1HG       GLU  54  -7.142  -4.351   4.471
  390   2HG   GLU  54          2HG       GLU  54  -5.977  -3.408   5.413
  391    H    ALA  55           H        ALA  55  -3.917  -2.761   5.936
  392    HA   ALA  55           HA       ALA  55  -5.373  -1.387   7.710
  393   1HB   ALA  55          1HB       ALA  55  -2.974  -1.190   8.908
  394   2HB   ALA  55          2HB       ALA  55  -3.808  -2.748   8.703
  395   3HB   ALA  55          3HB       ALA  55  -2.517  -2.276   7.574
  396    H    GLU  56           H        GLU  56  -2.157  -0.076   6.637
  397    HA   GLU  56           HA       GLU  56  -3.439   2.539   6.604
  398   1HB   GLU  56          1HB       GLU  56  -1.063   1.610   8.140
  399   2HB   GLU  56          2HB       GLU  56  -0.912   3.203   7.378
  400   1HG   GLU  56          1HG       GLU  56  -3.350   3.526   8.439
  401   2HG   GLU  56          2HG       GLU  56  -2.779   2.278   9.556
  402    H    CYS  57           H        CYS  57  -2.836   0.569   4.446
  403    HA   CYS  57           HA       CYS  57  -0.730   2.033   3.039
  404   1HB   CYS  57          1HB       CYS  57  -0.620  -0.512   3.435
  405   2HB   CYS  57          2HB       CYS  57  -1.846  -0.621   2.169
  406    H    THR  58           H        THR  58  -3.924   0.349   2.533
  407    HA   THR  58           HA       THR  58  -4.437   1.784   0.119
  408    HB   THR  58           HB       THR  58  -5.237  -0.596   1.024
  409    HG1  THR  58           HG1      THR  58  -5.802   0.466  -1.027
  410   1HG2  THR  58          1HG2      THR  58  -6.494   0.344   3.007
  411   2HG2  THR  58          2HG2      THR  58  -7.503   1.280   1.879
  412   3HG2  THR  58          3HG2      THR  58  -7.564  -0.499   1.861
  413    H    PHE  59           H        PHE  59  -5.051   2.321   3.561
  414    HA   PHE  59           HA       PHE  59  -7.164   3.877   3.721
  415   1HB   PHE  59          1HB       PHE  59  -4.973   3.407   5.236
  416   2HB   PHE  59          2HB       PHE  59  -4.505   5.016   4.673
  417    HD1  PHE  59           HD1      PHE  59  -4.967   6.705   6.155
  418    HD2  PHE  59           HD2      PHE  59  -7.600   3.380   6.002
  419    HE1  PHE  59           HE1      PHE  59  -6.368   7.730   7.968
  420    HE2  PHE  59           HE2      PHE  59  -9.001   4.405   7.815
  421    HZ   PHE  59           HZ       PHE  59  -8.368   6.568   8.777
  422   1H    GLU   1           H1       GLU   1 -20.068  -0.694  -3.759
  423    HA   GLU   1           HA       GLU   1 -21.726  -1.417  -5.760
  424   1HB   GLU   1          1HB       GLU   1 -23.341  -1.068  -3.568
  425   2HB   GLU   1          2HB       GLU   1 -23.423   0.541  -4.308
  426   1HG   GLU   1          1HG       GLU   1 -24.712  -0.220  -6.004
  427   2HG   GLU   1          2HG       GLU   1 -23.642  -1.597  -6.310
  428    H    GLU   2           H        GLU   2 -21.118   1.413  -3.568
  429    HA   GLU   2           HA       GLU   2 -20.794   3.077  -5.894
  430   1HB   GLU   2          1HB       GLU   2 -21.862   3.575  -3.454
  431   2HB   GLU   2          2HB       GLU   2 -20.212   4.150  -3.164
  432   1HG   GLU   2          1HG       GLU   2 -21.558   4.984  -5.713
  433   2HG   GLU   2          2HG       GLU   2 -22.138   5.727  -4.215
  434    H    TYR   3           H        TYR   3 -18.880   1.513  -6.459
  435    HA   TYR   3           HA       TYR   3 -16.478   2.123  -4.938
  436   1HB   TYR   3          1HB       TYR   3 -15.670   0.490  -6.905
  437   2HB   TYR   3          2HB       TYR   3 -16.642  -0.177  -5.589
  438    HD1  TYR   3           HD1      TYR   3 -16.594   0.789  -9.137
  439    HD2  TYR   3           HD2      TYR   3 -18.968  -0.835  -5.969
  440    HE1  TYR   3           HE1      TYR   3 -18.309  -0.024 -10.828
  441    HE2  TYR   3           HE2      TYR   3 -20.675  -1.642  -7.671
  442    HH   TYR   3           HH       TYR   3 -20.171  -1.060 -11.144
  443    H    VAL   4           H        VAL   4 -16.446   4.447  -5.531
  444    HA   VAL   4           HA       VAL   4 -15.147   4.758  -8.128
  445    HB   VAL   4           HB       VAL   4 -17.282   6.634  -7.103
  446   1HG1  VAL   4          1HG1      VAL   4 -16.481   6.550  -9.965
  447   2HG1  VAL   4          2HG1      VAL   4 -16.894   7.935  -8.924
  448   3HG1  VAL   4          3HG1      VAL   4 -15.277   7.197  -8.824
  449   1HG2  VAL   4          1HG2      VAL   4 -18.465   4.647  -7.629
  450   2HG2  VAL   4          2HG2      VAL   4 -18.630   5.699  -9.055
  451   3HG2  VAL   4          3HG2      VAL   4 -17.475   4.346  -9.077
  452    H    GLY   5           H        GLY   5 -16.079   6.284  -4.974
  453   1HA   GLY   5          1HA       GLY   5 -14.021   8.213  -4.987
  454   2HA   GLY   5          2HA       GLY   5 -14.944   7.660  -3.603
  455    H    LEU   6           H        LEU   6 -13.806   4.820  -4.853
  456    HA   LEU   6           HA       LEU   6 -11.146   5.045  -3.685
  457   1HB   LEU   6          1HB       LEU   6 -11.429   3.224  -2.221
  458   2HB   LEU   6          2HB       LEU   6 -12.710   4.401  -1.877
  459    HG   LEU   6           HG       LEU   6 -13.726   2.294  -1.716
  460   1HD1  LEU   6          1HD1      LEU   6 -15.482   2.436  -3.211
  461   2HD1  LEU   6          2HD1      LEU   6 -14.801   4.079  -3.283
  462   3HD1  LEU   6          3HD1      LEU   6 -14.433   2.907  -4.570
  463   1HD2  LEU   6          1HD2      LEU   6 -12.972   1.271  -4.400
  464   2HD2  LEU   6          2HD2      LEU   6 -11.694   1.298  -3.162
  465   3HD2  LEU   6          3HD2      LEU   6 -13.208   0.412  -2.859
  466    H    SER   7           H        SER   7 -12.780   4.575  -6.363
  467    HA   SER   7           HA       SER   7 -11.393   2.107  -7.050
  468   1HB   SER   7          1HB       SER   7 -13.995   2.481  -7.325
  469   2HB   SER   7          2HB       SER   7 -13.522   3.342  -8.799
  470    HG   SER   7           HG       SER   7 -13.998   0.915  -8.890
  471    H    ALA   8           H        ALA   8  -9.528   2.390  -8.213
  472    HA   ALA   8           HA       ALA   8  -7.905   3.669  -9.171
  473   1HB   ALA   8          1HB       ALA   8  -8.907   4.061 -11.679
  474   2HB   ALA   8          2HB       ALA   8  -8.336   2.488 -11.072
  475   3HB   ALA   8          3HB       ALA   8 -10.073   2.876 -11.043
  476    H    ASN   9           H        ASN   9 -10.747   5.212 -10.787
  477    HA   ASN   9           HA       ASN   9  -9.840   7.632 -11.103
  478   1HB   ASN   9          1HB       ASN   9 -12.275   6.615 -11.353
  479   2HB   ASN   9          2HB       ASN   9 -12.573   7.398  -9.794
  480   1HD2  ASN   9          1HD2      ASN   9 -12.071   9.692  -9.624
  481   2HD2  ASN   9          2HD2      ASN   9 -12.319  10.732 -10.986
  482    H    GLN  10           H        GLN  10 -10.484   6.070  -8.009
  483    HA   GLN  10           HA       GLN  10 -10.938   8.191  -6.370
  484   1HB   GLN  10          1HB       GLN  10 -10.926   6.530  -4.867
  485   2HB   GLN  10          2HB       GLN  10 -10.283   5.434  -6.103
  486   1HG   GLN  10          1HG       GLN  10  -8.010   5.947  -5.475
  487   2HG   GLN  10          2HG       GLN  10  -8.522   7.289  -4.440
  488   1HE2  GLN  10          1HE2      GLN  10  -8.848   6.920  -2.373
  489   2HE2  GLN  10          2HE2      GLN  10  -8.980   5.376  -1.601
  490    H    CYS  11           H        CYS  11  -7.759   6.796  -7.421
  491    HA   CYS  11           HA       CYS  11  -6.183   8.534  -5.939
  492   1HB   CYS  11          1HB       CYS  11  -5.208   6.578  -6.808
  493   2HB   CYS  11          2HB       CYS  11  -5.680   6.968  -8.464
  494    H    ALA  12           H        ALA  12  -8.389   9.157  -8.451
  495    HA   ALA  12           HA       ALA  12  -6.876  11.474  -9.412
  496   1HB   ALA  12          1HB       ALA  12  -7.847  11.086 -11.413
  497   2HB   ALA  12          2HB       ALA  12  -8.343   9.514 -10.741
  498   3HB   ALA  12          3HB       ALA  12  -9.459  10.899 -10.683
  499    H    VAL  13           H        VAL  13  -8.216  11.137  -6.699
  500    HA   VAL  13           HA       VAL  13 -10.617  12.308  -6.426
  501    HB   VAL  13           HB       VAL  13  -9.219  13.509  -4.420
  502   1HG1  VAL  13          1HG1      VAL  13  -9.637  11.310  -3.169
  503   2HG1  VAL  13          2HG1      VAL  13 -11.042  12.092  -3.933
  504   3HG1  VAL  13          3HG1      VAL  13 -10.270  10.689  -4.712
  505   1HG2  VAL  13          1HG2      VAL  13  -7.672  10.963  -4.870
  506   2HG2  VAL  13          2HG2      VAL  13  -7.121  12.496  -5.587
  507   3HG2  VAL  13          3HG2      VAL  13  -7.290  12.350  -3.822
  508    HA   PRO  14           HA       PRO  14 -10.376  16.438  -7.685
  509   1HB   PRO  14          1HB       PRO  14 -11.777  17.829  -5.798
  510   2HB   PRO  14          2HB       PRO  14 -12.549  16.890  -7.074
  511   1HG   PRO  14          1HG       PRO  14 -12.191  16.267  -4.213
  512   2HG   PRO  14          2HG       PRO  14 -13.369  15.561  -5.377
  513   1HD   PRO  14          1HD       PRO  14 -10.968  14.390  -4.343
  514   2HD   PRO  14          2HD       PRO  14 -12.009  13.722  -5.606
  515    H    ALA  15           H        ALA  15  -8.570  15.426  -5.216
  516    HA   ALA  15           HA       ALA  15  -6.597  16.249  -4.536
  517   1HB   ALA  15          1HB       ALA  15  -7.024  19.082  -5.268
  518   2HB   ALA  15          2HB       ALA  15  -5.655  18.003  -5.625
  519   3HB   ALA  15          3HB       ALA  15  -7.117  17.950  -6.638
  520    H    LYS  16           H        LYS  16  -8.722  15.842  -2.859
  521    HA   LYS  16           HA       LYS  16  -8.086  17.337  -0.651
  522   1HB   LYS  16          1HB       LYS  16 -10.497  18.542  -0.650
  523   2HB   LYS  16          2HB       LYS  16  -8.994  19.339  -1.148
  524   1HG   LYS  16          1HG       LYS  16  -9.569  19.318  -3.371
  525   2HG   LYS  16          2HG       LYS  16 -10.428  17.773  -3.258
  526   1HD   LYS  16          1HD       LYS  16 -12.315  19.019  -3.376
  527   2HD   LYS  16          2HD       LYS  16 -11.993  19.456  -1.689
  528   1HE   LYS  16          1HE       LYS  16 -11.365  21.580  -2.239
  529   2HE   LYS  16          2HE       LYS  16 -10.496  21.065  -3.693
  530   1HZ   LYS  16          1HZ       LYS  16 -13.422  21.113  -3.523
  531   2HZ   LYS  16          2HZ       LYS  16 -12.552  22.394  -4.042
  532   3HZ   LYS  16          3HZ       LYS  16 -12.501  20.985  -4.866
  533    H    ASP  17           H        ASP  17  -8.428  14.650  -1.252
  534    HA   ASP  17           HA       ASP  17 -10.506  14.043   0.618
  535   1HB   ASP  17          1HB       ASP  17 -11.671  13.971  -1.578
  536   2HB   ASP  17          2HB       ASP  17 -10.473  12.816  -2.180
  537    H    ARG  18           H        ARG  18  -7.419  13.892  -0.202
  538    HA   ARG  18           HA       ARG  18  -7.060  11.041  -0.041
  539   1HB   ARG  18          1HB       ARG  18  -4.907  13.196  -0.136
  540   2HB   ARG  18          2HB       ARG  18  -4.726  11.486  -0.564
  541   1HG   ARG  18          1HG       ARG  18  -5.579  11.804  -2.650
  542   2HG   ARG  18          2HG       ARG  18  -6.851  12.897  -2.079
  543   1HD   ARG  18          1HD       ARG  18  -5.220  14.742  -1.945
  544   2HD   ARG  18          2HD       ARG  18  -3.911  13.657  -2.437
  545    HE   ARG  18           HE       ARG  18  -6.217  13.855  -4.282
  546   1HH1  ARG  18          1HH1      ARG  18  -2.957  14.921  -3.493
  547   2HH1  ARG  18          2HH1      ARG  18  -2.621  15.495  -5.092
  548   1HH2  ARG  18          1HH2      ARG  18  -5.774  14.612  -6.392
  549   2HH2  ARG  18          2HH2      ARG  18  -4.233  15.319  -6.752
  550    H    VAL  19           H        VAL  19  -4.875  10.549   1.447
  551    HA   VAL  19           HA       VAL  19  -5.564  11.658   4.076
  552    HB   VAL  19           HB       VAL  19  -4.332   9.017   3.271
  553   1HG1  VAL  19          1HG1      VAL  19  -3.335   9.211   5.302
  554   2HG1  VAL  19          2HG1      VAL  19  -4.506  10.418   5.887
  555   3HG1  VAL  19          3HG1      VAL  19  -4.936   8.690   5.882
  556   1HG2  VAL  19          1HG2      VAL  19  -7.081   9.873   4.131
  557   2HG2  VAL  19          2HG2      VAL  19  -6.589   8.752   2.839
  558   3HG2  VAL  19          3HG2      VAL  19  -6.497   8.243   4.542
  559    H    ASP  20           H        ASP  20  -3.724  12.700   1.814
  560    HA   ASP  20           HA       ASP  20  -1.621  13.313   1.516
  561   1HB   ASP  20          1HB       ASP  20  -2.172  15.222   2.700
  562   2HB   ASP  20          2HB       ASP  20  -2.562  14.329   4.179
  563    H    CYS  21           H        CYS  21  -0.537  11.185   1.425
  564    HA   CYS  21           HA       CYS  21   0.184   9.620   3.505
  565   1HB   CYS  21          1HB       CYS  21   0.669   9.650   0.830
  566   2HB   CYS  21          2HB       CYS  21   2.292   9.928   1.469
  567    H    GLY  22           H        GLY  22   1.670  12.670   2.325
  568   1HA   GLY  22          1HA       GLY  22   3.306  13.977   3.151
  569   2HA   GLY  22          2HA       GLY  22   2.696  13.503   4.725
  570    H    TYR  23           H        TYR  23   4.595  11.934   2.039
  571    HA   TYR  23           HA       TYR  23   6.212  10.597   4.054
  572   1HB   TYR  23          1HB       TYR  23   5.327  10.323   1.246
  573   2HB   TYR  23          2HB       TYR  23   7.076  10.104   1.362
  574    HD1  TYR  23           HD1      TYR  23   3.785   8.720   2.201
  575    HD2  TYR  23           HD2      TYR  23   8.011   8.206   2.619
  576    HE1  TYR  23           HE1      TYR  23   3.426   6.318   2.949
  577    HE2  TYR  23           HE2      TYR  23   7.638   5.805   3.366
  578    HH   TYR  23           HH       TYR  23   6.131   4.356   4.071
  579    HA   PRO  24           HA       PRO  24   9.530  13.336   3.565
  580   1HB   PRO  24          1HB       PRO  24  11.567  11.805   4.551
  581   2HB   PRO  24          2HB       PRO  24  10.444  12.693   5.579
  582   1HG   PRO  24          1HG       PRO  24  10.565   9.814   4.946
  583   2HG   PRO  24          2HG       PRO  24   9.753  10.625   6.333
  584   1HD   PRO  24          1HD       PRO  24   8.566   9.514   3.976
  585   2HD   PRO  24          2HD       PRO  24   7.742  10.442   5.236
  586    H    HIS  25           H        HIS  25   9.176  10.558   1.781
  587    HA   HIS  25           HA       HIS  25  11.419  11.410   0.099
  588   1HB   HIS  25          1HB       HIS  25  11.031   8.937   1.340
  589   2HB   HIS  25          2HB       HIS  25  10.578   8.666  -0.348
  590    HD1  HIS  25           HD1      HIS  25  12.667   7.264  -0.907
  591    HD2  HIS  25           HD2      HIS  25  13.549  11.093   0.564
  592    HE1  HIS  25           HE1      HIS  25  15.162   7.627  -1.304
  593    HE2  HIS  25           HE2      HIS  25  15.633  10.016  -0.431
  594    H    VAL  26           H        VAL  26   8.274  11.891   0.389
  595    HA   VAL  26           HA       VAL  26   6.832  10.870  -1.602
  596    HB   VAL  26           HB       VAL  26   5.855  12.456  -0.197
  597   1HG1  VAL  26          1HG1      VAL  26   8.279  13.733  -0.191
  598   2HG1  VAL  26          2HG1      VAL  26   7.272  14.879  -1.107
  599   3HG1  VAL  26          3HG1      VAL  26   6.785  14.377   0.529
  600   1HG2  VAL  26          1HG2      VAL  26   4.595  13.712  -1.661
  601   2HG2  VAL  26          2HG2      VAL  26   6.001  14.181  -2.646
  602   3HG2  VAL  26          3HG2      VAL  26   5.325  12.540  -2.784
  603    H    THR  27           H        THR  27   7.069  10.545  -3.749
  604    HA   THR  27           HA       THR  27   8.069  12.568  -5.462
  605    HB   THR  27           HB       THR  27  10.023  10.878  -4.176
  606    HG1  THR  27           HG1      THR  27  10.575  12.971  -4.822
  607   1HG2  THR  27          1HG2      THR  27   9.926   9.166  -5.842
  608   2HG2  THR  27          2HG2      THR  27   9.502  10.324  -7.126
  609   3HG2  THR  27          3HG2      THR  27  11.158  10.285  -6.474
  610    HA   PRO  28           HA       PRO  28   5.880  10.151  -8.247
  611   1HB   PRO  28          1HB       PRO  28   6.940  10.913 -10.647
  612   2HB   PRO  28          2HB       PRO  28   5.750  11.872  -9.770
  613   1HG   PRO  28          1HG       PRO  28   8.664  12.249 -10.045
  614   2HG   PRO  28          2HG       PRO  28   7.415  13.458  -9.576
  615   1HD   PRO  28          1HD       PRO  28   9.308  12.112  -7.900
  616   2HD   PRO  28          2HD       PRO  28   7.995  13.171  -7.369
  617    H    LYS  29           H        LYS  29   7.646   8.582  -6.935
  618    HA   LYS  29           HA       LYS  29   7.869   6.446  -8.669
  619   1HB   LYS  29          1HB       LYS  29   9.710   8.227  -9.473
  620   2HB   LYS  29          2HB       LYS  29  10.663   7.366  -8.252
  621   1HG   LYS  29          1HG       LYS  29  10.872   5.563  -9.594
  622   2HG   LYS  29          2HG       LYS  29   9.128   5.497  -9.898
  623   1HD   LYS  29          1HD       LYS  29  10.028   7.743 -11.336
  624   2HD   LYS  29          2HD       LYS  29  11.289   6.524 -11.595
  625   1HE   LYS  29          1HE       LYS  29   9.286   4.911 -12.081
  626   2HE   LYS  29          2HE       LYS  29   8.333   6.390 -12.278
  627   1HZ   LYS  29          1HZ       LYS  29  10.223   5.240 -14.020
  628   2HZ   LYS  29          2HZ       LYS  29   9.146   6.433 -14.312
  629   3HZ   LYS  29          3HZ       LYS  29  10.616   6.792 -13.697
  630    H    GLU  30           H        GLU  30   8.421   8.204  -5.751
  631    HA   GLU  30           HA       GLU  30   9.435   5.821  -4.445
  632   1HB   GLU  30          1HB       GLU  30   9.673   8.706  -4.014
  633   2HB   GLU  30          2HB       GLU  30   9.239   7.854  -2.522
  634   1HG   GLU  30          1HG       GLU  30  11.615   7.845  -2.574
  635   2HG   GLU  30          2HG       GLU  30  11.157   6.217  -3.100
  636    H    CYS  31           H        CYS  31   6.736   8.219  -4.360
  637    HA   CYS  31           HA       CYS  31   5.404   7.227  -2.172
  638   1HB   CYS  31          1HB       CYS  31   4.393   8.564  -4.675
  639   2HB   CYS  31          2HB       CYS  31   3.348   8.178  -3.305
  640    H    ASN  32           H        ASN  32   4.950   6.453  -5.704
  641    HA   ASN  32           HA       ASN  32   3.073   4.478  -5.276
  642   1HB   ASN  32          1HB       ASN  32   4.872   5.352  -7.490
  643   2HB   ASN  32          2HB       ASN  32   4.321   3.675  -7.610
  644   1HD2  ASN  32          1HD2      ASN  32   2.835   6.663  -6.367
  645   2HD2  ASN  32          2HD2      ASN  32   1.421   6.638  -7.367
  646    H    ASN  33           H        ASN  33   6.386   4.610  -4.452
  647    HA   ASN  33           HA       ASN  33   6.866   1.810  -4.898
  648   1HB   ASN  33          1HB       ASN  33   8.534   3.941  -4.993
  649   2HB   ASN  33          2HB       ASN  33   8.759   3.518  -3.288
  650   1HD2  ASN  33          1HD2      ASN  33  10.965   3.144  -4.056
  651   2HD2  ASN  33          2HD2      ASN  33  11.394   1.595  -4.700
  652    H    ARG  34           H        ARG  34   6.210   4.209  -2.311
  653    HA   ARG  34           HA       ARG  34   6.690   2.310  -0.246
  654   1HB   ARG  34          1HB       ARG  34   5.210   4.935   0.097
  655   2HB   ARG  34          2HB       ARG  34   6.256   4.110   1.266
  656   1HG   ARG  34          1HG       ARG  34   7.831   4.603  -1.060
  657   2HG   ARG  34          2HG       ARG  34   6.950   6.105  -0.724
  658   1HD   ARG  34          1HD       ARG  34   8.187   6.520   1.136
  659   2HD   ARG  34          2HD       ARG  34   8.049   4.853   1.714
  660    HE   ARG  34           HE       ARG  34   9.808   4.798  -0.492
  661   1HH1  ARG  34          1HH1      ARG  34   9.714   6.277   2.701
  662   2HH1  ARG  34          2HH1      ARG  34  11.436   6.297   2.882
  663   1HH2  ARG  34          1HH2      ARG  34  12.081   4.825  -0.252
  664   2HH2  ARG  34          2HH2      ARG  34  12.791   5.466   1.192
  665    H    GLY  35           H        GLY  35   4.005   3.437  -2.235
  666   1HA   GLY  35          1HA       GLY  35   2.141   1.850  -2.334
  667   2HA   GLY  35          2HA       GLY  35   2.134   1.846  -0.582
  668    H    CYS  36           H        CYS  36   2.847   4.852  -2.326
  669    HA   CYS  36           HA       CYS  36   0.177   5.796  -1.571
  670   1HB   CYS  36          1HB       CYS  36   2.761   7.357  -1.667
  671   2HB   CYS  36          2HB       CYS  36   1.169   8.027  -1.299
  672    H    CYS  37           H        CYS  37  -0.446   7.806  -3.017
  673    HA   CYS  37           HA       CYS  37   0.358   7.149  -5.755
  674   1HB   CYS  37          1HB       CYS  37  -2.073   6.830  -4.936
  675   2HB   CYS  37          2HB       CYS  37  -2.181   8.589  -5.043
  676    H    PHE  38           H        PHE  38   1.311   8.792  -6.962
  677    HA   PHE  38           HA       PHE  38   1.720  11.307  -5.560
  678   1HB   PHE  38          1HB       PHE  38   3.539   9.815  -6.657
  679   2HB   PHE  38          2HB       PHE  38   2.834  10.243  -8.221
  680    HD1  PHE  38           HD1      PHE  38   4.480  11.654  -5.212
  681    HD2  PHE  38           HD2      PHE  38   3.426  12.259  -9.279
  682    HE1  PHE  38           HE1      PHE  38   5.917  13.710  -5.279
  683    HE2  PHE  38           HE2      PHE  38   4.862  14.316  -9.344
  684    HZ   PHE  38           HZ       PHE  38   6.090  15.017  -7.344
  685    H    ASP  39           H        ASP  39   0.461  13.047  -6.003
  686    HA   ASP  39           HA       ASP  39  -1.290  12.936  -8.228
  687   1HB   ASP  39          1HB       ASP  39  -2.348  14.100  -6.568
  688   2HB   ASP  39          2HB       ASP  39  -0.831  14.669  -5.854
  689    H    SER  40           H        SER  40   0.635  15.815  -7.169
  690    HA   SER  40           HA       SER  40   2.223  16.958  -8.191
  691   1HB   SER  40          1HB       SER  40   2.676  14.675  -9.466
  692   2HB   SER  40          2HB       SER  40   1.936  15.529 -10.833
  693    HG   SER  40           HG       SER  40   4.253  15.789 -10.789
  694    H    ARG  41           H        ARG  41  -0.919  16.182  -9.507
  695    HA   ARG  41           HA       ARG  41  -1.029  18.113 -11.496
  696   1HB   ARG  41          1HB       ARG  41  -3.400  17.194  -9.825
  697   2HB   ARG  41          2HB       ARG  41  -3.403  17.672 -11.531
  698   1HG   ARG  41          1HG       ARG  41  -1.740  15.659 -11.822
  699   2HG   ARG  41          2HG       ARG  41  -2.381  15.117 -10.260
  700   1HD   ARG  41          1HD       ARG  41  -4.073  15.770 -12.714
  701   2HD   ARG  41          2HD       ARG  41  -3.598  14.133 -12.238
  702    HE   ARG  41           HE       ARG  41  -4.787  15.124  -9.956
  703   1HH1  ARG  41          1HH1      ARG  41  -5.815  14.955 -13.318
  704   2HH1  ARG  41          2HH1      ARG  41  -7.500  14.852 -12.930
  705   1HH2  ARG  41          1HH2      ARG  41  -7.010  14.988  -9.445
  706   2HH2  ARG  41          2HH2      ARG  41  -8.184  14.870 -10.713
  707    H    ILE  42           H        ILE  42  -1.875  18.122  -7.983
  708    HA   ILE  42           HA       ILE  42  -2.132  21.044  -8.177
  709    HB   ILE  42           HB       ILE  42  -3.510  19.416  -6.072
  710   1HG1  ILE  42          1HG1      ILE  42  -4.222  19.614  -8.948
  711   2HG1  ILE  42          2HG1      ILE  42  -4.538  18.318  -7.783
  712   1HG2  ILE  42          1HG2      ILE  42  -4.825  21.305  -5.739
  713   2HG2  ILE  42          2HG2      ILE  42  -3.211  21.983  -6.063
  714   3HG2  ILE  42          3HG2      ILE  42  -4.448  21.977  -7.343
  715   1HD1  ILE  42          1HD1      ILE  42  -6.129  20.130  -6.670
  716   2HD1  ILE  42          2HD1      ILE  42  -6.073  20.870  -8.289
  717   3HD1  ILE  42          3HD1      ILE  42  -6.681  19.208  -8.090
  718    HA   PRO  43           HA       PRO  43   1.362  20.621  -5.555
  719   1HB   PRO  43          1HB       PRO  43   2.238  23.196  -5.799
  720   2HB   PRO  43          2HB       PRO  43   2.699  21.912  -6.913
  721   1HG   PRO  43          1HG       PRO  43   0.755  24.105  -7.250
  722   2HG   PRO  43          2HG       PRO  43   1.564  23.116  -8.518
  723   1HD   PRO  43          1HD       PRO  43  -1.134  22.943  -7.575
  724   2HD   PRO  43          2HD       PRO  43  -0.342  21.845  -8.713
  725    H    GLY  44           H        GLY  44  -1.503  22.181  -5.134
  726   1HA   GLY  44          1HA       GLY  44  -0.728  23.377  -2.576
  727   2HA   GLY  44          2HA       GLY  44  -2.255  23.559  -3.418
  728    H    VAL  45           H        VAL  45  -1.600  20.319  -3.746
  729    HA   VAL  45           HA       VAL  45  -2.908  19.681  -1.192
  730    HB   VAL  45           HB       VAL  45  -4.399  18.303  -2.227
  731   1HG1  VAL  45          1HG1      VAL  45  -4.952  20.529  -2.953
  732   2HG1  VAL  45          2HG1      VAL  45  -3.792  20.436  -4.300
  733   3HG1  VAL  45          3HG1      VAL  45  -5.252  19.415  -4.308
  734   1HG2  VAL  45          1HG2      VAL  45  -2.651  18.132  -4.704
  735   2HG2  VAL  45          2HG2      VAL  45  -2.647  16.946  -3.376
  736   3HG2  VAL  45          3HG2      VAL  45  -4.116  17.185  -4.352
  737    HA   PRO  46           HA       PRO  46   0.019  16.513  -0.712
  738   1HB   PRO  46          1HB       PRO  46  -1.324  14.177  -0.267
  739   2HB   PRO  46          2HB       PRO  46  -1.122  15.422   0.963
  740   1HG   PRO  46          1HG       PRO  46  -3.478  14.740  -0.676
  741   2HG   PRO  46          2HG       PRO  46  -3.415  15.654   0.875
  742   1HD   PRO  46          1HD       PRO  46  -3.796  16.670  -1.774
  743   2HD   PRO  46          2HD       PRO  46  -3.582  17.622  -0.300
  744    H    TRP  47           H        TRP  47   1.510  15.987  -2.170
  745    HA   TRP  47           HA       TRP  47   0.514  14.764  -4.604
  746   1HB   TRP  47          1HB       TRP  47   3.396  15.150  -4.347
  747   2HB   TRP  47          2HB       TRP  47   2.281  15.667  -5.613
  748    HD1  TRP  47           HD1      TRP  47   0.935  18.081  -5.053
  749    HE1  TRP  47           HE1      TRP  47   1.687  20.254  -3.757
  750    HE3  TRP  47           HE3      TRP  47   4.758  15.883  -2.521
  751    HZ2  TRP  47           HZ2      TRP  47   3.749  20.797  -1.861
  752    HZ3  TRP  47           HZ3      TRP  47   6.092  17.306  -0.968
  753    HH2  TRP  47           HH2      TRP  47   5.640  19.683  -0.619
  754    H    CYS  48           H        CYS  48   0.395  13.335  -1.977
  755    HA   CYS  48           HA       CYS  48   1.462  10.889  -2.869
  756   1HB   CYS  48          1HB       CYS  48   3.529  12.054  -2.012
  757   2HB   CYS  48          2HB       CYS  48   2.818  11.970  -0.398
  758    H    PHE  49           H        PHE  49  -0.300   9.658  -2.300
  759    HA   PHE  49           HA       PHE  49  -1.162   9.740   0.461
  760   1HB   PHE  49          1HB       PHE  49  -3.593   9.724  -0.788
  761   2HB   PHE  49          2HB       PHE  49  -2.830  11.232  -0.270
  762    HD1  PHE  49           HD1      PHE  49  -1.234  12.320  -2.060
  763    HD2  PHE  49           HD2      PHE  49  -4.295   9.525  -2.969
  764    HE1  PHE  49           HE1      PHE  49  -1.279  13.141  -4.431
  765    HE2  PHE  49           HE2      PHE  49  -4.341  10.347  -5.341
  766    HZ   PHE  49           HZ       PHE  49  -2.833  12.145  -6.044
  767    H    LYS  50           H        LYS  50  -3.431   8.142   0.282
  768    HA   LYS  50           HA       LYS  50  -2.456   5.784  -1.170
  769   1HB   LYS  50          1HB       LYS  50  -3.743   4.715   0.978
  770   2HB   LYS  50          2HB       LYS  50  -1.987   4.924   0.847
  771   1HG   LYS  50          1HG       LYS  50  -3.595   7.263   1.813
  772   2HG   LYS  50          2HG       LYS  50  -3.424   5.895   2.925
  773   1HD   LYS  50          1HD       LYS  50  -1.203   7.520   1.622
  774   2HD   LYS  50          2HD       LYS  50  -1.609   7.470   3.345
  775   1HE   LYS  50          1HE       LYS  50  -0.220   5.418   1.630
  776   2HE   LYS  50          2HE       LYS  50   0.216   5.996   3.246
  777   1HZ   LYS  50          1HZ       LYS  50  -1.734   3.999   2.468
  778   2HZ   LYS  50          2HZ       LYS  50  -0.675   3.987   3.711
  779   3HZ   LYS  50          3HZ       LYS  50  -2.042   4.875   3.811
  780    HA   PRO  51           HA       PRO  51  -6.713   6.781  -2.341
  781   1HB   PRO  51          1HB       PRO  51  -6.329   6.886  -5.043
  782   2HB   PRO  51          2HB       PRO  51  -6.308   8.314  -4.011
  783   1HG   PRO  51          1HG       PRO  51  -4.075   6.830  -5.242
  784   2HG   PRO  51          2HG       PRO  51  -4.091   8.517  -4.614
  785   1HD   PRO  51          1HD       PRO  51  -2.946   6.181  -3.416
  786   2HD   PRO  51          2HD       PRO  51  -3.075   7.786  -2.685
  787    H    LEU  52           H        LEU  52  -5.754   5.271  -5.251
  788    HA   LEU  52           HA       LEU  52  -7.255   2.929  -4.401
  789   1HB   LEU  52          1HB       LEU  52  -7.724   2.552  -6.576
  790   2HB   LEU  52          2HB       LEU  52  -7.571   4.318  -6.582
  791    HG   LEU  52           HG       LEU  52  -5.021   3.088  -7.148
  792   1HD1  LEU  52          1HD1      LEU  52  -7.356   1.806  -8.389
  793   2HD1  LEU  52          2HD1      LEU  52  -6.133   2.381  -9.548
  794   3HD1  LEU  52          3HD1      LEU  52  -5.669   1.252  -8.252
  795   1HD2  LEU  52          1HD2      LEU  52  -6.106   4.411  -9.421
  796   2HD2  LEU  52          2HD2      LEU  52  -6.621   5.304  -7.970
  797   3HD2  LEU  52          3HD2      LEU  52  -4.892   5.000  -8.261
  798    H    GLN  53           H        GLN  53  -4.613   3.476  -3.238
  799    HA   GLN  53           HA       GLN  53  -2.524   2.276  -4.393
  800   1HB   GLN  53          1HB       GLN  53  -3.419   2.115  -1.493
  801   2HB   GLN  53          2HB       GLN  53  -1.799   1.653  -2.042
  802   1HG   GLN  53          1HG       GLN  53  -3.099   4.397  -2.324
  803   2HG   GLN  53          2HG       GLN  53  -1.811   3.974  -1.186
  804   1HE2  GLN  53          1HE2      GLN  53  -0.325   2.290  -2.891
  805   2HE2  GLN  53          2HE2      GLN  53   0.438   3.246  -4.116
  806    H    GLU  54           H        GLU  54  -5.513   0.763  -3.363
  807    HA   GLU  54           HA       GLU  54  -4.932  -1.717  -2.703
  808   1HB   GLU  54          1HB       GLU  54  -7.015  -2.406  -3.662
  809   2HB   GLU  54          2HB       GLU  54  -7.220  -0.710  -3.186
  810   1HG   GLU  54          1HG       GLU  54  -6.439  -0.235  -5.668
  811   2HG   GLU  54          2HG       GLU  54  -6.937  -1.912  -5.951
  812    H    ALA  55           H        ALA  55  -4.194  -0.205  -5.803
  813    HA   ALA  55           HA       ALA  55  -4.019  -2.042  -7.653
  814   1HB   ALA  55          1HB       ALA  55  -1.388  -0.753  -7.167
  815   2HB   ALA  55          2HB       ALA  55  -2.446  -0.692  -8.597
  816   3HB   ALA  55          3HB       ALA  55  -2.785   0.350  -7.194
  817    H    GLU  56           H        GLU  56  -1.464  -1.800  -5.072
  818    HA   GLU  56           HA       GLU  56  -1.330  -4.676  -5.101
  819   1HB   GLU  56          1HB       GLU  56   0.604  -3.029  -6.449
  820   2HB   GLU  56          2HB       GLU  56   1.394  -3.788  -5.057
  821   1HG   GLU  56          1HG       GLU  56   1.124  -5.921  -5.904
  822   2HG   GLU  56          2HG       GLU  56  -0.380  -5.524  -6.750
  823    H    CYS  57           H        CYS  57  -2.079  -2.225  -3.341
  824    HA   CYS  57           HA       CYS  57  -0.146  -2.543  -1.205
  825   1HB   CYS  57          1HB       CYS  57  -1.847  -0.450  -2.099
  826   2HB   CYS  57          2HB       CYS  57  -2.336  -0.873  -0.456
  827    H    THR  58           H        THR  58  -3.783  -2.401  -1.404
  828    HA   THR  58           HA       THR  58  -4.160  -3.915   0.930
  829    HB   THR  58           HB       THR  58  -5.735  -2.266  -0.351
  830    HG1  THR  58           HG1      THR  58  -6.646  -4.943   0.436
  831   1HG2  THR  58          1HG2      THR  58  -5.707  -3.538  -2.544
  832   2HG2  THR  58          2HG2      THR  58  -6.462  -4.915  -1.707
  833   3HG2  THR  58          3HG2      THR  58  -7.343  -3.375  -1.861
  834    H    PHE  59           H        PHE  59  -3.973  -4.836  -2.539
  835    HA   PHE  59           HA       PHE  59  -4.869  -7.405  -2.358
  836   1HB   PHE  59          1HB       PHE  59  -2.890  -5.799  -3.958
  837   2HB   PHE  59          2HB       PHE  59  -2.733  -7.551  -4.125
  838    HD1  PHE  59           HD1      PHE  59  -3.655  -8.239  -6.116
  839    HD2  PHE  59           HD2      PHE  59  -5.661  -5.237  -3.888
  840    HE1  PHE  59           HE1      PHE  59  -5.513  -8.227  -7.803
  841    HE2  PHE  59           HE2      PHE  59  -7.519  -5.225  -5.574
  842    HZ   PHE  59           HZ       PHE  59  -7.423  -6.720  -7.513
  Start of MODEL   43
    1   1H    GLU   1           H1       GLU   1 -15.914  -7.598  -4.716
    2    HA   GLU   1           HA       GLU   1 -17.050  -9.578  -3.386
    3   1HB   GLU   1          1HB       GLU   1 -14.345  -8.974  -4.326
    4   2HB   GLU   1          2HB       GLU   1 -14.327 -10.099  -2.956
    5   1HG   GLU   1          1HG       GLU   1 -15.115 -11.783  -4.239
    6   2HG   GLU   1          2HG       GLU   1 -16.436 -10.786  -4.869
    7    H    GLU   2           H        GLU   2 -15.797 -10.808  -1.375
    8    HA   GLU   2           HA       GLU   2 -16.203  -8.958   0.796
    9   1HB   GLU   2          1HB       GLU   2 -17.107 -11.447   0.485
   10   2HB   GLU   2          2HB       GLU   2 -15.559 -11.863   1.244
   11   1HG   GLU   2          1HG       GLU   2 -16.097 -10.386   3.150
   12   2HG   GLU   2          2HG       GLU   2 -17.622  -9.917   2.384
   13    H    TYR   3           H        TYR   3 -14.251  -7.691   0.637
   14    HA   TYR   3           HA       TYR   3 -11.707  -8.561   0.336
   15   1HB   TYR   3          1HB       TYR   3 -12.754  -6.558   2.420
   16   2HB   TYR   3          2HB       TYR   3 -11.182  -6.480   1.621
   17    HD1  TYR   3           HD1      TYR   3 -13.631  -4.445   1.801
   18    HD2  TYR   3           HD2      TYR   3 -12.150  -7.101  -1.208
   19    HE1  TYR   3           HE1      TYR   3 -14.635  -2.966  -0.007
   20    HE2  TYR   3           HE2      TYR   3 -13.159  -5.613  -3.007
   21    HH   TYR   3           HH       TYR   3 -15.469  -3.493  -2.504
   22    H    VAL   4           H        VAL   4 -11.465 -10.691   1.284
   23    HA   VAL   4           HA       VAL   4 -11.055 -10.539   4.189
   24    HB   VAL   4           HB       VAL   4 -11.983 -12.952   2.624
   25   1HG1  VAL   4          1HG1      VAL   4 -11.233 -12.431   5.451
   26   2HG1  VAL   4          2HG1      VAL   4 -12.696 -13.414   5.193
   27   3HG1  VAL   4          3HG1      VAL   4 -11.141 -13.928   4.492
   28   1HG2  VAL   4          1HG2      VAL   4 -14.090 -12.228   2.716
   29   2HG2  VAL   4          2HG2      VAL   4 -13.956 -11.947   4.468
   30   3HG2  VAL   4          3HG2      VAL   4 -13.497 -10.664   3.323
   31    H    GLY   5           H        GLY   5 -10.179 -12.208   1.092
   32   1HA   GLY   5          1HA       GLY   5  -7.785 -13.338   2.143
   33   2HA   GLY   5          2HA       GLY   5  -8.270 -13.233   0.462
   34    H    LEU   6           H        LEU   6  -8.589 -10.117   1.679
   35    HA   LEU   6           HA       LEU   6  -5.788  -9.466   1.110
   36   1HB   LEU   6          1HB       LEU   6  -7.049  -7.314   0.127
   37   2HB   LEU   6          2HB       LEU   6  -6.506  -8.691  -0.849
   38    HG   LEU   6           HG       LEU   6  -9.271  -8.705   0.312
   39   1HD1  LEU   6          1HD1      LEU   6  -8.568  -7.239  -2.244
   40   2HD1  LEU   6          2HD1      LEU   6 -10.182  -7.445  -1.521
   41   3HD1  LEU   6          3HD1      LEU   6  -8.956  -6.452  -0.696
   42   1HD2  LEU   6          1HD2      LEU   6  -9.413  -9.663  -2.240
   43   2HD2  LEU   6          2HD2      LEU   6  -7.757 -10.125  -1.777
   44   3HD2  LEU   6          3HD2      LEU   6  -9.139 -10.654  -0.787
   45    H    SER   7           H        SER   7  -7.990  -9.713   3.458
   46    HA   SER   7           HA       SER   7  -7.404  -7.080   4.554
   47   1HB   SER   7          1HB       SER   7  -9.824  -8.245   4.315
   48   2HB   SER   7          2HB       SER   7  -9.369  -8.905   5.895
   49    HG   SER   7           HG       SER   7  -8.769  -6.448   6.253
   50    H    ALA   8           H        ALA   8  -8.129  -8.096   7.312
   51    HA   ALA   8           HA       ALA   8  -5.528  -8.822   8.115
   52   1HB   ALA   8          1HB       ALA   8  -8.212  -8.406   9.366
   53   2HB   ALA   8          2HB       ALA   8  -7.026  -9.358  10.289
   54   3HB   ALA   8          3HB       ALA   8  -6.634  -7.696   9.783
   55    H    ASN   9           H        ASN   9  -4.968 -10.711   6.881
   56    HA   ASN   9           HA       ASN   9  -5.200 -13.047   8.153
   57   1HB   ASN   9          1HB       ASN   9  -7.717 -12.477   6.984
   58   2HB   ASN   9          2HB       ASN   9  -6.988 -13.678   5.907
   59   1HD2  ASN   9          1HD2      ASN   9  -5.725 -15.420   7.251
   60   2HD2  ASN   9          2HD2      ASN   9  -6.632 -16.178   8.518
   61    H    GLN  10           H        GLN  10  -5.160 -11.224   5.102
   62    HA   GLN  10           HA       GLN  10  -4.068 -13.241   3.506
   63   1HB   GLN  10          1HB       GLN  10  -5.222 -11.152   2.707
   64   2HB   GLN  10          2HB       GLN  10  -3.781 -10.226   3.160
   65   1HG   GLN  10          1HG       GLN  10  -2.423 -11.623   1.614
   66   2HG   GLN  10          2HG       GLN  10  -3.872 -12.530   1.155
   67   1HE2  GLN  10          1HE2      GLN  10  -3.134  -9.089   1.711
   68   2HE2  GLN  10          2HE2      GLN  10  -3.695  -8.494   0.184
   69    H    CYS  11           H        CYS  11  -2.729 -10.985   5.874
   70    HA   CYS  11           HA       CYS  11  -0.063 -11.135   4.937
   71   1HB   CYS  11          1HB       CYS  11  -0.768  -9.258   6.237
   72   2HB   CYS  11          2HB       CYS  11  -1.244 -10.291   7.587
   73    H    ALA  12           H        ALA  12  -2.122 -13.484   6.092
   74    HA   ALA  12           HA       ALA  12   0.062 -14.910   7.452
   75   1HB   ALA  12          1HB       ALA  12  -2.197 -16.226   8.220
   76   2HB   ALA  12          2HB       ALA  12  -1.474 -14.882   9.136
   77   3HB   ALA  12          3HB       ALA  12  -2.836 -14.575   8.031
   78    H    VAL  13           H        VAL  13  -1.096 -14.537   4.489
   79    HA   VAL  13           HA       VAL  13  -2.206 -16.823   3.566
   80    HB   VAL  13           HB       VAL  13  -1.006 -14.563   2.521
   81   1HG1  VAL  13          1HG1      VAL  13   1.160 -15.666   2.345
   82   2HG1  VAL  13          2HG1      VAL  13   0.426 -17.017   1.446
   83   3HG1  VAL  13          3HG1      VAL  13   0.480 -15.391   0.723
   84   1HG2  VAL  13          1HG2      VAL  13  -2.681 -14.973   1.108
   85   2HG2  VAL  13          2HG2      VAL  13  -1.715 -16.262   0.351
   86   3HG2  VAL  13          3HG2      VAL  13  -2.802 -16.646   1.706
   87    HA   PRO  14           HA       PRO  14   0.696 -20.010   3.891
   88   1HB   PRO  14          1HB       PRO  14   0.479 -21.390   1.544
   89   2HB   PRO  14          2HB       PRO  14  -0.680 -21.544   2.862
   90   1HG   PRO  14          1HG       PRO  14  -0.898 -20.084   0.309
   91   2HG   PRO  14          2HG       PRO  14  -2.216 -20.633   1.404
   92   1HD   PRO  14          1HD       PRO  14  -1.184 -17.986   1.047
   93   2HD   PRO  14          2HD       PRO  14  -2.371 -18.502   2.252
   94    H    ALA  15           H        ALA  15   1.683 -17.431   2.838
   95    HA   ALA  15           HA       ALA  15   3.500 -16.599   1.868
   96   1HB   ALA  15          1HB       ALA  15   4.311 -18.973   3.438
   97   2HB   ALA  15          2HB       ALA  15   5.515 -18.434   2.243
   98   3HB   ALA  15          3HB       ALA  15   4.926 -17.303   3.486
   99    H    LYS  16           H        LYS  16   2.108 -17.107  -0.194
  100    HA   LYS  16           HA       LYS  16   3.822 -17.807  -2.221
  101   1HB   LYS  16          1HB       LYS  16   2.673 -19.999  -2.917
  102   2HB   LYS  16          2HB       LYS  16   3.928 -20.064  -1.667
  103   1HG   LYS  16          1HG       LYS  16   2.452 -21.002  -0.253
  104   2HG   LYS  16          2HG       LYS  16   1.423 -19.562  -0.356
  105   1HD   LYS  16          1HD       LYS  16  -0.066 -21.132  -1.146
  106   2HD   LYS  16          2HD       LYS  16   0.714 -20.723  -2.684
  107   1HE   LYS  16          1HE       LYS  16   2.203 -22.656  -2.478
  108   2HE   LYS  16          2HE       LYS  16   1.573 -23.024  -0.866
  109   1HZ   LYS  16          1HZ       LYS  16  -0.361 -23.776  -1.748
  110   2HZ   LYS  16          2HZ       LYS  16  -0.280 -22.857  -3.094
  111   3HZ   LYS  16          3HZ       LYS  16   0.651 -24.192  -2.960
  112    H    ASP  17           H        ASP  17   1.889 -15.811  -1.466
  113    HA   ASP  17           HA       ASP  17   0.389 -15.853  -3.884
  114   1HB   ASP  17          1HB       ASP  17  -1.012 -17.061  -2.078
  115   2HB   ASP  17          2HB       ASP  17  -1.145 -15.486  -1.279
  116    H    ARG  18           H        ARG  18   2.477 -14.377  -2.016
  117    HA   ARG  18           HA       ARG  18   1.111 -11.884  -1.619
  118   1HB   ARG  18          1HB       ARG  18   4.047 -12.571  -1.153
  119   2HB   ARG  18          2HB       ARG  18   3.182 -11.171  -0.497
  120   1HG   ARG  18          1HG       ARG  18   2.214 -12.401   1.163
  121   2HG   ARG  18          2HG       ARG  18   1.942 -13.806   0.117
  122   1HD   ARG  18          1HD       ARG  18   4.201 -14.568   0.411
  123   2HD   ARG  18          2HD       ARG  18   4.710 -13.035   1.134
  124    HE   ARG  18           HE       ARG  18   2.566 -14.416   2.592
  125   1HH1  ARG  18          1HH1      ARG  18   6.044 -14.030   2.223
  126   2HH1  ARG  18          2HH1      ARG  18   6.406 -14.603   3.817
  127   1HH2  ARG  18          1HH2      ARG  18   3.042 -15.173   4.695
  128   2HH2  ARG  18          2HH2      ARG  18   4.686 -15.257   5.233
  129    H    VAL  19           H        VAL  19   2.699  -9.850  -2.239
  130    HA   VAL  19           HA       VAL  19   3.286 -10.241  -5.084
  131    HB   VAL  19           HB       VAL  19   2.703  -7.714  -3.527
  132   1HG1  VAL  19          1HG1      VAL  19   3.726  -6.785  -5.314
  133   2HG1  VAL  19          2HG1      VAL  19   3.571  -8.258  -6.302
  134   3HG1  VAL  19          3HG1      VAL  19   2.193  -7.142  -6.145
  135   1HG2  VAL  19          1HG2      VAL  19   0.656  -8.817  -3.513
  136   2HG2  VAL  19          2HG2      VAL  19   0.556  -7.853  -5.006
  137   3HG2  VAL  19          3HG2      VAL  19   0.941  -9.589  -5.092
  138    H    ASP  20           H        ASP  20   4.988 -10.869  -2.580
  139    HA   ASP  20           HA       ASP  20   6.962 -10.336  -1.717
  140   1HB   ASP  20          1HB       ASP  20   7.820 -11.814  -3.275
  141   2HB   ASP  20          2HB       ASP  20   7.251 -10.865  -4.658
  142    H    CYS  21           H        CYS  21   6.637  -8.098  -0.977
  143    HA   CYS  21           HA       CYS  21   6.649  -5.856  -2.494
  144   1HB   CYS  21          1HB       CYS  21   6.490  -6.339   0.120
  145   2HB   CYS  21          2HB       CYS  21   8.152  -5.741   0.072
  146    H    GLY  22           H        GLY  22   9.374  -7.929  -1.437
  147   1HA   GLY  22          1HA       GLY  22  11.572  -7.912  -1.923
  148   2HA   GLY  22          2HA       GLY  22  11.078  -7.322  -3.498
  149    H    TYR  23           H        TYR  23  11.352  -6.022  -0.105
  150    HA   TYR  23           HA       TYR  23  12.170  -3.462  -1.210
  151   1HB   TYR  23          1HB       TYR  23  10.910  -4.635   1.169
  152   2HB   TYR  23          2HB       TYR  23  12.290  -3.656   1.677
  153    HD1  TYR  23           HD1      TYR  23   8.886  -3.640   0.414
  154    HD2  TYR  23           HD2      TYR  23  12.345  -1.212   1.084
  155    HE1  TYR  23           HE1      TYR  23   7.463  -1.543   0.210
  156    HE2  TYR  23           HE2      TYR  23  10.910   0.876   0.878
  157    HH   TYR  23           HH       TYR  23   8.792   1.503  -0.214
  158    HA   PRO  24           HA       PRO  24  16.373  -4.231  -0.467
  159   1HB   PRO  24          1HB       PRO  24  17.333  -1.683  -0.676
  160   2HB   PRO  24          2HB       PRO  24  17.001  -2.704  -2.072
  161   1HG   PRO  24          1HG       PRO  24  15.456  -0.449  -0.959
  162   2HG   PRO  24          2HG       PRO  24  15.380  -1.155  -2.614
  163   1HD   PRO  24          1HD       PRO  24  13.525  -1.473  -0.456
  164   2HD   PRO  24          2HD       PRO  24  13.489  -2.314  -2.010
  165    H    HIS  25           H        HIS  25  14.347  -2.684   1.633
  166    HA   HIS  25           HA       HIS  25  16.477  -2.740   3.643
  167   1HB   HIS  25          1HB       HIS  25  14.341  -0.673   3.173
  168   2HB   HIS  25          2HB       HIS  25  15.085  -0.878   4.763
  169    HD1  HIS  25           HD1      HIS  25  15.429   1.055   1.768
  170    HD2  HIS  25           HD2      HIS  25  18.126  -0.709   4.453
  171    HE1  HIS  25           HE1      HIS  25  17.660   2.244   1.425
  172    HE2  HIS  25           HE2      HIS  25  19.264   1.155   3.139
  173    H    VAL  26           H        VAL  26  14.280  -4.661   2.590
  174    HA   VAL  26           HA       VAL  26  12.155  -4.934   4.200
  175    HB   VAL  26           HB       VAL  26  12.430  -6.463   2.475
  176   1HG1  VAL  26          1HG1      VAL  26  15.184  -6.390   3.195
  177   2HG1  VAL  26          2HG1      VAL  26  14.667  -8.093   3.219
  178   3HG1  VAL  26          3HG1      VAL  26  14.434  -7.113   1.752
  179   1HG2  VAL  26          1HG2      VAL  26  11.637  -7.374   4.807
  180   2HG2  VAL  26          2HG2      VAL  26  11.913  -8.496   3.454
  181   3HG2  VAL  26          3HG2      VAL  26  13.142  -8.320   4.728
  182    H    THR  27           H        THR  27  11.733  -5.201   6.341
  183    HA   THR  27           HA       THR  27  13.520  -6.613   8.049
  184    HB   THR  27           HB       THR  27  13.922  -3.745   7.649
  185    HG1  THR  27           HG1      THR  27  15.833  -4.452   8.704
  186   1HG2  THR  27          1HG2      THR  27  12.378  -4.287   9.970
  187   2HG2  THR  27          2HG2      THR  27  14.062  -4.229  10.541
  188   3HG2  THR  27          3HG2      THR  27  13.367  -2.837   9.676
  189    HA   PRO  28           HA       PRO  28   9.823  -6.979  10.192
  190   1HB   PRO  28          1HB       PRO  28  10.701  -7.825  12.636
  191   2HB   PRO  28          2HB       PRO  28  10.541  -8.896  11.245
  192   1HG   PRO  28          1HG       PRO  28  12.952  -7.694  12.445
  193   2HG   PRO  28          2HG       PRO  28  12.833  -9.128  11.364
  194   1HD   PRO  28          1HD       PRO  28  13.719  -6.483  10.718
  195   2HD   PRO  28          2HD       PRO  28  13.468  -7.818   9.585
  196    H    LYS  29           H        LYS  29  10.325  -4.375   9.863
  197    HA   LYS  29           HA       LYS  29   8.906  -3.242  11.930
  198   1HB   LYS  29          1HB       LYS  29  11.207  -3.855  13.056
  199   2HB   LYS  29          2HB       LYS  29  11.742  -2.350  12.286
  200   1HG   LYS  29          1HG       LYS  29  10.694  -1.138  13.867
  201   2HG   LYS  29          2HG       LYS  29   9.150  -1.935  13.520
  202   1HD   LYS  29          1HD       LYS  29  10.469  -3.901  14.911
  203   2HD   LYS  29          2HD       LYS  29  11.131  -2.450  15.684
  204   1HE   LYS  29          1HE       LYS  29   8.349  -1.981  15.408
  205   2HE   LYS  29          2HE       LYS  29   8.486  -3.657  15.961
  206   1HZ   LYS  29          1HZ       LYS  29   8.432  -2.068  17.770
  207   2HZ   LYS  29          2HZ       LYS  29   9.845  -2.886  17.761
  208   3HZ   LYS  29          3HZ       LYS  29   9.791  -1.345  17.223
  209    H    GLU  30           H        GLU  30  11.063  -3.162   9.182
  210    HA   GLU  30           HA       GLU  30  10.447  -0.376   8.722
  211   1HB   GLU  30          1HB       GLU  30  12.576  -2.211   7.965
  212   2HB   GLU  30          2HB       GLU  30  11.938  -1.373   6.539
  213   1HG   GLU  30          1HG       GLU  30  13.520   0.165   7.245
  214   2HG   GLU  30          2HG       GLU  30  12.117   0.759   8.145
  215    H    CYS  31           H        CYS  31   9.990  -3.653   7.276
  216    HA   CYS  31           HA       CYS  31   8.735  -2.889   4.956
  217   1HB   CYS  31          1HB       CYS  31   8.552  -5.335   6.683
  218   2HB   CYS  31          2HB       CYS  31   7.535  -5.171   5.251
  219    H    ASN  32           H        ASN  32   7.336  -3.693   8.218
  220    HA   ASN  32           HA       ASN  32   4.720  -3.127   7.458
  221   1HB   ASN  32          1HB       ASN  32   6.229  -3.636   9.974
  222   2HB   ASN  32          2HB       ASN  32   4.761  -2.671  10.198
  223   1HD2  ASN  32          1HD2      ASN  32   5.861  -5.474   8.285
  224   2HD2  ASN  32          2HD2      ASN  32   4.497  -6.497   8.592
  225    H    ASN  33           H        ASN  33   7.391  -1.101   7.666
  226    HA   ASN  33           HA       ASN  33   5.849   1.129   8.710
  227   1HB   ASN  33          1HB       ASN  33   8.233   0.526   9.557
  228   2HB   ASN  33          2HB       ASN  33   8.820   1.143   8.006
  229   1HD2  ASN  33          1HD2      ASN  33   9.950   2.564   9.601
  230   2HD2  ASN  33          2HD2      ASN  33   9.184   4.048  10.061
  231    H    ARG  34           H        ARG  34   7.378  -0.315   5.863
  232    HA   ARG  34           HA       ARG  34   7.317   2.128   4.386
  233   1HB   ARG  34          1HB       ARG  34   7.729  -0.659   3.241
  234   2HB   ARG  34          2HB       ARG  34   8.364   0.874   2.619
  235   1HG   ARG  34          1HG       ARG  34   9.359   0.741   5.230
  236   2HG   ARG  34          2HG       ARG  34   9.468  -0.935   4.664
  237   1HD   ARG  34          1HD       ARG  34  11.042  -0.421   3.056
  238   2HD   ARG  34          2HD       ARG  34  10.383   1.194   2.757
  239    HE   ARG  34           HE       ARG  34  12.560   0.578   4.484
  240   1HH1  ARG  34          1HH1      ARG  34   9.606   2.490   4.521
  241   2HH1  ARG  34          2HH1      ARG  34  10.221   3.653   5.647
  242   1HH2  ARG  34          1HH2      ARG  34  13.372   2.112   5.970
  243   2HH2  ARG  34          2HH2      ARG  34  12.378   3.437   6.476
  244    H    GLY  35           H        GLY  35   5.274  -0.671   5.014
  245   1HA   GLY  35          1HA       GLY  35   2.903  -0.236   4.508
  246   2HA   GLY  35          2HA       GLY  35   3.410   0.222   2.894
  247    H    CYS  36           H        CYS  36   5.127  -2.402   4.533
  248    HA   CYS  36           HA       CYS  36   3.675  -4.297   2.830
  249   1HB   CYS  36          1HB       CYS  36   6.598  -4.424   3.576
  250   2HB   CYS  36          2HB       CYS  36   5.723  -5.543   2.527
  251    H    CYS  37           H        CYS  37   4.504  -6.691   3.825
  252    HA   CYS  37           HA       CYS  37   4.109  -6.469   6.718
  253   1HB   CYS  37          1HB       CYS  37   2.062  -7.170   5.332
  254   2HB   CYS  37          2HB       CYS  37   2.910  -8.700   5.091
  255    H    PHE  38           H        PHE  38   5.690  -7.562   7.857
  256    HA   PHE  38           HA       PHE  38   7.599  -9.087   6.308
  257   1HB   PHE  38          1HB       PHE  38   8.073  -7.273   8.102
  258   2HB   PHE  38          2HB       PHE  38   7.464  -8.415   9.306
  259    HD1  PHE  38           HD1      PHE  38   8.801 -10.283  10.007
  260    HD2  PHE  38           HD2      PHE  38  10.179  -7.702   6.933
  261    HE1  PHE  38           HE1      PHE  38  11.096 -11.279  10.199
  262    HE2  PHE  38           HE2      PHE  38  12.474  -8.699   7.126
  263    HZ   PHE  38           HZ       PHE  38  12.906 -10.475   8.756
  264    H    ASP  39           H        ASP  39   7.553 -11.276   6.149
  265    HA   ASP  39           HA       ASP  39   5.662 -12.686   7.744
  266   1HB   ASP  39          1HB       ASP  39   5.689 -13.694   5.692
  267   2HB   ASP  39          2HB       ASP  39   7.354 -13.195   5.352
  268    H    SER  40           H        SER  40   8.996 -13.770   6.830
  269    HA   SER  40           HA       SER  40  10.774 -14.189   8.077
  270   1HB   SER  40          1HB       SER  40   9.616 -12.519   9.803
  271   2HB   SER  40          2HB       SER  40   9.341 -14.010  10.721
  272    HG   SER  40           HG       SER  40  11.819 -14.284  10.123
  273    H    ARG  41           H        ARG  41   7.571 -15.534   8.580
  274    HA   ARG  41           HA       ARG  41   8.286 -17.767  10.051
  275   1HB   ARG  41          1HB       ARG  41   6.069 -17.705   7.969
  276   2HB   ARG  41          2HB       ARG  41   6.095 -18.608   9.493
  277   1HG   ARG  41          1HG       ARG  41   6.307 -16.202  10.566
  278   2HG   ARG  41          2HG       ARG  41   5.645 -15.652   9.017
  279   1HD   ARG  41          1HD       ARG  41   3.738 -15.969  10.387
  280   2HD   ARG  41          2HD       ARG  41   3.788 -17.442   9.406
  281    HE   ARG  41           HE       ARG  41   4.467 -17.199  12.291
  282   1HH1  ARG  41          1HH1      ARG  41   4.222 -19.230   9.428
  283   2HH1  ARG  41          2HH1      ARG  41   4.277 -20.715  10.320
  284   1HH2  ARG  41          1HH2      ARG  41   4.540 -19.156  13.468
  285   2HH2  ARG  41          2HH2      ARG  41   4.459 -20.672  12.633
  286    H    ILE  42           H        ILE  42   8.097 -17.115   6.503
  287    HA   ILE  42           HA       ILE  42   9.505 -19.660   6.084
  288    HB   ILE  42           HB       ILE  42   7.720 -18.407   4.026
  289   1HG1  ILE  42          1HG1      ILE  42   6.910 -20.051   6.406
  290   2HG1  ILE  42          2HG1      ILE  42   6.152 -18.592   5.743
  291   1HG2  ILE  42          1HG2      ILE  42   9.386 -20.215   3.462
  292   2HG2  ILE  42          2HG2      ILE  42   8.436 -21.308   4.496
  293   3HG2  ILE  42          3HG2      ILE  42   7.691 -20.574   3.056
  294   1HD1  ILE  42          1HD1      ILE  42   5.948 -21.454   4.839
  295   2HD1  ILE  42          2HD1      ILE  42   4.682 -20.209   4.953
  296   3HD1  ILE  42          3HD1      ILE  42   5.840 -20.178   3.602
  297    HA   PRO  43           HA       PRO  43  12.426 -16.689   4.672
  298   1HB   PRO  43          1HB       PRO  43  14.607 -18.325   4.813
  299   2HB   PRO  43          2HB       PRO  43  14.043 -17.353   6.170
  300   1HG   PRO  43          1HG       PRO  43  13.755 -20.244   5.659
  301   2HG   PRO  43          2HG       PRO  43  13.616 -19.360   7.222
  302   1HD   PRO  43          1HD       PRO  43  11.520 -20.436   5.594
  303   2HD   PRO  43          2HD       PRO  43  11.325 -19.436   7.039
  304    H    GLY  44           H        GLY  44  11.115 -19.336   3.255
  305   1HA   GLY  44          1HA       GLY  44  12.847 -19.249   0.904
  306   2HA   GLY  44          2HA       GLY  44  11.544 -20.376   1.231
  307    H    VAL  45           H        VAL  45  10.183 -17.517   2.144
  308    HA   VAL  45           HA       VAL  45   9.294 -16.906  -0.591
  309    HB   VAL  45           HB       VAL  45   7.104 -16.833   0.069
  310   1HG1  VAL  45          1HG1      VAL  45   7.544 -18.808   2.190
  311   2HG1  VAL  45          2HG1      VAL  45   6.744 -18.981   0.609
  312   3HG1  VAL  45          3HG1      VAL  45   8.515 -19.120   0.732
  313   1HG2  VAL  45          1HG2      VAL  45   7.517 -15.256   1.965
  314   2HG2  VAL  45          2HG2      VAL  45   6.269 -16.479   2.304
  315   3HG2  VAL  45          3HG2      VAL  45   7.900 -16.658   2.993
  316    HA   PRO  46           HA       PRO  46   9.864 -12.713   0.387
  317   1HB   PRO  46          1HB       PRO  46   7.527 -11.387  -0.102
  318   2HB   PRO  46          2HB       PRO  46   8.626 -11.904  -1.378
  319   1HG   PRO  46          1HG       PRO  46   6.060 -13.066  -0.499
  320   2HG   PRO  46          2HG       PRO  46   6.915 -13.289  -2.068
  321   1HD   PRO  46          1HD       PRO  46   6.721 -15.115   0.130
  322   2HD   PRO  46          2HD       PRO  46   7.706 -15.316  -1.326
  323    H    TRP  47           H        TRP  47  10.472 -11.919   2.289
  324    HA   TRP  47           HA       TRP  47   8.533 -12.205   4.436
  325   1HB   TRP  47          1HB       TRP  47  11.098 -10.991   5.092
  326   2HB   TRP  47          2HB       TRP  47  10.275 -12.379   5.806
  327    HD1  TRP  47           HD1      TRP  47  10.682 -14.801   4.392
  328    HE1  TRP  47           HE1      TRP  47  12.788 -15.740   3.108
  329    HE3  TRP  47           HE3      TRP  47  12.984 -10.305   3.806
  330    HZ2  TRP  47           HZ2      TRP  47  15.127 -14.525   2.017
  331    HZ3  TRP  47           HZ3      TRP  47  15.176 -10.269   2.620
  332    HH2  TRP  47           HH2      TRP  47  16.247 -12.283   1.740
  333    H    CYS  48           H        CYS  48   8.095 -10.314   2.171
  334    HA   CYS  48           HA       CYS  48   7.429  -8.061   3.725
  335   1HB   CYS  48          1HB       CYS  48   9.885  -7.692   3.372
  336   2HB   CYS  48          2HB       CYS  48   9.557  -7.546   1.642
  337    H    PHE  49           H        PHE  49   5.352  -8.082   2.874
  338    HA   PHE  49           HA       PHE  49   5.154  -7.649   0.000
  339   1HB   PHE  49          1HB       PHE  49   3.002  -9.275   0.466
  340   2HB   PHE  49          2HB       PHE  49   4.562  -9.924  -0.050
  341    HD1  PHE  49           HD1      PHE  49   6.218 -10.437   1.967
  342    HD2  PHE  49           HD2      PHE  49   1.994 -10.209   2.300
  343    HE1  PHE  49           HE1      PHE  49   6.308 -11.834   4.051
  344    HE2  PHE  49           HE2      PHE  49   2.083 -11.607   4.383
  345    HZ   PHE  49           HZ       PHE  49   4.239 -12.403   5.233
  346    H    LYS  50           H        LYS  50   2.392  -7.592  -0.260
  347    HA   LYS  50           HA       LYS  50   1.614  -5.586   1.741
  348   1HB   LYS  50          1HB       LYS  50   0.261  -5.141  -0.726
  349   2HB   LYS  50          2HB       LYS  50   1.381  -4.072   0.135
  350   1HG   LYS  50          1HG       LYS  50   2.421  -6.369  -1.537
  351   2HG   LYS  50          2HG       LYS  50   1.949  -4.851  -2.319
  352   1HD   LYS  50          1HD       LYS  50   4.131  -5.350  -0.277
  353   2HD   LYS  50          2HD       LYS  50   4.281  -4.609  -1.882
  354   1HE   LYS  50          1HE       LYS  50   3.103  -3.434   0.658
  355   2HE   LYS  50          2HE       LYS  50   4.424  -2.791  -0.330
  356   1HZ   LYS  50          1HZ       LYS  50   2.200  -3.022  -1.941
  357   2HZ   LYS  50          2HZ       LYS  50   1.691  -2.317  -0.560
  358   3HZ   LYS  50          3HZ       LYS  50   2.911  -1.649  -1.415
  359    HA   PRO  51           HA       PRO  51  -1.365  -9.000   1.701
  360   1HB   PRO  51          1HB       PRO  51  -1.269  -9.600   4.363
  361   2HB   PRO  51          2HB       PRO  51  -0.322 -10.455   3.148
  362   1HG   PRO  51          1HG       PRO  51   0.505  -8.399   5.096
  363   2HG   PRO  51          2HG       PRO  51   1.529  -9.588   4.216
  364   1HD   PRO  51          1HD       PRO  51   1.230  -6.784   3.719
  365   2HD   PRO  51          2HD       PRO  51   2.127  -7.942   2.727
  366    H    LEU  52           H        LEU  52  -1.672  -7.935   4.958
  367    HA   LEU  52           HA       LEU  52  -4.215  -6.744   4.201
  368   1HB   LEU  52          1HB       LEU  52  -4.961  -7.303   6.219
  369   2HB   LEU  52          2HB       LEU  52  -3.631  -8.473   6.144
  370    HG   LEU  52           HG       LEU  52  -3.895  -5.956   7.756
  371   1HD1  LEU  52          1HD1      LEU  52  -4.392  -7.608   9.200
  372   2HD1  LEU  52          2HD1      LEU  52  -3.557  -8.852   8.239
  373   3HD1  LEU  52          3HD1      LEU  52  -2.624  -7.778   9.309
  374   1HD2  LEU  52          1HD2      LEU  52  -1.492  -6.742   6.358
  375   2HD2  LEU  52          2HD2      LEU  52  -1.804  -5.316   7.378
  376   3HD2  LEU  52          3HD2      LEU  52  -1.257  -6.840   8.119
  377    H    GLN  53           H        GLN  53  -1.619  -5.465   3.503
  378    HA   GLN  53           HA       GLN  53  -0.925  -3.494   5.257
  379   1HB   GLN  53          1HB       GLN  53  -0.955  -3.486   2.217
  380   2HB   GLN  53          2HB       GLN  53  -0.122  -2.262   3.192
  381   1HG   GLN  53          1HG       GLN  53   0.425  -5.257   3.110
  382   2HG   GLN  53          2HG       GLN  53   1.490  -3.971   2.524
  383   1HE2  GLN  53          1HE2      GLN  53   0.430  -5.856   5.168
  384   2HE2  GLN  53          2HE2      GLN  53   1.411  -5.166   6.417
  385    H    GLU  54           H        GLU  54  -3.846  -3.868   3.369
  386    HA   GLU  54           HA       GLU  54  -4.687  -1.434   2.785
  387   1HB   GLU  54          1HB       GLU  54  -6.835  -2.289   2.797
  388   2HB   GLU  54          2HB       GLU  54  -5.905  -3.796   2.847
  389   1HG   GLU  54          1HG       GLU  54  -7.379  -4.183   4.586
  390   2HG   GLU  54          2HG       GLU  54  -6.082  -3.392   5.492
  391    H    ALA  55           H        ALA  55  -4.069  -2.677   6.033
  392    HA   ALA  55           HA       ALA  55  -5.548  -1.236   7.703
  393   1HB   ALA  55          1HB       ALA  55  -3.551  -2.771   8.167
  394   2HB   ALA  55          2HB       ALA  55  -2.524  -1.333   7.956
  395   3HB   ALA  55          3HB       ALA  55  -3.740  -1.376   9.256
  396    H    GLU  56           H        GLU  56  -2.382   0.090   6.495
  397    HA   GLU  56           HA       GLU  56  -3.715   2.676   6.391
  398   1HB   GLU  56          1HB       GLU  56  -0.967   2.084   7.553
  399   2HB   GLU  56          2HB       GLU  56  -1.596   3.717   7.267
  400   1HG   GLU  56          1HG       GLU  56  -3.321   3.437   8.897
  401   2HG   GLU  56          2HG       GLU  56  -3.097   1.682   8.963
  402    H    CYS  57           H        CYS  57  -3.032   0.561   4.347
  403    HA   CYS  57           HA       CYS  57  -1.000   2.010   2.827
  404   1HB   CYS  57          1HB       CYS  57  -0.838  -0.499   3.320
  405   2HB   CYS  57          2HB       CYS  57  -2.123  -0.694   2.124
  406    H    THR  58           H        THR  58  -4.210   0.320   2.473
  407    HA   THR  58           HA       THR  58  -4.756   1.728   0.022
  408    HB   THR  58           HB       THR  58  -5.420  -0.690   0.648
  409    HG1  THR  58           HG1      THR  58  -7.740  -0.038  -0.184
  410   1HG2  THR  58          1HG2      THR  58  -7.441   0.915   2.293
  411   2HG2  THR  58          2HG2      THR  58  -7.725  -0.760   1.763
  412   3HG2  THR  58          3HG2      THR  58  -6.385  -0.393   2.876
  413    H    PHE  59           H        PHE  59  -5.680   1.976   3.473
  414    HA   PHE  59           HA       PHE  59  -7.806   3.521   3.515
  415   1HB   PHE  59          1HB       PHE  59  -6.253   2.916   5.421
  416   2HB   PHE  59          2HB       PHE  59  -5.100   4.131   4.852
  417    HD1  PHE  59           HD1      PHE  59  -8.470   3.652   6.301
  418    HD2  PHE  59           HD2      PHE  59  -5.350   6.403   5.458
  419    HE1  PHE  59           HE1      PHE  59  -9.601   5.374   7.734
  420    HE2  PHE  59           HE2      PHE  59  -6.481   8.126   6.891
  421    HZ   PHE  59           HZ       PHE  59  -8.594   7.591   8.013
  422   1H    GLU   1           H1       GLU   1 -19.810  -1.082  -1.143
  423    HA   GLU   1           HA       GLU   1 -20.602  -2.864  -3.019
  424   1HB   GLU   1          1HB       GLU   1 -22.948  -2.293  -3.492
  425   2HB   GLU   1          2HB       GLU   1 -22.790  -2.984  -1.868
  426   1HG   GLU   1          1HG       GLU   1 -22.579  -0.493  -1.094
  427   2HG   GLU   1          2HG       GLU   1 -23.267  -0.097  -2.677
  428    H    GLU   2           H        GLU   2 -20.774   0.494  -1.796
  429    HA   GLU   2           HA       GLU   2 -20.661   1.537  -4.463
  430   1HB   GLU   2          1HB       GLU   2 -20.684   3.739  -3.346
  431   2HB   GLU   2          2HB       GLU   2 -21.991   2.705  -2.746
  432   1HG   GLU   2          1HG       GLU   2 -19.928   2.081  -1.021
  433   2HG   GLU   2          2HG       GLU   2 -19.612   3.794  -1.337
  434    H    TYR   3           H        TYR   3 -18.549   0.080  -4.629
  435    HA   TYR   3           HA       TYR   3 -16.239   1.417  -3.478
  436   1HB   TYR   3          1HB       TYR   3 -15.201  -0.598  -4.853
  437   2HB   TYR   3          2HB       TYR   3 -16.170  -0.998  -3.430
  438    HD1  TYR   3           HD1      TYR   3 -16.010  -1.047  -7.102
  439    HD2  TYR   3           HD2      TYR   3 -18.389  -2.004  -3.677
  440    HE1  TYR   3           HE1      TYR   3 -17.521  -2.493  -8.547
  441    HE2  TYR   3           HE2      TYR   3 -19.892  -3.448  -5.134
  442    HH   TYR   3           HH       TYR   3 -19.126  -4.676  -7.848
  443    H    VAL   4           H        VAL   4 -16.861   3.421  -4.838
  444    HA   VAL   4           HA       VAL   4 -15.580   3.119  -7.465
  445    HB   VAL   4           HB       VAL   4 -17.106   4.809  -8.327
  446   1HG1  VAL   4          1HG1      VAL   4 -18.412   3.126  -8.988
  447   2HG1  VAL   4          2HG1      VAL   4 -17.753   2.125  -7.672
  448   3HG1  VAL   4          3HG1      VAL   4 -19.223   3.093  -7.405
  449   1HG2  VAL   4          1HG2      VAL   4 -17.697   6.137  -6.472
  450   2HG2  VAL   4          2HG2      VAL   4 -19.200   5.298  -6.923
  451   3HG2  VAL   4          3HG2      VAL   4 -18.249   4.732  -5.528
  452    H    GLY   5           H        GLY   5 -16.562   5.474  -4.877
  453   1HA   GLY   5          1HA       GLY   5 -14.599   7.394  -5.610
  454   2HA   GLY   5          2HA       GLY   5 -15.549   7.348  -4.138
  455    H    LEU   6           H        LEU   6 -14.146   4.298  -4.443
  456    HA   LEU   6           HA       LEU   6 -11.649   5.111  -3.166
  457   1HB   LEU   6          1HB       LEU   6 -12.163   3.074  -1.601
  458   2HB   LEU   6          2HB       LEU   6 -12.702   4.716  -1.210
  459    HG   LEU   6           HG       LEU   6 -14.501   2.782  -2.657
  460   1HD1  LEU   6          1HD1      LEU   6 -13.427   2.034  -0.298
  461   2HD1  LEU   6          2HD1      LEU   6 -14.813   2.990   0.281
  462   3HD1  LEU   6          3HD1      LEU   6 -15.077   1.613  -0.816
  463   1HD2  LEU   6          1HD2      LEU   6 -16.182   4.193  -1.232
  464   2HD2  LEU   6          2HD2      LEU   6 -14.831   5.348  -1.141
  465   3HD2  LEU   6          3HD2      LEU   6 -15.482   4.864  -2.725
  466    H    SER   7           H        SER   7 -12.815   3.916  -5.820
  467    HA   SER   7           HA       SER   7 -11.236   1.470  -5.747
  468   1HB   SER   7          1HB       SER   7 -13.807   2.018  -6.766
  469   2HB   SER   7          2HB       SER   7 -12.775   1.856  -8.199
  470    HG   SER   7           HG       SER   7 -13.858  -0.128  -6.973
  471    H    ALA   8           H        ALA   8 -10.765   1.196  -8.541
  472    HA   ALA   8           HA       ALA   8  -8.497   2.782  -8.858
  473   1HB   ALA   8          1HB       ALA   8  -8.146   1.196 -10.408
  474   2HB   ALA   8          2HB       ALA   8  -9.802   0.596 -10.147
  475   3HB   ALA   8          3HB       ALA   8  -9.488   1.831 -11.390
  476    H    ASN   9           H        ASN   9  -9.083   4.996  -8.523
  477    HA   ASN   9           HA       ASN   9  -9.372   6.518 -10.655
  478   1HB   ASN   9          1HB       ASN   9 -11.506   5.792 -11.359
  479   2HB   ASN   9          2HB       ASN   9 -12.101   5.587  -9.705
  480   1HD2  ASN   9          1HD2      ASN   9 -10.729   8.120 -11.806
  481   2HD2  ASN   9          2HD2      ASN   9 -11.836   9.381 -11.381
  482    H    GLN  10           H        GLN  10 -10.175   5.787  -7.304
  483    HA   GLN  10           HA       GLN  10 -10.901   8.271  -6.390
  484   1HB   GLN  10          1HB       GLN  10 -11.073   6.167  -5.099
  485   2HB   GLN  10          2HB       GLN  10  -9.309   6.114  -4.931
  486   1HG   GLN  10          1HG       GLN  10  -9.413   8.339  -3.769
  487   2HG   GLN  10          2HG       GLN  10 -11.180   8.277  -3.855
  488   1HE2  GLN  10          1HE2      GLN  10  -8.385   6.290  -2.893
  489   2HE2  GLN  10          2HE2      GLN  10  -9.072   5.628  -1.446
  490    H    CYS  11           H        CYS  11  -7.678   6.857  -7.064
  491    HA   CYS  11           HA       CYS  11  -6.140   8.744  -5.752
  492   1HB   CYS  11          1HB       CYS  11  -5.087   6.792  -6.476
  493   2HB   CYS  11          2HB       CYS  11  -5.641   6.986  -8.143
  494    H    ALA  12           H        ALA  12  -8.338   9.079  -8.361
  495    HA   ALA  12           HA       ALA  12  -6.909  11.359  -9.495
  496   1HB   ALA  12          1HB       ALA  12  -8.318   9.312 -10.661
  497   2HB   ALA  12          2HB       ALA  12  -9.559  10.584 -10.568
  498   3HB   ALA  12          3HB       ALA  12  -8.027  10.897 -11.418
  499    H    VAL  13           H        VAL  13  -8.226  11.162  -6.717
  500    HA   VAL  13           HA       VAL  13 -10.602  12.416  -6.513
  501    HB   VAL  13           HB       VAL  13  -9.274  13.609  -4.504
  502   1HG1  VAL  13          1HG1      VAL  13 -10.277  10.790  -4.845
  503   2HG1  VAL  13          2HG1      VAL  13  -9.559  11.309  -3.300
  504   3HG1  VAL  13          3HG1      VAL  13 -10.993  12.147  -3.941
  505   1HG2  VAL  13          1HG2      VAL  13  -7.593  11.141  -4.934
  506   2HG2  VAL  13          2HG2      VAL  13  -7.101  12.715  -5.603
  507   3HG2  VAL  13          3HG2      VAL  13  -7.312  12.521  -3.847
  508    HA   PRO  14           HA       PRO  14 -10.187  16.477  -7.932
  509   1HB   PRO  14          1HB       PRO  14 -11.641  17.965  -6.163
  510   2HB   PRO  14          2HB       PRO  14 -12.376  17.002  -7.444
  511   1HG   PRO  14          1HG       PRO  14 -12.172  16.470  -4.549
  512   2HG   PRO  14          2HG       PRO  14 -13.310  15.753  -5.745
  513   1HD   PRO  14          1HD       PRO  14 -10.993  14.561  -4.555
  514   2HD   PRO  14          2HD       PRO  14 -11.988  13.875  -5.846
  515    H    ALA  15           H        ALA  15  -8.514  15.503  -5.366
  516    HA   ALA  15           HA       ALA  15  -6.548  16.308  -4.636
  517   1HB   ALA  15          1HB       ALA  15  -5.550  18.137  -5.599
  518   2HB   ALA  15          2HB       ALA  15  -6.846  17.895  -6.794
  519   3HB   ALA  15          3HB       ALA  15  -7.030  19.124  -5.520
  520    H    LYS  16           H        LYS  16  -8.479  15.867  -2.901
  521    HA   LYS  16           HA       LYS  16  -7.979  17.449  -0.760
  522   1HB   LYS  16          1HB       LYS  16 -10.371  18.631  -0.762
  523   2HB   LYS  16          2HB       LYS  16  -8.910  19.421  -1.380
  524   1HG   LYS  16          1HG       LYS  16  -9.742  19.475  -3.480
  525   2HG   LYS  16          2HG       LYS  16 -10.182  17.760  -3.435
  526   1HD   LYS  16          1HD       LYS  16 -11.794  20.069  -2.265
  527   2HD   LYS  16          2HD       LYS  16 -12.179  19.199  -3.761
  528   1HE   LYS  16          1HE       LYS  16 -12.102  17.077  -2.161
  529   2HE   LYS  16          2HE       LYS  16 -12.391  18.276  -0.890
  530   1HZ   LYS  16          1HZ       LYS  16 -14.154  18.945  -2.787
  531   2HZ   LYS  16          2HZ       LYS  16 -14.144  17.318  -2.920
  532   3HZ   LYS  16          3HZ       LYS  16 -14.496  18.019  -1.487
  533    H    ASP  17           H        ASP  17  -8.261  14.741  -1.313
  534    HA   ASP  17           HA       ASP  17 -10.350  14.132   0.548
  535   1HB   ASP  17          1HB       ASP  17 -11.454  13.978  -1.688
  536   2HB   ASP  17          2HB       ASP  17 -10.231  12.806  -2.203
  537    H    ARG  18           H        ARG  18  -7.240  14.021  -0.284
  538    HA   ARG  18           HA       ARG  18  -6.831  11.190   0.026
  539   1HB   ARG  18          1HB       ARG  18  -4.715  13.367  -0.219
  540   2HB   ARG  18          2HB       ARG  18  -4.513  11.640  -0.557
  541   1HG   ARG  18          1HG       ARG  18  -5.398  11.832  -2.643
  542   2HG   ARG  18          2HG       ARG  18  -6.681  12.933  -2.115
  543   1HD   ARG  18          1HD       ARG  18  -5.062  14.805  -2.089
  544   2HD   ARG  18          2HD       ARG  18  -3.760  13.710  -2.577
  545    HE   ARG  18           HE       ARG  18  -6.157  13.918  -4.331
  546   1HH1  ARG  18          1HH1      ARG  18  -2.759  14.648  -3.779
  547   2HH1  ARG  18          2HH1      ARG  18  -2.449  15.066  -5.431
  548   1HH2  ARG  18          1HH2      ARG  18  -5.749  14.470  -6.510
  549   2HH2  ARG  18          2HH2      ARG  18  -4.161  14.965  -6.995
  550    H    VAL  19           H        VAL  19  -4.681  10.756   1.530
  551    HA   VAL  19           HA       VAL  19  -5.306  12.064   4.083
  552    HB   VAL  19           HB       VAL  19  -3.965   9.395   3.641
  553   1HG1  VAL  19          1HG1      VAL  19  -4.203  10.989   5.912
  554   2HG1  VAL  19          2HG1      VAL  19  -5.502   9.785   6.092
  555   3HG1  VAL  19          3HG1      VAL  19  -3.818   9.252   5.869
  556   1HG2  VAL  19          1HG2      VAL  19  -6.045   8.971   2.693
  557   2HG2  VAL  19          2HG2      VAL  19  -6.314   8.542   4.400
  558   3HG2  VAL  19          3HG2      VAL  19  -6.888  10.106   3.774
  559    H    ASP  20           H        ASP  20  -3.448  12.848   1.714
  560    HA   ASP  20           HA       ASP  20  -1.342  13.394   1.357
  561   1HB   ASP  20          1HB       ASP  20  -1.802  15.387   2.433
  562   2HB   ASP  20          2HB       ASP  20  -2.200  14.600   3.967
  563    H    CYS  21           H        CYS  21  -0.240  11.303   1.342
  564    HA   CYS  21           HA       CYS  21   0.445   9.823   3.525
  565   1HB   CYS  21          1HB       CYS  21   0.848   9.651   0.838
  566   2HB   CYS  21          2HB       CYS  21   2.498   9.908   1.413
  567    H    GLY  22           H        GLY  22   1.857  12.817   2.204
  568   1HA   GLY  22          1HA       GLY  22   3.683  14.027   2.805
  569   2HA   GLY  22          2HA       GLY  22   2.988  13.830   4.401
  570    H    TYR  23           H        TYR  23   4.835  11.735   2.059
  571    HA   TYR  23           HA       TYR  23   6.276  10.591   4.304
  572   1HB   TYR  23          1HB       TYR  23   5.534  10.036   1.485
  573   2HB   TYR  23          2HB       TYR  23   7.235   9.664   1.782
  574    HD1  TYR  23           HD1      TYR  23   7.854   7.669   2.896
  575    HD2  TYR  23           HD2      TYR  23   3.767   8.935   2.941
  576    HE1  TYR  23           HE1      TYR  23   7.167   5.439   3.904
  577    HE2  TYR  23           HE2      TYR  23   3.094   6.700   3.948
  578    HH   TYR  23           HH       TYR  23   3.970   4.411   3.993
  579    HA   PRO  24           HA       PRO  24   9.869  12.908   3.643
  580   1HB   PRO  24          1HB       PRO  24  11.786  11.225   4.618
  581   2HB   PRO  24          2HB       PRO  24  10.770  12.227   5.650
  582   1HG   PRO  24          1HG       PRO  24  10.626   9.337   5.079
  583   2HG   PRO  24          2HG       PRO  24   9.919  10.244   6.464
  584   1HD   PRO  24          1HD       PRO  24   8.584   9.192   4.160
  585   2HD   PRO  24          2HD       PRO  24   7.875  10.215   5.416
  586    H    HIS  25           H        HIS  25   9.257  10.105   1.950
  587    HA   HIS  25           HA       HIS  25  11.524  10.726   0.199
  588   1HB   HIS  25          1HB       HIS  25  10.795   8.284   1.455
  589   2HB   HIS  25          2HB       HIS  25  10.509   8.091  -0.279
  590    HD1  HIS  25           HD1      HIS  25  12.569   6.344  -0.099
  591    HD2  HIS  25           HD2      HIS  25  13.511  10.391   0.471
  592    HE1  HIS  25           HE1      HIS  25  15.100   6.533  -0.362
  593    HE2  HIS  25           HE2      HIS  25  15.612   9.050  -0.055
  594    H    VAL  26           H        VAL  26   8.389  11.415   0.564
  595    HA   VAL  26           HA       VAL  26   6.878  10.511  -1.437
  596    HB   VAL  26           HB       VAL  26   6.013  12.114   0.033
  597   1HG1  VAL  26          1HG1      VAL  26   7.000  14.039   0.709
  598   2HG1  VAL  26          2HG1      VAL  26   8.464  13.274   0.047
  599   3HG1  VAL  26          3HG1      VAL  26   7.559  14.457  -0.928
  600   1HG2  VAL  26          1HG2      VAL  26   4.709  13.295  -1.404
  601   2HG2  VAL  26          2HG2      VAL  26   6.098  13.946  -2.307
  602   3HG2  VAL  26          3HG2      VAL  26   5.531  12.287  -2.619
  603    H    THR  27           H        THR  27   7.308  10.059  -3.530
  604    HA   THR  27           HA       THR  27   8.247  12.110  -5.267
  605    HB   THR  27           HB       THR  27  10.247  10.628  -3.906
  606    HG1  THR  27           HG1      THR  27  11.499  11.864  -5.501
  607   1HG2  THR  27          1HG2      THR  27   9.431   9.226  -6.339
  608   2HG2  THR  27          2HG2      THR  27  11.048   9.940  -6.556
  609   3HG2  THR  27          3HG2      THR  27  10.745   8.817  -5.209
  610    HA   PRO  28           HA       PRO  28   6.236   9.601  -8.106
  611   1HB   PRO  28          1HB       PRO  28   7.496  10.158 -10.466
  612   2HB   PRO  28          2HB       PRO  28   6.294  11.223  -9.740
  613   1HG   PRO  28          1HG       PRO  28   9.234  11.459  -9.823
  614   2HG   PRO  28          2HG       PRO  28   8.011  12.747  -9.524
  615   1HD   PRO  28          1HD       PRO  28   9.719  11.436  -7.634
  616   2HD   PRO  28          2HD       PRO  28   8.422  12.582  -7.268
  617    H    LYS  29           H        LYS  29   7.863   8.064  -6.571
  618    HA   LYS  29           HA       LYS  29   8.093   5.802  -8.139
  619   1HB   LYS  29          1HB       LYS  29  10.049   7.440  -8.952
  620   2HB   LYS  29          2HB       LYS  29  10.892   6.653  -7.606
  621   1HG   LYS  29          1HG       LYS  29  11.224   4.841  -8.896
  622   2HG   LYS  29          2HG       LYS  29   9.474   4.619  -9.057
  623   1HD   LYS  29          1HD       LYS  29  10.647   6.772 -10.740
  624   2HD   LYS  29          2HD       LYS  29  11.180   5.134 -11.153
  625   1HE   LYS  29          1HE       LYS  29   8.595   4.581 -10.986
  626   2HE   LYS  29          2HE       LYS  29   8.399   6.324 -11.229
  627   1HZ   LYS  29          1HZ       LYS  29  10.037   4.639 -12.984
  628   2HZ   LYS  29          2HZ       LYS  29   8.455   4.931 -13.265
  629   3HZ   LYS  29          3HZ       LYS  29   9.525   6.166 -13.262
  630    H    GLU  30           H        GLU  30   8.708   7.763  -5.323
  631    HA   GLU  30           HA       GLU  30   9.484   5.434  -3.798
  632   1HB   GLU  30          1HB       GLU  30   9.798   8.334  -3.550
  633   2HB   GLU  30          2HB       GLU  30   9.256   7.601  -2.031
  634   1HG   GLU  30          1HG       GLU  30  11.458   7.151  -1.708
  635   2HG   GLU  30          2HG       GLU  30  11.211   5.824  -2.852
  636    H    CYS  31           H        CYS  31   6.858   7.891  -4.074
  637    HA   CYS  31           HA       CYS  31   5.370   7.160  -1.894
  638   1HB   CYS  31          1HB       CYS  31   4.521   8.189  -4.596
  639   2HB   CYS  31          2HB       CYS  31   3.406   8.000  -3.240
  640    H    ASN  32           H        ASN  32   5.103   5.990  -5.335
  641    HA   ASN  32           HA       ASN  32   3.181   4.089  -4.788
  642   1HB   ASN  32          1HB       ASN  32   5.079   4.722  -6.989
  643   2HB   ASN  32          2HB       ASN  32   4.578   3.025  -6.943
  644   1HD2  ASN  32          1HD2      ASN  32   2.752   5.847  -5.865
  645   2HD2  ASN  32          2HD2      ASN  32   1.465   5.749  -7.021
  646    H    ASN  33           H        ASN  33   6.486   4.285  -3.874
  647    HA   ASN  33           HA       ASN  33   7.027   1.491  -4.019
  648   1HB   ASN  33          1HB       ASN  33   8.637   3.659  -4.005
  649   2HB   ASN  33          2HB       ASN  33   8.642   3.343  -2.263
  650   1HD2  ASN  33          1HD2      ASN  33  10.973   3.073  -2.911
  651   2HD2  ASN  33          2HD2      ASN  33  11.515   1.481  -3.323
  652    H    ARG  34           H        ARG  34   6.076   3.989  -1.602
  653    HA   ARG  34           HA       ARG  34   6.279   2.144   0.554
  654   1HB   ARG  34          1HB       ARG  34   4.811   4.800   0.646
  655   2HB   ARG  34          2HB       ARG  34   5.693   3.994   1.954
  656   1HG   ARG  34          1HG       ARG  34   7.364   4.575  -0.406
  657   2HG   ARG  34          2HG       ARG  34   6.683   6.035   0.333
  658   1HD   ARG  34          1HD       ARG  34   8.158   5.899   2.037
  659   2HD   ARG  34          2HD       ARG  34   7.651   4.245   2.411
  660    HE   ARG  34           HE       ARG  34   9.313   4.195   0.086
  661   1HH1  ARG  34          1HH1      ARG  34   9.548   4.817   3.542
  662   2HH1  ARG  34          2HH1      ARG  34  11.207   4.328   3.646
  663   1HH2  ARG  34          1HH2      ARG  34  11.501   3.549   0.224
  664   2HH2  ARG  34          2HH2      ARG  34  12.325   3.602   1.747
  665    H    GLY  35           H        GLY  35   3.846   3.288  -1.742
  666   1HA   GLY  35          1HA       GLY  35   1.978   1.738  -2.045
  667   2HA   GLY  35          2HA       GLY  35   1.788   1.721  -0.303
  668    H    CYS  36           H        CYS  36   2.710   4.720  -1.972
  669    HA   CYS  36           HA       CYS  36   0.038   5.743  -1.349
  670   1HB   CYS  36          1HB       CYS  36   2.603   7.306  -1.646
  671   2HB   CYS  36          2HB       CYS  36   1.031   7.934  -1.141
  672    H    CYS  37           H        CYS  37  -0.331   7.849  -2.910
  673    HA   CYS  37           HA       CYS  37   0.362   6.943  -5.612
  674   1HB   CYS  37          1HB       CYS  37  -2.078   6.713  -4.773
  675   2HB   CYS  37          2HB       CYS  37  -2.157   8.463  -5.002
  676    H    PHE  38           H        PHE  38   1.480   8.467  -6.803
  677    HA   PHE  38           HA       PHE  38   1.801  11.086  -5.584
  678   1HB   PHE  38          1HB       PHE  38   3.768   9.711  -6.302
  679   2HB   PHE  38          2HB       PHE  38   3.106   9.591  -7.937
  680    HD1  PHE  38           HD1      PHE  38   3.536  11.279  -9.528
  681    HD2  PHE  38           HD2      PHE  38   4.515  11.950  -5.454
  682    HE1  PHE  38           HE1      PHE  38   4.793  13.353 -10.171
  683    HE2  PHE  38           HE2      PHE  38   5.773  14.024  -6.097
  684    HZ   PHE  38           HZ       PHE  38   5.896  14.702  -8.448
  685    H    ASP  39           H        ASP  39   0.517  12.744  -6.229
  686    HA   ASP  39           HA       ASP  39  -0.929  12.467  -8.674
  687   1HB   ASP  39          1HB       ASP  39  -2.094  13.409  -6.784
  688   2HB   ASP  39          2HB       ASP  39  -0.817  14.602  -6.502
  689    H    SER  40           H        SER  40   0.601  15.466  -7.331
  690    HA   SER  40           HA       SER  40   2.299  16.672  -8.108
  691   1HB   SER  40          1HB       SER  40   2.908  14.473  -9.489
  692   2HB   SER  40          2HB       SER  40   2.313  15.436 -10.853
  693    HG   SER  40           HG       SER  40   3.847  17.152  -9.904
  694    H    ARG  41           H        ARG  41  -0.722  15.943  -9.650
  695    HA   ARG  41           HA       ARG  41  -0.772  17.847 -11.628
  696   1HB   ARG  41          1HB       ARG  41  -2.991  16.712  -9.872
  697   2HB   ARG  41          2HB       ARG  41  -3.312  17.723 -11.292
  698   1HG   ARG  41          1HG       ARG  41  -1.564  15.836 -12.303
  699   2HG   ARG  41          2HG       ARG  41  -2.479  14.880 -11.122
  700   1HD   ARG  41          1HD       ARG  41  -4.069  14.689 -12.725
  701   2HD   ARG  41          2HD       ARG  41  -4.450  16.394 -12.426
  702    HE   ARG  41           HE       ARG  41  -2.295  16.459 -14.188
  703   1HH1  ARG  41          1HH1      ARG  41  -5.486  14.976 -14.233
  704   2HH1  ARG  41          2HH1      ARG  41  -5.636  15.049 -15.957
  705   1HH2  ARG  41          1HH2      ARG  41  -2.493  16.554 -16.463
  706   2HH2  ARG  41          2HH2      ARG  41  -3.922  15.953 -17.234
  707    H    ILE  42           H        ILE  42  -1.504  18.026  -8.105
  708    HA   ILE  42           HA       ILE  42  -1.697  20.942  -8.409
  709    HB   ILE  42           HB       ILE  42  -3.062  19.344  -6.257
  710   1HG1  ILE  42          1HG1      ILE  42  -3.935  19.886  -9.063
  711   2HG1  ILE  42          2HG1      ILE  42  -4.167  18.439  -8.066
  712   1HG2  ILE  42          1HG2      ILE  42  -4.141  21.925  -7.196
  713   2HG2  ILE  42          2HG2      ILE  42  -3.937  21.288  -5.547
  714   3HG2  ILE  42          3HG2      ILE  42  -2.551  22.006  -6.402
  715   1HD1  ILE  42          1HD1      ILE  42  -5.726  21.017  -8.120
  716   2HD1  ILE  42          2HD1      ILE  42  -6.314  19.340  -8.018
  717   3HD1  ILE  42          3HD1      ILE  42  -5.617  20.128  -6.582
  718    HA   PRO  43           HA       PRO  43   1.848  20.686  -5.880
  719   1HB   PRO  43          1HB       PRO  43   2.486  23.341  -5.932
  720   2HB   PRO  43          2HB       PRO  43   2.995  22.204  -7.178
  721   1HG   PRO  43          1HG       PRO  43   0.857  24.235  -7.224
  722   2HG   PRO  43          2HG       PRO  43   1.676  23.435  -8.614
  723   1HD   PRO  43          1HD       PRO  43  -0.943  22.939  -7.567
  724   2HD   PRO  43          2HD       PRO  43  -0.122  22.018  -8.832
  725    H    GLY  44           H        GLY  44  -1.026  22.376  -5.279
  726   1HA   GLY  44          1HA       GLY  44  -0.204  23.135  -2.585
  727   2HA   GLY  44          2HA       GLY  44  -1.720  23.500  -3.384
  728    H    VAL  45           H        VAL  45  -1.361  20.338  -4.184
  729    HA   VAL  45           HA       VAL  45  -2.782  19.467  -1.767
  730    HB   VAL  45           HB       VAL  45  -3.548  19.447  -4.426
  731   1HG1  VAL  45          1HG1      VAL  45  -2.569  16.692  -3.625
  732   2HG1  VAL  45          2HG1      VAL  45  -3.756  16.978  -4.920
  733   3HG1  VAL  45          3HG1      VAL  45  -2.111  17.644  -5.056
  734   1HG2  VAL  45          1HG2      VAL  45  -5.074  17.461  -3.143
  735   2HG2  VAL  45          2HG2      VAL  45  -4.541  18.564  -1.852
  736   3HG2  VAL  45          3HG2      VAL  45  -5.432  19.201  -3.255
  737    HA   PRO  46           HA       PRO  46   0.209  16.413  -1.107
  738   1HB   PRO  46          1HB       PRO  46  -1.195  14.165  -0.439
  739   2HB   PRO  46          2HB       PRO  46  -0.917  15.498   0.681
  740   1HG   PRO  46          1HG       PRO  46  -3.342  14.768  -0.833
  741   2HG   PRO  46          2HG       PRO  46  -3.204  15.799   0.636
  742   1HD   PRO  46          1HD       PRO  46  -3.631  16.614  -2.076
  743   2HD   PRO  46          2HD       PRO  46  -3.343  17.672  -0.689
  744    H    TRP  47           H        TRP  47   1.585  15.885  -2.685
  745    HA   TRP  47           HA       TRP  47   0.484  14.420  -4.921
  746   1HB   TRP  47          1HB       TRP  47   3.336  14.730  -4.991
  747   2HB   TRP  47          2HB       TRP  47   2.102  15.386  -6.068
  748    HD1  TRP  47           HD1      TRP  47   1.306  17.942  -5.564
  749    HE1  TRP  47           HE1      TRP  47   2.310  19.964  -4.197
  750    HE3  TRP  47           HE3      TRP  47   4.639  15.171  -2.906
  751    HZ2  TRP  47           HZ2      TRP  47   4.339  20.172  -2.201
  752    HZ3  TRP  47           HZ3      TRP  47   6.093  16.361  -1.268
  753    HH2  TRP  47           HH2      TRP  47   5.983  18.774  -0.895
  754    H    CYS  48           H        CYS  48   0.433  13.169  -2.243
  755    HA   CYS  48           HA       CYS  48   1.505  10.679  -2.968
  756   1HB   CYS  48          1HB       CYS  48   3.592  11.902  -2.274
  757   2HB   CYS  48          2HB       CYS  48   2.935  11.959  -0.636
  758    H    PHE  49           H        PHE  49  -0.319   9.578  -2.311
  759    HA   PHE  49           HA       PHE  49  -1.033   9.752   0.485
  760   1HB   PHE  49          1HB       PHE  49  -3.526   9.865  -0.564
  761   2HB   PHE  49          2HB       PHE  49  -2.627  11.349  -0.232
  762    HD1  PHE  49           HD1      PHE  49  -1.171  12.235  -2.220
  763    HD2  PHE  49           HD2      PHE  49  -4.407   9.527  -2.666
  764    HE1  PHE  49           HE1      PHE  49  -1.386  12.890  -4.632
  765    HE2  PHE  49           HE2      PHE  49  -4.622  10.181  -5.079
  766    HZ   PHE  49           HZ       PHE  49  -3.109  11.855  -6.034
  767    H    LYS  50           H        LYS  50  -3.356   8.254   0.494
  768    HA   LYS  50           HA       LYS  50  -2.557   5.822  -0.946
  769   1HB   LYS  50          1HB       LYS  50  -3.657   4.678   1.108
  770   2HB   LYS  50          2HB       LYS  50  -1.992   5.272   1.226
  771   1HG   LYS  50          1HG       LYS  50  -3.563   7.484   1.926
  772   2HG   LYS  50          2HG       LYS  50  -4.404   6.120   2.682
  773   1HD   LYS  50          1HD       LYS  50  -2.787   6.953   4.265
  774   2HD   LYS  50          2HD       LYS  50  -2.165   5.407   3.660
  775   1HE   LYS  50          1HE       LYS  50  -0.326   6.959   3.672
  776   2HE   LYS  50          2HE       LYS  50  -0.789   6.749   1.975
  777   1HZ   LYS  50          1HZ       LYS  50  -0.682   8.995   2.182
  778   2HZ   LYS  50          2HZ       LYS  50  -2.266   8.776   2.508
  779   3HZ   LYS  50          3HZ       LYS  50  -1.209   9.028   3.727
  780    HA   PRO  51           HA       PRO  51  -6.759   6.979  -2.131
  781   1HB   PRO  51          1HB       PRO  51  -6.403   6.863  -4.836
  782   2HB   PRO  51          2HB       PRO  51  -6.271   8.356  -3.911
  783   1HG   PRO  51          1HG       PRO  51  -4.160   6.638  -5.048
  784   2HG   PRO  51          2HG       PRO  51  -4.054   8.363  -4.544
  785   1HD   PRO  51          1HD       PRO  51  -3.053   6.046  -3.189
  786   2HD   PRO  51          2HD       PRO  51  -3.065   7.705  -2.575
  787    H    LEU  52           H        LEU  52  -6.277   5.327  -4.998
  788    HA   LEU  52           HA       LEU  52  -7.699   3.066  -3.853
  789   1HB   LEU  52          1HB       LEU  52  -8.357   2.540  -6.012
  790   2HB   LEU  52          2HB       LEU  52  -8.450   4.308  -5.914
  791    HG   LEU  52           HG       LEU  52  -7.526   4.006  -7.993
  792   1HD1  LEU  52          1HD1      LEU  52  -6.064   5.504  -6.851
  793   2HD1  LEU  52          2HD1      LEU  52  -5.171   4.159  -6.099
  794   3HD1  LEU  52          3HD1      LEU  52  -5.059   4.432  -7.855
  795   1HD2  LEU  52          1HD2      LEU  52  -6.677   2.095  -8.769
  796   2HD2  LEU  52          2HD2      LEU  52  -5.435   2.025  -7.497
  797   3HD2  LEU  52          3HD2      LEU  52  -7.074   1.410  -7.174
  798    H    GLN  53           H        GLN  53  -4.909   3.501  -3.094
  799    HA   GLN  53           HA       GLN  53  -3.035   2.236  -4.491
  800   1HB   GLN  53          1HB       GLN  53  -3.561   1.980  -1.506
  801   2HB   GLN  53          2HB       GLN  53  -2.021   1.581  -2.287
  802   1HG   GLN  53          1HG       GLN  53  -3.386   4.307  -2.344
  803   2HG   GLN  53          2HG       GLN  53  -2.029   3.878  -1.291
  804   1HE2  GLN  53          1HE2      GLN  53  -3.113   4.523  -4.540
  805   2HE2  GLN  53          2HE2      GLN  53  -1.564   4.733  -5.286
  806    H    GLU  54           H        GLU  54  -5.926   0.802  -3.114
  807    HA   GLU  54           HA       GLU  54  -5.420  -1.692  -2.551
  808   1HB   GLU  54          1HB       GLU  54  -7.602  -0.322  -3.971
  809   2HB   GLU  54          2HB       GLU  54  -7.534  -2.056  -4.329
  810   1HG   GLU  54          1HG       GLU  54  -8.194  -2.625  -2.226
  811   2HG   GLU  54          2HG       GLU  54  -7.167  -1.405  -1.460
  812    H    ALA  55           H        ALA  55  -4.895  -0.220  -5.731
  813    HA   ALA  55           HA       ALA  55  -4.880  -2.123  -7.536
  814   1HB   ALA  55          1HB       ALA  55  -2.297  -1.054  -7.821
  815   2HB   ALA  55          2HB       ALA  55  -3.804  -0.404  -8.512
  816   3HB   ALA  55          3HB       ALA  55  -3.212   0.196  -6.943
  817    H    GLU  56           H        GLU  56  -2.025  -1.731  -5.308
  818    HA   GLU  56           HA       GLU  56  -1.850  -4.620  -5.269
  819   1HB   GLU  56          1HB       GLU  56   0.128  -2.748  -6.457
  820   2HB   GLU  56          2HB       GLU  56   0.813  -3.996  -5.401
  821   1HG   GLU  56          1HG       GLU  56   0.101  -5.735  -6.785
  822   2HG   GLU  56          2HG       GLU  56  -1.231  -4.795  -7.477
  823    H    CYS  57           H        CYS  57  -2.556  -2.158  -3.479
  824    HA   CYS  57           HA       CYS  57  -0.490  -2.351  -1.474
  825   1HB   CYS  57          1HB       CYS  57  -2.339  -0.392  -2.251
  826   2HB   CYS  57          2HB       CYS  57  -2.844  -0.901  -0.638
  827    H    THR  58           H        THR  58  -4.119  -2.712  -1.584
  828    HA   THR  58           HA       THR  58  -4.190  -4.206   0.825
  829    HB   THR  58           HB       THR  58  -5.982  -2.736  -0.579
  830    HG1  THR  58           HG1      THR  58  -6.606  -5.220   0.852
  831   1HG2  THR  58          1HG2      THR  58  -6.276  -4.302  -2.459
  832   2HG2  THR  58          2HG2      THR  58  -6.494  -5.661  -1.331
  833   3HG2  THR  58          3HG2      THR  58  -7.725  -4.378  -1.428
  834    H    PHE  59           H        PHE  59  -4.361  -5.121  -2.668
  835    HA   PHE  59           HA       PHE  59  -4.901  -7.745  -2.460
  836   1HB   PHE  59          1HB       PHE  59  -3.313  -5.908  -4.187
  837   2HB   PHE  59          2HB       PHE  59  -2.785  -7.589  -4.325
  838    HD1  PHE  59           HD1      PHE  59  -6.079  -5.827  -4.092
  839    HD2  PHE  59           HD2      PHE  59  -3.676  -8.653  -6.151
  840    HE1  PHE  59           HE1      PHE  59  -7.968  -6.271  -5.685
  841    HE2  PHE  59           HE2      PHE  59  -5.565  -9.098  -7.745
  842    HZ   PHE  59           HZ       PHE  59  -7.688  -7.901  -7.492
  Start of MODEL   44
    1   1H    GLU   1           H1       GLU   1 -16.444 -14.834  -1.127
    2    HA   GLU   1           HA       GLU   1 -17.887 -13.149   0.752
    3   1HB   GLU   1          1HB       GLU   1 -15.691 -14.926   1.364
    4   2HB   GLU   1          2HB       GLU   1 -15.174 -13.251   1.628
    5   1HG   GLU   1          1HG       GLU   1 -16.561 -12.987   3.416
    6   2HG   GLU   1          2HG       GLU   1 -17.896 -13.857   2.644
    7    H    GLU   2           H        GLU   2 -17.058 -10.933   0.889
    8    HA   GLU   2           HA       GLU   2 -16.062 -10.090  -1.623
    9   1HB   GLU   2          1HB       GLU   2 -17.317  -8.903   0.730
   10   2HB   GLU   2          2HB       GLU   2 -16.001  -7.883   0.125
   11   1HG   GLU   2          1HG       GLU   2 -17.102  -8.330  -2.223
   12   2HG   GLU   2          2HG       GLU   2 -18.531  -8.780  -1.282
   13    H    TYR   3           H        TYR   3 -14.884  -8.751   1.500
   14    HA   TYR   3           HA       TYR   3 -12.207  -8.717   0.471
   15   1HB   TYR   3          1HB       TYR   3 -13.746  -7.956   3.001
   16   2HB   TYR   3          2HB       TYR   3 -11.981  -7.869   3.008
   17    HD1  TYR   3           HD1      TYR   3 -14.967  -6.088   2.377
   18    HD2  TYR   3           HD2      TYR   3 -10.928  -6.474   1.017
   19    HE1  TYR   3           HE1      TYR   3 -15.084  -3.766   1.348
   20    HE2  TYR   3           HE2      TYR   3 -11.059  -4.151  -0.007
   21    HH   TYR   3           HH       TYR   3 -12.399  -2.510  -0.574
   22    H    VAL   4           H        VAL   4 -11.937 -11.092   0.194
   23    HA   VAL   4           HA       VAL   4 -11.260 -12.326   2.773
   24    HB   VAL   4           HB       VAL   4 -13.005 -13.647   2.217
   25   1HG1  VAL   4          1HG1      VAL   4 -13.882 -14.039  -0.011
   26   2HG1  VAL   4          2HG1      VAL   4 -13.610 -12.296   0.219
   27   3HG1  VAL   4          3HG1      VAL   4 -12.462 -13.255  -0.745
   28   1HG2  VAL   4          1HG2      VAL   4 -10.606 -14.818   1.774
   29   2HG2  VAL   4          2HG2      VAL   4 -12.158 -15.686   1.696
   30   3HG2  VAL   4          3HG2      VAL   4 -11.386 -15.107   0.201
   31    H    GLY   5           H        GLY   5 -10.687 -12.511  -0.814
   32   1HA   GLY   5          1HA       GLY   5  -8.170 -13.766  -0.582
   33   2HA   GLY   5          2HA       GLY   5  -8.814 -12.938  -1.985
   34    H    LEU   6           H        LEU   6  -9.088 -10.706   0.486
   35    HA   LEU   6           HA       LEU   6  -6.323  -9.810   0.338
   36   1HB   LEU   6          1HB       LEU   6  -8.069  -7.576  -0.076
   37   2HB   LEU   6          2HB       LEU   6  -6.655  -8.100  -1.009
   38    HG   LEU   6           HG       LEU   6  -8.095  -9.609  -2.315
   39   1HD1  LEU   6          1HD1      LEU   6 -10.030  -8.941  -0.232
   40   2HD1  LEU   6          2HD1      LEU   6 -10.689  -8.761  -1.876
   41   3HD1  LEU   6          3HD1      LEU   6  -9.983 -10.314  -1.364
   42   1HD2  LEU   6          1HD2      LEU   6  -8.359  -7.946  -3.758
   43   2HD2  LEU   6          2HD2      LEU   6  -9.674  -7.244  -2.784
   44   3HD2  LEU   6          3HD2      LEU   6  -7.983  -6.801  -2.447
   45    H    SER   7           H        SER   7  -7.969 -11.062   2.418
   46    HA   SER   7           HA       SER   7  -8.576  -8.818   4.133
   47   1HB   SER   7          1HB       SER   7  -9.841 -11.212   3.748
   48   2HB   SER   7          2HB       SER   7  -8.870 -11.589   5.181
   49    HG   SER   7           HG       SER   7 -10.805 -10.752   5.947
   50    H    ALA   8           H        ALA   8  -8.016  -9.801   6.674
   51    HA   ALA   8           HA       ALA   8  -5.270  -9.332   6.890
   52   1HB   ALA   8          1HB       ALA   8  -7.356 -10.462   8.791
   53   2HB   ALA   8          2HB       ALA   8  -5.686 -10.090   9.281
   54   3HB   ALA   8          3HB       ALA   8  -6.755  -8.790   8.699
   55    H    ASN   9           H        ASN   9  -7.055 -12.151   5.979
   56    HA   ASN   9           HA       ASN   9  -5.181 -14.008   7.019
   57   1HB   ASN   9          1HB       ASN   9  -7.777 -14.157   6.075
   58   2HB   ASN   9          2HB       ASN   9  -6.880 -14.846   4.713
   59   1HD2  ASN   9          1HD2      ASN   9  -4.759 -16.015   6.035
   60   2HD2  ASN   9          2HD2      ASN   9  -5.306 -17.343   7.002
   61    H    GLN  10           H        GLN  10  -5.452 -11.896   4.259
   62    HA   GLN  10           HA       GLN  10  -4.131 -13.451   2.363
   63   1HB   GLN  10          1HB       GLN  10  -5.494 -11.185   2.204
   64   2HB   GLN  10          2HB       GLN  10  -3.893 -10.444   2.376
   65   1HG   GLN  10          1HG       GLN  10  -3.205 -12.133   0.483
   66   2HG   GLN  10          2HG       GLN  10  -4.944 -12.249   0.175
   67   1HE2  GLN  10          1HE2      GLN  10  -2.686  -9.643   1.085
   68   2HE2  GLN  10          2HE2      GLN  10  -3.111  -8.535  -0.177
   69    H    CYS  11           H        CYS  11  -3.024 -11.272   4.976
   70    HA   CYS  11           HA       CYS  11  -0.353 -11.141   4.091
   71   1HB   CYS  11          1HB       CYS  11  -1.276  -9.465   5.553
   72   2HB   CYS  11          2HB       CYS  11  -1.583 -10.665   6.812
   73    H    ALA  12           H        ALA  12  -2.234 -13.731   5.098
   74    HA   ALA  12           HA       ALA  12  -0.006 -15.050   6.473
   75   1HB   ALA  12          1HB       ALA  12  -2.646 -16.387   6.313
   76   2HB   ALA  12          2HB       ALA  12  -1.566 -16.148   7.707
   77   3HB   ALA  12          3HB       ALA  12  -2.647 -14.835   7.182
   78    H    VAL  13           H        VAL  13  -0.825 -14.472   3.410
   79    HA   VAL  13           HA       VAL  13  -1.417 -16.719   2.073
   80    HB   VAL  13           HB       VAL  13  -0.374 -14.233   1.497
   81   1HG1  VAL  13          1HG1      VAL  13   1.587 -14.428   0.215
   82   2HG1  VAL  13          2HG1      VAL  13   1.917 -15.396   1.672
   83   3HG1  VAL  13          3HG1      VAL  13   1.479 -16.203   0.147
   84   1HG2  VAL  13          1HG2      VAL  13  -1.635 -14.631  -0.297
   85   2HG2  VAL  13          2HG2      VAL  13  -0.449 -15.812  -0.905
   86   3HG2  VAL  13          3HG2      VAL  13  -1.753 -16.340   0.186
   87    HA   PRO  14           HA       PRO  14   1.732 -19.614   2.679
   88   1HB   PRO  14          1HB       PRO  14   1.848 -20.920   0.283
   89   2HB   PRO  14          2HB       PRO  14   0.607 -21.236   1.493
   90   1HG   PRO  14          1HG       PRO  14   0.452 -19.712  -1.029
   91   2HG   PRO  14          2HG       PRO  14  -0.888 -20.428  -0.065
   92   1HD   PRO  14          1HD       PRO  14  -0.103 -17.682  -0.257
   93   2HD   PRO  14          2HD       PRO  14  -1.328 -18.355   0.828
   94    H    ALA  15           H        ALA  15   2.658 -16.986   2.066
   95    HA   ALA  15           HA       ALA  15   4.442 -15.919   1.260
   96   1HB   ALA  15          1HB       ALA  15   6.183 -16.597   2.522
   97   2HB   ALA  15          2HB       ALA  15   5.178 -17.992   2.988
   98   3HB   ALA  15          3HB       ALA  15   6.322 -18.132   1.631
   99    H    LYS  16           H        LYS  16   3.523 -15.966  -0.961
  100    HA   LYS  16           HA       LYS  16   5.304 -16.416  -2.893
  101   1HB   LYS  16          1HB       LYS  16   4.388 -18.617  -3.915
  102   2HB   LYS  16          2HB       LYS  16   5.619 -18.692  -2.640
  103   1HG   LYS  16          1HG       LYS  16   4.220 -19.975  -1.434
  104   2HG   LYS  16          2HG       LYS  16   3.091 -18.613  -1.321
  105   1HD   LYS  16          1HD       LYS  16   1.631 -19.752  -2.598
  106   2HD   LYS  16          2HD       LYS  16   2.794 -19.750  -3.936
  107   1HE   LYS  16          1HE       LYS  16   3.691 -21.857  -3.291
  108   2HE   LYS  16          2HE       LYS  16   2.976 -21.776  -1.673
  109   1HZ   LYS  16          1HZ       LYS  16   1.123 -22.646  -2.460
  110   2HZ   LYS  16          2HZ       LYS  16   1.035 -21.612  -3.720
  111   3HZ   LYS  16          3HZ       LYS  16   1.913 -22.982  -3.848
  112    H    ASP  17           H        ASP  17   3.330 -14.577  -2.280
  113    HA   ASP  17           HA       ASP  17   1.867 -14.658  -4.722
  114   1HB   ASP  17          1HB       ASP  17   0.416 -15.895  -3.049
  115   2HB   ASP  17          2HB       ASP  17   0.349 -14.412  -2.084
  116    H    ARG  18           H        ARG  18   2.996 -13.206  -1.700
  117    HA   ARG  18           HA       ARG  18   1.855 -10.752  -1.790
  118   1HB   ARG  18          1HB       ARG  18   4.736 -11.420  -1.027
  119   2HB   ARG  18          2HB       ARG  18   3.851  -9.977  -0.504
  120   1HG   ARG  18          1HG       ARG  18   2.643 -11.133   1.056
  121   2HG   ARG  18          2HG       ARG  18   2.491 -12.576   0.037
  122   1HD   ARG  18          1HD       ARG  18   4.952 -13.035   0.520
  123   2HD   ARG  18          2HD       ARG  18   4.899 -11.726   1.711
  124    HE   ARG  18           HE       ARG  18   2.874 -13.887   1.956
  125   1HH1  ARG  18          1HH1      ARG  18   5.872 -12.451   3.115
  126   2HH1  ARG  18          2HH1      ARG  18   5.843 -13.300   4.625
  127   1HH2  ARG  18          1HH2      ARG  18   2.837 -15.006   3.948
  128   2HH2  ARG  18          2HH2      ARG  18   4.105 -14.762   5.102
  129    H    VAL  19           H        VAL  19   3.460  -8.638  -2.147
  130    HA   VAL  19           HA       VAL  19   4.404  -8.912  -4.916
  131    HB   VAL  19           HB       VAL  19   3.571  -6.331  -3.631
  132   1HG1  VAL  19          1HG1      VAL  19   4.521  -7.119  -6.186
  133   2HG1  VAL  19          2HG1      VAL  19   2.812  -6.664  -6.384
  134   3HG1  VAL  19          3HG1      VAL  19   3.962  -5.512  -5.666
  135   1HG2  VAL  19          1HG2      VAL  19   1.655  -7.671  -3.193
  136   2HG2  VAL  19          2HG2      VAL  19   1.285  -6.738  -4.662
  137   3HG2  VAL  19          3HG2      VAL  19   1.746  -8.453  -4.790
  138    H    ASP  20           H        ASP  20   5.768  -9.371  -2.173
  139    HA   ASP  20           HA       ASP  20   7.542  -8.693  -1.052
  140   1HB   ASP  20          1HB       ASP  20   8.815  -9.932  -2.524
  141   2HB   ASP  20          2HB       ASP  20   8.284  -9.007  -3.937
  142    H    CYS  21           H        CYS  21   6.875  -6.576  -0.228
  143    HA   CYS  21           HA       CYS  21   6.765  -4.245  -1.604
  144   1HB   CYS  21          1HB       CYS  21   6.331  -4.905   0.919
  145   2HB   CYS  21          2HB       CYS  21   7.926  -4.182   1.145
  146    H    GLY  22           H        GLY  22   9.593  -6.064  -0.386
  147   1HA   GLY  22          1HA       GLY  22  11.813  -5.722  -0.563
  148   2HA   GLY  22          2HA       GLY  22  11.432  -5.119  -2.163
  149    H    TYR  23           H        TYR  23  11.073  -3.951   1.269
  150    HA   TYR  23           HA       TYR  23  11.749  -1.273   0.355
  151   1HB   TYR  23          1HB       TYR  23  10.294  -2.678   2.512
  152   2HB   TYR  23          2HB       TYR  23  11.385  -1.466   3.194
  153    HD1  TYR  23           HD1      TYR  23  10.700   0.770   3.313
  154    HD2  TYR  23           HD2      TYR  23   8.686  -1.888   0.634
  155    HE1  TYR  23           HE1      TYR  23   8.978   2.572   2.809
  156    HE2  TYR  23           HE2      TYR  23   6.970  -0.078   0.139
  157    HH   TYR  23           HH       TYR  23   6.074   1.885   1.195
  158    HA   PRO  24           HA       PRO  24  15.813  -1.574   1.829
  159   1HB   PRO  24          1HB       PRO  24  16.469   1.077   1.908
  160   2HB   PRO  24          2HB       PRO  24  16.514   0.116   0.432
  161   1HG   PRO  24          1HG       PRO  24  14.532   2.100   1.343
  162   2HG   PRO  24          2HG       PRO  24  14.831   1.500  -0.327
  163   1HD   PRO  24          1HD       PRO  24  12.685   0.832   1.449
  164   2HD   PRO  24          2HD       PRO  24  13.023   0.093  -0.123
  165    H    HIS  25           H        HIS  25  13.282  -0.351   3.589
  166    HA   HIS  25           HA       HIS  25  15.026  -0.271   5.943
  167   1HB   HIS  25          1HB       HIS  25  13.645   1.856   4.943
  168   2HB   HIS  25          2HB       HIS  25  12.477   1.207   6.100
  169    HD1  HIS  25           HD1      HIS  25  13.272   1.110   8.650
  170    HD2  HIS  25           HD2      HIS  25  15.811   3.192   6.038
  171    HE1  HIS  25           HE1      HIS  25  14.837   2.488  10.121
  172    HE2  HIS  25           HE2      HIS  25  16.408   3.702   8.462
  173    H    VAL  26           H        VAL  26  13.420  -2.457   4.477
  174    HA   VAL  26           HA       VAL  26  11.114  -3.123   5.746
  175    HB   VAL  26           HB       VAL  26  11.812  -4.408   3.930
  176   1HG1  VAL  26          1HG1      VAL  26  14.406  -4.053   4.974
  177   2HG1  VAL  26          2HG1      VAL  26  14.138  -5.811   4.924
  178   3HG1  VAL  26          3HG1      VAL  26  13.947  -4.841   3.444
  179   1HG2  VAL  26          1HG2      VAL  26  10.778  -5.652   5.948
  180   2HG2  VAL  26          2HG2      VAL  26  11.522  -6.619   4.651
  181   3HG2  VAL  26          3HG2      VAL  26  12.404  -6.341   6.172
  182    H    THR  27           H        THR  27  10.497  -3.678   7.783
  183    HA   THR  27           HA       THR  27  12.241  -5.029   9.569
  184    HB   THR  27           HB       THR  27  12.338  -2.102   9.473
  185    HG1  THR  27           HG1      THR  27  13.488  -4.007  11.363
  186   1HG2  THR  27          1HG2      THR  27  10.853  -1.832  11.291
  187   2HG2  THR  27          2HG2      THR  27  11.203  -3.452  11.940
  188   3HG2  THR  27          3HG2      THR  27  12.386  -2.139  12.141
  189    HA   PRO  28           HA       PRO  28   8.396  -5.978  11.218
  190   1HB   PRO  28          1HB       PRO  28   9.097  -6.975  13.664
  191   2HB   PRO  28          2HB       PRO  28   9.205  -7.911  12.173
  192   1HG   PRO  28          1HG       PRO  28  11.327  -6.599  13.749
  193   2HG   PRO  28          2HG       PRO  28  11.483  -7.924  12.539
  194   1HD   PRO  28          1HD       PRO  28  12.137  -5.152  12.240
  195   2HD   PRO  28          2HD       PRO  28  12.157  -6.383  10.971
  196    H    LYS  29           H        LYS  29   8.563  -3.339  11.164
  197    HA   LYS  29           HA       LYS  29   6.843  -2.567  13.154
  198   1HB   LYS  29          1HB       LYS  29   9.112  -3.031  14.448
  199   2HB   LYS  29          2HB       LYS  29   9.472  -1.377  13.919
  200   1HG   LYS  29          1HG       LYS  29   8.160  -0.579  15.562
  201   2HG   LYS  29          2HG       LYS  29   6.761  -1.423  14.874
  202   1HD   LYS  29          1HD       LYS  29   6.923  -3.170  16.361
  203   2HD   LYS  29          2HD       LYS  29   8.692  -3.088  16.450
  204   1HE   LYS  29          1HE       LYS  29   8.297  -2.188  18.507
  205   2HE   LYS  29          2HE       LYS  29   7.999  -0.691  17.609
  206   1HZ   LYS  29          1HZ       LYS  29   5.761  -0.967  17.813
  207   2HZ   LYS  29          2HZ       LYS  29   5.827  -2.587  18.000
  208   3HZ   LYS  29          3HZ       LYS  29   6.252  -1.606  19.234
  209    H    GLU  30           H        GLU  30   9.158  -2.037  10.623
  210    HA   GLU  30           HA       GLU  30   8.276   0.712  10.351
  211   1HB   GLU  30          1HB       GLU  30  10.701  -0.785   9.673
  212   2HB   GLU  30          2HB       GLU  30  10.125   0.192   8.310
  213   1HG   GLU  30          1HG       GLU  30  11.582   1.613   9.551
  214   2HG   GLU  30          2HG       GLU  30   9.951   2.144   9.986
  215    H    CYS  31           H        CYS  31   8.482  -2.429   8.573
  216    HA   CYS  31           HA       CYS  31   7.395  -1.606   6.195
  217   1HB   CYS  31          1HB       CYS  31   7.460  -4.206   7.666
  218   2HB   CYS  31          2HB       CYS  31   6.482  -4.070   6.202
  219    H    ASN  32           H        ASN  32   5.765  -2.934   9.165
  220    HA   ASN  32           HA       ASN  32   3.199  -2.654   8.132
  221   1HB   ASN  32          1HB       ASN  32   4.475  -3.256  10.738
  222   2HB   ASN  32          2HB       ASN  32   2.905  -2.458  10.907
  223   1HD2  ASN  32          1HD2      ASN  32   4.460  -4.931   8.862
  224   2HD2  ASN  32          2HD2      ASN  32   3.183  -6.100   8.922
  225    H    ASN  33           H        ASN  33   5.505  -0.316   8.878
  226    HA   ASN  33           HA       ASN  33   3.547   1.561   9.912
  227   1HB   ASN  33          1HB       ASN  33   5.918   1.201  10.943
  228   2HB   ASN  33          2HB       ASN  33   6.530   2.085   9.538
  229   1HD2  ASN  33          1HD2      ASN  33   7.256   3.408  11.462
  230   2HD2  ASN  33          2HD2      ASN  33   6.230   4.707  11.971
  231    H    ARG  34           H        ARG  34   5.610   0.684   7.155
  232    HA   ARG  34           HA       ARG  34   5.293   3.221   5.897
  233   1HB   ARG  34          1HB       ARG  34   6.228   0.700   4.497
  234   2HB   ARG  34          2HB       ARG  34   6.746   2.371   4.211
  235   1HG   ARG  34          1HG       ARG  34   7.408   1.937   6.883
  236   2HG   ARG  34          2HG       ARG  34   7.765   0.371   6.130
  237   1HD   ARG  34          1HD       ARG  34   9.441   1.256   4.789
  238   2HD   ARG  34          2HD       ARG  34   8.698   2.862   4.715
  239    HE   ARG  34           HE       ARG  34   9.561   2.212   7.406
  240   1HH1  ARG  34          1HH1      ARG  34  10.745   3.290   4.272
  241   2HH1  ARG  34          2HH1      ARG  34  12.128   4.099   4.929
  242   1HH2  ARG  34          1HH2      ARG  34  11.385   3.280   8.275
  243   2HH2  ARG  34          2HH2      ARG  34  12.495   4.093   7.221
  244    H    GLY  35           H        GLY  35   3.760   0.018   5.917
  245   1HA   GLY  35          1HA       GLY  35   1.374   0.186   5.207
  246   2HA   GLY  35          2HA       GLY  35   1.980   0.868   3.711
  247    H    CYS  36           H        CYS  36   3.843  -1.645   5.389
  248    HA   CYS  36           HA       CYS  36   2.962  -3.533   3.328
  249   1HB   CYS  36          1HB       CYS  36   5.719  -3.292   4.534
  250   2HB   CYS  36          2HB       CYS  36   5.208  -4.484   3.336
  251    H    CYS  37           H        CYS  37   3.951  -5.890   4.252
  252    HA   CYS  37           HA       CYS  37   3.073  -6.016   7.044
  253   1HB   CYS  37          1HB       CYS  37   1.382  -6.834   5.329
  254   2HB   CYS  37          2HB       CYS  37   2.491  -8.171   5.017
  255    H    PHE  38           H        PHE  38   4.590  -7.000   8.359
  256    HA   PHE  38           HA       PHE  38   6.991  -7.961   7.121
  257   1HB   PHE  38          1HB       PHE  38   6.754  -6.545   9.250
  258   2HB   PHE  38          2HB       PHE  38   6.017  -7.942  10.040
  259    HD1  PHE  38           HD1      PHE  38   9.127  -6.508   8.739
  260    HD2  PHE  38           HD2      PHE  38   7.373  -9.830  10.714
  261    HE1  PHE  38           HE1      PHE  38  11.408  -7.314   9.409
  262    HE2  PHE  38           HE2      PHE  38   9.654 -10.636  11.384
  263    HZ   PHE  38           HZ       PHE  38  11.644  -9.368  10.723
  264    H    ASP  39           H        ASP  39   7.584 -10.062   6.766
  265    HA   ASP  39           HA       ASP  39   5.643 -12.050   7.101
  266   1HB   ASP  39          1HB       ASP  39   7.175 -12.270   5.285
  267   2HB   ASP  39          2HB       ASP  39   8.585 -12.053   6.331
  268    H    SER  40           H        SER  40   8.965 -12.934   7.964
  269    HA   SER  40           HA       SER  40   9.941 -13.267   9.942
  270   1HB   SER  40          1HB       SER  40   8.060 -11.723  10.937
  271   2HB   SER  40          2HB       SER  40   7.329 -13.249  11.467
  272    HG   SER  40           HG       SER  40   8.625 -12.785  13.167
  273    H    ARG  41           H        ARG  41   7.381 -14.853   8.377
  274    HA   ARG  41           HA       ARG  41   7.504 -17.184  10.052
  275   1HB   ARG  41          1HB       ARG  41   6.037 -16.859   7.401
  276   2HB   ARG  41          2HB       ARG  41   5.694 -18.045   8.672
  277   1HG   ARG  41          1HG       ARG  41   5.488 -15.670  10.053
  278   2HG   ARG  41          2HG       ARG  41   4.896 -15.188   8.453
  279   1HD   ARG  41          1HD       ARG  41   2.921 -15.954   9.389
  280   2HD   ARG  41          2HD       ARG  41   3.501 -17.473   8.685
  281    HE   ARG  41           HE       ARG  41   4.588 -17.217  11.312
  282   1HH1  ARG  41          1HH1      ARG  41   1.478 -17.718   9.742
  283   2HH1  ARG  41          2HH1      ARG  41   0.801 -18.590  11.077
  284   1HH2  ARG  41          1HH2      ARG  41   3.694 -18.366  13.074
  285   2HH2  ARG  41          2HH2      ARG  41   2.070 -18.960  12.985
  286    H    ILE  42           H        ILE  42   8.067 -16.288   6.566
  287    HA   ILE  42           HA       ILE  42   9.943 -18.547   6.437
  288    HB   ILE  42           HB       ILE  42   8.575 -17.446   4.018
  289   1HG1  ILE  42          1HG1      ILE  42   7.351 -19.254   6.089
  290   2HG1  ILE  42          2HG1      ILE  42   6.662 -17.807   5.334
  291   1HG2  ILE  42          1HG2      ILE  42   9.016 -19.582   3.087
  292   2HG2  ILE  42          2HG2      ILE  42  10.502 -19.077   3.929
  293   3HG2  ILE  42          3HG2      ILE  42   9.418 -20.274   4.677
  294   1HD1  ILE  42          1HD1      ILE  42   5.559 -19.512   4.170
  295   2HD1  ILE  42          2HD1      ILE  42   6.952 -19.220   3.101
  296   3HD1  ILE  42          3HD1      ILE  42   6.967 -20.600   4.226
  297    HA   PRO  43           HA       PRO  43  12.770 -15.304   5.751
  298   1HB   PRO  43          1HB       PRO  43  15.031 -16.833   5.661
  299   2HB   PRO  43          2HB       PRO  43  14.324 -16.247   7.166
  300   1HG   PRO  43          1HG       PRO  43  14.240 -18.935   5.952
  301   2HG   PRO  43          2HG       PRO  43  13.949 -18.467   7.665
  302   1HD   PRO  43          1HD       PRO  43  12.032 -19.198   5.666
  303   2HD   PRO  43          2HD       PRO  43  11.683 -18.593   7.292
  304    H    GLY  44           H        GLY  44  11.968 -17.818   3.677
  305   1HA   GLY  44          1HA       GLY  44  13.728 -16.897   1.547
  306   2HA   GLY  44          2HA       GLY  44  12.619 -18.254   1.510
  307    H    VAL  45           H        VAL  45  10.734 -15.955   2.905
  308    HA   VAL  45           HA       VAL  45   9.739 -15.063   0.294
  309    HB   VAL  45           HB       VAL  45   8.492 -16.418   2.354
  310   1HG1  VAL  45          1HG1      VAL  45   8.406 -14.471   3.787
  311   2HG1  VAL  45          2HG1      VAL  45   7.711 -13.487   2.477
  312   3HG1  VAL  45          3HG1      VAL  45   6.767 -14.819   3.186
  313   1HG2  VAL  45          1HG2      VAL  45   6.445 -15.143   0.913
  314   2HG2  VAL  45          2HG2      VAL  45   7.824 -15.232  -0.207
  315   3HG2  VAL  45          3HG2      VAL  45   7.203 -16.714   0.556
  316    HA   PRO  46           HA       PRO  46  10.328 -10.931   1.428
  317   1HB   PRO  46          1HB       PRO  46   8.059  -9.631   0.640
  318   2HB   PRO  46          2HB       PRO  46   9.331 -10.113  -0.480
  319   1HG   PRO  46          1HG       PRO  46   6.688 -11.322   0.021
  320   2HG   PRO  46          2HG       PRO  46   7.754 -11.511  -1.417
  321   1HD   PRO  46          1HD       PRO  46   7.288 -13.372   0.708
  322   2HD   PRO  46          2HD       PRO  46   8.467 -13.536  -0.599
  323    H    TRP  47           H        TRP  47  10.669 -10.209   3.424
  324    HA   TRP  47           HA       TRP  47   8.502 -10.589   5.302
  325   1HB   TRP  47          1HB       TRP  47  10.887  -9.170   6.216
  326   2HB   TRP  47          2HB       TRP  47  10.076 -10.588   6.881
  327    HD1  TRP  47           HD1      TRP  47  10.821 -13.020   5.691
  328    HE1  TRP  47           HE1      TRP  47  13.094 -13.853   4.640
  329    HE3  TRP  47           HE3      TRP  47  12.802  -8.389   4.992
  330    HZ2  TRP  47           HZ2      TRP  47  15.413 -12.512   3.657
  331    HZ3  TRP  47           HZ3      TRP  47  15.076  -8.239   3.981
  332    HH2  TRP  47           HH2      TRP  47  16.372 -10.203   3.321
  333    H    CYS  48           H        CYS  48   8.158  -8.731   3.000
  334    HA   CYS  48           HA       CYS  48   7.142  -6.546   4.463
  335   1HB   CYS  48          1HB       CYS  48   9.607  -5.997   4.338
  336   2HB   CYS  48          2HB       CYS  48   9.397  -5.819   2.594
  337    H    PHE  49           H        PHE  49   5.183  -6.962   3.392
  338    HA   PHE  49           HA       PHE  49   5.217  -6.386   0.534
  339   1HB   PHE  49          1HB       PHE  49   3.333  -8.339   0.641
  340   2HB   PHE  49          2HB       PHE  49   5.034  -8.737   0.373
  341    HD1  PHE  49           HD1      PHE  49   6.395  -9.015   2.674
  342    HD2  PHE  49           HD2      PHE  49   2.210  -9.553   2.221
  343    HE1  PHE  49           HE1      PHE  49   6.361 -10.467   4.721
  344    HE2  PHE  49           HE2      PHE  49   2.176 -11.006   4.268
  345    HZ   PHE  49           HZ       PHE  49   4.251 -11.445   5.493
  346    H    LYS  50           H        LYS  50   2.573  -6.627  -0.093
  347    HA   LYS  50           HA       LYS  50   1.223  -5.008   1.953
  348   1HB   LYS  50          1HB       LYS  50   0.124  -4.218  -0.448
  349   2HB   LYS  50          2HB       LYS  50   1.310  -3.310   0.507
  350   1HG   LYS  50          1HG       LYS  50   2.317  -5.447  -1.349
  351   2HG   LYS  50          2HG       LYS  50   1.731  -3.940  -2.077
  352   1HD   LYS  50          1HD       LYS  50   3.953  -4.292  -0.027
  353   2HD   LYS  50          2HD       LYS  50   4.115  -3.700  -1.691
  354   1HE   LYS  50          1HE       LYS  50   2.954  -2.322   0.739
  355   2HE   LYS  50          2HE       LYS  50   4.166  -1.716  -0.401
  356   1HZ   LYS  50          1HZ       LYS  50   1.336  -2.182  -1.041
  357   2HZ   LYS  50          2HZ       LYS  50   1.987  -0.723  -0.702
  358   3HZ   LYS  50          3HZ       LYS  50   2.454  -1.535  -2.041
  359    HA   PRO  51           HA       PRO  51  -1.204  -8.700   0.972
  360   1HB   PRO  51          1HB       PRO  51  -1.501  -9.623   3.527
  361   2HB   PRO  51          2HB       PRO  51  -0.240 -10.194   2.435
  362   1HG   PRO  51          1HG       PRO  51  -0.076  -8.321   4.710
  363   2HG   PRO  51          2HG       PRO  51   1.248  -9.257   3.928
  364   1HD   PRO  51          1HD       PRO  51   0.647  -6.468   3.674
  365   2HD   PRO  51          2HD       PRO  51   1.863  -7.373   2.762
  366    H    LEU  52           H        LEU  52  -2.181  -8.000   4.216
  367    HA   LEU  52           HA       LEU  52  -4.754  -7.204   3.153
  368   1HB   LEU  52          1HB       LEU  52  -5.622  -7.686   5.213
  369   2HB   LEU  52          2HB       LEU  52  -4.321  -8.878   5.044
  370    HG   LEU  52           HG       LEU  52  -3.439  -6.433   6.377
  371   1HD1  LEU  52          1HD1      LEU  52  -5.162  -6.029   7.718
  372   2HD1  LEU  52          2HD1      LEU  52  -6.043  -7.454   7.119
  373   3HD1  LEU  52          3HD1      LEU  52  -4.886  -7.623   8.460
  374   1HD2  LEU  52          1HD2      LEU  52  -3.167  -8.585   8.112
  375   2HD2  LEU  52          2HD2      LEU  52  -3.047  -9.317   6.493
  376   3HD2  LEU  52          3HD2      LEU  52  -1.955  -7.989   6.952
  377    H    GLN  53           H        GLN  53  -2.088  -5.562   3.102
  378    HA   GLN  53           HA       GLN  53  -2.199  -3.485   4.823
  379   1HB   GLN  53          1HB       GLN  53  -1.379  -3.663   1.916
  380   2HB   GLN  53          2HB       GLN  53  -1.206  -2.146   2.818
  381   1HG   GLN  53          1HG       GLN  53   0.008  -4.844   3.555
  382   2HG   GLN  53          2HG       GLN  53   0.891  -3.466   2.880
  383   1HE2  GLN  53          1HE2      GLN  53  -0.181  -1.362   4.228
  384   2HE2  GLN  53          2HE2      GLN  53   0.185  -1.448   5.920
  385    H    GLU  54           H        GLU  54  -4.453  -4.309   2.272
  386    HA   GLU  54           HA       GLU  54  -5.466  -2.013   1.421
  387   1HB   GLU  54          1HB       GLU  54  -7.343  -3.208   0.835
  388   2HB   GLU  54          2HB       GLU  54  -6.270  -4.559   1.235
  389   1HG   GLU  54          1HG       GLU  54  -8.124  -5.149   2.483
  390   2HG   GLU  54          2HG       GLU  54  -7.285  -4.159   3.686
  391    H    ALA  55           H        ALA  55  -5.476  -3.172   4.740
  392    HA   ALA  55           HA       ALA  55  -7.643  -1.787   5.767
  393   1HB   ALA  55          1HB       ALA  55  -5.686  -1.754   7.755
  394   2HB   ALA  55          2HB       ALA  55  -6.844  -3.069   7.443
  395   3HB   ALA  55          3HB       ALA  55  -5.216  -3.127   6.726
  396    H    GLU  56           H        GLU  56  -4.319  -0.720   6.624
  397    HA   GLU  56           HA       GLU  56  -5.243   1.967   6.616
  398   1HB   GLU  56          1HB       GLU  56  -2.746   0.515   7.411
  399   2HB   GLU  56          2HB       GLU  56  -2.611   2.256   7.102
  400   1HG   GLU  56          1HG       GLU  56  -4.565   2.585   8.691
  401   2HG   GLU  56          2HG       GLU  56  -4.457   0.866   9.097
  402    H    CYS  57           H        CYS  57  -4.522  -0.008   4.112
  403    HA   CYS  57           HA       CYS  57  -2.894   1.937   2.681
  404   1HB   CYS  57          1HB       CYS  57  -2.254  -0.468   2.697
  405   2HB   CYS  57          2HB       CYS  57  -3.736  -0.832   1.808
  406    H    THR  58           H        THR  58  -5.625  -0.289   1.767
  407    HA   THR  58           HA       THR  58  -6.634   1.188  -0.288
  408    HB   THR  58           HB       THR  58  -7.259  -1.154   1.034
  409    HG1  THR  58           HG1      THR  58  -8.493  -1.259  -0.838
  410   1HG2  THR  58          1HG2      THR  58  -9.481  -1.062   1.893
  411   2HG2  THR  58          2HG2      THR  58  -8.717   0.370   2.622
  412   3HG2  THR  58          3HG2      THR  58  -9.774   0.552   1.202
  413    H    PHE  59           H        PHE  59  -7.201   1.661   3.223
  414    HA   PHE  59           HA       PHE  59  -9.278   3.262   3.376
  415   1HB   PHE  59          1HB       PHE  59  -6.978   2.733   4.843
  416   2HB   PHE  59          2HB       PHE  59  -6.751   4.452   4.499
  417    HD1  PHE  59           HD1      PHE  59  -9.011   1.987   6.077
  418    HD2  PHE  59           HD2      PHE  59  -8.004   6.089   5.665
  419    HE1  PHE  59           HE1      PHE  59 -10.536   2.553   7.988
  420    HE2  PHE  59           HE2      PHE  59  -9.528   6.655   7.576
  421    HZ   PHE  59           HZ       PHE  59 -10.777   4.882   8.715
  422   1H    GLU   1           H1       GLU   1 -21.180   3.491   3.323
  423    HA   GLU   1           HA       GLU   1 -19.375   3.742   2.101
  424   1HB   GLU   1          1HB       GLU   1 -18.285   3.095   4.850
  425   2HB   GLU   1          2HB       GLU   1 -17.203   3.581   3.532
  426   1HG   GLU   1          1HG       GLU   1 -19.590   5.303   3.841
  427   2HG   GLU   1          2HG       GLU   1 -18.526   5.312   5.255
  428    H    GLU   2           H        GLU   2 -19.622   2.032   0.554
  429    HA   GLU   2           HA       GLU   2 -18.384  -0.480   1.212
  430   1HB   GLU   2          1HB       GLU   2 -19.869   0.488  -1.259
  431   2HB   GLU   2          2HB       GLU   2 -19.240  -1.158  -1.064
  432   1HG   GLU   2          1HG       GLU   2 -20.683  -0.655   1.298
  433   2HG   GLU   2          2HG       GLU   2 -21.681   0.058   0.021
  434    H    TYR   3           H        TYR   3 -18.131   0.095  -2.133
  435    HA   TYR   3           HA       TYR   3 -15.252   0.384  -1.875
  436   1HB   TYR   3          1HB       TYR   3 -15.667   0.045  -4.488
  437   2HB   TYR   3          2HB       TYR   3 -15.952  -1.327  -3.414
  438    HD1  TYR   3           HD1      TYR   3 -17.500   1.201  -5.580
  439    HD2  TYR   3           HD2      TYR   3 -18.241  -2.075  -2.928
  440    HE1  TYR   3           HE1      TYR   3 -19.885   1.033  -6.442
  441    HE2  TYR   3           HE2      TYR   3 -20.624  -2.231  -3.801
  442    HH   TYR   3           HH       TYR   3 -22.170  -1.244  -4.993
  443    H    VAL   4           H        VAL   4 -15.288   2.660  -1.163
  444    HA   VAL   4           HA       VAL   4 -15.548   4.416  -3.489
  445    HB   VAL   4           HB       VAL   4 -16.435   6.157  -1.863
  446   1HG1  VAL   4          1HG1      VAL   4 -17.771   5.005  -3.639
  447   2HG1  VAL   4          2HG1      VAL   4 -18.271   3.805  -2.423
  448   3HG1  VAL   4          3HG1      VAL   4 -18.729   5.514  -2.228
  449   1HG2  VAL   4          1HG2      VAL   4 -17.863   4.961  -0.012
  450   2HG2  VAL   4          2HG2      VAL   4 -16.633   3.683  -0.166
  451   3HG2  VAL   4          3HG2      VAL   4 -16.147   5.336   0.283
  452    H    GLY   5           H        GLY   5 -14.506   4.241  -0.007
  453   1HA   GLY   5          1HA       GLY   5 -12.450   6.167  -0.317
  454   2HA   GLY   5          2HA       GLY   5 -12.672   5.053   1.016
  455    H    LEU   6           H        LEU   6 -12.691   3.240  -1.854
  456    HA   LEU   6           HA       LEU   6  -9.825   3.074  -2.130
  457   1HB   LEU   6          1HB       LEU   6 -10.181   0.474  -1.792
  458   2HB   LEU   6          2HB       LEU   6  -9.686   1.561  -0.481
  459    HG   LEU   6           HG       LEU   6 -11.398  -0.079   0.195
  460   1HD1  LEU   6          1HD1      LEU   6 -12.857   2.512   0.336
  461   2HD1  LEU   6          2HD1      LEU   6 -12.435   1.354   1.620
  462   3HD1  LEU   6          3HD1      LEU   6 -11.198   2.463   0.980
  463   1HD2  LEU   6          1HD2      LEU   6 -12.516  -0.098  -2.093
  464   2HD2  LEU   6          2HD2      LEU   6 -13.585  -0.141  -0.671
  465   3HD2  LEU   6          3HD2      LEU   6 -13.364   1.379  -1.573
  466    H    SER   7           H        SER   7 -12.254   3.856  -3.702
  467    HA   SER   7           HA       SER   7 -12.206   1.711  -5.666
  468   1HB   SER   7          1HB       SER   7 -14.300   2.470  -6.447
  469   2HB   SER   7          2HB       SER   7 -14.420   2.622  -4.685
  470    HG   SER   7           HG       SER   7 -14.836   4.521  -6.514
  471    H    ALA   8           H        ALA   8 -12.044   2.361  -8.000
  472    HA   ALA   8           HA       ALA   8  -9.889   4.056  -8.443
  473   1HB   ALA   8          1HB       ALA   8 -11.451   2.213  -9.878
  474   2HB   ALA   8          2HB       ALA   8 -11.634   3.747 -10.761
  475   3HB   ALA   8          3HB       ALA   8 -10.011   3.078 -10.468
  476    H    ASN   9           H        ASN   9 -10.221   6.096  -7.446
  477    HA   ASN   9           HA       ASN   9 -11.157   8.066  -9.013
  478   1HB   ASN   9          1HB       ASN   9 -13.379   6.682  -7.927
  479   2HB   ASN   9          2HB       ASN   9 -13.255   8.159  -6.959
  480   1HD2  ASN   9          1HD2      ASN   9 -12.920  10.190  -8.212
  481   2HD2  ASN   9          2HD2      ASN   9 -13.812  10.409  -9.681
  482    H    GLN  10           H        GLN  10 -10.764   6.656  -5.767
  483    HA   GLN  10           HA       GLN  10 -10.691   9.006  -4.305
  484   1HB   GLN  10          1HB       GLN  10 -10.821   6.561  -3.509
  485   2HB   GLN  10          2HB       GLN  10  -9.055   6.526  -3.660
  486   1HG   GLN  10          1HG       GLN  10  -8.925   8.491  -2.120
  487   2HG   GLN  10          2HG       GLN  10 -10.684   8.456  -1.938
  488   1HE2  GLN  10          1HE2      GLN  10  -8.132   5.972  -2.057
  489   2HE2  GLN  10          2HE2      GLN  10  -8.509   5.196  -0.555
  490    H    CYS  11           H        CYS  11  -8.303   7.396  -6.383
  491    HA   CYS  11           HA       CYS  11  -6.058   8.765  -5.364
  492   1HB   CYS  11          1HB       CYS  11  -5.734   6.722  -6.524
  493   2HB   CYS  11          2HB       CYS  11  -6.575   7.313  -7.959
  494    H    ALA  12           H        ALA  12  -8.840   9.869  -6.882
  495    HA   ALA  12           HA       ALA  12  -7.385  12.064  -8.192
  496   1HB   ALA  12          1HB       ALA  12  -8.636  11.600  -9.998
  497   2HB   ALA  12          2HB       ALA  12  -9.479  10.305  -9.114
  498   3HB   ALA  12          3HB       ALA  12 -10.096  11.973  -9.052
  499    H    VAL  13           H        VAL  13  -8.487  11.398  -5.289
  500    HA   VAL  13           HA       VAL  13 -10.612  12.903  -4.611
  501    HB   VAL  13           HB       VAL  13  -8.489  11.652  -3.334
  502   1HG1  VAL  13          1HG1      VAL  13  -7.802  13.262  -1.574
  503   2HG1  VAL  13          2HG1      VAL  13  -7.222  13.722  -3.193
  504   3HG1  VAL  13          3HG1      VAL  13  -8.617  14.563  -2.475
  505   1HG2  VAL  13          1HG2      VAL  13 -10.162  11.249  -1.917
  506   2HG2  VAL  13          2HG2      VAL  13 -10.201  12.956  -1.414
  507   3HG2  VAL  13          3HG2      VAL  13 -11.161  12.417  -2.813
  508    HA   PRO  14           HA       PRO  14  -9.663  17.072  -5.241
  509   1HB   PRO  14          1HB       PRO  14 -10.767  18.346  -3.091
  510   2HB   PRO  14          2HB       PRO  14 -11.712  17.781  -4.467
  511   1HG   PRO  14          1HG       PRO  14 -11.424  16.635  -1.764
  512   2HG   PRO  14          2HG       PRO  14 -12.726  16.346  -2.972
  513   1HD   PRO  14          1HD       PRO  14 -10.554  14.626  -2.251
  514   2HD   PRO  14          2HD       PRO  14 -11.715  14.366  -3.558
  515    H    ALA  15           H        ALA  15  -7.621  15.456  -3.864
  516    HA   ALA  15           HA       ALA  15  -5.713  15.747  -2.770
  517   1HB   ALA  15          1HB       ALA  15  -5.844  18.637  -3.689
  518   2HB   ALA  15          2HB       ALA  15  -4.407  17.609  -3.472
  519   3HB   ALA  15          3HB       ALA  15  -5.533  17.292  -4.812
  520    H    LYS  16           H        LYS  16  -7.065  15.440  -0.753
  521    HA   LYS  16           HA       LYS  16  -6.236  16.952   1.293
  522   1HB   LYS  16          1HB       LYS  16  -8.435  18.314   1.725
  523   2HB   LYS  16          2HB       LYS  16  -7.126  18.993   0.741
  524   1HG   LYS  16          1HG       LYS  16  -8.461  19.086  -1.074
  525   2HG   LYS  16          2HG       LYS  16  -8.928  17.386  -0.902
  526   1HD   LYS  16          1HD       LYS  16 -10.966  18.541  -0.670
  527   2HD   LYS  16          2HD       LYS  16 -10.492  18.253   1.013
  528   1HE   LYS  16          1HE       LYS  16  -9.409  20.569   0.966
  529   2HE   LYS  16          2HE       LYS  16 -10.201  20.829  -0.596
  530   1HZ   LYS  16          1HZ       LYS  16 -12.178  19.933   0.975
  531   2HZ   LYS  16          2HZ       LYS  16 -11.308  20.834   2.024
  532   3HZ   LYS  16          3HZ       LYS  16 -11.883  21.506   0.651
  533    H    ASP  17           H        ASP  17  -6.839  14.274   0.646
  534    HA   ASP  17           HA       ASP  17  -8.476  13.680   2.891
  535   1HB   ASP  17          1HB       ASP  17 -10.059  13.966   0.876
  536   2HB   ASP  17          2HB       ASP  17  -9.309  12.509   0.205
  537    H    ARG  18           H        ARG  18  -5.750  13.324   1.250
  538    HA   ARG  18           HA       ARG  18  -5.689  10.454   1.097
  539   1HB   ARG  18          1HB       ARG  18  -3.428  12.440   0.601
  540   2HB   ARG  18          2HB       ARG  18  -3.488  10.754   0.059
  541   1HG   ARG  18          1HG       ARG  18  -4.876  11.238  -1.696
  542   2HG   ARG  18          2HG       ARG  18  -5.774  12.476  -0.799
  543   1HD   ARG  18          1HD       ARG  18  -4.063  14.116  -1.191
  544   2HD   ARG  18          2HD       ARG  18  -2.911  12.899  -1.761
  545    HE   ARG  18           HE       ARG  18  -5.411  13.115  -3.313
  546   1HH1  ARG  18          1HH1      ARG  18  -2.050  14.107  -3.002
  547   2HH1  ARG  18          2HH1      ARG  18  -1.900  14.573  -4.664
  548   1HH2  ARG  18          1HH2      ARG  18  -5.215  13.729  -5.505
  549   2HH2  ARG  18          2HH2      ARG  18  -3.713  14.357  -6.098
  550    H    VAL  19           H        VAL  19  -3.403   9.497   1.976
  551    HA   VAL  19           HA       VAL  19  -3.226  10.424   4.751
  552    HB   VAL  19           HB       VAL  19  -2.245   7.788   3.690
  553   1HG1  VAL  19          1HG1      VAL  19  -1.694   7.489   5.829
  554   2HG1  VAL  19          2HG1      VAL  19  -2.394   9.067   6.262
  555   3HG1  VAL  19          3HG1      VAL  19  -3.414   7.609   6.270
  556   1HG2  VAL  19          1HG2      VAL  19  -4.386   7.454   2.981
  557   2HG2  VAL  19          2HG2      VAL  19  -4.625   7.067   4.702
  558   3HG2  VAL  19          3HG2      VAL  19  -5.064   8.677   4.082
  559    H    ASP  20           H        ASP  20  -1.875  11.503   2.187
  560    HA   ASP  20           HA       ASP  20   0.153  11.907   1.404
  561   1HB   ASP  20          1HB       ASP  20   0.161  13.724   2.839
  562   2HB   ASP  20          2HB       ASP  20   0.044  12.722   4.292
  563    H    CYS  21           H        CYS  21   0.932   9.729   0.853
  564    HA   CYS  21           HA       CYS  21   1.898   7.851   2.536
  565   1HB   CYS  21          1HB       CYS  21   1.625   7.874  -0.029
  566   2HB   CYS  21          2HB       CYS  21   3.299   8.432  -0.061
  567    H    GLY  22           H        GLY  22   3.415  10.893   1.406
  568   1HA   GLY  22          1HA       GLY  22   5.422  11.840   1.854
  569   2HA   GLY  22          2HA       GLY  22   5.021  11.401   3.502
  570    H    TYR  23           H        TYR  23   6.128   9.626   0.518
  571    HA   TYR  23           HA       TYR  23   7.857   8.007   2.203
  572   1HB   TYR  23          1HB       TYR  23   6.690   8.077  -0.592
  573   2HB   TYR  23          2HB       TYR  23   8.208   7.192  -0.402
  574    HD1  TYR  23           HD1      TYR  23   6.214   7.107   2.566
  575    HD2  TYR  23           HD2      TYR  23   6.692   5.281  -1.273
  576    HE1  TYR  23           HE1      TYR  23   4.911   5.075   3.363
  577    HE2  TYR  23           HE2      TYR  23   5.387   3.255  -0.464
  578    HH   TYR  23           HH       TYR  23   4.814   2.646   2.747
  579    HA   PRO  24           HA       PRO  24  11.428  10.197   1.105
  580   1HB   PRO  24          1HB       PRO  24  13.337   8.330   1.679
  581   2HB   PRO  24          2HB       PRO  24  12.584   9.346   2.905
  582   1HG   PRO  24          1HG       PRO  24  12.119   6.508   2.244
  583   2HG   PRO  24          2HG       PRO  24  11.722   7.386   3.765
  584   1HD   PRO  24          1HD       PRO  24   9.952   6.560   1.670
  585   2HD   PRO  24          2HD       PRO  24   9.537   7.562   3.068
  586    H    HIS  25           H        HIS  25  10.214   7.710  -0.655
  587    HA   HIS  25           HA       HIS  25  12.256   8.197  -2.699
  588   1HB   HIS  25          1HB       HIS  25  11.310   5.703  -1.541
  589   2HB   HIS  25          2HB       HIS  25  11.092   5.731  -3.294
  590    HD1  HIS  25           HD1      HIS  25  13.491   6.753  -4.529
  591    HD2  HIS  25           HD2      HIS  25  13.735   4.703  -0.878
  592    HE1  HIS  25           HE1      HIS  25  15.902   5.946  -4.323
  593    HE2  HIS  25           HE2      HIS  25  16.005   4.741  -2.036
  594    H    VAL  26           H        VAL  26   9.380   9.239  -1.819
  595    HA   VAL  26           HA       VAL  26   7.443   8.569  -3.551
  596    HB   VAL  26           HB       VAL  26   6.993  10.166  -1.912
  597   1HG1  VAL  26          1HG1      VAL  26   8.545  12.453  -2.876
  598   2HG1  VAL  26          2HG1      VAL  26   8.387  11.786  -1.234
  599   3HG1  VAL  26          3HG1      VAL  26   9.569  11.089  -2.367
  600   1HG2  VAL  26          1HG2      VAL  26   5.727  11.716  -3.055
  601   2HG2  VAL  26          2HG2      VAL  26   7.000  12.038  -4.255
  602   3HG2  VAL  26          3HG2      VAL  26   6.047  10.538  -4.349
  603    H    THR  27           H        THR  27   7.180   8.469  -5.725
  604    HA   THR  27           HA       THR  27   8.304  10.422  -7.456
  605    HB   THR  27           HB       THR  27   9.936   8.116  -6.745
  606    HG1  THR  27           HG1      THR  27  11.346   9.455  -8.155
  607   1HG2  THR  27          1HG2      THR  27   9.942   6.842  -8.640
  608   2HG2  THR  27          2HG2      THR  27   8.511   7.737  -9.206
  609   3HG2  THR  27          3HG2      THR  27  10.143   8.300  -9.641
  610    HA   PRO  28           HA       PRO  28   5.082   8.921  -9.857
  611   1HB   PRO  28          1HB       PRO  28   5.760   9.850 -12.335
  612   2HB   PRO  28          2HB       PRO  28   5.007  10.858 -11.100
  613   1HG   PRO  28          1HG       PRO  28   7.813  10.741 -12.003
  614   2HG   PRO  28          2HG       PRO  28   6.972  12.066 -11.120
  615   1HD   PRO  28          1HD       PRO  28   8.843  10.152 -10.099
  616   2HD   PRO  28          2HD       PRO  28   7.922  11.334  -9.158
  617    H    LYS  29           H        LYS  29   6.753   6.885  -9.187
  618    HA   LYS  29           HA       LYS  29   6.142   5.040 -11.156
  619   1HB   LYS  29          1HB       LYS  29   7.955   6.471 -12.322
  620   2HB   LYS  29          2HB       LYS  29   9.096   5.613 -11.271
  621   1HG   LYS  29          1HG       LYS  29   8.791   3.618 -12.359
  622   2HG   LYS  29          2HG       LYS  29   7.073   3.916 -12.676
  623   1HD   LYS  29          1HD       LYS  29   7.759   5.595 -14.423
  624   2HD   LYS  29          2HD       LYS  29   9.450   5.129 -14.164
  625   1HE   LYS  29          1HE       LYS  29   8.777   2.748 -14.725
  626   2HE   LYS  29          2HE       LYS  29   7.175   3.355 -15.168
  627   1HZ   LYS  29          1HZ       LYS  29   9.745   3.881 -16.446
  628   2HZ   LYS  29          2HZ       LYS  29   8.354   3.356 -17.123
  629   3HZ   LYS  29          3HZ       LYS  29   8.497   4.914 -16.653
  630    H    GLU  30           H        GLU  30   7.794   6.192  -8.312
  631    HA   GLU  30           HA       GLU  30   8.483   3.490  -7.549
  632   1HB   GLU  30          1HB       GLU  30   9.420   6.171  -6.889
  633   2HB   GLU  30          2HB       GLU  30   9.102   5.232  -5.419
  634   1HG   GLU  30          1HG       GLU  30  10.906   3.911  -5.772
  635   2HG   GLU  30          2HG       GLU  30  10.485   3.643  -7.472
  636    H    CYS  31           H        CYS  31   6.414   6.275  -6.544
  637    HA   CYS  31           HA       CYS  31   5.405   5.204  -4.229
  638   1HB   CYS  31          1HB       CYS  31   4.280   7.109  -6.258
  639   2HB   CYS  31          2HB       CYS  31   3.337   6.623  -4.846
  640    H    ASN  32           H        ASN  32   4.047   5.065  -7.608
  641    HA   ASN  32           HA       ASN  32   1.946   3.409  -6.976
  642   1HB   ASN  32          1HB       ASN  32   3.428   4.214  -9.443
  643   2HB   ASN  32          2HB       ASN  32   2.496   2.717  -9.589
  644   1HD2  ASN  32          1HD2      ASN  32   2.009   5.747  -7.784
  645   2HD2  ASN  32          2HD2      ASN  32   0.459   6.151  -8.441
  646    H    ASN  33           H        ASN  33   5.341   2.826  -7.003
  647    HA   ASN  33           HA       ASN  33   5.059   0.042  -7.697
  648   1HB   ASN  33          1HB       ASN  33   7.022   1.527  -8.437
  649   2HB   ASN  33          2HB       ASN  33   7.573   1.510  -6.755
  650   1HD2  ASN  33          1HD2      ASN  33   9.408   0.607  -8.201
  651   2HD2  ASN  33          2HD2      ASN  33   9.514  -1.118  -8.305
  652    H    ARG  34           H        ARG  34   5.411   2.261  -4.949
  653    HA   ARG  34           HA       ARG  34   6.164   0.160  -3.164
  654   1HB   ARG  34          1HB       ARG  34   5.268   2.967  -2.406
  655   2HB   ARG  34          2HB       ARG  34   6.341   1.894  -1.491
  656   1HG   ARG  34          1HG       ARG  34   7.579   2.163  -3.998
  657   2HG   ARG  34          2HG       ARG  34   6.970   3.790  -3.644
  658   1HD   ARG  34          1HD       ARG  34   8.629   4.110  -2.148
  659   2HD   ARG  34          2HD       ARG  34   8.152   2.665  -1.244
  660    HE   ARG  34           HE       ARG  34   9.677   2.137  -3.705
  661   1HH1  ARG  34          1HH1      ARG  34   9.846   2.714  -0.238
  662   2HH1  ARG  34          2HH1      ARG  34  11.402   1.973  -0.062
  663   1HH2  ARG  34          1HH2      ARG  34  11.729   1.159  -3.473
  664   2HH2  ARG  34          2HH2      ARG  34  12.480   1.083  -1.915
  665    H    GLY  35           H        GLY  35   3.267   1.832  -4.300
  666   1HA   GLY  35          1HA       GLY  35   1.217   0.518  -3.969
  667   2HA   GLY  35          2HA       GLY  35   1.660   0.384  -2.279
  668    H    CYS  36           H        CYS  36   2.381   3.388  -4.012
  669    HA   CYS  36           HA       CYS  36   0.140   4.630  -2.585
  670   1HB   CYS  36          1HB       CYS  36   2.901   5.719  -3.135
  671   2HB   CYS  36          2HB       CYS  36   1.557   6.689  -2.523
  672    H    CYS  37           H        CYS  37  -0.172   7.001  -3.750
  673    HA   CYS  37           HA       CYS  37  -0.157   6.465  -6.632
  674   1HB   CYS  37          1HB       CYS  37  -2.407   6.311  -5.378
  675   2HB   CYS  37          2HB       CYS  37  -2.314   8.072  -5.288
  676    H    PHE  38           H        PHE  38   0.853   8.072  -7.817
  677    HA   PHE  38           HA       PHE  38   1.768  10.390  -6.329
  678   1HB   PHE  38          1HB       PHE  38   3.230   8.872  -7.794
  679   2HB   PHE  38          2HB       PHE  38   2.290   9.397  -9.195
  680    HD1  PHE  38           HD1      PHE  38   2.719  11.496 -10.230
  681    HD2  PHE  38           HD2      PHE  38   4.673  10.490  -6.601
  682    HE1  PHE  38           HE1      PHE  38   4.275  13.444 -10.528
  683    HE2  PHE  38           HE2      PHE  38   6.230  12.437  -6.899
  684    HZ   PHE  38           HZ       PHE  38   6.012  13.891  -8.859
  685    H    ASP  39           H        ASP  39   0.812  12.362  -6.489
  686    HA   ASP  39           HA       ASP  39  -1.259  12.639  -8.461
  687   1HB   ASP  39          1HB       ASP  39  -1.791  13.365  -6.221
  688   2HB   ASP  39          2HB       ASP  39  -0.321  14.347  -6.116
  689    H    SER  40           H        SER  40   0.972  15.173  -7.144
  690    HA   SER  40           HA       SER  40   2.595  16.312  -8.139
  691   1HB   SER  40          1HB       SER  40   2.611  14.305  -9.880
  692   2HB   SER  40          2HB       SER  40   1.832  15.494 -10.940
  693    HG   SER  40           HG       SER  40   3.946  15.894 -11.332
  694    H    ARG  41           H        ARG  41  -0.761  16.176  -8.935
  695    HA   ARG  41           HA       ARG  41  -1.005  18.321 -10.631
  696   1HB   ARG  41          1HB       ARG  41  -2.868  17.224  -8.482
  697   2HB   ARG  41          2HB       ARG  41  -3.374  18.465  -9.643
  698   1HG   ARG  41          1HG       ARG  41  -2.243  16.551 -11.287
  699   2HG   ARG  41          2HG       ARG  41  -2.970  15.548 -10.019
  700   1HD   ARG  41          1HD       ARG  41  -4.737  15.782 -11.541
  701   2HD   ARG  41          2HD       ARG  41  -5.084  17.090 -10.402
  702    HE   ARG  41           HE       ARG  41  -4.626  18.632 -12.100
  703   1HH1  ARG  41          1HH1      ARG  41  -3.291  15.504 -13.000
  704   2HH1  ARG  41          2HH1      ARG  41  -2.852  16.007 -14.598
  705   1HH2  ARG  41          1HH2      ARG  41  -4.048  19.297 -14.209
  706   2HH2  ARG  41          2HH2      ARG  41  -3.286  18.179 -15.291
  707    H    ILE  42           H        ILE  42  -1.187  18.146  -7.004
  708    HA   ILE  42           HA       ILE  42  -0.751  21.052  -6.976
  709    HB   ILE  42           HB       ILE  42  -1.964  19.741  -4.621
  710   1HG1  ILE  42          1HG1      ILE  42  -3.486  20.104  -7.209
  711   2HG1  ILE  42          2HG1      ILE  42  -3.171  18.573  -6.372
  712   1HG2  ILE  42          1HG2      ILE  42  -3.377  22.031  -5.509
  713   2HG2  ILE  42          2HG2      ILE  42  -2.268  21.879  -4.125
  714   3HG2  ILE  42          3HG2      ILE  42  -1.642  22.368  -5.717
  715   1HD1  ILE  42          1HD1      ILE  42  -5.344  19.089  -5.653
  716   2HD1  ILE  42          2HD1      ILE  42  -4.362  19.780  -4.339
  717   3HD1  ILE  42          3HD1      ILE  42  -5.022  20.840  -5.609
  718    HA   PRO  43           HA       PRO  43   2.953  19.862  -5.028
  719   1HB   PRO  43          1HB       PRO  43   3.998  22.364  -4.692
  720   2HB   PRO  43          2HB       PRO  43   4.160  21.444  -6.187
  721   1HG   PRO  43          1HG       PRO  43   2.386  23.710  -5.536
  722   2HG   PRO  43          2HG       PRO  43   2.890  23.106  -7.156
  723   1HD   PRO  43          1HD       PRO  43   0.375  22.764  -5.832
  724   2HD   PRO  43          2HD       PRO  43   0.874  22.016  -7.353
  725    H    GLY  44           H        GLY  44   0.458  21.704  -3.697
  726   1HA   GLY  44          1HA       GLY  44   1.716  21.881  -1.080
  727   2HA   GLY  44          2HA       GLY  44   0.135  22.472  -1.553
  728    H    VAL  45           H        VAL  45   0.008  19.527  -2.926
  729    HA   VAL  45           HA       VAL  45  -1.064  18.309  -0.482
  730    HB   VAL  45           HB       VAL  45  -2.246  18.841  -2.925
  731   1HG1  VAL  45          1HG1      VAL  45  -1.112  17.088  -4.097
  732   2HG1  VAL  45          2HG1      VAL  45  -1.443  15.920  -2.795
  733   3HG1  VAL  45          3HG1      VAL  45  -2.779  16.534  -3.800
  734   1HG2  VAL  45          1HG2      VAL  45  -3.942  18.504  -1.517
  735   2HG2  VAL  45          2HG2      VAL  45  -3.727  16.752  -1.743
  736   3HG2  VAL  45          3HG2      VAL  45  -2.898  17.584  -0.406
  737    HA   PRO  46           HA       PRO  46   1.676  14.989  -0.897
  738   1HB   PRO  46          1HB       PRO  46   0.186  12.762  -0.369
  739   2HB   PRO  46          2HB       PRO  46   0.781  13.845   0.888
  740   1HG   PRO  46          1HG       PRO  46  -1.925  13.573  -0.256
  741   2HG   PRO  46          2HG       PRO  46  -1.438  14.308   1.314
  742   1HD   PRO  46          1HD       PRO  46  -2.231  15.631  -1.100
  743   2HD   PRO  46          2HD       PRO  46  -1.608  16.397   0.367
  744    H    TRP  47           H        TRP  47   2.735  14.587  -2.729
  745    HA   TRP  47           HA       TRP  47   1.134  13.690  -4.965
  746   1HB   TRP  47          1HB       TRP  47   3.981  13.731  -5.421
  747   2HB   TRP  47          2HB       TRP  47   2.692  14.644  -6.209
  748    HD1  TRP  47           HD1      TRP  47   2.058  17.076  -4.985
  749    HE1  TRP  47           HE1      TRP  47   3.495  18.803  -3.601
  750    HE3  TRP  47           HE3      TRP  47   5.819  13.844  -3.858
  751    HZ2  TRP  47           HZ2      TRP  47   5.986  18.626  -2.219
  752    HZ3  TRP  47           HZ3      TRP  47   7.715  14.701  -2.487
  753    HH2  TRP  47           HH2      TRP  47   7.837  17.002  -1.674
  754    H    CYS  48           H        CYS  48   1.385  11.994  -2.522
  755    HA   CYS  48           HA       CYS  48   1.937   9.571  -3.822
  756   1HB   CYS  48          1HB       CYS  48   4.267  10.321  -3.482
  757   2HB   CYS  48          2HB       CYS  48   3.985  10.356  -1.739
  758    H    PHE  49           H        PHE  49  -0.009   8.795  -2.990
  759    HA   PHE  49           HA       PHE  49  -0.119   8.569  -0.080
  760   1HB   PHE  49          1HB       PHE  49  -2.751   8.926  -0.756
  761   2HB   PHE  49          2HB       PHE  49  -1.714  10.282  -0.299
  762    HD1  PHE  49           HD1      PHE  49  -0.282  11.192  -2.416
  763    HD2  PHE  49           HD2      PHE  49  -4.032   9.218  -2.625
  764    HE1  PHE  49           HE1      PHE  49  -0.719  12.257  -4.646
  765    HE2  PHE  49           HE2      PHE  49  -4.469  10.283  -4.856
  766    HZ   PHE  49           HZ       PHE  49  -2.808  11.790  -5.840
  767    H    LYS  50           H        LYS  50  -2.597   7.273   0.124
  768    HA   LYS  50           HA       LYS  50  -2.208   4.931  -1.606
  769   1HB   LYS  50          1HB       LYS  50  -3.319   4.010   0.778
  770   2HB   LYS  50          2HB       LYS  50  -1.659   3.766   0.208
  771   1HG   LYS  50          1HG       LYS  50  -2.416   6.325   1.626
  772   2HG   LYS  50          2HG       LYS  50  -2.102   4.863   2.577
  773   1HD   LYS  50          1HD       LYS  50  -0.217   6.295   0.666
  774   2HD   LYS  50          2HD       LYS  50  -0.020   6.098   2.417
  775   1HE   LYS  50          1HE       LYS  50   0.265   4.037   0.213
  776   2HE   LYS  50          2HE       LYS  50   1.428   4.460   1.478
  777   1HZ   LYS  50          1HZ       LYS  50   0.253   2.366   1.855
  778   2HZ   LYS  50          2HZ       LYS  50   0.016   3.433   3.069
  779   3HZ   LYS  50          3HZ       LYS  50  -1.164   3.170   1.972
  780    HA   PRO  51           HA       PRO  51  -6.436   6.552  -1.946
  781   1HB   PRO  51          1HB       PRO  51  -6.466   6.970  -4.644
  782   2HB   PRO  51          2HB       PRO  51  -6.115   8.241  -3.476
  783   1HG   PRO  51          1HG       PRO  51  -4.294   6.718  -5.226
  784   2HG   PRO  51          2HG       PRO  51  -4.010   8.301  -4.418
  785   1HD   PRO  51          1HD       PRO  51  -2.979   5.727  -3.702
  786   2HD   PRO  51          2HD       PRO  51  -2.801   7.227  -2.784
  787    H    LEU  52           H        LEU  52  -5.804   5.183  -5.074
  788    HA   LEU  52           HA       LEU  52  -7.518   2.949  -4.263
  789   1HB   LEU  52          1HB       LEU  52  -8.496   3.028  -6.247
  790   2HB   LEU  52          2HB       LEU  52  -7.888   4.693  -6.271
  791    HG   LEU  52           HG       LEU  52  -6.904   2.269  -7.756
  792   1HD1  LEU  52          1HD1      LEU  52  -6.808   4.330  -9.494
  793   2HD1  LEU  52          2HD1      LEU  52  -8.251   3.323  -9.226
  794   3HD1  LEU  52          3HD1      LEU  52  -8.101   4.898  -8.410
  795   1HD2  LEU  52          1HD2      LEU  52  -5.123   4.380  -8.316
  796   2HD2  LEU  52          2HD2      LEU  52  -5.208   4.254  -6.542
  797   3HD2  LEU  52          3HD2      LEU  52  -4.773   2.829  -7.515
  798    H    GLN  53           H        GLN  53  -4.609   3.237  -3.630
  799    HA   GLN  53           HA       GLN  53  -2.975   1.918  -5.318
  800   1HB   GLN  53          1HB       GLN  53  -2.286   0.952  -2.761
  801   2HB   GLN  53          2HB       GLN  53  -1.642   2.397  -3.560
  802   1HG   GLN  53          1HG       GLN  53  -2.539   2.921  -1.317
  803   2HG   GLN  53          2HG       GLN  53  -3.468   3.754  -2.574
  804   1HE2  GLN  53          1HE2      GLN  53  -3.540   0.338  -1.663
  805   2HE2  GLN  53          2HE2      GLN  53  -5.184   0.277  -1.120
  806    H    GLU  54           H        GLU  54  -5.805   0.685  -3.753
  807    HA   GLU  54           HA       GLU  54  -5.329  -1.849  -3.153
  808   1HB   GLU  54          1HB       GLU  54  -7.603  -2.261  -3.487
  809   2HB   GLU  54          2HB       GLU  54  -7.567  -0.495  -3.341
  810   1HG   GLU  54          1HG       GLU  54  -8.734  -0.540  -5.293
  811   2HG   GLU  54          2HG       GLU  54  -7.158  -0.824  -6.048
  812    H    ALA  55           H        ALA  55  -5.007  -0.388  -6.333
  813    HA   ALA  55           HA       ALA  55  -5.393  -2.275  -8.145
  814   1HB   ALA  55          1HB       ALA  55  -4.079  -0.951  -9.423
  815   2HB   ALA  55          2HB       ALA  55  -3.895   0.049  -7.962
  816   3HB   ALA  55          3HB       ALA  55  -2.669  -1.178  -8.361
  817    H    GLU  56           H        GLU  56  -2.229  -2.086  -6.353
  818    HA   GLU  56           HA       GLU  56  -2.207  -4.997  -6.477
  819   1HB   GLU  56          1HB       GLU  56  -0.316  -3.099  -7.640
  820   2HB   GLU  56          2HB       GLU  56   0.494  -4.212  -6.522
  821   1HG   GLU  56          1HG       GLU  56  -0.052  -6.087  -7.797
  822   2HG   GLU  56          2HG       GLU  56  -1.483  -5.327  -8.514
  823    H    CYS  57           H        CYS  57  -2.840  -2.713  -4.430
  824    HA   CYS  57           HA       CYS  57  -0.781  -3.246  -2.464
  825   1HB   CYS  57          1HB       CYS  57  -1.624  -0.951  -2.845
  826   2HB   CYS  57          2HB       CYS  57  -3.214  -1.459  -2.268
  827    H    THR  58           H        THR  58  -4.374  -2.923  -2.103
  828    HA   THR  58           HA       THR  58  -4.705  -4.597  -0.002
  829    HB   THR  58           HB       THR  58  -6.439  -3.120  -1.061
  830    HG1  THR  58           HG1      THR  58  -8.111  -4.931  -0.900
  831   1HG2  THR  58          1HG2      THR  58  -6.205  -3.637  -3.445
  832   2HG2  THR  58          2HG2      THR  58  -6.463  -5.370  -3.136
  833   3HG2  THR  58          3HG2      THR  58  -7.803  -4.218  -2.921
  834    H    PHE  59           H        PHE  59  -4.321  -5.531  -3.442
  835    HA   PHE  59           HA       PHE  59  -5.103  -8.088  -3.441
  836   1HB   PHE  59          1HB       PHE  59  -2.966  -6.406  -4.655
  837   2HB   PHE  59          2HB       PHE  59  -2.564  -8.126  -4.687
  838    HD1  PHE  59           HD1      PHE  59  -3.062  -9.148  -6.680
  839    HD2  PHE  59           HD2      PHE  59  -5.618  -6.051  -5.307
  840    HE1  PHE  59           HE1      PHE  59  -4.501  -9.430  -8.718
  841    HE2  PHE  59           HE2      PHE  59  -7.056  -6.334  -7.344
  842    HZ   PHE  59           HZ       PHE  59  -6.480  -8.020  -9.025
  Start of MODEL   45
    1   1H    GLU   1           H1       GLU   1 -18.100 -11.233   0.426
    2    HA   GLU   1           HA       GLU   1 -17.968 -10.575  -2.334
    3   1HB   GLU   1          1HB       GLU   1 -17.677  -8.941  -0.443
    4   2HB   GLU   1          2HB       GLU   1 -16.118  -9.699  -0.074
    5   1HG   GLU   1          1HG       GLU   1 -15.987  -7.625  -1.525
    6   2HG   GLU   1          2HG       GLU   1 -15.218  -9.055  -2.230
    7    H    GLU   2           H        GLU   2 -15.733 -10.478  -3.469
    8    HA   GLU   2           HA       GLU   2 -14.616 -13.109  -3.225
    9   1HB   GLU   2          1HB       GLU   2 -14.666 -10.943  -5.259
   10   2HB   GLU   2          2HB       GLU   2 -13.197 -11.935  -5.249
   11   1HG   GLU   2          1HG       GLU   2 -15.490 -13.661  -4.978
   12   2HG   GLU   2          2HG       GLU   2 -15.779 -12.568  -6.341
   13    H    TYR   3           H        TYR   3 -14.177 -10.740  -1.240
   14    HA   TYR   3           HA       TYR   3 -11.316 -10.335  -1.514
   15   1HB   TYR   3          1HB       TYR   3 -13.699  -9.335   0.053
   16   2HB   TYR   3          2HB       TYR   3 -12.140  -9.207   0.875
   17    HD1  TYR   3           HD1      TYR   3 -13.092  -8.702  -2.721
   18    HD2  TYR   3           HD2      TYR   3 -11.542  -6.957   0.866
   19    HE1  TYR   3           HE1      TYR   3 -12.624  -6.536  -3.968
   20    HE2  TYR   3           HE2      TYR   3 -11.080  -4.797  -0.394
   21    HH   TYR   3           HH       TYR   3 -12.448  -4.001  -3.165
   22    H    VAL   4           H        VAL   4 -10.959 -12.772  -1.272
   23    HA   VAL   4           HA       VAL   4 -10.943 -13.438   1.592
   24    HB   VAL   4           HB       VAL   4 -12.498 -14.813   0.328
   25   1HG1  VAL   4          1HG1      VAL   4 -11.881 -16.184  -1.522
   26   2HG1  VAL   4          2HG1      VAL   4 -11.278 -14.548  -1.878
   27   3HG1  VAL   4          3HG1      VAL   4 -10.153 -15.808  -1.315
   28   1HG2  VAL   4          1HG2      VAL   4 -10.552 -15.704   2.060
   29   2HG2  VAL   4          2HG2      VAL   4 -11.956 -16.650   1.508
   30   3HG2  VAL   4          3HG2      VAL   4 -10.385 -16.827   0.690
   31    H    GLY   5           H        GLY   5  -9.290 -14.087  -1.581
   32   1HA   GLY   5          1HA       GLY   5  -6.868 -14.931  -0.351
   33   2HA   GLY   5          2HA       GLY   5  -7.128 -14.542  -2.040
   34    H    LEU   6           H        LEU   6  -8.302 -11.920  -0.273
   35    HA   LEU   6           HA       LEU   6  -5.679 -10.635  -0.126
   36   1HB   LEU   6          1HB       LEU   6  -7.030  -8.588  -1.065
   37   2HB   LEU   6          2HB       LEU   6  -6.199  -9.739  -2.126
   38    HG   LEU   6           HG       LEU   6  -9.077 -10.209  -1.448
   39   1HD1  LEU   6          1HD1      LEU   6  -8.226  -8.249  -3.593
   40   2HD1  LEU   6          2HD1      LEU   6  -9.882  -8.721  -3.142
   41   3HD1  LEU   6          3HD1      LEU   6  -8.884  -7.783  -2.007
   42   1HD2  LEU   6          1HD2      LEU   6  -8.928 -11.728  -3.060
   43   2HD2  LEU   6          2HD2      LEU   6  -8.299 -10.528  -4.214
   44   3HD2  LEU   6          3HD2      LEU   6  -7.180 -11.398  -3.136
   45    H    SER   7           H        SER   7  -8.123 -11.781   1.595
   46    HA   SER   7           HA       SER   7  -9.084  -9.512   2.927
   47   1HB   SER   7          1HB       SER   7 -10.354 -10.996   4.113
   48   2HB   SER   7          2HB       SER   7  -9.858 -12.105   2.821
   49    HG   SER   7           HG       SER   7  -9.361 -13.218   4.662
   50    H    ALA   8           H        ALA   8  -8.770 -10.171   5.695
   51    HA   ALA   8           HA       ALA   8  -6.210  -9.036   6.161
   52   1HB   ALA   8          1HB       ALA   8  -8.530 -10.006   7.830
   53   2HB   ALA   8          2HB       ALA   8  -6.981  -9.600   8.609
   54   3HB   ALA   8          3HB       ALA   8  -7.859  -8.365   7.674
   55    H    ASN   9           H        ASN   9  -7.335 -12.233   5.569
   56    HA   ASN   9           HA       ASN   9  -5.268 -13.421   7.182
   57   1HB   ASN   9          1HB       ASN   9  -7.802 -14.251   6.234
   58   2HB   ASN   9          2HB       ASN   9  -6.647 -15.242   5.328
   59   1HD2  ASN   9          1HD2      ASN   9  -4.932 -16.296   6.598
   60   2HD2  ASN   9          2HD2      ASN   9  -5.311 -16.932   8.165
   61    H    GLN  10           H        GLN  10  -5.638 -11.985   4.118
   62    HA   GLN  10           HA       GLN  10  -4.329 -13.762   2.453
   63   1HB   GLN  10          1HB       GLN  10  -4.568 -12.124   0.897
   64   2HB   GLN  10          2HB       GLN  10  -5.569 -11.345   2.136
   65   1HG   GLN  10          1HG       GLN  10  -3.613 -10.066   2.923
   66   2HG   GLN  10          2HG       GLN  10  -2.573 -10.881   1.745
   67   1HE2  GLN  10          1HE2      GLN  10  -2.739 -10.403  -0.426
   68   2HE2  GLN  10          2HE2      GLN  10  -3.548  -8.997  -1.036
   69    H    CYS  11           H        CYS  11  -3.113 -11.156   4.628
   70    HA   CYS  11           HA       CYS  11  -0.482 -11.184   3.780
   71   1HB   CYS  11          1HB       CYS  11  -1.218  -9.416   5.139
   72   2HB   CYS  11          2HB       CYS  11  -1.763 -10.501   6.421
   73    H    ALA  12           H        ALA  12  -2.385 -13.643   5.217
   74    HA   ALA  12           HA       ALA  12  -0.120 -14.900   6.549
   75   1HB   ALA  12          1HB       ALA  12  -2.850 -16.135   6.347
   76   2HB   ALA  12          2HB       ALA  12  -1.693 -16.146   7.699
   77   3HB   ALA  12          3HB       ALA  12  -2.649 -14.684   7.357
   78    H    VAL  13           H        VAL  13  -0.450 -14.453   3.518
   79    HA   VAL  13           HA       VAL  13  -1.151 -16.640   2.121
   80    HB   VAL  13           HB       VAL  13   1.152 -15.952   0.860
   81   1HG1  VAL  13          1HG1      VAL  13  -1.555 -14.596   0.890
   82   2HG1  VAL  13          2HG1      VAL  13  -0.280 -14.171  -0.277
   83   3HG1  VAL  13          3HG1      VAL  13  -0.941 -15.824  -0.243
   84   1HG2  VAL  13          1HG2      VAL  13   1.797 -13.734   1.257
   85   2HG2  VAL  13          2HG2      VAL  13   0.335 -13.376   2.206
   86   3HG2  VAL  13          3HG2      VAL  13   1.607 -14.416   2.891
   87    HA   PRO  14           HA       PRO  14   1.530 -19.892   3.086
   88   1HB   PRO  14          1HB       PRO  14   2.089 -21.070   0.686
   89   2HB   PRO  14          2HB       PRO  14   0.572 -21.313   1.549
   90   1HG   PRO  14          1HG       PRO  14   1.167 -19.645  -0.811
   91   2HG   PRO  14          2HG       PRO  14  -0.427 -20.259  -0.244
   92   1HD   PRO  14          1HD       PRO  14   0.637 -17.610  -0.030
   93   2HD   PRO  14          2HD       PRO  14  -0.867 -18.203   0.685
   94    H    ALA  15           H        ALA  15   2.707 -17.203   1.791
   95    HA   ALA  15           HA       ALA  15   4.777 -16.364   1.986
   96   1HB   ALA  15          1HB       ALA  15   5.035 -18.573   3.562
   97   2HB   ALA  15          2HB       ALA  15   6.205 -18.956   2.276
   98   3HB   ALA  15          3HB       ALA  15   6.368 -17.447   3.207
   99    H    LYS  16           H        LYS  16   3.505 -16.866  -0.432
  100    HA   LYS  16           HA       LYS  16   5.599 -16.742  -2.225
  101   1HB   LYS  16          1HB       LYS  16   4.774 -19.083  -3.337
  102   2HB   LYS  16          2HB       LYS  16   6.246 -18.886  -2.370
  103   1HG   LYS  16          1HG       LYS  16   5.336 -19.948  -0.538
  104   2HG   LYS  16          2HG       LYS  16   3.692 -19.381  -0.875
  105   1HD   LYS  16          1HD       LYS  16   3.459 -21.616  -1.417
  106   2HD   LYS  16          2HD       LYS  16   3.962 -20.996  -3.000
  107   1HE   LYS  16          1HE       LYS  16   6.379 -21.513  -2.225
  108   2HE   LYS  16          2HE       LYS  16   5.641 -22.448  -0.916
  109   1HZ   LYS  16          1HZ       LYS  16   4.334 -23.416  -2.946
  110   2HZ   LYS  16          2HZ       LYS  16   5.678 -22.967  -3.758
  111   3HZ   LYS  16          3HZ       LYS  16   5.790 -24.012  -2.508
  112    H    ASP  17           H        ASP  17   3.347 -15.224  -1.670
  113    HA   ASP  17           HA       ASP  17   2.044 -15.421  -4.214
  114   1HB   ASP  17          1HB       ASP  17   0.576 -16.768  -2.772
  115   2HB   ASP  17          2HB       ASP  17   0.507 -15.465  -1.576
  116    H    ARG  18           H        ARG  18   3.805 -13.715  -2.141
  117    HA   ARG  18           HA       ARG  18   2.158 -11.361  -2.018
  118   1HB   ARG  18          1HB       ARG  18   5.044 -11.658  -1.092
  119   2HB   ARG  18          2HB       ARG  18   3.861 -10.456  -0.546
  120   1HG   ARG  18          1HG       ARG  18   2.973 -11.882   0.975
  121   2HG   ARG  18          2HG       ARG  18   2.937 -13.235  -0.170
  122   1HD   ARG  18          1HD       ARG  18   5.340 -13.645   0.230
  123   2HD   ARG  18          2HD       ARG  18   5.420 -12.256   1.324
  124    HE   ARG  18           HE       ARG  18   3.427 -14.335   1.999
  125   1HH1  ARG  18          1HH1      ARG  18   6.650 -13.038   2.557
  126   2HH1  ARG  18          2HH1      ARG  18   6.842 -13.827   4.087
  127   1HH2  ARG  18          1HH2      ARG  18   3.680 -15.376   4.018
  128   2HH2  ARG  18          2HH2      ARG  18   5.141 -15.166   4.923
  129    H    VAL  19           H        VAL  19   3.768  -9.219  -2.380
  130    HA   VAL  19           HA       VAL  19   4.820  -9.608  -5.094
  131    HB   VAL  19           HB       VAL  19   3.930  -6.997  -3.894
  132   1HG1  VAL  19          1HG1      VAL  19   4.552  -6.199  -5.879
  133   2HG1  VAL  19          2HG1      VAL  19   5.025  -7.833  -6.406
  134   3HG1  VAL  19          3HG1      VAL  19   3.361  -7.257  -6.674
  135   1HG2  VAL  19          1HG2      VAL  19   1.797  -7.647  -5.408
  136   2HG2  VAL  19          2HG2      VAL  19   2.248  -9.267  -4.826
  137   3HG2  VAL  19          3HG2      VAL  19   1.888  -7.972  -3.660
  138    H    ASP  20           H        ASP  20   6.106 -10.000  -2.317
  139    HA   ASP  20           HA       ASP  20   7.855  -9.308  -1.163
  140   1HB   ASP  20          1HB       ASP  20   9.186 -10.567  -2.549
  141   2HB   ASP  20          2HB       ASP  20   8.656  -9.722  -4.012
  142    H    CYS  21           H        CYS  21   7.295  -7.188  -0.344
  143    HA   CYS  21           HA       CYS  21   7.255  -4.876  -1.838
  144   1HB   CYS  21          1HB       CYS  21   6.670  -5.531   0.715
  145   2HB   CYS  21          2HB       CYS  21   8.165  -4.624   0.966
  146    H    GLY  22           H        GLY  22   9.916  -6.715  -0.321
  147   1HA   GLY  22          1HA       GLY  22  12.150  -6.448  -0.332
  148   2HA   GLY  22          2HA       GLY  22  11.926  -5.779  -1.936
  149    H    TYR  23           H        TYR  23  11.137  -4.656   1.439
  150    HA   TYR  23           HA       TYR  23  12.047  -2.000   0.698
  151   1HB   TYR  23          1HB       TYR  23  10.304  -3.407   2.645
  152   2HB   TYR  23          2HB       TYR  23  11.311  -2.199   3.451
  153    HD1  TYR  23           HD1      TYR  23   8.236  -2.238   3.151
  154    HD2  TYR  23           HD2      TYR  23  11.340  -0.335   0.904
  155    HE1  TYR  23           HE1      TYR  23   6.611  -0.419   2.433
  156    HE2  TYR  23           HE2      TYR  23   9.705   1.477   0.194
  157    HH   TYR  23           HH       TYR  23   6.288   1.234   0.990
  158    HA   PRO  24           HA       PRO  24  15.881  -2.515   2.661
  159   1HB   PRO  24          1HB       PRO  24  16.664   0.098   2.788
  160   2HB   PRO  24          2HB       PRO  24  16.845  -0.892   1.342
  161   1HG   PRO  24          1HG       PRO  24  14.872   1.211   1.965
  162   2HG   PRO  24          2HG       PRO  24  15.350   0.561   0.355
  163   1HD   PRO  24          1HD       PRO  24  12.962   0.042   1.846
  164   2HD   PRO  24          2HD       PRO  24  13.459  -0.746   0.343
  165    H    HIS  25           H        HIS  25  13.250  -0.958   4.041
  166    HA   HIS  25           HA       HIS  25  14.692  -0.834   6.586
  167   1HB   HIS  25          1HB       HIS  25  13.220   1.110   5.327
  168   2HB   HIS  25          2HB       HIS  25  12.037   0.425   6.449
  169    HD1  HIS  25           HD1      HIS  25  15.754   0.766   7.204
  170    HD2  HIS  25           HD2      HIS  25  12.092   2.491   8.305
  171    HE1  HIS  25           HE1      HIS  25  16.253   2.308   9.174
  172    HE2  HIS  25           HE2      HIS  25  13.975   3.380   9.771
  173    H    VAL  26           H        VAL  26  13.153  -3.073   4.902
  174    HA   VAL  26           HA       VAL  26  10.882  -3.883   6.076
  175    HB   VAL  26           HB       VAL  26  11.763  -5.121   4.299
  176   1HG1  VAL  26          1HG1      VAL  26  14.244  -4.603   5.377
  177   2HG1  VAL  26          2HG1      VAL  26  14.084  -6.359   5.613
  178   3HG1  VAL  26          3HG1      VAL  26  13.923  -5.661   3.984
  179   1HG2  VAL  26          1HG2      VAL  26  11.525  -7.356   5.000
  180   2HG2  VAL  26          2HG2      VAL  26  12.226  -7.025   6.601
  181   3HG2  VAL  26          3HG2      VAL  26  10.605  -6.413   6.195
  182    H    THR  27           H        THR  27  10.174  -4.503   8.068
  183    HA   THR  27           HA       THR  27  11.834  -5.789   9.952
  184    HB   THR  27           HB       THR  27  11.953  -2.869   9.846
  185    HG1  THR  27           HG1      THR  27  13.576  -3.530  11.540
  186   1HG2  THR  27          1HG2      THR  27  10.601  -4.169  12.218
  187   2HG2  THR  27          2HG2      THR  27  11.840  -2.931  12.536
  188   3HG2  THR  27          3HG2      THR  27  10.399  -2.522  11.573
  189    HA   PRO  28           HA       PRO  28   7.925  -6.731  11.444
  190   1HB   PRO  28          1HB       PRO  28   8.501  -7.646  13.953
  191   2HB   PRO  28          2HB       PRO  28   8.704  -8.623  12.501
  192   1HG   PRO  28          1HG       PRO  28  10.719  -7.238  14.150
  193   2HG   PRO  28          2HG       PRO  28  10.957  -8.594  12.990
  194   1HD   PRO  28          1HD       PRO  28  11.594  -5.824  12.644
  195   2HD   PRO  28          2HD       PRO  28  11.698  -7.092  11.416
  196    H    LYS  29           H        LYS  29   7.854  -4.169  11.270
  197    HA   LYS  29           HA       LYS  29   6.071  -3.320  13.087
  198   1HB   LYS  29          1HB       LYS  29   7.521  -3.671  14.929
  199   2HB   LYS  29          2HB       LYS  29   8.865  -2.827  14.141
  200   1HG   LYS  29          1HG       LYS  29   8.092  -0.796  14.786
  201   2HG   LYS  29          2HG       LYS  29   6.423  -1.178  14.330
  202   1HD   LYS  29          1HD       LYS  29   7.316  -2.689  16.683
  203   2HD   LYS  29          2HD       LYS  29   7.438  -0.939  16.940
  204   1HE   LYS  29          1HE       LYS  29   5.239  -1.447  17.621
  205   2HE   LYS  29          2HE       LYS  29   5.007  -0.860  15.966
  206   1HZ   LYS  29          1HZ       LYS  29   5.438  -3.699  16.435
  207   2HZ   LYS  29          2HZ       LYS  29   3.962  -3.064  16.726
  208   3HZ   LYS  29          3HZ       LYS  29   4.614  -2.965  15.231
  209    H    GLU  30           H        GLU  30   8.736  -2.780  10.897
  210    HA   GLU  30           HA       GLU  30   7.944  -0.028  10.517
  211   1HB   GLU  30          1HB       GLU  30  10.320  -1.687   9.898
  212   2HB   GLU  30          2HB       GLU  30   9.910  -0.501   8.647
  213   1HG   GLU  30          1HG       GLU  30  11.120   0.923   9.952
  214   2HG   GLU  30          2HG       GLU  30   9.640   1.025  10.918
  215    H    CYS  31           H        CYS  31   8.141  -3.172   8.743
  216    HA   CYS  31           HA       CYS  31   7.301  -2.312   6.287
  217   1HB   CYS  31          1HB       CYS  31   7.027  -4.899   7.770
  218   2HB   CYS  31          2HB       CYS  31   6.250  -4.701   6.197
  219    H    ASN  32           H        ASN  32   5.354  -3.451   9.139
  220    HA   ASN  32           HA       ASN  32   2.914  -2.914   7.835
  221   1HB   ASN  32          1HB       ASN  32   3.820  -3.749  10.574
  222   2HB   ASN  32          2HB       ASN  32   2.211  -3.020  10.474
  223   1HD2  ASN  32          1HD2      ASN  32   4.279  -5.362   8.759
  224   2HD2  ASN  32          2HD2      ASN  32   3.058  -6.555   8.461
  225    H    ASN  33           H        ASN  33   5.243  -0.800   8.618
  226    HA   ASN  33           HA       ASN  33   3.478   1.090   9.946
  227   1HB   ASN  33          1HB       ASN  33   5.673   0.730  11.028
  228   2HB   ASN  33          2HB       ASN  33   6.514   1.117   9.520
  229   1HD2  ASN  33          1HD2      ASN  33   7.589   2.896  10.088
  230   2HD2  ASN  33          2HD2      ASN  33   6.880   4.383  10.624
  231    H    ARG  34           H        ARG  34   5.677   0.515   7.140
  232    HA   ARG  34           HA       ARG  34   5.144   3.090   6.057
  233   1HB   ARG  34          1HB       ARG  34   6.345   1.894   4.003
  234   2HB   ARG  34          2HB       ARG  34   7.282   2.352   5.436
  235   1HG   ARG  34          1HG       ARG  34   6.086  -0.260   5.826
  236   2HG   ARG  34          2HG       ARG  34   6.977  -0.246   4.294
  237   1HD   ARG  34          1HD       ARG  34   8.363   1.047   6.591
  238   2HD   ARG  34          2HD       ARG  34   8.123  -0.699   6.757
  239    HE   ARG  34           HE       ARG  34   9.476  -1.046   4.796
  240   1HH1  ARG  34          1HH1      ARG  34   9.190   2.351   5.668
  241   2HH1  ARG  34          2HH1      ARG  34  10.535   2.845   4.695
  242   1HH2  ARG  34          1HH2      ARG  34  11.250  -0.394   3.512
  243   2HH2  ARG  34          2HH2      ARG  34  11.714   1.274   3.460
  244    H    GLY  35           H        GLY  35   4.081  -0.306   5.586
  245   1HA   GLY  35          1HA       GLY  35   1.624  -0.183   4.830
  246   2HA   GLY  35          2HA       GLY  35   2.312   0.532   3.386
  247    H    CYS  36           H        CYS  36   4.214  -1.864   5.163
  248    HA   CYS  36           HA       CYS  36   3.564  -3.799   3.058
  249   1HB   CYS  36          1HB       CYS  36   6.196  -3.120   4.346
  250   2HB   CYS  36          2HB       CYS  36   5.930  -4.662   3.525
  251    H    CYS  37           H        CYS  37   4.040  -6.144   3.851
  252    HA   CYS  37           HA       CYS  37   3.195  -6.312   6.650
  253   1HB   CYS  37          1HB       CYS  37   1.581  -7.111   4.932
  254   2HB   CYS  37          2HB       CYS  37   2.748  -8.350   4.462
  255    H    PHE  38           H        PHE  38   4.642  -7.275   8.051
  256    HA   PHE  38           HA       PHE  38   7.053  -8.383   6.873
  257   1HB   PHE  38          1HB       PHE  38   6.871  -6.622   8.780
  258   2HB   PHE  38          2HB       PHE  38   6.248  -7.922   9.803
  259    HD1  PHE  38           HD1      PHE  38   7.724  -9.618  10.663
  260    HD2  PHE  38           HD2      PHE  38   9.199  -6.622   8.044
  261    HE1  PHE  38           HE1      PHE  38  10.077 -10.255  11.259
  262    HE2  PHE  38           HE2      PHE  38  11.552  -7.260   8.640
  263    HZ   PHE  38           HZ       PHE  38  11.963  -9.068  10.241
  264    H    ASP  39           H        ASP  39   7.301 -10.545   6.596
  265    HA   ASP  39           HA       ASP  39   5.380 -12.291   7.737
  266   1HB   ASP  39          1HB       ASP  39   6.265 -12.694   5.493
  267   2HB   ASP  39          2HB       ASP  39   7.920 -12.780   6.115
  268    H    SER  40           H        SER  40   8.960 -12.834   7.561
  269    HA   SER  40           HA       SER  40  10.469 -13.100   9.146
  270   1HB   SER  40          1HB       SER  40   8.789 -11.637  10.600
  271   2HB   SER  40          2HB       SER  40   8.497 -13.179  11.423
  272    HG   SER  40           HG       SER  40  10.640 -13.262  12.072
  273    H    ARG  41           H        ARG  41   7.352 -14.807   9.199
  274    HA   ARG  41           HA       ARG  41   8.158 -17.006  10.666
  275   1HB   ARG  41          1HB       ARG  41   6.164 -17.048   8.363
  276   2HB   ARG  41          2HB       ARG  41   6.158 -18.082   9.800
  277   1HG   ARG  41          1HG       ARG  41   6.096 -15.571  10.925
  278   2HG   ARG  41          2HG       ARG  41   5.168 -15.299   9.439
  279   1HD   ARG  41          1HD       ARG  41   3.401 -16.141  10.586
  280   2HD   ARG  41          2HD       ARG  41   4.157 -17.728  10.384
  281    HE   ARG  41           HE       ARG  41   4.816 -17.672  12.645
  282   1HH1  ARG  41          1HH1      ARG  41   3.646 -14.504  11.660
  283   2HH1  ARG  41          2HH1      ARG  41   3.615 -13.873  13.273
  284   1HH2  ARG  41          1HH2      ARG  41   4.776 -16.841  14.773
  285   2HH2  ARG  41          2HH2      ARG  41   4.262 -15.211  15.055
  286    H    ILE  42           H        ILE  42   8.359 -16.190   7.164
  287    HA   ILE  42           HA       ILE  42   9.993 -18.606   6.810
  288    HB   ILE  42           HB       ILE  42   8.467 -17.344   4.566
  289   1HG1  ILE  42          1HG1      ILE  42   7.331 -18.810   6.861
  290   2HG1  ILE  42          2HG1      ILE  42   6.561 -17.683   5.730
  291   1HG2  ILE  42          1HG2      ILE  42  10.306 -19.169   4.382
  292   2HG2  ILE  42          2HG2      ILE  42   9.037 -20.267   4.975
  293   3HG2  ILE  42          3HG2      ILE  42   8.792 -19.356   3.466
  294   1HD1  ILE  42          1HD1      ILE  42   6.997 -20.659   5.489
  295   2HD1  ILE  42          2HD1      ILE  42   5.545 -19.697   5.123
  296   3HD1  ILE  42          3HD1      ILE  42   6.929 -19.678   4.004
  297    HA   PRO  43           HA       PRO  43  12.846 -15.344   6.014
  298   1HB   PRO  43          1HB       PRO  43  15.105 -16.811   6.474
  299   2HB   PRO  43          2HB       PRO  43  14.248 -15.938   7.741
  300   1HG   PRO  43          1HG       PRO  43  14.288 -18.821   7.116
  301   2HG   PRO  43          2HG       PRO  43  13.824 -18.012   8.657
  302   1HD   PRO  43          1HD       PRO  43  12.118 -19.184   6.678
  303   2HD   PRO  43          2HD       PRO  43  11.608 -18.259   8.096
  304    H    GLY  44           H        GLY  44  12.069 -18.090   4.362
  305   1HA   GLY  44          1HA       GLY  44  14.124 -17.738   2.320
  306   2HA   GLY  44          2HA       GLY  44  12.908 -18.996   2.408
  307    H    VAL  45           H        VAL  45  11.150 -16.299   3.141
  308    HA   VAL  45           HA       VAL  45  10.645 -15.693   0.309
  309    HB   VAL  45           HB       VAL  45   8.388 -15.863   0.603
  310   1HG1  VAL  45          1HG1      VAL  45   7.911 -17.909   2.035
  311   2HG1  VAL  45          2HG1      VAL  45   9.179 -18.096   0.801
  312   3HG1  VAL  45          3HG1      VAL  45   9.626 -17.866   2.508
  313   1HG2  VAL  45          1HG2      VAL  45   8.288 -14.283   2.518
  314   2HG2  VAL  45          2HG2      VAL  45   7.173 -15.659   2.695
  315   3HG2  VAL  45          3HG2      VAL  45   8.697 -15.625   3.614
  316    HA   PRO  46           HA       PRO  46  10.647 -11.498   1.432
  317   1HB   PRO  46          1HB       PRO  46   8.304 -10.381   0.581
  318   2HB   PRO  46          2HB       PRO  46   9.643 -10.754  -0.503
  319   1HG   PRO  46          1HG       PRO  46   7.091 -12.175  -0.082
  320   2HG   PRO  46          2HG       PRO  46   8.211 -12.269  -1.489
  321   1HD   PRO  46          1HD       PRO  46   7.835 -14.172   0.618
  322   2HD   PRO  46          2HD       PRO  46   9.060 -14.236  -0.655
  323    H    TRP  47           H        TRP  47  10.854 -10.707   3.419
  324    HA   TRP  47           HA       TRP  47   8.631 -11.244   5.213
  325   1HB   TRP  47          1HB       TRP  47  10.919  -9.795   6.288
  326   2HB   TRP  47          2HB       TRP  47  10.135 -11.271   6.851
  327    HD1  TRP  47           HD1      TRP  47  11.003 -13.610   5.503
  328    HE1  TRP  47           HE1      TRP  47  13.372 -14.310   4.575
  329    HE3  TRP  47           HE3      TRP  47  12.911  -8.900   5.334
  330    HZ2  TRP  47           HZ2      TRP  47  15.725 -12.848   3.889
  331    HZ3  TRP  47           HZ3      TRP  47  15.251  -8.623   4.523
  332    HH2  TRP  47           HH2      TRP  47  16.646 -10.501   3.816
  333    H    CYS  48           H        CYS  48   8.420  -9.326   2.912
  334    HA   CYS  48           HA       CYS  48   7.249  -7.206   4.359
  335   1HB   CYS  48          1HB       CYS  48   9.768  -6.670   4.345
  336   2HB   CYS  48          2HB       CYS  48   9.539  -6.298   2.634
  337    H    PHE  49           H        PHE  49   5.368  -7.428   3.152
  338    HA   PHE  49           HA       PHE  49   5.645  -6.957   0.285
  339   1HB   PHE  49          1HB       PHE  49   3.548  -8.734   0.424
  340   2HB   PHE  49          2HB       PHE  49   5.209  -9.255   0.122
  341    HD1  PHE  49           HD1      PHE  49   6.599  -9.568   2.417
  342    HD2  PHE  49           HD2      PHE  49   2.384  -9.876   2.025
  343    HE1  PHE  49           HE1      PHE  49   6.510 -10.988   4.485
  344    HE2  PHE  49           HE2      PHE  49   2.296 -11.297   4.093
  345    HZ   PHE  49           HZ       PHE  49   4.360 -11.836   5.298
  346    H    LYS  50           H        LYS  50   2.949  -7.136  -0.428
  347    HA   LYS  50           HA       LYS  50   1.668  -5.234   1.406
  348   1HB   LYS  50          1HB       LYS  50   0.691  -4.275  -0.800
  349   2HB   LYS  50          2HB       LYS  50   2.314  -3.789  -0.275
  350   1HG   LYS  50          1HG       LYS  50   2.216  -6.239  -1.951
  351   2HG   LYS  50          2HG       LYS  50   1.692  -4.764  -2.782
  352   1HD   LYS  50          1HD       LYS  50   4.292  -5.021  -1.215
  353   2HD   LYS  50          2HD       LYS  50   4.177  -5.265  -2.967
  354   1HE   LYS  50          1HE       LYS  50   3.201  -2.720  -1.628
  355   2HE   LYS  50          2HE       LYS  50   4.893  -2.913  -2.112
  356   1HZ   LYS  50          1HZ       LYS  50   4.335  -2.781  -4.260
  357   2HZ   LYS  50          2HZ       LYS  50   2.915  -3.572  -4.095
  358   3HZ   LYS  50          3HZ       LYS  50   3.019  -1.990  -3.703
  359    HA   PRO  51           HA       PRO  51  -0.985  -8.815   0.574
  360   1HB   PRO  51          1HB       PRO  51  -1.391  -9.585   3.164
  361   2HB   PRO  51          2HB       PRO  51  -0.156 -10.299   2.128
  362   1HG   PRO  51          1HG       PRO  51   0.108  -8.331   4.310
  363   2HG   PRO  51          2HG       PRO  51   1.373  -9.398   3.601
  364   1HD   PRO  51          1HD       PRO  51   0.982  -6.590   3.201
  365   2HD   PRO  51          2HD       PRO  51   2.141  -7.625   2.356
  366    H    LEU  52           H        LEU  52  -2.104  -8.125   3.724
  367    HA   LEU  52           HA       LEU  52  -4.462  -6.934   2.509
  368   1HB   LEU  52          1HB       LEU  52  -5.625  -7.606   4.334
  369   2HB   LEU  52          2HB       LEU  52  -4.393  -8.876   4.220
  370    HG   LEU  52           HG       LEU  52  -3.339  -6.859   5.906
  371   1HD1  LEU  52          1HD1      LEU  52  -4.974  -5.982   7.123
  372   2HD1  LEU  52          2HD1      LEU  52  -6.137  -6.674   5.965
  373   3HD1  LEU  52          3HD1      LEU  52  -5.687  -7.585   7.427
  374   1HD2  LEU  52          1HD2      LEU  52  -2.632  -8.762   6.799
  375   2HD2  LEU  52          2HD2      LEU  52  -4.252  -8.996   7.497
  376   3HD2  LEU  52          3HD2      LEU  52  -3.861  -9.692   5.906
  377    H    GLN  53           H        GLN  53  -2.056  -5.376   2.388
  378    HA   GLN  53           HA       GLN  53  -1.746  -3.652   4.495
  379   1HB   GLN  53          1HB       GLN  53  -1.381  -3.185   1.513
  380   2HB   GLN  53          2HB       GLN  53  -0.772  -2.090   2.764
  381   1HG   GLN  53          1HG       GLN  53  -0.028  -5.025   2.400
  382   2HG   GLN  53          2HG       GLN  53   1.003  -3.639   2.009
  383   1HE2  GLN  53          1HE2      GLN  53   0.420  -1.997   4.176
  384   2HE2  GLN  53          2HE2      GLN  53   1.058  -2.686   5.632
  385    H    GLU  54           H        GLU  54  -4.341  -3.931   2.159
  386    HA   GLU  54           HA       GLU  54  -5.281  -1.460   1.856
  387   1HB   GLU  54          1HB       GLU  54  -7.365  -2.417   1.391
  388   2HB   GLU  54          2HB       GLU  54  -6.259  -3.781   1.155
  389   1HG   GLU  54          1HG       GLU  54  -7.637  -4.889   2.578
  390   2HG   GLU  54          2HG       GLU  54  -6.844  -3.962   3.860
  391    H    ALA  55           H        ALA  55  -4.983  -3.222   4.872
  392    HA   ALA  55           HA       ALA  55  -6.921  -2.237   6.467
  393   1HB   ALA  55          1HB       ALA  55  -5.081  -3.812   7.093
  394   2HB   ALA  55          2HB       ALA  55  -3.965  -2.427   7.170
  395   3HB   ALA  55          3HB       ALA  55  -5.338  -2.527   8.298
  396    H    GLU  56           H        GLU  56  -3.682  -0.618   6.080
  397    HA   GLU  56           HA       GLU  56  -5.119   1.889   6.488
  398   1HB   GLU  56          1HB       GLU  56  -2.654   0.801   7.748
  399   2HB   GLU  56          2HB       GLU  56  -2.586   2.515   7.298
  400   1HG   GLU  56          1HG       GLU  56  -4.317   3.094   8.759
  401   2HG   GLU  56          2HG       GLU  56  -5.012   1.465   8.768
  402    H    CYS  57           H        CYS  57  -4.215   0.221   4.029
  403    HA   CYS  57           HA       CYS  57  -2.338   2.117   2.867
  404   1HB   CYS  57          1HB       CYS  57  -1.702  -0.154   2.590
  405   2HB   CYS  57          2HB       CYS  57  -3.299  -0.607   1.990
  406    H    THR  58           H        THR  58  -4.919   0.214   1.225
  407    HA   THR  58           HA       THR  58  -5.696   2.099  -0.555
  408    HB   THR  58           HB       THR  58  -6.393  -0.385  -0.262
  409    HG1  THR  58           HG1      THR  58  -8.694   0.449  -1.058
  410   1HG2  THR  58          1HG2      THR  58  -8.443  -0.839   0.917
  411   2HG2  THR  58          2HG2      THR  58  -7.451   0.079   2.076
  412   3HG2  THR  58          3HG2      THR  58  -8.758   0.893   1.183
  413    H    PHE  59           H        PHE  59  -6.334   2.087   2.908
  414    HA   PHE  59           HA       PHE  59  -8.522   3.443   3.343
  415   1HB   PHE  59          1HB       PHE  59  -6.466   2.950   4.852
  416   2HB   PHE  59          2HB       PHE  59  -5.768   4.460   4.254
  417    HD1  PHE  59           HD1      PHE  59  -8.360   2.964   6.364
  418    HD2  PHE  59           HD2      PHE  59  -6.656   6.595   4.978
  419    HE1  PHE  59           HE1      PHE  59  -9.574   4.221   8.166
  420    HE2  PHE  59           HE2      PHE  59  -7.870   7.851   6.779
  421    HZ   PHE  59           HZ       PHE  59  -9.315   6.650   8.352
  422   1H    GLU   1           H1       GLU   1 -23.287   0.027  -0.265
  423    HA   GLU   1           HA       GLU   1 -20.662  -0.850   0.663
  424   1HB   GLU   1          1HB       GLU   1 -22.041  -1.263  -2.008
  425   2HB   GLU   1          2HB       GLU   1 -20.293  -1.481  -1.808
  426   1HG   GLU   1          1HG       GLU   1 -20.670  -3.562  -1.039
  427   2HG   GLU   1          2HG       GLU   1 -21.567  -2.893   0.334
  428    H    GLU   2           H        GLU   2 -20.289   1.431   1.285
  429    HA   GLU   2           HA       GLU   2 -20.307   3.326  -0.863
  430   1HB   GLU   2          1HB       GLU   2 -19.600   3.483   2.082
  431   2HB   GLU   2          2HB       GLU   2 -19.391   4.864   0.990
  432   1HG   GLU   2          1HG       GLU   2 -22.034   3.575   0.755
  433   2HG   GLU   2          2HG       GLU   2 -21.724   4.206   2.377
  434    H    TYR   3           H        TYR   3 -18.664   1.467  -1.806
  435    HA   TYR   3           HA       TYR   3 -15.950   1.994  -0.920
  436   1HB   TYR   3          1HB       TYR   3 -17.511   0.131  -2.740
  437   2HB   TYR   3          2HB       TYR   3 -15.786   0.316  -3.073
  438    HD1  TYR   3           HD1      TYR   3 -14.268  -1.069  -1.967
  439    HD2  TYR   3           HD2      TYR   3 -18.150  -0.473  -0.271
  440    HE1  TYR   3           HE1      TYR   3 -13.762  -2.804  -0.180
  441    HE2  TYR   3           HE2      TYR   3 -17.630  -2.210   1.511
  442    HH   TYR   3           HH       TYR   3 -14.483  -3.352   2.050
  443    H    VAL   4           H        VAL   4 -16.223   4.365  -1.598
  444    HA   VAL   4           HA       VAL   4 -15.673   4.578  -4.478
  445    HB   VAL   4           HB       VAL   4 -17.633   5.719  -4.307
  446   1HG1  VAL   4          1HG1      VAL   4 -17.928   5.301  -1.884
  447   2HG1  VAL   4          2HG1      VAL   4 -16.882   6.697  -1.530
  448   3HG1  VAL   4          3HG1      VAL   4 -18.440   6.938  -2.359
  449   1HG2  VAL   4          1HG2      VAL   4 -17.126   7.888  -4.767
  450   2HG2  VAL   4          2HG2      VAL   4 -16.158   8.094  -3.288
  451   3HG2  VAL   4          3HG2      VAL   4 -15.460   7.265  -4.700
  452    H    GLY   5           H        GLY   5 -15.066   6.050  -1.215
  453   1HA   GLY   5          1HA       GLY   5 -12.767   7.490  -2.093
  454   2HA   GLY   5          2HA       GLY   5 -13.299   7.225  -0.444
  455    H    LEU   6           H        LEU   6 -13.209   4.205  -1.989
  456    HA   LEU   6           HA       LEU   6 -10.397   3.794  -1.273
  457   1HB   LEU   6          1HB       LEU   6 -11.655   1.431  -0.619
  458   2HB   LEU   6          2HB       LEU   6 -11.003   2.639   0.501
  459    HG   LEU   6           HG       LEU   6 -13.848   2.688  -0.525
  460   1HD1  LEU   6          1HD1      LEU   6 -12.650   0.846   1.353
  461   2HD1  LEU   6          2HD1      LEU   6 -13.879   1.856   2.151
  462   3HD1  LEU   6          3HD1      LEU   6 -14.309   0.903   0.711
  463   1HD2  LEU   6          1HD2      LEU   6 -12.264   4.267   1.439
  464   2HD2  LEU   6          2HD2      LEU   6 -13.569   4.770   0.339
  465   3HD2  LEU   6          3HD2      LEU   6 -13.959   3.909   1.847
  466    H    SER   7           H        SER   7 -12.580   3.959  -3.695
  467    HA   SER   7           HA       SER   7 -11.551   1.562  -4.993
  468   1HB   SER   7          1HB       SER   7 -13.460   1.691  -6.487
  469   2HB   SER   7          2HB       SER   7 -14.045   1.779  -4.816
  470    HG   SER   7           HG       SER   7 -13.656   4.295  -5.464
  471    H    ALA   8           H        ALA   8 -11.575   2.028  -7.609
  472    HA   ALA   8           HA       ALA   8  -9.480   3.829  -8.031
  473   1HB   ALA   8          1HB       ALA   8 -11.433   2.503  -9.954
  474   2HB   ALA   8          2HB       ALA   8  -9.929   3.325 -10.435
  475   3HB   ALA   8          3HB       ALA   8  -9.859   1.860  -9.425
  476    H    ASN   9           H        ASN   9 -10.174   5.851  -7.076
  477    HA   ASN   9           HA       ASN   9 -11.131   7.635  -8.906
  478   1HB   ASN   9          1HB       ASN   9 -13.288   6.183  -8.044
  479   2HB   ASN   9          2HB       ASN   9 -13.282   7.461  -6.820
  480   1HD2  ASN   9          1HD2      ASN   9 -12.892   9.709  -7.766
  481   2HD2  ASN   9          2HD2      ASN   9 -13.818  10.139  -9.166
  482    H    GLN  10           H        GLN  10 -10.835   6.538  -5.516
  483    HA   GLN  10           HA       GLN  10 -10.955   9.009  -4.284
  484   1HB   GLN  10          1HB       GLN  10 -11.070   6.761  -3.170
  485   2HB   GLN  10          2HB       GLN  10  -9.322   6.589  -3.405
  486   1HG   GLN  10          1HG       GLN  10  -9.730   9.150  -2.239
  487   2HG   GLN  10          2HG       GLN  10 -10.773   8.038  -1.339
  488   1HE2  GLN  10          1HE2      GLN  10  -9.238   5.698  -1.703
  489   2HE2  GLN  10          2HE2      GLN  10  -7.785   5.818  -0.767
  490    H    CYS  11           H        CYS  11  -8.387   7.376  -6.103
  491    HA   CYS  11           HA       CYS  11  -6.255   8.908  -5.101
  492   1HB   CYS  11          1HB       CYS  11  -5.798   6.833  -6.148
  493   2HB   CYS  11          2HB       CYS  11  -6.617   7.312  -7.638
  494    H    ALA  12           H        ALA  12  -9.025   9.790  -6.802
  495    HA   ALA  12           HA       ALA  12  -7.635  11.915  -8.272
  496   1HB   ALA  12          1HB       ALA  12  -9.567  12.012  -9.682
  497   2HB   ALA  12          2HB       ALA  12  -9.186  10.286  -9.477
  498   3HB   ALA  12          3HB       ALA  12 -10.523  11.017  -8.557
  499    H    VAL  13           H        VAL  13  -8.455  11.537  -5.249
  500    HA   VAL  13           HA       VAL  13 -10.511  13.179  -4.563
  501    HB   VAL  13           HB       VAL  13  -8.447  11.846  -3.307
  502   1HG1  VAL  13          1HG1      VAL  13  -7.440  13.450  -1.746
  503   2HG1  VAL  13          2HG1      VAL  13  -7.010  13.836  -3.430
  504   3HG1  VAL  13          3HG1      VAL  13  -8.254  14.791  -2.587
  505   1HG2  VAL  13          1HG2      VAL  13 -10.972  13.054  -2.657
  506   2HG2  VAL  13          2HG2      VAL  13 -10.151  11.680  -1.879
  507   3HG2  VAL  13          3HG2      VAL  13  -9.826  13.340  -1.326
  508    HA   PRO  14           HA       PRO  14  -9.330  17.234  -5.481
  509   1HB   PRO  14          1HB       PRO  14 -10.225  18.697  -3.356
  510   2HB   PRO  14          2HB       PRO  14 -11.282  18.123  -4.644
  511   1HG   PRO  14          1HG       PRO  14 -10.917  17.110  -1.897
  512   2HG   PRO  14          2HG       PRO  14 -12.301  16.846  -3.017
  513   1HD   PRO  14          1HD       PRO  14 -10.209  15.024  -2.310
  514   2HD   PRO  14          2HD       PRO  14 -11.456  14.771  -3.537
  515    H    ALA  15           H        ALA  15  -7.337  15.551  -4.082
  516    HA   ALA  15           HA       ALA  15  -5.398  15.774  -3.009
  517   1HB   ALA  15          1HB       ALA  15  -4.199  16.731  -4.653
  518   2HB   ALA  15          2HB       ALA  15  -5.591  17.719  -5.159
  519   3HB   ALA  15          3HB       ALA  15  -4.499  18.307  -3.881
  520    H    LYS  16           H        LYS  16  -7.071  16.092  -1.069
  521    HA   LYS  16           HA       LYS  16  -5.870  17.861   0.698
  522   1HB   LYS  16          1HB       LYS  16  -7.662  19.512   1.024
  523   2HB   LYS  16          2HB       LYS  16  -6.882  19.664  -0.561
  524   1HG   LYS  16          1HG       LYS  16  -8.757  18.925  -1.697
  525   2HG   LYS  16          2HG       LYS  16  -9.311  17.901  -0.361
  526   1HD   LYS  16          1HD       LYS  16  -9.268  20.882   0.035
  527   2HD   LYS  16          2HD       LYS  16 -10.546  20.203  -0.987
  528   1HE   LYS  16          1HE       LYS  16 -11.463  18.952   0.790
  529   2HE   LYS  16          2HE       LYS  16  -9.970  19.008   1.742
  530   1HZ   LYS  16          1HZ       LYS  16 -10.357  21.355   2.056
  531   2HZ   LYS  16          2HZ       LYS  16 -11.726  21.294   1.170
  532   3HZ   LYS  16          3HZ       LYS  16 -11.639  20.497   2.591
  533    H    ASP  17           H        ASP  17  -6.691  15.092   0.435
  534    HA   ASP  17           HA       ASP  17  -8.028  14.903   2.922
  535   1HB   ASP  17          1HB       ASP  17  -9.879  15.139   1.144
  536   2HB   ASP  17          2HB       ASP  17  -9.369  13.556   0.541
  537    H    ARG  18           H        ARG  18  -5.525  14.152   1.255
  538    HA   ARG  18           HA       ARG  18  -5.756  11.294   1.150
  539   1HB   ARG  18          1HB       ARG  18  -3.359  13.100   0.584
  540   2HB   ARG  18          2HB       ARG  18  -3.475  11.381   0.168
  541   1HG   ARG  18          1HG       ARG  18  -4.810  11.786  -1.644
  542   2HG   ARG  18          2HG       ARG  18  -5.697  13.095  -0.844
  543   1HD   ARG  18          1HD       ARG  18  -3.957  14.677  -1.318
  544   2HD   ARG  18          2HD       ARG  18  -2.811  13.408  -1.775
  545    HE   ARG  18           HE       ARG  18  -5.199  13.371  -3.433
  546   1HH1  ARG  18          1HH1      ARG  18  -2.107  14.990  -2.976
  547   2HH1  ARG  18          2HH1      ARG  18  -1.978  15.487  -4.631
  548   1HH2  ARG  18          1HH2      ARG  18  -5.029  14.027  -5.615
  549   2HH2  ARG  18          2HH2      ARG  18  -3.651  14.935  -6.142
  550    H    VAL  19           H        VAL  19  -3.548  10.131   2.018
  551    HA   VAL  19           HA       VAL  19  -3.326  10.999   4.803
  552    HB   VAL  19           HB       VAL  19  -2.499   8.353   3.622
  553   1HG1  VAL  19          1HG1      VAL  19  -3.492   8.087   6.246
  554   2HG1  VAL  19          2HG1      VAL  19  -1.798   7.986   5.709
  555   3HG1  VAL  19          3HG1      VAL  19  -2.466   9.541   6.259
  556   1HG2  VAL  19          1HG2      VAL  19  -4.752   7.536   4.494
  557   2HG2  VAL  19          2HG2      VAL  19  -5.241   9.246   4.540
  558   3HG2  VAL  19          3HG2      VAL  19  -4.779   8.495   2.994
  559    H    ASP  20           H        ASP  20  -1.905  12.111   2.300
  560    HA   ASP  20           HA       ASP  20   0.157  12.418   1.537
  561   1HB   ASP  20          1HB       ASP  20   0.218  14.236   2.961
  562   2HB   ASP  20          2HB       ASP  20  -0.007  13.249   4.413
  563    H    CYS  21           H        CYS  21   0.907  10.240   0.988
  564    HA   CYS  21           HA       CYS  21   1.769   8.326   2.704
  565   1HB   CYS  21          1HB       CYS  21   1.499   8.231   0.190
  566   2HB   CYS  21          2HB       CYS  21   3.126   8.909   0.072
  567    H    GLY  22           H        GLY  22   3.402  11.305   1.566
  568   1HA   GLY  22          1HA       GLY  22   5.271  12.350   2.244
  569   2HA   GLY  22          2HA       GLY  22   5.101  11.500   3.767
  570    H    TYR  23           H        TYR  23   5.684  10.222   0.420
  571    HA   TYR  23           HA       TYR  23   7.788   8.548   1.451
  572   1HB   TYR  23          1HB       TYR  23   5.863   8.502  -0.574
  573   2HB   TYR  23          2HB       TYR  23   7.304   8.948  -1.493
  574    HD1  TYR  23           HD1      TYR  23   6.860   6.612   1.408
  575    HD2  TYR  23           HD2      TYR  23   7.942   7.063  -2.706
  576    HE1  TYR  23           HE1      TYR  23   7.542   4.165   1.312
  577    HE2  TYR  23           HE2      TYR  23   8.621   4.615  -2.789
  578    HH   TYR  23           HH       TYR  23   7.842   2.442  -0.239
  579    HA   PRO  24           HA       PRO  24  10.978  11.304   0.403
  580   1HB   PRO  24          1HB       PRO  24  13.104   9.638   0.814
  581   2HB   PRO  24          2HB       PRO  24  12.306  10.522   2.113
  582   1HG   PRO  24          1HG       PRO  24  12.118   7.677   1.361
  583   2HG   PRO  24          2HG       PRO  24  11.702   8.452   2.932
  584   1HD   PRO  24          1HD       PRO  24   9.931   7.511   0.887
  585   2HD   PRO  24          2HD       PRO  24   9.481   8.412   2.341
  586    H    HIS  25           H        HIS  25  10.024   8.679  -1.367
  587    HA   HIS  25           HA       HIS  25  11.854   9.509  -3.500
  588   1HB   HIS  25          1HB       HIS  25  11.414   6.909  -2.339
  589   2HB   HIS  25          2HB       HIS  25  10.951   6.889  -4.045
  590    HD1  HIS  25           HD1      HIS  25  13.007   8.370  -5.521
  591    HD2  HIS  25           HD2      HIS  25  13.999   6.147  -2.106
  592    HE1  HIS  25           HE1      HIS  25  15.507   7.889  -5.685
  593    HE2  HIS  25           HE2      HIS  25  16.069   6.567  -3.532
  594    H    VAL  26           H        VAL  26   9.116  10.483  -2.632
  595    HA   VAL  26           HA       VAL  26   7.043   9.537  -4.072
  596    HB   VAL  26           HB       VAL  26   6.569  11.283  -2.661
  597   1HG1  VAL  26          1HG1      VAL  26   8.257  12.594  -2.007
  598   2HG1  VAL  26          2HG1      VAL  26   9.160  12.290  -3.511
  599   3HG1  VAL  26          3HG1      VAL  26   7.947  13.592  -3.449
  600   1HG2  VAL  26          1HG2      VAL  26   6.613  13.108  -5.005
  601   2HG2  VAL  26          2HG2      VAL  26   5.777  11.552  -5.232
  602   3HG2  VAL  26          3HG2      VAL  26   5.273  12.652  -3.925
  603    H    THR  27           H        THR  27   6.719   9.048  -6.175
  604    HA   THR  27           HA       THR  27   7.507  10.850  -8.235
  605    HB   THR  27           HB       THR  27   9.365   8.739  -7.390
  606    HG1  THR  27           HG1      THR  27   9.312  10.669  -9.598
  607   1HG2  THR  27          1HG2      THR  27   7.879   7.951  -9.635
  608   2HG2  THR  27          2HG2      THR  27   9.263   8.815 -10.346
  609   3HG2  THR  27          3HG2      THR  27   9.539   7.427  -9.266
  610    HA   PRO  28           HA       PRO  28   4.235   8.773 -10.078
  611   1HB   PRO  28          1HB       PRO  28   4.514   9.579 -12.673
  612   2HB   PRO  28          2HB       PRO  28   3.766  10.577 -11.429
  613   1HG   PRO  28          1HG       PRO  28   6.449  10.751 -12.640
  614   2HG   PRO  28          2HG       PRO  28   5.534  12.023 -11.754
  615   1HD   PRO  28          1HD       PRO  28   7.745  10.454 -10.833
  616   2HD   PRO  28          2HD       PRO  28   6.776  11.578  -9.871
  617    H    LYS  29           H        LYS  29   6.133   6.986  -9.451
  618    HA   LYS  29           HA       LYS  29   5.622   4.978 -11.302
  619   1HB   LYS  29          1HB       LYS  29   7.071   6.219 -12.805
  620   2HB   LYS  29          2HB       LYS  29   8.375   6.213 -11.606
  621   1HG   LYS  29          1HG       LYS  29   8.984   4.101 -12.147
  622   2HG   LYS  29          2HG       LYS  29   7.311   3.516 -12.122
  623   1HD   LYS  29          1HD       LYS  29   6.959   4.075 -14.383
  624   2HD   LYS  29          2HD       LYS  29   8.302   5.229 -14.420
  625   1HE   LYS  29          1HE       LYS  29   9.903   3.554 -14.661
  626   2HE   LYS  29          2HE       LYS  29   8.912   2.328 -13.853
  627   1HZ   LYS  29          1HZ       LYS  29   9.201   2.647 -16.514
  628   2HZ   LYS  29          2HZ       LYS  29   8.031   1.770 -15.786
  629   3HZ   LYS  29          3HZ       LYS  29   7.734   3.311 -16.236
  630    H    GLU  30           H        GLU  30   7.390   6.437  -8.635
  631    HA   GLU  30           HA       GLU  30   8.271   3.837  -7.743
  632   1HB   GLU  30          1HB       GLU  30   9.130   6.569  -7.376
  633   2HB   GLU  30          2HB       GLU  30   8.845   5.836  -5.786
  634   1HG   GLU  30          1HG       GLU  30  10.227   4.000  -7.602
  635   2HG   GLU  30          2HG       GLU  30  11.123   5.516  -7.418
  636    H    CYS  31           H        CYS  31   6.077   6.541  -6.787
  637    HA   CYS  31           HA       CYS  31   5.269   5.432  -4.368
  638   1HB   CYS  31          1HB       CYS  31   4.148   7.470  -6.243
  639   2HB   CYS  31          2HB       CYS  31   3.144   6.881  -4.915
  640    H    ASN  32           H        ASN  32   3.666   5.455  -7.643
  641    HA   ASN  32           HA       ASN  32   1.617   3.765  -6.927
  642   1HB   ASN  32          1HB       ASN  32   2.890   4.704  -9.463
  643   2HB   ASN  32          2HB       ASN  32   1.934   3.222  -9.609
  644   1HD2  ASN  32          1HD2      ASN  32   1.757   6.338  -7.881
  645   2HD2  ASN  32          2HD2      ASN  32   0.116   6.719  -8.284
  646    H    ASN  33           H        ASN  33   4.951   3.163  -7.054
  647    HA   ASN  33           HA       ASN  33   4.580   0.402  -7.876
  648   1HB   ASN  33          1HB       ASN  33   6.404   1.466  -9.050
  649   2HB   ASN  33          2HB       ASN  33   7.049   2.174  -7.561
  650   1HD2  ASN  33          1HD2      ASN  33   8.789   1.235  -6.845
  651   2HD2  ASN  33          2HD2      ASN  33   9.219  -0.438  -6.978
  652    H    ARG  34           H        ARG  34   5.272   2.599  -5.195
  653    HA   ARG  34           HA       ARG  34   6.275   0.475  -3.548
  654   1HB   ARG  34          1HB       ARG  34   7.008   2.137  -2.112
  655   2HB   ARG  34          2HB       ARG  34   6.903   3.099  -3.596
  656   1HG   ARG  34          1HG       ARG  34   5.702   4.458  -2.166
  657   2HG   ARG  34          2HG       ARG  34   4.376   3.441  -2.755
  658   1HD   ARG  34          1HD       ARG  34   5.408   1.974  -0.620
  659   2HD   ARG  34          2HD       ARG  34   5.555   3.644  -0.051
  660    HE   ARG  34           HE       ARG  34   2.967   3.265  -1.227
  661   1HH1  ARG  34          1HH1      ARG  34   4.811   2.338   1.623
  662   2HH1  ARG  34          2HH1      ARG  34   3.410   2.153   2.626
  663   1HH2  ARG  34          1HH2      ARG  34   1.120   3.020   0.094
  664   2HH2  ARG  34          2HH2      ARG  34   1.296   2.543   1.750
  665    H    GLY  35           H        GLY  35   3.297   2.264  -4.221
  666   1HA   GLY  35          1HA       GLY  35   1.300   0.932  -3.562
  667   2HA   GLY  35          2HA       GLY  35   1.975   0.911  -1.945
  668    H    CYS  36           H        CYS  36   2.537   3.799  -3.878
  669    HA   CYS  36           HA       CYS  36   0.427   5.141  -2.348
  670   1HB   CYS  36          1HB       CYS  36   3.187   6.129  -3.064
  671   2HB   CYS  36          2HB       CYS  36   1.901   7.169  -2.443
  672    H    CYS  37           H        CYS  37  -0.187   7.321  -3.521
  673    HA   CYS  37           HA       CYS  37  -0.207   6.776  -6.401
  674   1HB   CYS  37          1HB       CYS  37  -2.388   6.619  -5.016
  675   2HB   CYS  37          2HB       CYS  37  -2.327   8.384  -5.006
  676    H    PHE  38           H        PHE  38   0.702   8.378  -7.674
  677    HA   PHE  38           HA       PHE  38   1.682  10.727  -6.288
  678   1HB   PHE  38          1HB       PHE  38   3.024   9.205  -7.870
  679   2HB   PHE  38          2HB       PHE  38   1.977   9.744  -9.189
  680    HD1  PHE  38           HD1      PHE  38   4.414  10.946  -6.657
  681    HD2  PHE  38           HD2      PHE  38   2.472  11.717 -10.351
  682    HE1  PHE  38           HE1      PHE  38   5.944  12.895  -7.055
  683    HE2  PHE  38           HE2      PHE  38   4.002  13.666 -10.749
  684    HZ   PHE  38           HZ       PHE  38   5.720  14.232  -9.097
  685    H    ASP  39           H        ASP  39   0.687  12.684  -6.377
  686    HA   ASP  39           HA       ASP  39  -1.579  12.923  -8.105
  687   1HB   ASP  39          1HB       ASP  39  -2.007  13.859  -6.010
  688   2HB   ASP  39          2HB       ASP  39  -0.367  14.505  -5.841
  689    H    SER  40           H        SER  40   0.744  15.547  -7.231
  690    HA   SER  40           HA       SER  40   2.246  16.609  -8.483
  691   1HB   SER  40          1HB       SER  40   2.099  14.508 -10.080
  692   2HB   SER  40          2HB       SER  40   1.141  15.593 -11.104
  693    HG   SER  40           HG       SER  40   2.902  16.923 -11.392
  694    H    ARG  41           H        ARG  41  -1.191  16.361  -9.017
  695    HA   ARG  41           HA       ARG  41  -1.564  18.503 -10.709
  696   1HB   ARG  41          1HB       ARG  41  -3.415  17.600  -8.458
  697   2HB   ARG  41          2HB       ARG  41  -3.900  18.457  -9.931
  698   1HG   ARG  41          1HG       ARG  41  -2.536  16.244 -10.913
  699   2HG   ARG  41          2HG       ARG  41  -3.365  15.582  -9.494
  700   1HD   ARG  41          1HD       ARG  41  -5.069  15.335 -11.020
  701   2HD   ARG  41          2HD       ARG  41  -5.411  17.012 -10.567
  702    HE   ARG  41           HE       ARG  41  -3.534  17.160 -12.644
  703   1HH1  ARG  41          1HH1      ARG  41  -6.765  15.827 -12.240
  704   2HH1  ARG  41          2HH1      ARG  41  -7.200  16.041 -13.903
  705   1HH2  ARG  41          1HH2      ARG  41  -4.107  17.442 -14.838
  706   2HH2  ARG  41          2HH2      ARG  41  -5.677  16.965 -15.391
  707    H    ILE  42           H        ILE  42  -1.513  18.273  -7.089
  708    HA   ILE  42           HA       ILE  42  -1.292  21.203  -7.033
  709    HB   ILE  42           HB       ILE  42  -2.258  19.596  -4.703
  710   1HG1  ILE  42          1HG1      ILE  42  -3.818  20.273  -7.183
  711   2HG1  ILE  42          2HG1      ILE  42  -3.744  18.740  -6.296
  712   1HG2  ILE  42          1HG2      ILE  42  -1.682  21.968  -4.412
  713   2HG2  ILE  42          2HG2      ILE  42  -2.868  22.404  -5.666
  714   3HG2  ILE  42          3HG2      ILE  42  -3.414  21.659  -4.145
  715   1HD1  ILE  42          1HD1      ILE  42  -4.761  20.181  -4.318
  716   2HD1  ILE  42          2HD1      ILE  42  -5.248  21.276  -5.633
  717   3HD1  ILE  42          3HD1      ILE  42  -5.822  19.592  -5.619
  718    HA   PRO  43           HA       PRO  43   2.674  20.099  -5.538
  719   1HB   PRO  43          1HB       PRO  43   3.790  22.583  -5.753
  720   2HB   PRO  43          2HB       PRO  43   3.754  21.425  -7.080
  721   1HG   PRO  43          1HG       PRO  43   2.105  23.827  -6.614
  722   2HG   PRO  43          2HG       PRO  43   2.397  22.947  -8.158
  723   1HD   PRO  43          1HD       PRO  43   0.058  22.915  -6.507
  724   2HD   PRO  43          2HD       PRO  43   0.359  21.910  -7.929
  725    H    GLY  44           H        GLY  44   0.290  21.941  -4.175
  726   1HA   GLY  44          1HA       GLY  44   1.892  22.593  -1.808
  727   2HA   GLY  44          2HA       GLY  44   0.278  23.161  -2.185
  728    H    VAL  45           H        VAL  45   0.282  19.908  -3.013
  729    HA   VAL  45           HA       VAL  45  -0.567  19.131  -0.308
  730    HB   VAL  45           HB       VAL  45  -2.446  18.122  -1.117
  731   1HG1  VAL  45          1HG1      VAL  45  -2.830  20.447  -1.452
  732   2HG1  VAL  45          2HG1      VAL  45  -1.909  20.456  -2.975
  733   3HG1  VAL  45          3HG1      VAL  45  -3.478  19.620  -2.888
  734   1HG2  VAL  45          1HG2      VAL  45  -1.267  18.046  -3.915
  735   2HG2  VAL  45          2HG2      VAL  45  -1.253  16.693  -2.757
  736   3HG2  VAL  45          3HG2      VAL  45  -2.800  17.313  -3.383
  737    HA   PRO  46           HA       PRO  46   1.830  15.549  -0.807
  738   1HB   PRO  46          1HB       PRO  46   0.239  13.392  -0.281
  739   2HB   PRO  46          2HB       PRO  46   0.905  14.429   0.978
  740   1HG   PRO  46          1HG       PRO  46  -1.827  14.305  -0.130
  741   2HG   PRO  46          2HG       PRO  46  -1.282  14.995   1.442
  742   1HD   PRO  46          1HD       PRO  46  -2.042  16.382  -0.945
  743   2HD   PRO  46          2HD       PRO  46  -1.363  17.100   0.522
  744    H    TRP  47           H        TRP  47   2.876  14.947  -2.586
  745    HA   TRP  47           HA       TRP  47   1.185  14.193  -4.828
  746   1HB   TRP  47          1HB       TRP  47   4.081  14.195  -5.214
  747   2HB   TRP  47          2HB       TRP  47   2.802  14.966  -6.153
  748    HD1  TRP  47           HD1      TRP  47   1.951  17.450  -5.120
  749    HE1  TRP  47           HE1      TRP  47   3.255  19.375  -3.874
  750    HE3  TRP  47           HE3      TRP  47   5.897  14.574  -3.704
  751    HZ2  TRP  47           HZ2      TRP  47   5.737  19.477  -2.467
  752    HZ3  TRP  47           HZ3      TRP  47   7.719  15.665  -2.397
  753    HH2  TRP  47           HH2      TRP  47   7.682  18.029  -1.778
  754    H    CYS  48           H        CYS  48   1.470  12.500  -2.367
  755    HA   CYS  48           HA       CYS  48   1.900  10.056  -3.685
  756   1HB   CYS  48          1HB       CYS  48   4.261  10.746  -3.385
  757   2HB   CYS  48          2HB       CYS  48   4.010  10.765  -1.637
  758    H    PHE  49           H        PHE  49   0.001   9.250  -2.805
  759    HA   PHE  49           HA       PHE  49  -0.091   9.118   0.113
  760   1HB   PHE  49          1HB       PHE  49  -2.731   9.411  -0.570
  761   2HB   PHE  49          2HB       PHE  49  -1.714  10.796  -0.156
  762    HD1  PHE  49           HD1      PHE  49  -0.327  11.712  -2.273
  763    HD2  PHE  49           HD2      PHE  49  -3.987   9.574  -2.475
  764    HE1  PHE  49           HE1      PHE  49  -0.780  12.701  -4.535
  765    HE2  PHE  49           HE2      PHE  49  -4.440  10.562  -4.736
  766    HZ   PHE  49           HZ       PHE  49  -2.832  12.114  -5.740
  767    H    LYS  50           H        LYS  50  -2.533   7.786   0.388
  768    HA   LYS  50           HA       LYS  50  -2.151   5.407  -1.290
  769   1HB   LYS  50          1HB       LYS  50  -2.744   4.063   0.724
  770   2HB   LYS  50          2HB       LYS  50  -1.173   4.882   0.824
  771   1HG   LYS  50          1HG       LYS  50  -3.099   6.704   1.844
  772   2HG   LYS  50          2HG       LYS  50  -3.497   5.131   2.557
  773   1HD   LYS  50          1HD       LYS  50  -1.861   6.507   3.898
  774   2HD   LYS  50          2HD       LYS  50  -1.246   4.904   3.452
  775   1HE   LYS  50          1HE       LYS  50  -0.568   6.682   1.323
  776   2HE   LYS  50          2HE       LYS  50  -0.158   7.522   2.827
  777   1HZ   LYS  50          1HZ       LYS  50   1.121   5.340   1.614
  778   2HZ   LYS  50          2HZ       LYS  50   1.616   6.245   2.881
  779   3HZ   LYS  50          3HZ       LYS  50   0.673   4.937   3.132
  780    HA   PRO  51           HA       PRO  51  -6.417   6.923  -1.516
  781   1HB   PRO  51          1HB       PRO  51  -6.571   7.190  -4.230
  782   2HB   PRO  51          2HB       PRO  51  -6.187   8.530  -3.149
  783   1HG   PRO  51          1HG       PRO  51  -4.422   6.933  -4.892
  784   2HG   PRO  51          2HG       PRO  51  -4.127   8.562  -4.184
  785   1HD   PRO  51          1HD       PRO  51  -3.028   6.044  -3.376
  786   2HD   PRO  51          2HD       PRO  51  -2.833   7.595  -2.549
  787    H    LEU  52           H        LEU  52  -6.169   5.520  -4.633
  788    HA   LEU  52           HA       LEU  52  -7.727   3.277  -3.612
  789   1HB   LEU  52          1HB       LEU  52  -8.686   3.118  -5.647
  790   2HB   LEU  52          2HB       LEU  52  -8.346   4.857  -5.594
  791    HG   LEU  52           HG       LEU  52  -6.080   3.661  -6.762
  792   1HD1  LEU  52          1HD1      LEU  52  -7.648   2.700  -8.791
  793   2HD1  LEU  52          2HD1      LEU  52  -6.808   1.706  -7.576
  794   3HD1  LEU  52          3HD1      LEU  52  -8.521   2.131  -7.348
  795   1HD2  LEU  52          1HD2      LEU  52  -6.361   5.404  -8.108
  796   2HD2  LEU  52          2HD2      LEU  52  -7.898   4.754  -8.726
  797   3HD2  LEU  52          3HD2      LEU  52  -7.882   5.753  -7.252
  798    H    GLN  53           H        GLN  53  -4.981   3.329  -2.865
  799    HA   GLN  53           HA       GLN  53  -3.275   2.081  -4.574
  800   1HB   GLN  53          1HB       GLN  53  -3.537   1.804  -1.557
  801   2HB   GLN  53          2HB       GLN  53  -2.126   1.257  -2.479
  802   1HG   GLN  53          1HG       GLN  53  -3.194   4.107  -2.319
  803   2HG   GLN  53          2HG       GLN  53  -1.736   3.505  -1.517
  804   1HE2  GLN  53          1HE2      GLN  53  -0.868   1.811  -3.632
  805   2HE2  GLN  53          2HE2      GLN  53  -0.281   2.797  -4.930
  806    H    GLU  54           H        GLU  54  -6.193   0.855  -3.170
  807    HA   GLU  54           HA       GLU  54  -5.776  -1.720  -2.671
  808   1HB   GLU  54          1HB       GLU  54  -8.074  -2.143  -3.445
  809   2HB   GLU  54          2HB       GLU  54  -7.981  -0.606  -2.566
  810   1HG   GLU  54          1HG       GLU  54  -8.312   0.659  -4.484
  811   2HG   GLU  54          2HG       GLU  54  -7.601  -0.559  -5.553
  812    H    ALA  55           H        ALA  55  -5.387  -0.109  -5.773
  813    HA   ALA  55           HA       ALA  55  -5.783  -1.947  -7.658
  814   1HB   ALA  55          1HB       ALA  55  -3.209  -0.956  -8.230
  815   2HB   ALA  55          2HB       ALA  55  -4.766  -0.245  -8.721
  816   3HB   ALA  55          3HB       ALA  55  -3.975   0.293  -7.220
  817    H    GLU  56           H        GLU  56  -2.360  -1.702  -6.588
  818    HA   GLU  56           HA       GLU  56  -2.364  -4.617  -6.513
  819   1HB   GLU  56          1HB       GLU  56  -0.691  -2.708  -7.883
  820   2HB   GLU  56          2HB       GLU  56   0.308  -3.635  -6.751
  821   1HG   GLU  56          1HG       GLU  56  -0.467  -5.735  -7.718
  822   2HG   GLU  56          2HG       GLU  56  -1.629  -4.886  -8.751
  823    H    CYS  57           H        CYS  57  -2.913  -2.434  -4.364
  824    HA   CYS  57           HA       CYS  57  -0.680  -2.961  -2.582
  825   1HB   CYS  57          1HB       CYS  57  -1.695  -0.659  -2.938
  826   2HB   CYS  57          2HB       CYS  57  -3.087  -1.232  -2.013
  827    H    THR  58           H        THR  58  -4.313  -2.845  -2.287
  828    HA   THR  58           HA       THR  58  -4.600  -4.364  -0.059
  829    HB   THR  58           HB       THR  58  -6.363  -3.123  -1.444
  830    HG1  THR  58           HG1      THR  58  -6.765  -5.954  -0.769
  831   1HG2  THR  58          1HG2      THR  58  -7.137  -5.623  -2.814
  832   2HG2  THR  58          2HG2      THR  58  -7.115  -3.959  -3.444
  833   3HG2  THR  58          3HG2      THR  58  -5.629  -4.939  -3.465
  834    H    PHE  59           H        PHE  59  -3.511  -5.443  -3.220
  835    HA   PHE  59           HA       PHE  59  -4.089  -8.195  -2.695
  836   1HB   PHE  59          1HB       PHE  59  -2.702  -6.445  -4.736
  837   2HB   PHE  59          2HB       PHE  59  -2.242  -8.151  -4.727
  838    HD1  PHE  59           HD1      PHE  59  -3.934  -9.873  -5.253
  839    HD2  PHE  59           HD2      PHE  59  -4.818  -5.735  -5.560
  840    HE1  PHE  59           HE1      PHE  59  -5.949 -10.408  -6.650
  841    HE2  PHE  59           HE2      PHE  59  -6.834  -6.270  -6.957
  842    HZ   PHE  59           HZ       PHE  59  -7.375  -8.599  -7.486
  Start of MODEL   46
    1   1H    GLU   1           H1       GLU   1 -12.683 -14.302  -4.778
    2    HA   GLU   1           HA       GLU   1 -13.581 -12.247  -6.445
    3   1HB   GLU   1          1HB       GLU   1 -15.255 -14.746  -6.275
    4   2HB   GLU   1          2HB       GLU   1 -16.065 -13.172  -6.383
    5   1HG   GLU   1          1HG       GLU   1 -14.777 -12.671  -8.448
    6   2HG   GLU   1          2HG       GLU   1 -13.981 -14.249  -8.342
    7    H    GLU   2           H        GLU   2 -14.167 -14.437  -3.660
    8    HA   GLU   2           HA       GLU   2 -15.725 -12.535  -2.274
    9   1HB   GLU   2          1HB       GLU   2 -15.519 -15.169  -2.047
   10   2HB   GLU   2          2HB       GLU   2 -14.266 -14.764  -0.861
   11   1HG   GLU   2          1HG       GLU   2 -15.796 -14.057   0.660
   12   2HG   GLU   2          2HG       GLU   2 -16.725 -13.156  -0.548
   13    H    TYR   3           H        TYR   3 -14.288 -10.627  -2.497
   14    HA   TYR   3           HA       TYR   3 -11.793 -10.191  -1.893
   15   1HB   TYR   3          1HB       TYR   3 -14.076  -8.793  -0.388
   16   2HB   TYR   3          2HB       TYR   3 -12.581  -8.037  -0.950
   17    HD1  TYR   3           HD1      TYR   3 -12.218  -8.124  -3.578
   18    HD2  TYR   3           HD2      TYR   3 -16.008  -8.528  -1.634
   19    HE1  TYR   3           HE1      TYR   3 -13.400  -7.435  -5.722
   20    HE2  TYR   3           HE2      TYR   3 -17.177  -7.838  -3.784
   21    HH   TYR   3           HH       TYR   3 -16.123  -6.256  -5.977
   22    H    VAL   4           H        VAL   4 -10.890 -11.907  -0.581
   23    HA   VAL   4           HA       VAL   4 -11.243 -11.351   2.273
   24    HB   VAL   4           HB       VAL   4 -11.079 -13.779   2.701
   25   1HG1  VAL   4          1HG1      VAL   4 -13.344 -12.335   1.600
   26   2HG1  VAL   4          2HG1      VAL   4 -13.469 -14.077   1.258
   27   3HG1  VAL   4          3HG1      VAL   4 -13.285 -13.510   2.935
   28   1HG2  VAL   4          1HG2      VAL   4 -11.108 -13.891  -0.307
   29   2HG2  VAL   4          2HG2      VAL   4 -10.080 -14.769   0.850
   30   3HG2  VAL   4          3HG2      VAL   4 -11.786 -15.231   0.648
   31    H    GLY   5           H        GLY   5  -9.281 -12.829  -0.376
   32   1HA   GLY   5          1HA       GLY   5  -6.906 -13.021   1.190
   33   2HA   GLY   5          2HA       GLY   5  -7.057 -13.182  -0.549
   34    H    LEU   6           H        LEU   6  -8.584 -10.289   0.390
   35    HA   LEU   6           HA       LEU   6  -6.124  -8.789  -0.189
   36   1HB   LEU   6          1HB       LEU   6  -7.689  -7.053  -1.073
   37   2HB   LEU   6          2HB       LEU   6  -7.542  -8.537  -2.031
   38    HG   LEU   6           HG       LEU   6  -9.697  -9.276  -1.392
   39   1HD1  LEU   6          1HD1      LEU   6 -11.074  -7.812   0.244
   40   2HD1  LEU   6          2HD1      LEU   6  -9.876  -8.954   0.898
   41   3HD1  LEU   6          3HD1      LEU   6  -9.488  -7.220   0.793
   42   1HD2  LEU   6          1HD2      LEU   6 -10.321  -7.874  -3.025
   43   2HD2  LEU   6          2HD2      LEU   6 -11.003  -6.898  -1.702
   44   3HD2  LEU   6          3HD2      LEU   6  -9.393  -6.511  -2.354
   45    H    SER   7           H        SER   7  -8.491  -9.598   2.149
   46    HA   SER   7           HA       SER   7  -7.962  -7.101   3.554
   47   1HB   SER   7          1HB       SER   7 -10.280  -9.004   3.502
   48   2HB   SER   7          2HB       SER   7  -9.961  -8.140   5.017
   49    HG   SER   7           HG       SER   7 -10.902  -6.440   4.140
   50    H    ALA   8           H        ALA   8  -8.388  -7.767   6.179
   51    HA   ALA   8           HA       ALA   8  -6.069  -8.861   7.036
   52   1HB   ALA   8          1HB       ALA   8  -8.308  -9.545   8.796
   53   2HB   ALA   8          2HB       ALA   8  -6.977  -8.390   9.046
   54   3HB   ALA   8          3HB       ALA   8  -8.437  -7.887   8.159
   55    H    ASN   9           H        ASN   9  -5.379 -10.936   7.811
   56    HA   ASN   9           HA       ASN   9  -5.641 -13.145   8.174
   57   1HB   ASN   9          1HB       ASN   9  -8.191 -12.862   7.683
   58   2HB   ASN   9          2HB       ASN   9  -7.794 -13.321   6.018
   59   1HD2  ASN   9          1HD2      ASN   9  -6.252 -15.285   5.935
   60   2HD2  ASN   9          2HD2      ASN   9  -6.705 -16.654   6.896
   61    H    GLN  10           H        GLN  10  -5.984 -11.582   4.959
   62    HA   GLN  10           HA       GLN  10  -4.980 -13.599   3.393
   63   1HB   GLN  10          1HB       GLN  10  -5.178 -12.069   1.741
   64   2HB   GLN  10          2HB       GLN  10  -5.884 -11.025   2.987
   65   1HG   GLN  10          1HG       GLN  10  -3.641 -10.079   3.451
   66   2HG   GLN  10          2HG       GLN  10  -2.928 -11.129   2.219
   67   1HE2  GLN  10          1HE2      GLN  10  -2.808 -10.425   0.217
   68   2HE2  GLN  10          2HE2      GLN  10  -3.619  -9.047  -0.450
   69    H    CYS  11           H        CYS  11  -3.302 -11.044   5.299
   70    HA   CYS  11           HA       CYS  11  -0.760 -11.437   4.303
   71   1HB   CYS  11          1HB       CYS  11  -1.274  -9.544   5.654
   72   2HB   CYS  11          2HB       CYS  11  -1.707 -10.557   7.034
   73    H    ALA  12           H        ALA  12  -2.837 -13.603   5.939
   74    HA   ALA  12           HA       ALA  12  -0.741 -15.029   7.326
   75   1HB   ALA  12          1HB       ALA  12  -3.256 -14.669   8.003
   76   2HB   ALA  12          2HB       ALA  12  -3.555 -16.030   6.895
   77   3HB   ALA  12          3HB       ALA  12  -2.482 -16.244   8.300
   78    H    VAL  13           H        VAL  13  -1.172 -14.590   4.183
   79    HA   VAL  13           HA       VAL  13  -1.772 -16.757   2.807
   80    HB   VAL  13           HB       VAL  13  -0.883 -15.325   1.365
   81   1HG1  VAL  13          1HG1      VAL  13  -0.444 -13.515   2.740
   82   2HG1  VAL  13          2HG1      VAL  13   0.755 -14.403   3.711
   83   3HG1  VAL  13          3HG1      VAL  13   1.171 -13.850   2.072
   84   1HG2  VAL  13          1HG2      VAL  13   0.700 -17.386   1.358
   85   2HG2  VAL  13          2HG2      VAL  13   1.189 -15.921   0.473
   86   3HG2  VAL  13          3HG2      VAL  13   1.891 -16.272   2.070
   87    HA   PRO  14           HA       PRO  14   0.587 -20.096   4.212
   88   1HB   PRO  14          1HB       PRO  14   0.452 -21.766   2.056
   89   2HB   PRO  14          2HB       PRO  14  -0.846 -21.609   3.235
   90   1HG   PRO  14          1HG       PRO  14  -0.623 -20.516   0.505
   91   2HG   PRO  14          2HG       PRO  14  -2.105 -20.763   1.498
   92   1HD   PRO  14          1HD       PRO  14  -0.735 -18.315   0.925
   93   2HD   PRO  14          2HD       PRO  14  -2.093 -18.528   2.038
   94    H    ALA  15           H        ALA  15   2.049 -17.843   3.175
   95    HA   ALA  15           HA       ALA  15   4.084 -17.333   2.462
   96   1HB   ALA  15          1HB       ALA  15   4.946 -18.495   4.313
   97   2HB   ALA  15          2HB       ALA  15   4.474 -20.082   3.659
   98   3HB   ALA  15          3HB       ALA  15   5.845 -19.198   2.946
   99    H    LYS  16           H        LYS  16   2.739 -17.518   0.292
  100    HA   LYS  16           HA       LYS  16   4.356 -18.164  -1.727
  101   1HB   LYS  16          1HB       LYS  16   3.259 -20.419  -2.479
  102   2HB   LYS  16          2HB       LYS  16   4.648 -20.414  -1.380
  103   1HG   LYS  16          1HG       LYS  16   3.432 -21.363   0.267
  104   2HG   LYS  16          2HG       LYS  16   2.131 -20.174   0.094
  105   1HD   LYS  16          1HD       LYS  16   0.992 -22.091  -0.506
  106   2HD   LYS  16          2HD       LYS  16   1.598 -21.619  -2.103
  107   1HE   LYS  16          1HE       LYS  16   3.314 -23.250  -2.054
  108   2HE   LYS  16          2HE       LYS  16   3.221 -23.444  -0.296
  109   1HZ   LYS  16          1HZ       LYS  16   1.237 -24.311  -2.280
  110   2HZ   LYS  16          2HZ       LYS  16   2.172 -25.268  -1.342
  111   3HZ   LYS  16          3HZ       LYS  16   0.987 -24.367  -0.667
  112    H    ASP  17           H        ASP  17   2.415 -16.262  -1.039
  113    HA   ASP  17           HA       ASP  17   0.784 -16.475  -3.375
  114   1HB   ASP  17          1HB       ASP  17  -0.540 -17.546  -1.486
  115   2HB   ASP  17          2HB       ASP  17  -0.517 -15.981  -0.658
  116    H    ARG  18           H        ARG  18   2.936 -14.868  -1.584
  117    HA   ARG  18           HA       ARG  18   1.587 -12.327  -1.512
  118   1HB   ARG  18          1HB       ARG  18   4.470 -12.983  -0.761
  119   2HB   ARG  18          2HB       ARG  18   3.563 -11.533  -0.296
  120   1HG   ARG  18          1HG       ARG  18   2.518 -12.605   1.413
  121   2HG   ARG  18          2HG       ARG  18   2.233 -14.071   0.460
  122   1HD   ARG  18          1HD       ARG  18   4.549 -14.796   0.843
  123   2HD   ARG  18          2HD       ARG  18   4.916 -13.292   1.701
  124    HE   ARG  18           HE       ARG  18   2.658 -14.791   2.823
  125   1HH1  ARG  18          1HH1      ARG  18   6.150 -14.359   2.868
  126   2HH1  ARG  18          2HH1      ARG  18   6.340 -15.025   4.456
  127   1HH2  ARG  18          1HH2      ARG  18   2.908 -15.668   4.918
  128   2HH2  ARG  18          2HH2      ARG  18   4.483 -15.775   5.630
  129    H    VAL  19           H        VAL  19   3.269 -10.394  -2.212
  130    HA   VAL  19           HA       VAL  19   4.093 -11.106  -4.937
  131    HB   VAL  19           HB       VAL  19   3.558  -8.335  -3.892
  132   1HG1  VAL  19          1HG1      VAL  19   4.341  -9.480  -6.414
  133   2HG1  VAL  19          2HG1      VAL  19   2.755  -8.691  -6.586
  134   3HG1  VAL  19          3HG1      VAL  19   4.146  -7.769  -5.966
  135   1HG2  VAL  19          1HG2      VAL  19   1.543  -9.548  -3.371
  136   2HG2  VAL  19          2HG2      VAL  19   1.247  -8.567  -4.826
  137   3HG2  VAL  19          3HG2      VAL  19   1.533 -10.318  -4.977
  138    H    ASP  20           H        ASP  20   5.517 -11.322  -2.158
  139    HA   ASP  20           HA       ASP  20   7.427 -10.769  -1.228
  140   1HB   ASP  20          1HB       ASP  20   8.456 -12.278  -2.653
  141   2HB   ASP  20          2HB       ASP  20   8.002 -11.385  -4.112
  142    H    CYS  21           H        CYS  21   6.999  -8.527  -0.595
  143    HA   CYS  21           HA       CYS  21   7.020  -6.332  -2.163
  144   1HB   CYS  21          1HB       CYS  21   6.689  -6.678   0.409
  145   2HB   CYS  21          2HB       CYS  21   8.390  -6.207   0.499
  146    H    GLY  22           H        GLY  22   9.791  -8.221  -0.865
  147   1HA   GLY  22          1HA       GLY  22  12.017  -8.062  -1.201
  148   2HA   GLY  22          2HA       GLY  22  11.563  -7.768  -2.868
  149    H    TYR  23           H        TYR  23  11.411  -5.868   0.237
  150    HA   TYR  23           HA       TYR  23  12.246  -3.511  -1.245
  151   1HB   TYR  23          1HB       TYR  23  10.908  -4.324   1.311
  152   2HB   TYR  23          2HB       TYR  23  11.966  -2.921   1.491
  153    HD1  TYR  23           HD1      TYR  23   9.724  -3.945  -1.336
  154    HD2  TYR  23           HD2      TYR  23  10.568  -1.068   1.715
  155    HE1  TYR  23           HE1      TYR  23   7.873  -2.447  -2.227
  156    HE2  TYR  23           HE2      TYR  23   8.714   0.421   0.814
  157    HH   TYR  23           HH       TYR  23   6.361  -0.419  -0.810
  158    HA   PRO  24           HA       PRO  24  16.325  -3.703   0.194
  159   1HB   PRO  24          1HB       PRO  24  17.078  -1.093  -0.095
  160   2HB   PRO  24          2HB       PRO  24  17.040  -2.240  -1.433
  161   1HG   PRO  24          1HG       PRO  24  15.160  -0.075  -0.737
  162   2HG   PRO  24          2HG       PRO  24  15.384  -0.901  -2.321
  163   1HD   PRO  24          1HD       PRO  24  13.274  -1.244  -0.415
  164   2HD   PRO  24          2HD       PRO  24  13.535  -2.195  -1.883
  165    H    HIS  25           H        HIS  25  13.886  -2.285   1.879
  166    HA   HIS  25           HA       HIS  25  15.715  -1.907   4.137
  167   1HB   HIS  25          1HB       HIS  25  13.693  -0.103   2.995
  168   2HB   HIS  25          2HB       HIS  25  13.573  -0.309   4.747
  169    HD1  HIS  25           HD1      HIS  25  15.280   1.649   2.225
  170    HD2  HIS  25           HD2      HIS  25  16.239   0.219   6.050
  171    HE1  HIS  25           HE1      HIS  25  17.249   3.054   3.041
  172    HE2  HIS  25           HE2      HIS  25  17.758   2.165   5.418
  173    H    VAL  26           H        VAL  26  13.838  -4.133   2.912
  174    HA   VAL  26           HA       VAL  26  11.644  -4.578   4.424
  175    HB   VAL  26           HB       VAL  26  12.151  -6.033   2.661
  176   1HG1  VAL  26          1HG1      VAL  26  14.474  -7.449   3.750
  177   2HG1  VAL  26          2HG1      VAL  26  14.192  -6.791   2.120
  178   3HG1  VAL  26          3HG1      VAL  26  14.801  -5.732   3.415
  179   1HG2  VAL  26          1HG2      VAL  26  11.461  -7.978   3.589
  180   2HG2  VAL  26          2HG2      VAL  26  12.801  -8.022   4.759
  181   3HG2  VAL  26          3HG2      VAL  26  11.375  -7.006   5.076
  182    H    THR  27           H        THR  27  11.183  -4.851   6.551
  183    HA   THR  27           HA       THR  27  12.942  -6.207   8.310
  184    HB   THR  27           HB       THR  27  13.421  -3.378   7.879
  185    HG1  THR  27           HG1      THR  27  15.234  -4.465   8.537
  186   1HG2  THR  27          1HG2      THR  27  13.318  -3.713  10.791
  187   2HG2  THR  27          2HG2      THR  27  12.724  -2.358   9.803
  188   3HG2  THR  27          3HG2      THR  27  11.682  -3.773  10.091
  189    HA   PRO  28           HA       PRO  28   9.220  -6.542  10.414
  190   1HB   PRO  28          1HB       PRO  28  10.052  -7.242  12.921
  191   2HB   PRO  28          2HB       PRO  28   9.957  -8.385  11.582
  192   1HG   PRO  28          1HG       PRO  28  12.304  -7.060  12.782
  193   2HG   PRO  28          2HG       PRO  28  12.249  -8.550  11.774
  194   1HD   PRO  28          1HD       PRO  28  13.087  -5.919  11.019
  195   2HD   PRO  28          2HD       PRO  28  12.902  -7.313   9.949
  196    H    LYS  29           H        LYS  29   9.625  -3.955   9.961
  197    HA   LYS  29           HA       LYS  29   8.130  -2.755  11.923
  198   1HB   LYS  29          1HB       LYS  29  10.436  -3.256  13.132
  199   2HB   LYS  29          2HB       LYS  29  10.908  -1.740  12.344
  200   1HG   LYS  29          1HG       LYS  29   9.712  -0.536  13.826
  201   2HG   LYS  29          2HG       LYS  29   8.252  -1.491  13.521
  202   1HD   LYS  29          1HD       LYS  29  10.087  -3.102  15.037
  203   2HD   LYS  29          2HD       LYS  29   9.972  -1.522  15.830
  204   1HE   LYS  29          1HE       LYS  29   8.069  -2.310  16.772
  205   2HE   LYS  29          2HE       LYS  29   7.316  -2.110  15.182
  206   1HZ   LYS  29          1HZ       LYS  29   6.956  -4.296  15.658
  207   2HZ   LYS  29          2HZ       LYS  29   8.334  -4.417  14.791
  208   3HZ   LYS  29          3HZ       LYS  29   8.382  -4.517  16.419
  209    H    GLU  30           H        GLU  30  10.332  -2.781   9.226
  210    HA   GLU  30           HA       GLU  30   9.688  -0.026   8.617
  211   1HB   GLU  30          1HB       GLU  30  11.900  -1.819   8.052
  212   2HB   GLU  30          2HB       GLU  30  11.278  -1.131   6.542
  213   1HG   GLU  30          1HG       GLU  30  12.593   0.648   7.062
  214   2HG   GLU  30          2HG       GLU  30  11.309   1.083   8.200
  215    H    CYS  31           H        CYS  31   9.360  -3.381   7.323
  216    HA   CYS  31           HA       CYS  31   8.159  -2.754   4.931
  217   1HB   CYS  31          1HB       CYS  31   7.960  -5.134   6.753
  218   2HB   CYS  31          2HB       CYS  31   7.045  -5.057   5.245
  219    H    ASN  32           H        ASN  32   6.676  -3.506   8.169
  220    HA   ASN  32           HA       ASN  32   4.074  -3.043   7.312
  221   1HB   ASN  32          1HB       ASN  32   5.512  -3.437   9.883
  222   2HB   ASN  32          2HB       ASN  32   4.026  -2.488  10.040
  223   1HD2  ASN  32          1HD2      ASN  32   5.134  -5.269   8.100
  224   2HD2  ASN  32          2HD2      ASN  32   3.808  -6.325   8.454
  225    H    ASN  33           H        ASN  33   6.660  -0.921   7.503
  226    HA   ASN  33           HA       ASN  33   5.030   1.288   8.449
  227   1HB   ASN  33          1HB       ASN  33   7.396   0.828   9.374
  228   2HB   ASN  33          2HB       ASN  33   8.017   1.331   7.795
  229   1HD2  ASN  33          1HD2      ASN  33   9.025   2.809   9.545
  230   2HD2  ASN  33          2HD2      ASN  33   8.252   4.340   9.786
  231    H    ARG  34           H        ARG  34   6.724  -0.163   5.682
  232    HA   ARG  34           HA       ARG  34   6.530   2.220   4.123
  233   1HB   ARG  34          1HB       ARG  34   7.165  -0.559   3.070
  234   2HB   ARG  34          2HB       ARG  34   7.722   0.999   2.433
  235   1HG   ARG  34          1HG       ARG  34   8.628   0.979   5.085
  236   2HG   ARG  34          2HG       ARG  34   8.874  -0.692   4.547
  237   1HD   ARG  34          1HD       ARG  34  10.732  -0.015   3.461
  238   2HD   ARG  34          2HD       ARG  34   9.728   0.983   2.398
  239    HE   ARG  34           HE       ARG  34  10.315   2.205   5.003
  240   1HH1  ARG  34          1HH1      ARG  34  11.402   1.801   1.681
  241   2HH1  ARG  34          2HH1      ARG  34  12.374   3.235   1.690
  242   1HH2  ARG  34          1HH2      ARG  34  11.596   4.096   5.016
  243   2HH2  ARG  34          2HH2      ARG  34  12.485   4.549   3.600
  244    H    GLY  35           H        GLY  35   4.695  -0.729   4.761
  245   1HA   GLY  35          1HA       GLY  35   2.307  -0.478   4.188
  246   2HA   GLY  35          2HA       GLY  35   2.824  -0.025   2.576
  247    H    CYS  36           H        CYS  36   4.615  -2.489   4.408
  248    HA   CYS  36           HA       CYS  36   3.432  -4.509   2.642
  249   1HB   CYS  36          1HB       CYS  36   6.284  -4.267   3.601
  250   2HB   CYS  36          2HB       CYS  36   5.630  -5.674   2.759
  251    H    CYS  37           H        CYS  37   4.078  -6.837   3.727
  252    HA   CYS  37           HA       CYS  37   3.451  -6.568   6.578
  253   1HB   CYS  37          1HB       CYS  37   1.602  -7.404   5.013
  254   2HB   CYS  37          2HB       CYS  37   2.553  -8.887   4.882
  255    H    PHE  38           H        PHE  38   5.022  -7.459   7.880
  256    HA   PHE  38           HA       PHE  38   7.065  -9.062   6.574
  257   1HB   PHE  38          1HB       PHE  38   7.434  -7.005   8.111
  258   2HB   PHE  38          2HB       PHE  38   6.828  -7.990   9.446
  259    HD1  PHE  38           HD1      PHE  38   9.610  -7.410   7.147
  260    HD2  PHE  38           HD2      PHE  38   8.174  -9.805  10.342
  261    HE1  PHE  38           HE1      PHE  38  11.929  -8.293   7.527
  262    HE2  PHE  38           HE2      PHE  38  10.493 -10.688  10.722
  263    HZ   PHE  38           HZ       PHE  38  12.342  -9.921   9.311
  264    H    ASP  39           H        ASP  39   7.003 -11.252   6.664
  265    HA   ASP  39           HA       ASP  39   5.178 -12.466   8.496
  266   1HB   ASP  39          1HB       ASP  39   5.348 -13.315   6.209
  267   2HB   ASP  39          2HB       ASP  39   7.085 -13.600   6.399
  268    H    SER  40           H        SER  40   8.505 -13.550   7.522
  269    HA   SER  40           HA       SER  40  10.341 -13.815   8.722
  270   1HB   SER  40          1HB       SER  40   9.139 -12.062  10.374
  271   2HB   SER  40          2HB       SER  40   9.065 -13.492  11.418
  272    HG   SER  40           HG       SER  40  11.017 -12.476  11.874
  273    H    ARG  41           H        ARG  41   7.269 -15.304   9.165
  274    HA   ARG  41           HA       ARG  41   7.976 -17.323  10.937
  275   1HB   ARG  41          1HB       ARG  41   5.925 -17.479   8.683
  276   2HB   ARG  41          2HB       ARG  41   5.915 -18.422  10.184
  277   1HG   ARG  41          1HG       ARG  41   5.753 -16.198  11.429
  278   2HG   ARG  41          2HG       ARG  41   5.477 -15.422   9.859
  279   1HD   ARG  41          1HD       ARG  41   3.762 -17.521  11.244
  280   2HD   ARG  41          2HD       ARG  41   3.302 -15.863  10.828
  281    HE   ARG  41           HE       ARG  41   3.068 -16.520   8.543
  282   1HH1  ARG  41          1HH1      ARG  41   4.174 -19.180  10.563
  283   2HH1  ARG  41          2HH1      ARG  41   3.825 -20.395   9.377
  284   1HH2  ARG  41          1HH2      ARG  41   2.607 -18.120   6.979
  285   2HH2  ARG  41          2HH2      ARG  41   2.928 -19.787   7.324
  286    H    ILE  42           H        ILE  42   8.086 -17.017   7.343
  287    HA   ILE  42           HA       ILE  42   9.663 -19.495   7.300
  288    HB   ILE  42           HB       ILE  42   8.012 -18.601   4.969
  289   1HG1  ILE  42          1HG1      ILE  42   7.029 -20.072   7.411
  290   2HG1  ILE  42          2HG1      ILE  42   6.345 -18.625   6.650
  291   1HG2  ILE  42          1HG2      ILE  42   9.845 -20.455   5.001
  292   2HG2  ILE  42          2HG2      ILE  42   8.586 -21.428   5.800
  293   3HG2  ILE  42          3HG2      ILE  42   8.294 -20.752   4.178
  294   1HD1  ILE  42          1HD1      ILE  42   5.933 -21.469   6.013
  295   2HD1  ILE  42          2HD1      ILE  42   4.948 -20.055   5.568
  296   3HD1  ILE  42          3HD1      ILE  42   6.359 -20.504   4.580
  297    HA   PRO  43           HA       PRO  43  12.522 -16.520   5.800
  298   1HB   PRO  43          1HB       PRO  43  14.761 -18.042   6.165
  299   2HB   PRO  43          2HB       PRO  43  14.081 -17.008   7.422
  300   1HG   PRO  43          1HG       PRO  43  13.944 -19.937   7.097
  301   2HG   PRO  43          2HG       PRO  43  13.683 -18.960   8.585
  302   1HD   PRO  43          1HD       PRO  43  11.729 -20.237   6.927
  303   2HD   PRO  43          2HD       PRO  43  11.411 -19.154   8.289
  304    H    GLY  44           H        GLY  44  11.399 -19.307   4.499
  305   1HA   GLY  44          1HA       GLY  44  13.255 -19.295   2.240
  306   2HA   GLY  44          2HA       GLY  44  11.990 -20.460   2.575
  307    H    VAL  45           H        VAL  45  10.419 -17.653   3.226
  308    HA   VAL  45           HA       VAL  45   9.681 -17.236   0.412
  309    HB   VAL  45           HB       VAL  45   7.448 -17.256   0.929
  310   1HG1  VAL  45          1HG1      VAL  45   7.808 -19.127   3.138
  311   2HG1  VAL  45          2HG1      VAL  45   7.214 -19.411   1.484
  312   3HG1  VAL  45          3HG1      VAL  45   8.963 -19.422   1.817
  313   1HG2  VAL  45          1HG2      VAL  45   7.660 -15.595   2.793
  314   2HG2  VAL  45          2HG2      VAL  45   6.451 -16.867   3.087
  315   3HG2  VAL  45          3HG2      VAL  45   8.038 -16.944   3.890
  316    HA   PRO  46           HA       PRO  46   9.926 -12.972   1.201
  317   1HB   PRO  46          1HB       PRO  46   7.548 -11.825   0.501
  318   2HB   PRO  46          2HB       PRO  46   8.758 -12.331  -0.676
  319   1HG   PRO  46          1HG       PRO  46   6.216 -13.611   0.101
  320   2HG   PRO  46          2HG       PRO  46   7.184 -13.854  -1.398
  321   1HD   PRO  46          1HD       PRO  46   6.959 -15.583   0.874
  322   2HD   PRO  46          2HD       PRO  46   8.047 -15.788  -0.504
  323    H    TRP  47           H        TRP  47  10.376 -12.103   3.115
  324    HA   TRP  47           HA       TRP  47   8.284 -12.360   5.123
  325   1HB   TRP  47          1HB       TRP  47  10.715 -11.063   5.993
  326   2HB   TRP  47          2HB       TRP  47   9.929 -12.525   6.594
  327    HD1  TRP  47           HD1      TRP  47  10.813 -14.888   5.524
  328    HE1  TRP  47           HE1      TRP  47  13.021 -15.636   4.289
  329    HE3  TRP  47           HE3      TRP  47  12.406 -10.189   4.411
  330    HZ2  TRP  47           HZ2      TRP  47  15.140 -14.211   3.013
  331    HZ3  TRP  47           HZ3      TRP  47  14.555  -9.956   3.168
  332    HH2  TRP  47           HH2      TRP  47  15.907 -11.871   2.473
  333    H    CYS  48           H        CYS  48   8.022 -10.560   2.743
  334    HA   CYS  48           HA       CYS  48   7.143  -8.281   4.129
  335   1HB   CYS  48          1HB       CYS  48   9.542  -7.763   4.155
  336   2HB   CYS  48          2HB       CYS  48   9.585  -7.857   2.392
  337    H    PHE  49           H        PHE  49   5.215  -8.189   3.016
  338    HA   PHE  49           HA       PHE  49   5.374  -7.919   0.129
  339   1HB   PHE  49          1HB       PHE  49   3.173  -9.525   0.376
  340   2HB   PHE  49          2HB       PHE  49   4.782 -10.195   0.089
  341    HD1  PHE  49           HD1      PHE  49   6.159 -10.709   2.271
  342    HD2  PHE  49           HD2      PHE  49   1.936 -10.310   2.147
  343    HE1  PHE  49           HE1      PHE  49   5.972 -12.028   4.399
  344    HE2  PHE  49           HE2      PHE  49   1.749 -11.629   4.276
  345    HZ   PHE  49           HZ       PHE  49   3.770 -12.472   5.376
  346    H    LYS  50           H        LYS  50   2.637  -7.910  -0.446
  347    HA   LYS  50           HA       LYS  50   1.620  -5.838   1.370
  348   1HB   LYS  50          1HB       LYS  50   0.557  -5.252  -1.116
  349   2HB   LYS  50          2HB       LYS  50   1.864  -4.379  -0.296
  350   1HG   LYS  50          1HG       LYS  50   2.516  -6.862  -1.875
  351   2HG   LYS  50          2HG       LYS  50   2.191  -5.358  -2.757
  352   1HD   LYS  50          1HD       LYS  50   4.323  -5.851  -0.640
  353   2HD   LYS  50          2HD       LYS  50   4.590  -5.514  -2.359
  354   1HE   LYS  50          1HE       LYS  50   3.686  -3.655  -0.152
  355   2HE   LYS  50          2HE       LYS  50   4.986  -3.421  -1.331
  356   1HZ   LYS  50          1HZ       LYS  50   3.387  -2.157  -2.243
  357   2HZ   LYS  50          2HZ       LYS  50   2.933  -3.566  -2.932
  358   3HZ   LYS  50          3HZ       LYS  50   2.143  -3.009  -1.616
  359    HA   PRO  51           HA       PRO  51  -1.344  -9.237   0.959
  360   1HB   PRO  51          1HB       PRO  51  -1.651  -9.775   3.620
  361   2HB   PRO  51          2HB       PRO  51  -0.536 -10.659   2.580
  362   1HG   PRO  51          1HG       PRO  51  -0.001  -8.559   4.582
  363   2HG   PRO  51          2HG       PRO  51   1.139  -9.771   3.892
  364   1HD   PRO  51          1HD       PRO  51   0.931  -6.979   3.291
  365   2HD   PRO  51          2HD       PRO  51   1.960  -8.161   2.471
  366    H    LEU  52           H        LEU  52  -2.255  -8.270   4.093
  367    HA   LEU  52           HA       LEU  52  -4.571  -6.975   2.913
  368   1HB   LEU  52          1HB       LEU  52  -5.675  -7.408   4.855
  369   2HB   LEU  52          2HB       LEU  52  -4.576  -8.795   4.741
  370    HG   LEU  52           HG       LEU  52  -3.249  -6.773   6.234
  371   1HD1  LEU  52          1HD1      LEU  52  -4.939  -5.588   7.110
  372   2HD1  LEU  52          2HD1      LEU  52  -6.159  -6.811   6.682
  373   3HD1  LEU  52          3HD1      LEU  52  -5.175  -7.011   8.152
  374   1HD2  LEU  52          1HD2      LEU  52  -3.997  -8.666   8.065
  375   2HD2  LEU  52          2HD2      LEU  52  -4.129  -9.560   6.531
  376   3HD2  LEU  52          3HD2      LEU  52  -2.594  -8.780   6.976
  377    H    GLN  53           H        GLN  53  -1.989  -5.661   2.639
  378    HA   GLN  53           HA       GLN  53  -1.456  -3.822   4.568
  379   1HB   GLN  53          1HB       GLN  53  -1.256  -3.565   1.544
  380   2HB   GLN  53          2HB       GLN  53  -0.488  -2.444   2.682
  381   1HG   GLN  53          1HG       GLN  53   0.013  -5.446   2.485
  382   2HG   GLN  53          2HG       GLN  53   1.109  -4.180   1.910
  383   1HE2  GLN  53          1HE2      GLN  53   0.859  -2.336   3.954
  384   2HE2  GLN  53          2HE2      GLN  53   1.542  -2.963   5.418
  385    H    GLU  54           H        GLU  54  -4.268  -4.090   2.551
  386    HA   GLU  54           HA       GLU  54  -5.074  -1.619   2.029
  387   1HB   GLU  54          1HB       GLU  54  -7.223  -2.466   1.894
  388   2HB   GLU  54          2HB       GLU  54  -6.290  -3.973   1.894
  389   1HG   GLU  54          1HG       GLU  54  -6.636  -4.151   4.358
  390   2HG   GLU  54          2HG       GLU  54  -7.606  -2.671   4.325
  391    H    ALA  55           H        ALA  55  -4.586  -3.013   5.230
  392    HA   ALA  55           HA       ALA  55  -6.162  -1.677   6.904
  393   1HB   ALA  55          1HB       ALA  55  -3.213  -2.316   6.980
  394   2HB   ALA  55          2HB       ALA  55  -3.975  -1.456   8.339
  395   3HB   ALA  55          3HB       ALA  55  -4.554  -3.074   7.871
  396    H    GLU  56           H        GLU  56  -2.921  -0.245   6.112
  397    HA   GLU  56           HA       GLU  56  -4.295   2.321   5.955
  398   1HB   GLU  56          1HB       GLU  56  -2.177   1.451   7.791
  399   2HB   GLU  56          2HB       GLU  56  -1.738   2.926   6.912
  400   1HG   GLU  56          1HG       GLU  56  -4.509   2.765   8.047
  401   2HG   GLU  56          2HG       GLU  56  -3.182   2.959   9.203
  402    H    CYS  57           H        CYS  57  -3.349   0.302   3.903
  403    HA   CYS  57           HA       CYS  57  -1.232   1.878   2.652
  404   1HB   CYS  57          1HB       CYS  57  -1.050  -0.659   3.081
  405   2HB   CYS  57          2HB       CYS  57  -2.148  -0.824   1.708
  406    H    THR  58           H        THR  58  -4.352   0.131   1.981
  407    HA   THR  58           HA       THR  58  -4.700   1.579  -0.491
  408    HB   THR  58           HB       THR  58  -5.347  -0.907   0.167
  409    HG1  THR  58           HG1      THR  58  -7.372  -0.393  -1.253
  410   1HG2  THR  58          1HG2      THR  58  -7.724   0.749   1.159
  411   2HG2  THR  58          2HG2      THR  58  -7.835  -0.973   0.725
  412   3HG2  THR  58          3HG2      THR  58  -6.810  -0.463   2.089
  413    H    PHE  59           H        PHE  59  -5.943   1.689   2.864
  414    HA   PHE  59           HA       PHE  59  -8.125   3.144   2.762
  415   1HB   PHE  59          1HB       PHE  59  -6.338   2.547   4.661
  416   2HB   PHE  59          2HB       PHE  59  -5.736   4.181   4.361
  417    HD1  PHE  59           HD1      PHE  59  -7.439   6.099   4.582
  418    HD2  PHE  59           HD2      PHE  59  -8.110   2.200   6.116
  419    HE1  PHE  59           HE1      PHE  59  -9.183   7.012   6.139
  420    HE2  PHE  59           HE2      PHE  59  -9.854   3.113   7.675
  421    HZ   PHE  59           HZ       PHE  59 -10.369   5.508   7.668
  422   1H    GLU   1           H1       GLU   1 -19.471  -4.456   0.493
  423    HA   GLU   1           HA       GLU   1 -16.773  -3.807   1.283
  424   1HB   GLU   1          1HB       GLU   1 -17.602  -6.311  -0.097
  425   2HB   GLU   1          2HB       GLU   1 -16.185  -5.491  -0.781
  426   1HG   GLU   1          1HG       GLU   1 -14.883  -6.096   0.969
  427   2HG   GLU   1          2HG       GLU   1 -16.099  -5.612   2.159
  428    H    GLU   2           H        GLU   2 -18.298  -1.835   0.475
  429    HA   GLU   2           HA       GLU   2 -18.389  -1.714  -2.387
  430   1HB   GLU   2          1HB       GLU   2 -19.192   0.215  -0.183
  431   2HB   GLU   2          2HB       GLU   2 -19.337   0.616  -1.902
  432   1HG   GLU   2          1HG       GLU   2 -21.363  -0.378  -1.838
  433   2HG   GLU   2          2HG       GLU   2 -20.520  -1.927  -1.682
  434    H    TYR   3           H        TYR   3 -15.973  -1.980  -2.592
  435    HA   TYR   3           HA       TYR   3 -14.310   0.137  -1.637
  436   1HB   TYR   3          1HB       TYR   3 -14.215  -2.343  -3.383
  437   2HB   TYR   3          2HB       TYR   3 -12.888  -1.192  -3.572
  438    HD1  TYR   3           HD1      TYR   3 -12.053  -0.334  -1.052
  439    HD2  TYR   3           HD2      TYR   3 -13.708  -4.150  -2.055
  440    HE1  TYR   3           HE1      TYR   3 -10.897  -1.372   0.960
  441    HE2  TYR   3           HE2      TYR   3 -12.546  -5.176  -0.039
  442    HH   TYR   3           HH       TYR   3 -11.658  -4.542   2.039
  443    H    VAL   4           H        VAL   4 -15.408   2.044  -2.507
  444    HA   VAL   4           HA       VAL   4 -14.809   2.381  -5.364
  445    HB   VAL   4           HB       VAL   4 -17.158   3.494  -3.818
  446   1HG1  VAL   4          1HG1      VAL   4 -15.943   4.627  -5.989
  447   2HG1  VAL   4          2HG1      VAL   4 -17.156   3.584  -6.772
  448   3HG1  VAL   4          3HG1      VAL   4 -17.667   4.806  -5.583
  449   1HG2  VAL   4          1HG2      VAL   4 -18.515   2.025  -5.320
  450   2HG2  VAL   4          2HG2      VAL   4 -17.002   1.271  -5.878
  451   3HG2  VAL   4          3HG2      VAL   4 -17.490   1.130  -4.171
  452    H    GLY   5           H        GLY   5 -15.522   4.141  -2.263
  453   1HA   GLY   5          1HA       GLY   5 -14.119   6.484  -3.080
  454   2HA   GLY   5          2HA       GLY   5 -14.720   6.101  -1.479
  455    H    LEU   6           H        LEU   6 -12.858   3.483  -2.655
  456    HA   LEU   6           HA       LEU   6 -10.337   4.592  -1.735
  457   1HB   LEU   6          1HB       LEU   6 -10.531   2.086  -0.490
  458   2HB   LEU   6          2HB       LEU   6 -10.390   3.684   0.264
  459    HG   LEU   6           HG       LEU   6 -12.258   2.258   1.116
  460   1HD1  LEU   6          1HD1      LEU   6 -13.831   4.457   0.079
  461   2HD1  LEU   6          2HD1      LEU   6 -13.248   4.148   1.732
  462   3HD1  LEU   6          3HD1      LEU   6 -12.207   5.000   0.565
  463   1HD2  LEU   6          1HD2      LEU   6 -13.901   1.411  -0.161
  464   2HD2  LEU   6          2HD2      LEU   6 -13.982   2.852  -1.204
  465   3HD2  LEU   6          3HD2      LEU   6 -12.729   1.620  -1.484
  466    H    SER   7           H        SER   7 -11.879   3.419  -4.206
  467    HA   SER   7           HA       SER   7  -9.827   1.432  -4.807
  468   1HB   SER   7          1HB       SER   7 -11.394   0.344  -6.301
  469   2HB   SER   7          2HB       SER   7 -12.177   0.537  -4.722
  470    HG   SER   7           HG       SER   7 -13.301   1.179  -6.913
  471    H    ALA   8           H        ALA   8 -10.645   1.398  -7.683
  472    HA   ALA   8           HA       ALA   8  -8.896   3.244  -8.699
  473   1HB   ALA   8          1HB       ALA   8 -11.269   2.491 -10.354
  474   2HB   ALA   8          2HB       ALA   8  -9.532   2.381 -10.729
  475   3HB   ALA   8          3HB       ALA   8 -10.295   1.159  -9.684
  476    H    ASN   9           H        ASN   9  -9.062   5.338  -9.586
  477    HA   ASN   9           HA       ASN   9 -10.164   7.183 -10.243
  478   1HB   ASN   9          1HB       ASN   9 -12.399   5.834  -9.948
  479   2HB   ASN   9          2HB       ASN   9 -12.487   6.608  -8.359
  480   1HD2  ASN   9          1HD2      ASN   9 -11.888   9.053  -8.507
  481   2HD2  ASN   9          2HD2      ASN   9 -12.742   9.961  -9.710
  482    H    GLN  10           H        GLN  10 -10.052   5.832  -6.957
  483    HA   GLN  10           HA       GLN  10 -10.348   8.166  -5.514
  484   1HB   GLN  10          1HB       GLN  10 -10.126   5.574  -4.866
  485   2HB   GLN  10          2HB       GLN  10  -8.457   6.058  -4.515
  486   1HG   GLN  10          1HG       GLN  10 -10.528   7.917  -3.490
  487   2HG   GLN  10          2HG       GLN  10 -10.590   6.303  -2.768
  488   1HE2  GLN  10          1HE2      GLN  10  -9.089   5.687  -1.341
  489   2HE2  GLN  10          2HE2      GLN  10  -7.754   6.650  -0.801
  490    H    CYS  11           H        CYS  11  -7.590   6.799  -7.294
  491    HA   CYS  11           HA       CYS  11  -5.596   8.329  -6.067
  492   1HB   CYS  11          1HB       CYS  11  -5.862   6.721  -8.542
  493   2HB   CYS  11          2HB       CYS  11  -4.555   7.909  -8.503
  494    H    ALA  12           H        ALA  12  -8.297   9.184  -7.976
  495    HA   ALA  12           HA       ALA  12  -6.961  11.645  -8.879
  496   1HB   ALA  12          1HB       ALA  12  -7.936   9.998 -10.602
  497   2HB   ALA  12          2HB       ALA  12  -9.535  10.483  -9.986
  498   3HB   ALA  12          3HB       ALA  12  -8.459  11.696 -10.721
  499    H    VAL  13           H        VAL  13  -8.090  10.920  -6.161
  500    HA   VAL  13           HA       VAL  13 -10.560  11.853  -5.637
  501    HB   VAL  13           HB       VAL  13  -8.270  11.225  -4.220
  502   1HG1  VAL  13          1HG1      VAL  13  -7.539  13.553  -4.181
  503   2HG1  VAL  13          2HG1      VAL  13  -9.111  14.059  -3.518
  504   3HG1  VAL  13          3HG1      VAL  13  -8.026  13.033  -2.549
  505   1HG2  VAL  13          1HG2      VAL  13  -9.924  10.458  -2.939
  506   2HG2  VAL  13          2HG2      VAL  13 -10.222  12.114  -2.358
  507   3HG2  VAL  13          3HG2      VAL  13 -11.095  11.500  -3.782
  508    HA   PRO  14           HA       PRO  14 -10.682  16.104  -6.409
  509   1HB   PRO  14          1HB       PRO  14 -12.076  17.158  -4.310
  510   2HB   PRO  14          2HB       PRO  14 -12.846  16.315  -5.652
  511   1HG   PRO  14          1HG       PRO  14 -12.292  15.396  -2.904
  512   2HG   PRO  14          2HG       PRO  14 -13.477  14.739  -4.090
  513   1HD   PRO  14          1HD       PRO  14 -10.948  13.647  -3.310
  514   2HD   PRO  14          2HD       PRO  14 -12.003  13.049  -4.597
  515    H    ALA  15           H        ALA  15  -8.329  15.084  -4.911
  516    HA   ALA  15           HA       ALA  15  -6.606  15.876  -3.744
  517   1HB   ALA  15          1HB       ALA  15  -6.581  17.101  -5.989
  518   2HB   ALA  15          2HB       ALA  15  -7.240  18.508  -5.120
  519   3HB   ALA  15          3HB       ALA  15  -5.645  17.854  -4.675
  520    H    LYS  16           H        LYS  16  -8.183  15.608  -1.809
  521    HA   LYS  16           HA       LYS  16  -7.708  17.457   0.070
  522   1HB   LYS  16          1HB       LYS  16 -10.019  18.629   0.174
  523   2HB   LYS  16          2HB       LYS  16  -8.761  19.276  -0.893
  524   1HG   LYS  16          1HG       LYS  16 -10.131  19.018  -2.657
  525   2HG   LYS  16          2HG       LYS  16 -10.223  17.273  -2.355
  526   1HD   LYS  16          1HD       LYS  16 -11.905  19.275  -0.811
  527   2HD   LYS  16          2HD       LYS  16 -12.447  18.612  -2.362
  528   1HE   LYS  16          1HE       LYS  16 -11.676  16.335  -0.996
  529   2HE   LYS  16          2HE       LYS  16 -12.306  17.339   0.319
  530   1HZ   LYS  16          1HZ       LYS  16 -14.359  17.195  -0.508
  531   2HZ   LYS  16          2HZ       LYS  16 -13.894  17.269  -2.071
  532   3HZ   LYS  16          3HZ       LYS  16 -13.808  15.854  -1.261
  533    H    ASP  17           H        ASP  17  -7.934  14.672  -0.221
  534    HA   ASP  17           HA       ASP  17  -9.663  14.164   1.957
  535   1HB   ASP  17          1HB       ASP  17 -11.140  14.055  -0.161
  536   2HB   ASP  17          2HB       ASP  17 -10.223  12.607  -0.601
  537    H    ARG  18           H        ARG  18  -6.807  13.929   0.608
  538    HA   ARG  18           HA       ARG  18  -6.444  11.089   0.647
  539   1HB   ARG  18          1HB       ARG  18  -4.395  13.330   0.331
  540   2HB   ARG  18          2HB       ARG  18  -4.113  11.617  -0.024
  541   1HG   ARG  18          1HG       ARG  18  -5.281  11.702  -1.999
  542   2HG   ARG  18          2HG       ARG  18  -6.448  12.894  -1.397
  543   1HD   ARG  18          1HD       ARG  18  -4.872  14.697  -1.709
  544   2HD   ARG  18          2HD       ARG  18  -3.540  13.576  -2.021
  545    HE   ARG  18           HE       ARG  18  -5.766  13.249  -3.882
  546   1HH1  ARG  18          1HH1      ARG  18  -2.851  15.107  -3.217
  547   2HH1  ARG  18          2HH1      ARG  18  -2.606  15.554  -4.872
  548   1HH2  ARG  18          1HH2      ARG  18  -5.442  13.839  -6.066
  549   2HH2  ARG  18          2HH2      ARG  18  -4.088  14.829  -6.504
  550    H    VAL  19           H        VAL  19  -4.176  10.437   1.855
  551    HA   VAL  19           HA       VAL  19  -4.499  11.441   4.592
  552    HB   VAL  19           HB       VAL  19  -3.311   8.848   3.586
  553   1HG1  VAL  19          1HG1      VAL  19  -2.429   8.705   5.634
  554   2HG1  VAL  19          2HG1      VAL  19  -3.278  10.173   6.173
  555   3HG1  VAL  19          3HG1      VAL  19  -4.088   8.591   6.267
  556   1HG2  VAL  19          1HG2      VAL  19  -5.320   7.778   3.928
  557   2HG2  VAL  19          2HG2      VAL  19  -5.894   8.987   5.101
  558   3HG2  VAL  19          3HG2      VAL  19  -5.898   9.363   3.362
  559    H    ASP  20           H        ASP  20  -2.918  12.573   2.179
  560    HA   ASP  20           HA       ASP  20  -0.843  13.149   1.660
  561   1HB   ASP  20          1HB       ASP  20  -1.240  15.027   2.952
  562   2HB   ASP  20          2HB       ASP  20  -1.468  14.096   4.440
  563    H    CYS  21           H        CYS  21   0.232  11.048   1.376
  564    HA   CYS  21           HA       CYS  21   1.138   9.408   3.342
  565   1HB   CYS  21          1HB       CYS  21   1.297   9.473   0.633
  566   2HB   CYS  21          2HB       CYS  21   2.990   9.722   1.069
  567    H    GLY  22           H        GLY  22   2.495  12.476   2.075
  568   1HA   GLY  22          1HA       GLY  22   4.229  13.752   2.729
  569   2HA   GLY  22          2HA       GLY  22   3.839  13.213   4.350
  570    H    TYR  23           H        TYR  23   5.327  11.727   1.372
  571    HA   TYR  23           HA       TYR  23   7.200  10.317   3.087
  572   1HB   TYR  23          1HB       TYR  23   5.943  10.170   0.416
  573   2HB   TYR  23          2HB       TYR  23   7.691   9.946   0.283
  574    HD1  TYR  23           HD1      TYR  23   4.534   8.448   1.221
  575    HD2  TYR  23           HD2      TYR  23   8.780   8.071   1.591
  576    HE1  TYR  23           HE1      TYR  23   4.266   6.014   1.905
  577    HE2  TYR  23           HE2      TYR  23   8.497   5.638   2.273
  578    HH   TYR  23           HH       TYR  23   5.748   4.379   3.355
  579    HA   PRO  24           HA       PRO  24  10.403  13.128   2.296
  580   1HB   PRO  24          1HB       PRO  24  12.535  11.622   3.106
  581   2HB   PRO  24          2HB       PRO  24  11.505  12.515   4.223
  582   1HG   PRO  24          1HG       PRO  24  11.588   9.629   3.612
  583   2HG   PRO  24          2HG       PRO  24  10.902  10.451   5.061
  584   1HD   PRO  24          1HD       PRO  24   9.509   9.304   2.837
  585   2HD   PRO  24          2HD       PRO  24   8.799  10.242   4.157
  586    H    HIS  25           H        HIS  25   9.771  10.482   0.489
  587    HA   HIS  25           HA       HIS  25  11.900  11.267  -1.364
  588   1HB   HIS  25          1HB       HIS  25  11.524   8.755  -0.120
  589   2HB   HIS  25          2HB       HIS  25  11.055   8.552  -1.811
  590    HD1  HIS  25           HD1      HIS  25  13.141  10.411  -3.165
  591    HD2  HIS  25           HD2      HIS  25  14.041   7.683  -0.108
  592    HE1  HIS  25           HE1      HIS  25  15.631   9.898  -3.375
  593    HE2  HIS  25           HE2      HIS  25  16.137   8.260  -1.437
  594    H    VAL  26           H        VAL  26   8.805  11.780  -0.775
  595    HA   VAL  26           HA       VAL  26   7.164  10.777  -2.614
  596    HB   VAL  26           HB       VAL  26   6.334  12.374  -1.140
  597   1HG1  VAL  26          1HG1      VAL  26   8.801  13.664  -1.499
  598   2HG1  VAL  26          2HG1      VAL  26   7.578  14.837  -2.041
  599   3HG1  VAL  26          3HG1      VAL  26   7.482  14.144  -0.405
  600   1HG2  VAL  26          1HG2      VAL  26   6.330  14.089  -3.609
  601   2HG2  VAL  26          2HG2      VAL  26   5.562  12.483  -3.647
  602   3HG2  VAL  26          3HG2      VAL  26   5.004  13.710  -2.483
  603    H    THR  27           H        THR  27   7.167  10.459  -4.776
  604    HA   THR  27           HA       THR  27   8.025  12.457  -6.586
  605    HB   THR  27           HB       THR  27  10.093  10.803  -5.479
  606    HG1  THR  27           HG1      THR  27  11.130  12.443  -6.588
  607   1HG2  THR  27          1HG2      THR  27  10.969  10.077  -7.849
  608   2HG2  THR  27          2HG2      THR  27   9.805   9.007  -7.031
  609   3HG2  THR  27          3HG2      THR  27   9.253  10.102  -8.322
  610    HA   PRO  28           HA       PRO  28   5.568  10.049  -9.146
  611   1HB   PRO  28          1HB       PRO  28   6.430  10.753 -11.641
  612   2HB   PRO  28          2HB       PRO  28   5.342  11.751 -10.679
  613   1HG   PRO  28          1HG       PRO  28   8.227  12.061 -11.210
  614   2HG   PRO  28          2HG       PRO  28   7.048  13.303 -10.654
  615   1HD   PRO  28          1HD       PRO  28   9.052  11.940  -9.129
  616   2HD   PRO  28          2HD       PRO  28   7.812  13.034  -8.502
  617    H    LYS  29           H        LYS  29   7.427   8.468  -7.968
  618    HA   LYS  29           HA       LYS  29   7.444   6.295  -9.667
  619   1HB   LYS  29          1HB       LYS  29   9.210   8.008 -10.713
  620   2HB   LYS  29          2HB       LYS  29  10.277   7.203  -9.549
  621   1HG   LYS  29          1HG       LYS  29  10.355   5.334 -10.810
  622   2HG   LYS  29          2HG       LYS  29   8.591   5.268 -10.961
  623   1HD   LYS  29          1HD       LYS  29   8.836   7.139 -12.714
  624   2HD   LYS  29          2HD       LYS  29  10.576   6.796 -12.694
  625   1HE   LYS  29          1HE       LYS  29  10.285   4.984 -14.010
  626   2HE   LYS  29          2HE       LYS  29   9.042   4.322 -12.937
  627   1HZ   LYS  29          1HZ       LYS  29   7.726   6.276 -14.116
  628   2HZ   LYS  29          2HZ       LYS  29   8.761   5.899 -15.321
  629   3HZ   LYS  29          3HZ       LYS  29   7.772   4.754 -14.705
  630    H    GLU  30           H        GLU  30   8.273   8.094  -6.852
  631    HA   GLU  30           HA       GLU  30   9.409   5.737  -5.603
  632   1HB   GLU  30          1HB       GLU  30   9.573   8.658  -5.163
  633   2HB   GLU  30          2HB       GLU  30   9.451   7.709  -3.671
  634   1HG   GLU  30          1HG       GLU  30  11.760   7.762  -4.030
  635   2HG   GLU  30          2HG       GLU  30  11.325   6.222  -4.789
  636    H    CYS  31           H        CYS  31   6.746   8.162  -5.249
  637    HA   CYS  31           HA       CYS  31   5.615   7.175  -2.959
  638   1HB   CYS  31          1HB       CYS  31   4.350   8.476  -5.367
  639   2HB   CYS  31          2HB       CYS  31   3.469   8.134  -3.873
  640    H    ASN  32           H        ASN  32   4.790   6.395  -6.424
  641    HA   ASN  32           HA       ASN  32   2.969   4.426  -5.814
  642   1HB   ASN  32          1HB       ASN  32   4.598   5.235  -8.188
  643   2HB   ASN  32          2HB       ASN  32   3.967   3.582  -8.236
  644   1HD2  ASN  32          1HD2      ASN  32   2.748   6.670  -6.944
  645   2HD2  ASN  32          2HD2      ASN  32   1.243   6.689  -7.802
  646    H    ASN  33           H        ASN  33   6.368   4.543  -5.347
  647    HA   ASN  33           HA       ASN  33   6.785   1.739  -5.787
  648   1HB   ASN  33          1HB       ASN  33   8.442   3.892  -5.997
  649   2HB   ASN  33          2HB       ASN  33   8.826   3.408  -4.339
  650   1HD2  ASN  33          1HD2      ASN  33  10.945   3.033  -5.292
  651   2HD2  ASN  33          2HD2      ASN  33  11.296   1.511  -6.040
  652    H    ARG  34           H        ARG  34   6.363   4.151  -3.160
  653    HA   ARG  34           HA       ARG  34   6.993   2.242  -1.142
  654   1HB   ARG  34          1HB       ARG  34   5.602   4.897  -0.672
  655   2HB   ARG  34          2HB       ARG  34   6.731   4.049   0.400
  656   1HG   ARG  34          1HG       ARG  34   8.023   4.573  -2.131
  657   2HG   ARG  34          2HG       ARG  34   7.312   6.081  -1.531
  658   1HD   ARG  34          1HD       ARG  34   8.895   6.261   0.076
  659   2HD   ARG  34          2HD       ARG  34   8.625   4.602   0.629
  660    HE   ARG  34           HE       ARG  34  10.039   4.340  -1.765
  661   1HH1  ARG  34          1HH1      ARG  34  10.593   5.980   1.300
  662   2HH1  ARG  34          2HH1      ARG  34  12.318   5.847   1.204
  663   1HH2  ARG  34          1HH2      ARG  34  12.314   4.164  -1.890
  664   2HH2  ARG  34          2HH2      ARG  34  13.303   4.808  -0.621
  665    H    GLY  35           H        GLY  35   4.175   3.406  -2.905
  666   1HA   GLY  35          1HA       GLY  35   2.274   1.871  -2.840
  667   2HA   GLY  35          2HA       GLY  35   2.421   1.854  -1.095
  668    H    CYS  36           H        CYS  36   3.030   4.853  -2.897
  669    HA   CYS  36           HA       CYS  36   0.438   5.833  -1.939
  670   1HB   CYS  36          1HB       CYS  36   3.025   7.377  -2.135
  671   2HB   CYS  36          2HB       CYS  36   1.467   8.023  -1.615
  672    H    CYS  37           H        CYS  37  -0.375   7.734  -3.315
  673    HA   CYS  37           HA       CYS  37   0.374   7.227  -6.097
  674   1HB   CYS  37          1HB       CYS  37  -2.092   7.094  -4.906
  675   2HB   CYS  37          2HB       CYS  37  -2.107   8.712  -5.613
  676    H    PHE  38           H        PHE  38   1.398   8.886  -7.184
  677    HA   PHE  38           HA       PHE  38   1.769  11.367  -5.752
  678   1HB   PHE  38          1HB       PHE  38   3.525   9.938  -7.039
  679   2HB   PHE  38          2HB       PHE  38   2.732  10.465  -8.528
  680    HD1  PHE  38           HD1      PHE  38   3.096  12.663  -9.390
  681    HD2  PHE  38           HD2      PHE  38   4.713  11.565  -5.624
  682    HE1  PHE  38           HE1      PHE  38   4.526  14.726  -9.402
  683    HE2  PHE  38           HE2      PHE  38   6.142  13.628  -5.636
  684    HZ   PHE  38           HZ       PHE  38   6.032  15.184  -7.525
  685    H    ASP  39           H        ASP  39   0.515  13.141  -6.063
  686    HA   ASP  39           HA       ASP  39  -1.396  13.094  -8.157
  687   1HB   ASP  39          1HB       ASP  39  -2.326  14.194  -6.377
  688   2HB   ASP  39          2HB       ASP  39  -0.762  14.763  -5.773
  689    H    SER  40           H        SER  40   0.588  15.948  -7.146
  690    HA   SER  40           HA       SER  40   2.108  17.120  -8.242
  691   1HB   SER  40          1HB       SER  40   2.457  14.883  -9.627
  692   2HB   SER  40          2HB       SER  40   1.622  15.788 -10.903
  693    HG   SER  40           HG       SER  40   3.257  17.417 -10.761
  694    H    ARG  41           H        ARG  41  -1.114  16.370  -9.396
  695    HA   ARG  41           HA       ARG  41  -1.363  18.386 -11.280
  696   1HB   ARG  41          1HB       ARG  41  -3.613  17.379  -9.494
  697   2HB   ARG  41          2HB       ARG  41  -3.735  17.938 -11.172
  698   1HG   ARG  41          1HG       ARG  41  -2.117  15.957 -11.700
  699   2HG   ARG  41          2HG       ARG  41  -2.581  15.340 -10.105
  700   1HD   ARG  41          1HD       ARG  41  -4.582  16.109 -12.270
  701   2HD   ARG  41          2HD       ARG  41  -3.968  14.461 -12.065
  702    HE   ARG  41           HE       ARG  41  -5.158  14.297  -9.995
  703   1HH1  ARG  41          1HH1      ARG  41  -5.560  17.450 -11.504
  704   2HH1  ARG  41          2HH1      ARG  41  -6.915  17.891 -10.519
  705   1HH2  ARG  41          1HH2      ARG  41  -6.946  14.878  -8.694
  706   2HH2  ARG  41          2HH2      ARG  41  -7.708  16.418  -8.909
  707    H    ILE  42           H        ILE  42  -1.996  18.244  -7.723
  708    HA   ILE  42           HA       ILE  42  -2.284  21.168  -7.780
  709    HB   ILE  42           HB       ILE  42  -3.462  19.466  -5.620
  710   1HG1  ILE  42          1HG1      ILE  42  -4.545  19.843  -8.398
  711   2HG1  ILE  42          2HG1      ILE  42  -4.430  18.358  -7.440
  712   1HG2  ILE  42          1HG2      ILE  42  -4.832  21.311  -5.197
  713   2HG2  ILE  42          2HG2      ILE  42  -3.248  22.026  -5.577
  714   3HG2  ILE  42          3HG2      ILE  42  -4.539  22.020  -6.802
  715   1HD1  ILE  42          1HD1      ILE  42  -6.022  19.854  -5.806
  716   2HD1  ILE  42          2HD1      ILE  42  -6.483  20.529  -7.388
  717   3HD1  ILE  42          3HD1      ILE  42  -6.662  18.785  -7.079
  718    HA   PRO  43           HA       PRO  43   1.409  20.704  -5.454
  719   1HB   PRO  43          1HB       PRO  43   2.229  23.300  -5.666
  720   2HB   PRO  43          2HB       PRO  43   2.620  22.066  -6.861
  721   1HG   PRO  43          1HG       PRO  43   0.626  24.239  -6.962
  722   2HG   PRO  43          2HG       PRO  43   1.347  23.311  -8.327
  723   1HD   PRO  43          1HD       PRO  43  -1.268  23.060  -7.185
  724   2HD   PRO  43          2HD       PRO  43  -0.551  22.017  -8.421
  725    H    GLY  44           H        GLY  44  -1.421  22.273  -4.775
  726   1HA   GLY  44          1HA       GLY  44  -0.471  23.367  -2.239
  727   2HA   GLY  44          2HA       GLY  44  -2.064  23.545  -2.950
  728    H    VAL  45           H        VAL  45  -1.414  20.336  -3.447
  729    HA   VAL  45           HA       VAL  45  -2.476  19.588  -0.810
  730    HB   VAL  45           HB       VAL  45  -4.043  18.229  -1.758
  731   1HG1  VAL  45          1HG1      VAL  45  -5.162  19.419  -3.602
  732   2HG1  VAL  45          2HG1      VAL  45  -4.587  20.542  -2.344
  733   3HG1  VAL  45          3HG1      VAL  45  -3.688  20.380  -3.872
  734   1HG2  VAL  45          1HG2      VAL  45  -2.547  18.186  -4.398
  735   2HG2  VAL  45          2HG2      VAL  45  -2.380  16.953  -3.125
  736   3HG2  VAL  45          3HG2      VAL  45  -3.949  17.192  -3.934
  737    HA   PRO  46           HA       PRO  46   0.504  16.432  -0.723
  738   1HB   PRO  46          1HB       PRO  46  -0.778  14.064  -0.266
  739   2HB   PRO  46          2HB       PRO  46  -0.480  15.257   0.995
  740   1HG   PRO  46          1HG       PRO  46  -2.965  14.619  -0.461
  741   2HG   PRO  46          2HG       PRO  46  -2.774  15.465   1.117
  742   1HD   PRO  46          1HD       PRO  46  -3.393  16.589  -1.443
  743   2HD   PRO  46          2HD       PRO  46  -3.057  17.480   0.047
  744    H    TRP  47           H        TRP  47   1.891  15.891  -2.272
  745    HA   TRP  47           HA       TRP  47   0.691  14.798  -4.685
  746   1HB   TRP  47          1HB       TRP  47   3.584  15.189  -4.641
  747   2HB   TRP  47          2HB       TRP  47   2.372  15.743  -5.800
  748    HD1  TRP  47           HD1      TRP  47   1.030  18.111  -4.999
  749    HE1  TRP  47           HE1      TRP  47   1.886  20.246  -3.707
  750    HE3  TRP  47           HE3      TRP  47   5.132  15.889  -2.974
  751    HZ2  TRP  47           HZ2      TRP  47   4.131  20.756  -2.021
  752    HZ3  TRP  47           HZ3      TRP  47   6.604  17.278  -1.517
  753    HH2  TRP  47           HH2      TRP  47   6.158  19.631  -1.030
  754    H    CYS  48           H        CYS  48   0.852  13.297  -2.068
  755    HA   CYS  48           HA       CYS  48   1.789  10.872  -3.148
  756   1HB   CYS  48          1HB       CYS  48   3.947  12.012  -2.495
  757   2HB   CYS  48          2HB       CYS  48   3.424  11.868  -0.814
  758    H    PHE  49           H        PHE  49  -0.070   9.813  -2.488
  759    HA   PHE  49           HA       PHE  49  -0.552   9.732   0.379
  760   1HB   PHE  49          1HB       PHE  49  -3.109   9.841  -0.566
  761   2HB   PHE  49          2HB       PHE  49  -2.237  11.306  -0.106
  762    HD1  PHE  49           HD1      PHE  49  -0.741  12.290  -2.104
  763    HD2  PHE  49           HD2      PHE  49  -4.172   9.840  -2.593
  764    HE1  PHE  49           HE1      PHE  49  -1.049  13.185  -4.429
  765    HE2  PHE  49           HE2      PHE  49  -4.479  10.734  -4.917
  766    HZ   PHE  49           HZ       PHE  49  -2.914  12.396  -5.808
  767    H    LYS  50           H        LYS  50  -2.852   8.193   0.427
  768    HA   LYS  50           HA       LYS  50  -2.119   5.874  -1.221
  769   1HB   LYS  50          1HB       LYS  50  -3.190   4.725   0.979
  770   2HB   LYS  50          2HB       LYS  50  -1.452   4.969   0.730
  771   1HG   LYS  50          1HG       LYS  50  -2.987   7.252   1.903
  772   2HG   LYS  50          2HG       LYS  50  -2.776   5.833   2.942
  773   1HD   LYS  50          1HD       LYS  50  -0.621   7.520   1.614
  774   2HD   LYS  50          2HD       LYS  50  -0.916   7.337   3.352
  775   1HE   LYS  50          1HE       LYS  50   0.324   5.404   1.394
  776   2HE   LYS  50          2HE       LYS  50   0.905   5.885   2.995
  777   1HZ   LYS  50          1HZ       LYS  50  -1.349   4.742   3.644
  778   2HZ   LYS  50          2HZ       LYS  50  -1.067   3.907   2.270
  779   3HZ   LYS  50          3HZ       LYS  50   0.033   3.888   3.476
  780    HA   PRO  51           HA       PRO  51  -6.444   7.040  -1.905
  781   1HB   PRO  51          1HB       PRO  51  -6.331   7.287  -4.623
  782   2HB   PRO  51          2HB       PRO  51  -6.167   8.654  -3.523
  783   1HG   PRO  51          1HG       PRO  51  -4.110   7.195  -5.053
  784   2HG   PRO  51          2HG       PRO  51  -4.018   8.844  -4.337
  785   1HD   PRO  51          1HD       PRO  51  -2.819   6.422  -3.388
  786   2HD   PRO  51          2HD       PRO  51  -2.833   7.987  -2.563
  787    H    LEU  52           H        LEU  52  -5.578   5.579  -4.917
  788    HA   LEU  52           HA       LEU  52  -7.118   3.246  -4.057
  789   1HB   LEU  52          1HB       LEU  52  -7.950   3.109  -6.108
  790   2HB   LEU  52          2HB       LEU  52  -7.500   4.822  -6.190
  791    HG   LEU  52           HG       LEU  52  -5.215   3.654  -7.082
  792   1HD1  LEU  52          1HD1      LEU  52  -6.959   1.500  -7.016
  793   2HD1  LEU  52          2HD1      LEU  52  -6.991   2.020  -8.718
  794   3HD1  LEU  52          3HD1      LEU  52  -5.442   1.611  -7.941
  795   1HD2  LEU  52          1HD2      LEU  52  -7.143   3.977  -9.255
  796   2HD2  LEU  52          2HD2      LEU  52  -7.179   5.317  -8.084
  797   3HD2  LEU  52          3HD2      LEU  52  -5.654   4.882  -8.891
  798    H    GLN  53           H        GLN  53  -4.469   3.561  -3.034
  799    HA   GLN  53           HA       GLN  53  -2.476   2.478  -4.504
  800   1HB   GLN  53          1HB       GLN  53  -3.093   2.104  -1.550
  801   2HB   GLN  53          2HB       GLN  53  -1.532   1.707  -2.290
  802   1HG   GLN  53          1HG       GLN  53  -2.870   4.445  -2.222
  803   2HG   GLN  53          2HG       GLN  53  -1.470   3.954  -1.257
  804   1HE2  GLN  53          1HE2      GLN  53  -0.163   2.425  -3.238
  805   2HE2  GLN  53          2HE2      GLN  53   0.470   3.487  -4.450
  806    H    GLU  54           H        GLU  54  -5.414   0.955  -3.431
  807    HA   GLU  54           HA       GLU  54  -4.850  -1.574  -2.935
  808   1HB   GLU  54          1HB       GLU  54  -6.986  -2.172  -3.865
  809   2HB   GLU  54          2HB       GLU  54  -7.138  -0.526  -3.224
  810   1HG   GLU  54          1HG       GLU  54  -7.988  -0.014  -5.263
  811   2HG   GLU  54          2HG       GLU  54  -6.315  -0.069  -5.836
  812    H    ALA  55           H        ALA  55  -4.194   0.115  -5.953
  813    HA   ALA  55           HA       ALA  55  -4.155  -1.611  -7.923
  814   1HB   ALA  55          1HB       ALA  55  -2.454  -0.343  -8.852
  815   2HB   ALA  55          2HB       ALA  55  -2.960   0.733  -7.528
  816   3HB   ALA  55          3HB       ALA  55  -1.518  -0.293  -7.338
  817    H    GLU  56           H        GLU  56  -1.411  -1.547  -5.529
  818    HA   GLU  56           HA       GLU  56  -1.306  -4.431  -5.828
  819   1HB   GLU  56          1HB       GLU  56   1.153  -4.372  -5.990
  820   2HB   GLU  56          2HB       GLU  56   0.409  -3.518  -7.353
  821   1HG   GLU  56          1HG       GLU  56   1.377  -1.562  -6.759
  822   2HG   GLU  56          2HG       GLU  56   0.893  -1.737  -5.065
  823    H    CYS  57           H        CYS  57  -2.126  -2.174  -3.801
  824    HA   CYS  57           HA       CYS  57  -0.292  -2.762  -1.645
  825   1HB   CYS  57          1HB       CYS  57  -2.138  -0.647  -2.301
  826   2HB   CYS  57          2HB       CYS  57  -2.455  -1.254  -0.674
  827    H    THR  58           H        THR  58  -3.906  -2.486  -1.639
  828    HA   THR  58           HA       THR  58  -4.373  -4.286   0.362
  829    HB   THR  58           HB       THR  58  -5.938  -2.629  -0.915
  830    HG1  THR  58           HG1      THR  58  -6.625  -5.408  -0.264
  831   1HG2  THR  58          1HG2      THR  58  -6.351  -5.198  -2.535
  832   2HG2  THR  58          2HG2      THR  58  -7.402  -3.764  -2.589
  833   3HG2  THR  58          3HG2      THR  58  -5.730  -3.664  -3.188
  834    H    PHE  59           H        PHE  59  -3.593  -4.947  -3.042
  835    HA   PHE  59           HA       PHE  59  -4.486  -7.521  -3.256
  836   1HB   PHE  59          1HB       PHE  59  -2.231  -5.807  -4.285
  837   2HB   PHE  59          2HB       PHE  59  -2.053  -7.539  -4.575
  838    HD1  PHE  59           HD1      PHE  59  -4.980  -5.215  -4.699
  839    HD2  PHE  59           HD2      PHE  59  -2.546  -8.004  -6.775
  840    HE1  PHE  59           HE1      PHE  59  -6.468  -5.015  -6.710
  841    HE2  PHE  59           HE2      PHE  59  -4.033  -7.803  -8.787
  842    HZ   PHE  59           HZ       PHE  59  -5.976  -6.312  -8.731
  Start of MODEL   47
    1   1H    GLU   1           H1       GLU   1 -18.367  -8.543  -3.663
    2    HA   GLU   1           HA       GLU   1 -16.148  -8.572  -3.231
    3   1HB   GLU   1          1HB       GLU   1 -17.783  -7.742  -0.868
    4   2HB   GLU   1          2HB       GLU   1 -16.027  -7.823  -0.641
    5   1HG   GLU   1          1HG       GLU   1 -16.975  -6.483  -3.133
    6   2HG   GLU   1          2HG       GLU   1 -17.340  -5.633  -1.624
    7    H    GLU   2           H        GLU   2 -14.997 -10.483  -3.383
    8    HA   GLU   2           HA       GLU   2 -15.362 -12.437  -1.302
    9   1HB   GLU   2          1HB       GLU   2 -14.849 -12.589  -4.026
   10   2HB   GLU   2          2HB       GLU   2 -13.274 -12.983  -3.313
   11   1HG   GLU   2          1HG       GLU   2 -14.158 -14.836  -2.122
   12   2HG   GLU   2          2HG       GLU   2 -15.831 -14.286  -2.312
   13    H    TYR   3           H        TYR   3 -14.428 -10.540   0.165
   14    HA   TYR   3           HA       TYR   3 -11.660 -10.019   0.021
   15   1HB   TYR   3          1HB       TYR   3 -12.211  -9.314   2.470
   16   2HB   TYR   3          2HB       TYR   3 -13.200  -8.543   1.225
   17    HD1  TYR   3           HD1      TYR   3 -13.150 -10.897   4.033
   18    HD2  TYR   3           HD2      TYR   3 -15.562  -9.193   0.938
   19    HE1  TYR   3           HE1      TYR   3 -15.248 -11.734   5.198
   20    HE2  TYR   3           HE2      TYR   3 -17.652 -10.036   2.113
   21    HH   TYR   3           HH       TYR   3 -17.476 -11.458   5.305
   22    H    VAL   4           H        VAL   4 -11.158 -12.469  -0.383
   23    HA   VAL   4           HA       VAL   4 -10.709 -13.709   2.244
   24    HB   VAL   4           HB       VAL   4 -11.325 -14.928  -0.448
   25   1HG1  VAL   4          1HG1      VAL   4  -9.452 -16.116   0.761
   26   2HG1  VAL   4          2HG1      VAL   4 -10.606 -16.450   2.075
   27   3HG1  VAL   4          3HG1      VAL   4 -10.899 -17.104   0.446
   28   1HG2  VAL   4          1HG2      VAL   4 -13.332 -15.644   0.457
   29   2HG2  VAL   4          2HG2      VAL   4 -12.735 -15.556   2.132
   30   3HG2  VAL   4          3HG2      VAL   4 -13.131 -14.063   1.248
   31    H    GLY   5           H        GLY   5  -9.473 -13.743  -1.180
   32   1HA   GLY   5          1HA       GLY   5  -6.847 -14.492  -0.397
   33   2HA   GLY   5          2HA       GLY   5  -7.369 -13.924  -1.970
   34    H    LEU   6           H        LEU   6  -8.445 -11.694   0.359
   35    HA   LEU   6           HA       LEU   6  -5.943 -10.215   0.415
   36   1HB   LEU   6          1HB       LEU   6  -7.002  -8.196  -0.435
   37   2HB   LEU   6          2HB       LEU   6  -6.912  -9.483  -1.650
   38    HG   LEU   6           HG       LEU   6  -9.011  -8.265  -1.803
   39   1HD1  LEU   6          1HD1      LEU   6  -8.757 -10.900  -1.999
   40   2HD1  LEU   6          2HD1      LEU   6  -9.906 -10.862  -0.639
   41   3HD1  LEU   6          3HD1      LEU   6 -10.328 -10.084  -2.184
   42   1HD2  LEU   6          1HD2      LEU   6 -10.556  -7.978  -0.082
   43   2HD2  LEU   6          2HD2      LEU   6  -9.825  -9.252   0.924
   44   3HD2  LEU   6          3HD2      LEU   6  -8.988  -7.695   0.713
   45    H    SER   7           H        SER   7  -8.067 -11.716   2.174
   46    HA   SER   7           HA       SER   7  -9.167  -9.638   3.739
   47   1HB   SER   7          1HB       SER   7 -10.234 -11.317   4.900
   48   2HB   SER   7          2HB       SER   7  -9.863 -12.197   3.406
   49    HG   SER   7           HG       SER   7  -8.274 -13.334   4.430
   50    H    ALA   8           H        ALA   8  -8.700 -10.379   6.402
   51    HA   ALA   8           HA       ALA   8  -6.132  -9.243   6.822
   52   1HB   ALA   8          1HB       ALA   8  -7.915  -8.709   8.336
   53   2HB   ALA   8          2HB       ALA   8  -8.261 -10.429   8.639
   54   3HB   ALA   8          3HB       ALA   8  -6.753  -9.703   9.247
   55    H    ASN   9           H        ASN   9  -7.113 -12.348   5.932
   56    HA   ASN   9           HA       ASN   9  -5.025 -13.610   7.494
   57   1HB   ASN   9          1HB       ASN   9  -7.193 -14.765   7.444
   58   2HB   ASN   9          2HB       ASN   9  -7.207 -14.754   5.673
   59   1HD2  ASN   9          1HD2      ASN   9  -4.619 -15.412   8.019
   60   2HD2  ASN   9          2HD2      ASN   9  -4.256 -17.026   7.505
   61    H    GLN  10           H        GLN  10  -5.468 -11.979   4.572
   62    HA   GLN  10           HA       GLN  10  -4.226 -13.681   2.755
   63   1HB   GLN  10          1HB       GLN  10  -4.440 -11.944   1.270
   64   2HB   GLN  10          2HB       GLN  10  -5.581 -11.379   2.503
   65   1HG   GLN  10          1HG       GLN  10  -3.790  -9.991   3.509
   66   2HG   GLN  10          2HG       GLN  10  -2.643 -10.564   2.289
   67   1HE2  GLN  10          1HE2      GLN  10  -2.663  -9.738   0.271
   68   2HE2  GLN  10          2HE2      GLN  10  -3.664  -8.426  -0.255
   69    H    CYS  11           H        CYS  11  -3.001 -11.271   5.108
   70    HA   CYS  11           HA       CYS  11  -0.393 -11.152   4.121
   71   1HB   CYS  11          1HB       CYS  11  -1.133  -9.458   5.580
   72   2HB   CYS  11          2HB       CYS  11  -1.587 -10.612   6.837
   73    H    ALA  12           H        ALA  12  -2.183 -13.741   5.395
   74    HA   ALA  12           HA       ALA  12   0.230 -15.034   6.461
   75   1HB   ALA  12          1HB       ALA  12  -1.785 -16.655   7.239
   76   2HB   ALA  12          2HB       ALA  12  -1.262 -15.243   8.190
   77   3HB   ALA  12          3HB       ALA  12  -2.682 -15.121   7.123
   78    H    VAL  13           H        VAL  13  -0.851 -14.572   3.560
   79    HA   VAL  13           HA       VAL  13  -1.858 -16.811   2.435
   80    HB   VAL  13           HB       VAL  13  -0.663 -14.459   1.602
   81   1HG1  VAL  13          1HG1      VAL  13   0.903 -15.140  -0.191
   82   2HG1  VAL  13          2HG1      VAL  13   1.529 -15.506   1.435
   83   3HG1  VAL  13          3HG1      VAL  13   0.858 -16.809   0.424
   84   1HG2  VAL  13          1HG2      VAL  13  -2.390 -16.505   0.576
   85   2HG2  VAL  13          2HG2      VAL  13  -2.271 -14.795   0.096
   86   3HG2  VAL  13          3HG2      VAL  13  -1.255 -16.018  -0.706
   87    HA   PRO  14           HA       PRO  14   1.105 -19.951   2.671
   88   1HB   PRO  14          1HB       PRO  14   1.018 -21.172   0.229
   89   2HB   PRO  14          2HB       PRO  14  -0.191 -21.441   1.484
   90   1HG   PRO  14          1HG       PRO  14  -0.339 -19.816  -0.973
   91   2HG   PRO  14          2HG       PRO  14  -1.688 -20.465   0.026
   92   1HD   PRO  14          1HD       PRO  14  -0.706 -17.778  -0.108
   93   2HD   PRO  14          2HD       PRO  14  -1.929 -18.401   1.008
   94    H    ALA  15           H        ALA  15   2.080 -17.291   1.855
   95    HA   ALA  15           HA       ALA  15   3.941 -16.360   1.095
   96   1HB   ALA  15          1HB       ALA  15   5.946 -17.373   1.803
   97   2HB   ALA  15          2HB       ALA  15   4.722 -18.083   2.883
   98   3HB   ALA  15          3HB       ALA  15   5.335 -19.016   1.496
   99    H    LYS  16           H        LYS  16   2.765 -16.361  -1.057
  100    HA   LYS  16           HA       LYS  16   4.405 -16.775  -3.130
  101   1HB   LYS  16          1HB       LYS  16   3.296 -18.937  -4.118
  102   2HB   LYS  16          2HB       LYS  16   4.694 -19.047  -3.034
  103   1HG   LYS  16          1HG       LYS  16   3.491 -20.177  -1.497
  104   2HG   LYS  16          2HG       LYS  16   2.196 -18.964  -1.515
  105   1HD   LYS  16          1HD       LYS  16   0.953 -20.642  -2.414
  106   2HD   LYS  16          2HD       LYS  16   1.785 -20.242  -3.926
  107   1HE   LYS  16          1HE       LYS  16   3.341 -22.022  -3.661
  108   2HE   LYS  16          2HE       LYS  16   2.966 -22.222  -1.943
  109   1HZ   LYS  16          1HZ       LYS  16   0.622 -22.691  -2.966
  110   2HZ   LYS  16          2HZ       LYS  16   1.508 -23.135  -4.264
  111   3HZ   LYS  16          3HZ       LYS  16   1.742 -23.872  -2.824
  112    H    ASP  17           H        ASP  17   2.448 -14.966  -2.230
  113    HA   ASP  17           HA       ASP  17   0.864 -14.875  -4.598
  114   1HB   ASP  17          1HB       ASP  17  -0.448 -16.239  -2.847
  115   2HB   ASP  17          2HB       ASP  17  -0.566 -14.742  -1.910
  116    H    ARG  18           H        ARG  18   2.931 -13.513  -2.531
  117    HA   ARG  18           HA       ARG  18   1.523 -11.049  -2.079
  118   1HB   ARG  18          1HB       ARG  18   4.436 -11.716  -1.467
  119   2HB   ARG  18          2HB       ARG  18   3.479 -10.403  -0.757
  120   1HG   ARG  18          1HG       ARG  18   2.446 -11.797   0.725
  121   2HG   ARG  18          2HG       ARG  18   2.313 -13.125  -0.441
  122   1HD   ARG  18          1HD       ARG  18   4.648 -13.733  -0.082
  123   2HD   ARG  18          2HD       ARG  18   4.918 -12.307   0.932
  124    HE   ARG  18           HE       ARG  18   2.807 -14.193   1.811
  125   1HH1  ARG  18          1HH1      ARG  18   6.119 -13.059   2.171
  126   2HH1  ARG  18          2HH1      ARG  18   6.325 -13.765   3.740
  127   1HH2  ARG  18          1HH2      ARG  18   3.079 -15.124   3.880
  128   2HH2  ARG  18          2HH2      ARG  18   4.585 -14.947   4.718
  129    H    VAL  19           H        VAL  19   3.191  -8.994  -2.459
  130    HA   VAL  19           HA       VAL  19   4.008  -9.248  -5.268
  131    HB   VAL  19           HB       VAL  19   3.351  -6.684  -3.837
  132   1HG1  VAL  19          1HG1      VAL  19   4.153  -7.435  -6.505
  133   2HG1  VAL  19          2HG1      VAL  19   2.545  -6.672  -6.547
  134   3HG1  VAL  19          3HG1      VAL  19   3.918  -5.813  -5.811
  135   1HG2  VAL  19          1HG2      VAL  19   1.055  -6.989  -5.028
  136   2HG2  VAL  19          2HG2      VAL  19   1.453  -8.724  -4.986
  137   3HG2  VAL  19          3HG2      VAL  19   1.339  -7.800  -3.469
  138    H    ASP  20           H        ASP  20   5.482  -9.886  -2.632
  139    HA   ASP  20           HA       ASP  20   7.339  -9.326  -1.568
  140   1HB   ASP  20          1HB       ASP  20   8.434 -10.631  -3.130
  141   2HB   ASP  20          2HB       ASP  20   7.935  -9.619  -4.494
  142    H    CYS  21           H        CYS  21   6.862  -7.184  -0.684
  143    HA   CYS  21           HA       CYS  21   6.877  -4.832  -2.064
  144   1HB   CYS  21          1HB       CYS  21   6.380  -5.470   0.448
  145   2HB   CYS  21          2HB       CYS  21   8.027  -4.882   0.692
  146    H    GLY  22           H        GLY  22   9.565  -6.854  -0.848
  147   1HA   GLY  22          1HA       GLY  22  11.804  -6.670  -1.019
  148   2HA   GLY  22          2HA       GLY  22  11.472  -6.027  -2.615
  149    H    TYR  23           H        TYR  23  11.338  -4.933   0.856
  150    HA   TYR  23           HA       TYR  23  12.069  -2.256  -0.014
  151   1HB   TYR  23          1HB       TYR  23  10.654  -3.646   2.145
  152   2HB   TYR  23          2HB       TYR  23  11.921  -2.640   2.856
  153    HD1  TYR  23           HD1      TYR  23  11.912  -0.157   2.391
  154    HD2  TYR  23           HD2      TYR  23   8.653  -2.703   1.292
  155    HE1  TYR  23           HE1      TYR  23  10.391   1.869   2.175
  156    HE2  TYR  23           HE2      TYR  23   7.145  -0.667   1.080
  157    HH   TYR  23           HH       TYR  23   8.094   2.240   0.648
  158    HA   PRO  24           HA       PRO  24  16.221  -2.823   1.099
  159   1HB   PRO  24          1HB       PRO  24  17.035  -0.216   1.111
  160   2HB   PRO  24          2HB       PRO  24  16.903  -1.177  -0.360
  161   1HG   PRO  24          1HG       PRO  24  15.119   0.919   0.699
  162   2HG   PRO  24          2HG       PRO  24  15.247   0.301  -0.986
  163   1HD   PRO  24          1HD       PRO  24  13.216  -0.240   0.958
  164   2HD   PRO  24          2HD       PRO  24  13.385  -0.999  -0.630
  165    H    HIS  25           H        HIS  25  13.899  -1.665   3.079
  166    HA   HIS  25           HA       HIS  25  15.823  -1.669   5.280
  167   1HB   HIS  25          1HB       HIS  25  13.993   0.465   4.452
  168   2HB   HIS  25          2HB       HIS  25  13.825   0.021   6.154
  169    HD1  HIS  25           HD1      HIS  25  16.428  -0.190   7.354
  170    HD2  HIS  25           HD2      HIS  25  15.845   2.408   4.114
  171    HE1  HIS  25           HE1      HIS  25  18.334   1.503   7.444
  172    HE2  HIS  25           HE2      HIS  25  17.954   3.040   5.397
  173    H    VAL  26           H        VAL  26  13.877  -3.642   3.918
  174    HA   VAL  26           HA       VAL  26  11.606  -4.101   5.281
  175    HB   VAL  26           HB       VAL  26  12.133  -5.508   3.508
  176   1HG1  VAL  26          1HG1      VAL  26  14.797  -5.396   4.568
  177   2HG1  VAL  26          2HG1      VAL  26  14.342  -7.101   4.332
  178   3HG1  VAL  26          3HG1      VAL  26  14.248  -5.958   2.970
  179   1HG2  VAL  26          1HG2      VAL  26  11.245  -6.586   5.796
  180   2HG2  VAL  26          2HG2      VAL  26  11.504  -7.545   4.319
  181   3HG2  VAL  26          3HG2      VAL  26  12.735  -7.541   5.605
  182    H    THR  27           H        THR  27  10.981  -4.560   7.342
  183    HA   THR  27           HA       THR  27  12.687  -5.960   9.142
  184    HB   THR  27           HB       THR  27  12.889  -3.042   8.969
  185    HG1  THR  27           HG1      THR  27  14.547  -4.799   9.249
  186   1HG2  THR  27          1HG2      THR  27  12.799  -3.791  11.820
  187   2HG2  THR  27          2HG2      THR  27  12.146  -2.342  11.021
  188   3HG2  THR  27          3HG2      THR  27  11.186  -3.840  11.069
  189    HA   PRO  28           HA       PRO  28   8.828  -6.723  10.854
  190   1HB   PRO  28          1HB       PRO  28   9.514  -7.669  13.323
  191   2HB   PRO  28          2HB       PRO  28   9.579  -8.653  11.861
  192   1HG   PRO  28          1HG       PRO  28  11.759  -7.369  13.380
  193   2HG   PRO  28          2HG       PRO  28  11.857  -8.734  12.211
  194   1HD   PRO  28          1HD       PRO  28  12.603  -5.996  11.820
  195   2HD   PRO  28          2HD       PRO  28  12.570  -7.266  10.590
  196    H    LYS  29           H        LYS  29   9.137  -4.081  10.729
  197    HA   LYS  29           HA       LYS  29   7.437  -3.184  12.687
  198   1HB   LYS  29          1HB       LYS  29   9.659  -3.725  14.020
  199   2HB   LYS  29          2HB       LYS  29  10.125  -2.116  13.440
  200   1HG   LYS  29          1HG       LYS  29   8.814  -1.155  14.997
  201   2HG   LYS  29          2HG       LYS  29   7.392  -2.022  14.388
  202   1HD   LYS  29          1HD       LYS  29   7.644  -3.767  15.921
  203   2HD   LYS  29          2HD       LYS  29   9.382  -3.490  16.127
  204   1HE   LYS  29          1HE       LYS  29   8.392  -1.120  17.054
  205   2HE   LYS  29          2HE       LYS  29   7.054  -2.194  17.485
  206   1HZ   LYS  29          1HZ       LYS  29   9.480  -1.907  18.761
  207   2HZ   LYS  29          2HZ       LYS  29   8.274  -2.942  19.136
  208   3HZ   LYS  29          3HZ       LYS  29   9.470  -3.414  18.130
  209    H    GLU  30           H        GLU  30   9.863  -2.785  10.210
  210    HA   GLU  30           HA       GLU  30   9.117  -0.013   9.862
  211   1HB   GLU  30          1HB       GLU  30  11.440  -1.658   9.237
  212   2HB   GLU  30          2HB       GLU  30  10.907  -0.754   7.809
  213   1HG   GLU  30          1HG       GLU  30  11.255   1.321   8.843
  214   2HG   GLU  30          2HG       GLU  30  11.127   0.657  10.478
  215    H    CYS  31           H        CYS  31   9.026  -3.210   8.194
  216    HA   CYS  31           HA       CYS  31   7.996  -2.363   5.789
  217   1HB   CYS  31          1HB       CYS  31   7.784  -4.927   7.332
  218   2HB   CYS  31          2HB       CYS  31   6.930  -4.728   5.799
  219    H    ASN  32           H        ASN  32   6.320  -3.426   8.834
  220    HA   ASN  32           HA       ASN  32   3.765  -2.983   7.809
  221   1HB   ASN  32          1HB       ASN  32   5.016  -3.548  10.457
  222   2HB   ASN  32          2HB       ASN  32   3.455  -2.719  10.548
  223   1HD2  ASN  32          1HD2      ASN  32   4.971  -5.253   8.547
  224   2HD2  ASN  32          2HD2      ASN  32   3.691  -6.414   8.658
  225    H    ASN  33           H        ASN  33   6.259  -0.823   8.444
  226    HA   ASN  33           HA       ASN  33   4.479   1.236   9.454
  227   1HB   ASN  33          1HB       ASN  33   6.851   0.688  10.443
  228   2HB   ASN  33          2HB       ASN  33   7.480   1.544   9.028
  229   1HD2  ASN  33          1HD2      ASN  33   8.358   2.878  10.816
  230   2HD2  ASN  33          2HD2      ASN  33   7.415   4.208  11.402
  231    H    ARG  34           H        ARG  34   6.384   0.096   6.691
  232    HA   ARG  34           HA       ARG  34   6.288   2.620   5.366
  233   1HB   ARG  34          1HB       ARG  34   6.986  -0.054   4.099
  234   2HB   ARG  34          2HB       ARG  34   7.571   1.553   3.631
  235   1HG   ARG  34          1HG       ARG  34   8.322   1.292   6.323
  236   2HG   ARG  34          2HG       ARG  34   8.616  -0.318   5.643
  237   1HD   ARG  34          1HD       ARG  34  10.315   0.430   4.293
  238   2HD   ARG  34          2HD       ARG  34   9.527   1.982   3.966
  239    HE   ARG  34           HE       ARG  34  11.536   1.498   5.942
  240   1HH1  ARG  34          1HH1      ARG  34   8.472   3.189   5.585
  241   2HH1  ARG  34          2HH1      ARG  34   8.846   4.385   6.781
  242   1HH2  ARG  34          1HH2      ARG  34  12.032   3.075   7.519
  243   2HH2  ARG  34          2HH2      ARG  34  10.886   4.320   7.888
  244    H    GLY  35           H        GLY  35   4.396  -0.347   5.600
  245   1HA   GLY  35          1HA       GLY  35   2.055  -0.022   4.902
  246   2HA   GLY  35          2HA       GLY  35   2.674   0.587   3.381
  247    H    CYS  36           H        CYS  36   4.412  -2.040   4.991
  248    HA   CYS  36           HA       CYS  36   3.260  -3.886   3.027
  249   1HB   CYS  36          1HB       CYS  36   6.102  -3.890   4.046
  250   2HB   CYS  36          2HB       CYS  36   5.409  -4.977   2.840
  251    H    CYS  37           H        CYS  37   4.148  -6.295   3.927
  252    HA   CYS  37           HA       CYS  37   3.458  -6.319   6.774
  253   1HB   CYS  37          1HB       CYS  37   1.604  -7.042   5.185
  254   2HB   CYS  37          2HB       CYS  37   2.594  -8.464   4.840
  255    H    PHE  38           H        PHE  38   5.003  -7.370   7.997
  256    HA   PHE  38           HA       PHE  38   7.162  -8.652   6.556
  257   1HB   PHE  38          1HB       PHE  38   7.401  -6.937   8.449
  258   2HB   PHE  38          2HB       PHE  38   6.662  -8.111   9.545
  259    HD1  PHE  38           HD1      PHE  38   7.931  -9.964  10.388
  260    HD2  PHE  38           HD2      PHE  38   9.643  -7.324   7.541
  261    HE1  PHE  38           HE1      PHE  38  10.199 -10.931  10.855
  262    HE2  PHE  38           HE2      PHE  38  11.912  -8.293   8.008
  263    HZ   PHE  38           HZ       PHE  38  12.162 -10.085   9.660
  264    H    ASP  39           H        ASP  39   7.330 -10.826   6.299
  265    HA   ASP  39           HA       ASP  39   5.441 -12.452   7.729
  266   1HB   ASP  39          1HB       ASP  39   5.665 -12.885   5.365
  267   2HB   ASP  39          2HB       ASP  39   7.429 -12.991   5.483
  268    H    SER  40           H        SER  40   8.814 -13.263   6.679
  269    HA   SER  40           HA       SER  40  10.637 -13.645   7.887
  270   1HB   SER  40          1HB       SER  40  10.826 -13.139  10.106
  271   2HB   SER  40          2HB       SER  40   9.265 -12.345   9.834
  272    HG   SER  40           HG       SER  40   9.883 -14.790  11.172
  273    H    ARG  41           H        ARG  41   7.622 -15.326   7.915
  274    HA   ARG  41           HA       ARG  41   8.264 -17.615   9.274
  275   1HB   ARG  41          1HB       ARG  41   6.459 -17.090   6.881
  276   2HB   ARG  41          2HB       ARG  41   6.535 -18.684   7.653
  277   1HG   ARG  41          1HG       ARG  41   6.235 -16.847   9.772
  278   2HG   ARG  41          2HG       ARG  41   5.139 -16.257   8.511
  279   1HD   ARG  41          1HD       ARG  41   3.671 -17.837   9.189
  280   2HD   ARG  41          2HD       ARG  41   4.772 -19.063   8.544
  281    HE   ARG  41           HE       ARG  41   5.791 -18.423  11.067
  282   1HH1  ARG  41          1HH1      ARG  41   2.723 -19.623   9.830
  283   2HH1  ARG  41          2HH1      ARG  41   2.337 -20.499  11.275
  284   1HH2  ARG  41          1HH2      ARG  41   5.283 -19.579  12.971
  285   2HH2  ARG  41          2HH2      ARG  41   3.804 -20.473  13.073
  286    H    ILE  42           H        ILE  42   8.369 -17.036   5.672
  287    HA   ILE  42           HA       ILE  42  10.364 -19.185   5.525
  288    HB   ILE  42           HB       ILE  42   8.986 -18.295   3.072
  289   1HG1  ILE  42          1HG1      ILE  42   7.519 -19.704   5.306
  290   2HG1  ILE  42          2HG1      ILE  42   7.084 -18.171   4.529
  291   1HG2  ILE  42          1HG2      ILE  42  10.632 -20.137   3.143
  292   2HG2  ILE  42          2HG2      ILE  42   9.548 -21.038   4.230
  293   3HG2  ILE  42          3HG2      ILE  42   9.031 -20.661   2.570
  294   1HD1  ILE  42          1HD1      ILE  42   6.922 -20.991   3.429
  295   2HD1  ILE  42          2HD1      ILE  42   5.662 -19.733   3.475
  296   3HD1  ILE  42          3HD1      ILE  42   7.014 -19.597   2.325
  297    HA   PRO  43           HA       PRO  43  13.095 -15.972   4.466
  298   1HB   PRO  43          1HB       PRO  43  15.327 -17.501   4.090
  299   2HB   PRO  43          2HB       PRO  43  14.806 -16.929   5.674
  300   1HG   PRO  43          1HG       PRO  43  14.574 -19.604   4.453
  301   2HG   PRO  43          2HG       PRO  43  14.491 -19.154   6.193
  302   1HD   PRO  43          1HD       PRO  43  12.347 -19.865   4.434
  303   2HD   PRO  43          2HD       PRO  43  12.197 -19.276   6.095
  304    H    GLY  44           H        GLY  44  12.043 -18.464   2.479
  305   1HA   GLY  44          1HA       GLY  44  13.527 -17.501   0.161
  306   2HA   GLY  44          2HA       GLY  44  12.452 -18.883   0.246
  307    H    VAL  45           H        VAL  45  10.667 -16.686   1.878
  308    HA   VAL  45           HA       VAL  45   9.378 -15.752  -0.586
  309    HB   VAL  45           HB       VAL  45   8.397 -17.223   1.542
  310   1HG1  VAL  45          1HG1      VAL  45   6.656 -15.676   2.523
  311   2HG1  VAL  45          2HG1      VAL  45   8.326 -15.385   3.068
  312   3HG1  VAL  45          3HG1      VAL  45   7.589 -14.317   1.849
  313   1HG2  VAL  45          1HG2      VAL  45   6.924 -17.531  -0.105
  314   2HG2  VAL  45          2HG2      VAL  45   6.182 -15.970   0.321
  315   3HG2  VAL  45          3HG2      VAL  45   7.456 -16.039  -0.920
  316    HA   PRO  46           HA       PRO  46   9.950 -11.645   0.641
  317   1HB   PRO  46          1HB       PRO  46   7.588 -10.397   0.069
  318   2HB   PRO  46          2HB       PRO  46   8.786 -10.800  -1.158
  319   1HG   PRO  46          1HG       PRO  46   6.227 -12.113  -0.504
  320   2HG   PRO  46          2HG       PRO  46   7.187 -12.218  -2.022
  321   1HD   PRO  46          1HD       PRO  46   6.940 -14.161   0.067
  322   2HD   PRO  46          2HD       PRO  46   8.021 -14.245  -1.331
  323    H    TRP  47           H        TRP  47  10.448 -11.121   2.671
  324    HA   TRP  47           HA       TRP  47   8.375 -11.530   4.648
  325   1HB   TRP  47          1HB       TRP  47  10.804 -10.268   5.591
  326   2HB   TRP  47          2HB       TRP  47  10.046 -11.786   6.079
  327    HD1  TRP  47           HD1      TRP  47  10.691 -13.959   4.317
  328    HE1  TRP  47           HE1      TRP  47  12.971 -14.599   3.155
  329    HE3  TRP  47           HE3      TRP  47  12.790  -9.346   4.715
  330    HZ2  TRP  47           HZ2      TRP  47  15.345 -13.136   2.547
  331    HZ3  TRP  47           HZ3      TRP  47  15.093  -9.036   3.812
  332    HH2  TRP  47           HH2      TRP  47  16.363 -10.838   2.757
  333    H    CYS  48           H        CYS  48   8.036  -9.508   2.462
  334    HA   CYS  48           HA       CYS  48   7.140  -7.397   4.087
  335   1HB   CYS  48          1HB       CYS  48   9.606  -6.921   4.011
  336   2HB   CYS  48          2HB       CYS  48   9.437  -6.644   2.275
  337    H    PHE  49           H        PHE  49   5.159  -7.602   3.006
  338    HA   PHE  49           HA       PHE  49   5.229  -6.893   0.174
  339   1HB   PHE  49          1HB       PHE  49   3.148  -8.655   0.271
  340   2HB   PHE  49          2HB       PHE  49   4.792  -9.194  -0.086
  341    HD1  PHE  49           HD1      PHE  49   6.208  -9.656   2.171
  342    HD2  PHE  49           HD2      PHE  49   1.985  -9.873   1.816
  343    HE1  PHE  49           HE1      PHE  49   6.120 -11.189   4.157
  344    HE2  PHE  49           HE2      PHE  49   1.897 -11.406   3.802
  345    HZ   PHE  49           HZ       PHE  49   3.966 -12.047   4.948
  346    H    LYS  50           H        LYS  50   2.496  -6.978  -0.359
  347    HA   LYS  50           HA       LYS  50   1.408  -5.168   1.683
  348   1HB   LYS  50          1HB       LYS  50   0.257  -4.565  -0.826
  349   2HB   LYS  50          2HB       LYS  50   1.316  -3.548   0.168
  350   1HG   LYS  50          1HG       LYS  50   2.501  -5.715  -1.570
  351   2HG   LYS  50          2HG       LYS  50   2.011  -4.181  -2.311
  352   1HD   LYS  50          1HD       LYS  50   4.087  -4.674  -0.153
  353   2HD   LYS  50          2HD       LYS  50   4.323  -3.916  -1.736
  354   1HE   LYS  50          1HE       LYS  50   2.983  -2.795   0.740
  355   2HE   LYS  50          2HE       LYS  50   4.312  -2.096  -0.198
  356   1HZ   LYS  50          1HZ       LYS  50   1.536  -1.816  -0.562
  357   2HZ   LYS  50          2HZ       LYS  50   2.754  -0.970  -1.247
  358   3HZ   LYS  50          3HZ       LYS  50   2.235  -2.358  -1.935
  359    HA   PRO  51           HA       PRO  51  -1.340  -8.722   1.070
  360   1HB   PRO  51          1HB       PRO  51  -1.450  -9.561   3.667
  361   2HB   PRO  51          2HB       PRO  51  -0.347 -10.251   2.477
  362   1HG   PRO  51          1HG       PRO  51   0.176  -8.345   4.666
  363   2HG   PRO  51          2HG       PRO  51   1.347  -9.394   3.788
  364   1HD   PRO  51          1HD       PRO  51   0.928  -6.575   3.511
  365   2HD   PRO  51          2HD       PRO  51   1.978  -7.589   2.511
  366    H    LEU  52           H        LEU  52  -2.093  -8.125   4.343
  367    HA   LEU  52           HA       LEU  52  -4.586  -6.944   3.456
  368   1HB   LEU  52          1HB       LEU  52  -5.486  -7.728   5.337
  369   2HB   LEU  52          2HB       LEU  52  -4.104  -8.834   5.259
  370    HG   LEU  52           HG       LEU  52  -4.624  -6.524   7.101
  371   1HD1  LEU  52          1HD1      LEU  52  -3.395  -8.453   8.555
  372   2HD1  LEU  52          2HD1      LEU  52  -5.155  -8.347   8.309
  373   3HD1  LEU  52          3HD1      LEU  52  -4.178  -9.439   7.298
  374   1HD2  LEU  52          1HD2      LEU  52  -1.980  -7.339   7.593
  375   2HD2  LEU  52          2HD2      LEU  52  -2.079  -7.038   5.842
  376   3HD2  LEU  52          3HD2      LEU  52  -2.544  -5.760   6.992
  377    H    GLN  53           H        GLN  53  -2.117  -5.415   3.069
  378    HA   GLN  53           HA       GLN  53  -1.655  -3.619   5.081
  379   1HB   GLN  53          1HB       GLN  53  -1.469  -3.350   2.062
  380   2HB   GLN  53          2HB       GLN  53  -0.873  -2.101   3.169
  381   1HG   GLN  53          1HG       GLN  53   0.025  -5.011   3.054
  382   2HG   GLN  53          2HG       GLN  53   0.960  -3.614   2.498
  383   1HE2  GLN  53          1HE2      GLN  53   0.569  -1.784   4.441
  384   2HE2  GLN  53          2HE2      GLN  53   1.225  -2.310   5.956
  385    H    GLU  54           H        GLU  54  -4.441  -3.995   3.019
  386    HA   GLU  54           HA       GLU  54  -5.386  -1.519   2.670
  387   1HB   GLU  54          1HB       GLU  54  -7.623  -2.484   2.691
  388   2HB   GLU  54          2HB       GLU  54  -6.500  -3.636   1.949
  389   1HG   GLU  54          1HG       GLU  54  -6.878  -5.177   3.566
  390   2HG   GLU  54          2HG       GLU  54  -6.698  -3.989   4.865
  391    H    ALA  55           H        ALA  55  -4.836  -3.151   5.718
  392    HA   ALA  55           HA       ALA  55  -6.597  -2.210   7.471
  393   1HB   ALA  55          1HB       ALA  55  -5.031  -3.065   8.832
  394   2HB   ALA  55          2HB       ALA  55  -3.859  -3.052   7.491
  395   3HB   ALA  55          3HB       ALA  55  -4.004  -1.635   8.559
  396    H    GLU  56           H        GLU  56  -3.640  -0.279   6.582
  397    HA   GLU  56           HA       GLU  56  -5.330   2.074   6.733
  398   1HB   GLU  56          1HB       GLU  56  -3.225   1.349   8.608
  399   2HB   GLU  56          2HB       GLU  56  -2.847   2.887   7.813
  400   1HG   GLU  56          1HG       GLU  56  -5.489   3.263   8.358
  401   2HG   GLU  56          2HG       GLU  56  -5.065   2.185   9.696
  402    H    CYS  57           H        CYS  57  -4.008   0.351   4.587
  403    HA   CYS  57           HA       CYS  57  -2.115   2.304   3.530
  404   1HB   CYS  57          1HB       CYS  57  -1.101   0.655   2.368
  405   2HB   CYS  57          2HB       CYS  57  -1.699  -0.282   3.739
  406    H    THR  58           H        THR  58  -4.935   0.213   2.555
  407    HA   THR  58           HA       THR  58  -5.402   1.592   0.139
  408    HB   THR  58           HB       THR  58  -6.121  -0.796   0.992
  409    HG1  THR  58           HG1      THR  58  -6.742   0.233  -1.053
  410   1HG2  THR  58          1HG2      THR  58  -7.457   0.115   2.974
  411   2HG2  THR  58          2HG2      THR  58  -8.556   0.875   1.798
  412   3HG2  THR  58          3HG2      THR  58  -8.408  -0.898   1.862
  413    H    PHE  59           H        PHE  59  -6.681   1.986   3.474
  414    HA   PHE  59           HA       PHE  59  -8.769   3.570   3.191
  415   1HB   PHE  59          1HB       PHE  59  -7.537   2.977   5.310
  416   2HB   PHE  59          2HB       PHE  59  -6.253   4.114   4.881
  417    HD1  PHE  59           HD1      PHE  59  -9.990   4.272   5.041
  418    HD2  PHE  59           HD2      PHE  59  -6.287   5.993   6.199
  419    HE1  PHE  59           HE1      PHE  59 -11.216   6.093   6.258
  420    HE2  PHE  59           HE2      PHE  59  -7.514   7.813   7.416
  421    HZ   PHE  59           HZ       PHE  59  -9.964   7.842   7.431
  422   1H    GLU   1           H1       GLU   1 -18.748  -2.043   3.434
  423    HA   GLU   1           HA       GLU   1 -18.004  -2.993   1.362
  424   1HB   GLU   1          1HB       GLU   1 -19.599  -3.145  -0.522
  425   2HB   GLU   1          2HB       GLU   1 -20.089  -4.191   0.823
  426   1HG   GLU   1          1HG       GLU   1 -21.252  -1.592   1.223
  427   2HG   GLU   1          2HG       GLU   1 -21.576  -2.077  -0.449
  428    H    GLU   2           H        GLU   2 -17.536  -0.636   2.592
  429    HA   GLU   2           HA       GLU   2 -18.539   1.474   0.909
  430   1HB   GLU   2          1HB       GLU   2 -17.042   1.307   3.506
  431   2HB   GLU   2          2HB       GLU   2 -16.912   2.802   2.565
  432   1HG   GLU   2          1HG       GLU   2 -19.570   2.514   2.440
  433   2HG   GLU   2          2HG       GLU   2 -19.311   1.578   3.920
  434    H    TYR   3           H        TYR   3 -17.432   0.521  -1.046
  435    HA   TYR   3           HA       TYR   3 -14.537   0.781  -1.030
  436   1HB   TYR   3          1HB       TYR   3 -15.297   0.104  -3.573
  437   2HB   TYR   3          2HB       TYR   3 -15.188  -1.108  -2.292
  438    HD1  TYR   3           HD1      TYR   3 -16.967  -2.582  -2.200
  439    HD2  TYR   3           HD2      TYR   3 -17.698   1.435  -3.475
  440    HE1  TYR   3           HE1      TYR   3 -19.426  -3.130  -2.539
  441    HE2  TYR   3           HE2      TYR   3 -20.154   0.874  -3.809
  442    HH   TYR   3           HH       TYR   3 -21.708  -1.236  -2.534
  443    H    VAL   4           H        VAL   4 -14.786   3.209  -0.621
  444    HA   VAL   4           HA       VAL   4 -15.014   4.521  -3.231
  445    HB   VAL   4           HB       VAL   4 -15.788   6.469  -1.499
  446   1HG1  VAL   4          1HG1      VAL   4 -17.529   6.557  -2.906
  447   2HG1  VAL   4          2HG1      VAL   4 -16.837   5.116  -3.689
  448   3HG1  VAL   4          3HG1      VAL   4 -18.091   4.934  -2.439
  449   1HG2  VAL   4          1HG2      VAL   4 -17.380   5.657   0.074
  450   2HG2  VAL   4          2HG2      VAL   4 -17.260   3.996  -0.554
  451   3HG2  VAL   4          3HG2      VAL   4 -15.893   4.714   0.329
  452    H    GLY   5           H        GLY   5 -13.988   4.997   0.226
  453   1HA   GLY   5          1HA       GLY   5 -11.961   6.866  -0.424
  454   2HA   GLY   5          2HA       GLY   5 -12.172   6.011   1.090
  455    H    LEU   6           H        LEU   6 -12.128   3.751  -1.468
  456    HA   LEU   6           HA       LEU   6  -9.274   3.577  -1.708
  457   1HB   LEU   6          1HB       LEU   6  -9.467   1.119  -0.843
  458   2HB   LEU   6          2HB       LEU   6  -9.121   2.467   0.255
  459    HG   LEU   6           HG       LEU   6 -10.753   0.780   1.113
  460   1HD1  LEU   6          1HD1      LEU   6 -10.645   3.380   1.619
  461   2HD1  LEU   6          2HD1      LEU   6 -12.271   3.341   0.896
  462   3HD1  LEU   6          3HD1      LEU   6 -11.906   2.336   2.319
  463   1HD2  LEU   6          1HD2      LEU   6 -12.766   0.319   0.152
  464   2HD2  LEU   6          2HD2      LEU   6 -12.897   1.917  -0.622
  465   3HD2  LEU   6          3HD2      LEU   6 -11.826   0.676  -1.316
  466    H    SER   7           H        SER   7 -11.692   3.985  -3.389
  467    HA   SER   7           HA       SER   7 -11.619   1.483  -4.875
  468   1HB   SER   7          1HB       SER   7 -13.771   3.076  -4.062
  469   2HB   SER   7          2HB       SER   7 -13.593   3.459  -5.785
  470    HG   SER   7           HG       SER   7 -13.976   1.329  -6.325
  471    H    ALA   8           H        ALA   8 -11.643   1.733  -7.335
  472    HA   ALA   8           HA       ALA   8  -9.487   3.288  -8.156
  473   1HB   ALA   8          1HB       ALA   8 -11.376   2.609 -10.287
  474   2HB   ALA   8          2HB       ALA   8  -9.723   2.014 -10.000
  475   3HB   ALA   8          3HB       ALA   8 -11.101   1.244  -9.178
  476    H    ASN   9           H        ASN   9  -9.792   5.465  -7.451
  477    HA   ASN   9           HA       ASN   9 -10.652   7.216  -9.242
  478   1HB   ASN   9          1HB       ASN   9 -12.961   5.984  -8.043
  479   2HB   ASN   9          2HB       ASN   9 -12.902   7.657  -7.470
  480   1HD2  ASN   9          1HD2      ASN   9 -12.298   9.267  -9.248
  481   2HD2  ASN   9          2HD2      ASN   9 -13.136   9.116 -10.755
  482    H    GLN  10           H        GLN  10 -10.313   6.170  -5.897
  483    HA   GLN  10           HA       GLN  10 -10.485   8.599  -4.605
  484   1HB   GLN  10          1HB       GLN  10  -9.915   5.944  -3.936
  485   2HB   GLN  10          2HB       GLN  10  -8.451   6.821  -3.457
  486   1HG   GLN  10          1HG       GLN  10 -10.862   8.289  -2.708
  487   2HG   GLN  10          2HG       GLN  10 -10.894   6.653  -2.036
  488   1HE2  GLN  10          1HE2      GLN  10  -8.488   5.998  -1.361
  489   2HE2  GLN  10          2HE2      GLN  10  -7.737   7.097  -0.253
  490    H    CYS  11           H        CYS  11  -7.854   7.078  -6.477
  491    HA   CYS  11           HA       CYS  11  -5.882   8.921  -5.591
  492   1HB   CYS  11          1HB       CYS  11  -5.334   6.666  -6.352
  493   2HB   CYS  11          2HB       CYS  11  -5.898   7.062  -7.978
  494    H    ALA  12           H        ALA  12  -8.677   9.337  -7.335
  495    HA   ALA  12           HA       ALA  12  -7.456  11.310  -9.138
  496   1HB   ALA  12          1HB       ALA  12  -8.992   9.232  -9.874
  497   2HB   ALA  12          2HB       ALA  12 -10.284  10.387  -9.472
  498   3HB   ALA  12          3HB       ALA  12  -9.067  10.806 -10.701
  499    H    VAL  13           H        VAL  13  -8.581  11.132  -6.100
  500    HA   VAL  13           HA       VAL  13 -10.738  12.681  -5.738
  501    HB   VAL  13           HB       VAL  13  -8.629  11.755  -4.222
  502   1HG1  VAL  13          1HG1      VAL  13  -8.775  14.766  -3.850
  503   2HG1  VAL  13          2HG1      VAL  13  -7.813  13.615  -2.890
  504   3HG1  VAL  13          3HG1      VAL  13  -7.420  13.892  -4.604
  505   1HG2  VAL  13          1HG2      VAL  13 -11.294  12.712  -3.862
  506   2HG2  VAL  13          2HG2      VAL  13 -10.348  11.634  -2.809
  507   3HG2  VAL  13          3HG2      VAL  13 -10.285  13.396  -2.566
  508    HA   PRO  14           HA       PRO  14  -9.926  16.662  -7.209
  509   1HB   PRO  14          1HB       PRO  14 -11.208  18.283  -5.423
  510   2HB   PRO  14          2HB       PRO  14 -12.046  17.401  -6.699
  511   1HG   PRO  14          1HG       PRO  14 -11.871  16.842  -3.807
  512   2HG   PRO  14          2HG       PRO  14 -13.086  16.246  -4.994
  513   1HD   PRO  14          1HD       PRO  14 -10.888  14.828  -3.828
  514   2HD   PRO  14          2HD       PRO  14 -11.958  14.246  -5.111
  515    H    ALA  15           H        ALA  15  -7.914  15.465  -5.405
  516    HA   ALA  15           HA       ALA  15  -6.113  16.077  -4.256
  517   1HB   ALA  15          1HB       ALA  15  -4.780  17.284  -5.623
  518   2HB   ALA  15          2HB       ALA  15  -6.204  17.444  -6.678
  519   3HB   ALA  15          3HB       ALA  15  -5.819  18.724  -5.501
  520    H    LYS  16           H        LYS  16  -7.711  16.255  -2.366
  521    HA   LYS  16           HA       LYS  16  -7.024  18.252  -0.695
  522   1HB   LYS  16          1HB       LYS  16  -9.333  19.565  -0.828
  523   2HB   LYS  16          2HB       LYS  16  -7.893  20.083  -1.722
  524   1HG   LYS  16          1HG       LYS  16  -8.919  19.725  -3.699
  525   2HG   LYS  16          2HG       LYS  16  -9.393  18.083  -3.235
  526   1HD   LYS  16          1HD       LYS  16 -10.850  20.596  -2.322
  527   2HD   LYS  16          2HD       LYS  16 -11.325  19.664  -3.753
  528   1HE   LYS  16          1HE       LYS  16 -11.258  17.643  -1.991
  529   2HE   LYS  16          2HE       LYS  16 -11.535  18.952  -0.832
  530   1HZ   LYS  16          1HZ       LYS  16 -13.432  17.731  -2.250
  531   2HZ   LYS  16          2HZ       LYS  16 -13.592  19.214  -1.587
  532   3HZ   LYS  16          3HZ       LYS  16 -13.183  19.063  -3.160
  533    H    ASP  17           H        ASP  17  -7.379  15.581  -0.433
  534    HA   ASP  17           HA       ASP  17  -9.317  15.514   1.623
  535   1HB   ASP  17          1HB       ASP  17 -10.653  15.053  -0.503
  536   2HB   ASP  17          2HB       ASP  17  -9.694  13.579  -0.705
  537    H    ARG  18           H        ARG  18  -6.869  14.091  -0.521
  538    HA   ARG  18           HA       ARG  18  -6.503  11.639   0.476
  539   1HB   ARG  18          1HB       ARG  18  -4.320  13.663  -0.209
  540   2HB   ARG  18          2HB       ARG  18  -4.087  11.906  -0.154
  541   1HG   ARG  18          1HG       ARG  18  -5.134  11.583  -2.161
  542   2HG   ARG  18          2HG       ARG  18  -6.349  12.839  -1.859
  543   1HD   ARG  18          1HD       ARG  18  -4.707  14.586  -2.402
  544   2HD   ARG  18          2HD       ARG  18  -3.432  13.376  -2.603
  545    HE   ARG  18           HE       ARG  18  -5.832  13.034  -4.297
  546   1HH1  ARG  18          1HH1      ARG  18  -2.543  14.259  -4.045
  547   2HH1  ARG  18          2HH1      ARG  18  -2.296  14.316  -5.758
  548   1HH2  ARG  18          1HH2      ARG  18  -5.507  13.108  -6.558
  549   2HH2  ARG  18          2HH2      ARG  18  -3.993  13.656  -7.197
  550    H    VAL  19           H        VAL  19  -4.310  11.033   1.842
  551    HA   VAL  19           HA       VAL  19  -4.568  12.540   4.348
  552    HB   VAL  19           HB       VAL  19  -3.577   9.716   3.960
  553   1HG1  VAL  19          1HG1      VAL  19  -3.855  11.531   6.238
  554   2HG1  VAL  19          2HG1      VAL  19  -4.685   9.977   6.491
  555   3HG1  VAL  19          3HG1      VAL  19  -2.951  10.004   6.093
  556   1HG2  VAL  19          1HG2      VAL  19  -5.727   9.331   3.308
  557   2HG2  VAL  19          2HG2      VAL  19  -5.992   9.331   5.068
  558   3HG2  VAL  19          3HG2      VAL  19  -6.353  10.789   4.113
  559    H    ASP  20           H        ASP  20  -2.847  13.024   1.821
  560    HA   ASP  20           HA       ASP  20  -0.723  13.284   1.265
  561   1HB   ASP  20          1HB       ASP  20  -0.859  15.379   2.218
  562   2HB   ASP  20          2HB       ASP  20  -1.263  14.749   3.822
  563    H    CYS  21           H        CYS  21   0.137  11.080   1.324
  564    HA   CYS  21           HA       CYS  21   0.779   9.563   3.418
  565   1HB   CYS  21          1HB       CYS  21   1.075   9.050   0.987
  566   2HB   CYS  21          2HB       CYS  21   2.615   9.911   1.043
  567    H    GLY  22           H        GLY  22   2.588  12.403   2.138
  568   1HA   GLY  22          1HA       GLY  22   4.172  13.701   3.062
  569   2HA   GLY  22          2HA       GLY  22   3.705  13.066   4.627
  570    H    TYR  23           H        TYR  23   5.105  11.434   1.698
  571    HA   TYR  23           HA       TYR  23   7.058  10.169   3.441
  572   1HB   TYR  23          1HB       TYR  23   5.663   9.785   0.847
  573   2HB   TYR  23          2HB       TYR  23   7.391   9.449   0.702
  574    HD1  TYR  23           HD1      TYR  23   4.920   7.537   0.465
  575    HD2  TYR  23           HD2      TYR  23   7.682   8.397   3.616
  576    HE1  TYR  23           HE1      TYR  23   4.537   5.221   1.442
  577    HE2  TYR  23           HE2      TYR  23   7.291   6.078   4.582
  578    HH   TYR  23           HH       TYR  23   4.726   4.206   3.788
  579    HA   PRO  24           HA       PRO  24  10.153  12.943   2.158
  580   1HB   PRO  24          1HB       PRO  24  12.286  11.729   3.358
  581   2HB   PRO  24          2HB       PRO  24  11.201  12.828   4.205
  582   1HG   PRO  24          1HG       PRO  24  11.365   9.883   4.293
  583   2HG   PRO  24          2HG       PRO  24  10.614  11.002   5.487
  584   1HD   PRO  24          1HD       PRO  24   9.320   9.328   3.556
  585   2HD   PRO  24          2HD       PRO  24   8.546  10.528   4.600
  586    H    HIS  25           H        HIS  25   9.672   9.892   1.045
  587    HA   HIS  25           HA       HIS  25  11.884  10.249  -0.847
  588   1HB   HIS  25          1HB       HIS  25  11.093   7.974   0.778
  589   2HB   HIS  25          2HB       HIS  25  11.126   7.563  -0.940
  590    HD1  HIS  25           HD1      HIS  25  13.340   8.591   1.931
  591    HD2  HIS  25           HD2      HIS  25  13.695   7.572  -2.122
  592    HE1  HIS  25           HE1      HIS  25  15.830   8.242   1.498
  593    HE2  HIS  25           HE2      HIS  25  15.981   7.565  -0.995
  594    H    VAL  26           H        VAL  26   8.834  11.058  -0.620
  595    HA   VAL  26           HA       VAL  26   7.234   9.724  -2.304
  596    HB   VAL  26           HB       VAL  26   6.385  11.613  -1.259
  597   1HG1  VAL  26          1HG1      VAL  26   8.950  12.721  -1.724
  598   2HG1  VAL  26          2HG1      VAL  26   7.772  13.829  -2.470
  599   3HG1  VAL  26          3HG1      VAL  26   7.623  13.397  -0.749
  600   1HG2  VAL  26          1HG2      VAL  26   5.247  12.735  -2.942
  601   2HG2  VAL  26          2HG2      VAL  26   6.668  12.793  -4.013
  602   3HG2  VAL  26          3HG2      VAL  26   5.789  11.261  -3.782
  603    H    THR  27           H        THR  27   7.197   9.106  -4.416
  604    HA   THR  27           HA       THR  27   8.431  10.633  -6.459
  605    HB   THR  27           HB       THR  27  10.082   8.712  -5.001
  606    HG1  THR  27           HG1      THR  27  10.685  10.070  -7.491
  607   1HG2  THR  27          1HG2      THR  27  11.037   7.930  -7.382
  608   2HG2  THR  27          2HG2      THR  27   9.789   6.967  -6.556
  609   3HG2  THR  27          3HG2      THR  27   9.332   8.082  -7.866
  610    HA   PRO  28           HA       PRO  28   5.644   8.284  -8.719
  611   1HB   PRO  28          1HB       PRO  28   6.581   8.608 -11.264
  612   2HB   PRO  28          2HB       PRO  28   5.615   9.824 -10.429
  613   1HG   PRO  28          1HG       PRO  28   8.517   9.739 -10.957
  614   2HG   PRO  28          2HG       PRO  28   7.491  11.161 -10.552
  615   1HD   PRO  28          1HD       PRO  28   9.324   9.750  -8.865
  616   2HD   PRO  28          2HD       PRO  28   8.220  11.042  -8.375
  617    H    LYS  29           H        LYS  29   7.337   6.648  -7.357
  618    HA   LYS  29           HA       LYS  29   7.093   4.312  -8.817
  619   1HB   LYS  29          1HB       LYS  29   8.976   5.605 -10.090
  620   2HB   LYS  29          2HB       LYS  29  10.005   5.035  -8.763
  621   1HG   LYS  29          1HG       LYS  29   9.952   2.887  -9.504
  622   2HG   LYS  29          2HG       LYS  29   8.222   2.948  -9.885
  623   1HD   LYS  29          1HD       LYS  29   8.860   4.357 -11.922
  624   2HD   LYS  29          2HD       LYS  29  10.550   3.943 -11.586
  625   1HE   LYS  29          1HE       LYS  29  10.204   1.656 -12.053
  626   2HE   LYS  29          2HE       LYS  29   8.454   1.761 -11.814
  627   1HZ   LYS  29          1HZ       LYS  29   8.983   3.483 -13.829
  628   2HZ   LYS  29          2HZ       LYS  29   9.982   2.230 -14.146
  629   3HZ   LYS  29          3HZ       LYS  29   8.376   1.975 -13.996
  630    H    GLU  30           H        GLU  30   8.132   6.294  -6.195
  631    HA   GLU  30           HA       GLU  30   8.935   3.951  -4.682
  632   1HB   GLU  30          1HB       GLU  30   9.636   6.791  -4.651
  633   2HB   GLU  30          2HB       GLU  30   9.221   6.206  -3.032
  634   1HG   GLU  30          1HG       GLU  30  11.576   5.847  -3.315
  635   2HG   GLU  30          2HG       GLU  30  10.822   4.254  -3.461
  636    H    CYS  31           H        CYS  31   6.632   6.733  -4.691
  637    HA   CYS  31           HA       CYS  31   5.394   6.202  -2.292
  638   1HB   CYS  31          1HB       CYS  31   4.457   7.487  -4.839
  639   2HB   CYS  31          2HB       CYS  31   3.373   7.306  -3.456
  640    H    ASN  32           H        ASN  32   4.467   5.171  -5.662
  641    HA   ASN  32           HA       ASN  32   2.360   3.587  -4.874
  642   1HB   ASN  32          1HB       ASN  32   4.114   3.841  -7.291
  643   2HB   ASN  32          2HB       ASN  32   3.200   2.332  -7.164
  644   1HD2  ASN  32          1HD2      ASN  32   2.504   5.683  -6.193
  645   2HD2  ASN  32          2HD2      ASN  32   1.044   5.879  -7.103
  646    H    ASN  33           H        ASN  33   5.755   3.228  -4.402
  647    HA   ASN  33           HA       ASN  33   5.629   0.343  -4.392
  648   1HB   ASN  33          1HB       ASN  33   7.603   1.659  -5.354
  649   2HB   ASN  33          2HB       ASN  33   7.999   2.151  -3.701
  650   1HD2  ASN  33          1HD2      ASN  33  10.008   1.015  -4.573
  651   2HD2  ASN  33          2HD2      ASN  33  10.178  -0.669  -4.206
  652    H    ARG  34           H        ARG  34   5.577   3.194  -2.310
  653    HA   ARG  34           HA       ARG  34   6.282   1.686   0.020
  654   1HB   ARG  34          1HB       ARG  34   5.276   4.557  -0.220
  655   2HB   ARG  34          2HB       ARG  34   6.047   3.845   1.208
  656   1HG   ARG  34          1HG       ARG  34   7.803   3.369  -0.974
  657   2HG   ARG  34          2HG       ARG  34   7.272   5.050  -1.142
  658   1HD   ARG  34          1HD       ARG  34   8.373   5.710   0.754
  659   2HD   ARG  34          2HD       ARG  34   7.990   4.222   1.631
  660    HE   ARG  34           HE       ARG  34   9.818   3.508  -0.393
  661   1HH1  ARG  34          1HH1      ARG  34   9.788   5.612   2.426
  662   2HH1  ARG  34          2HH1      ARG  34  11.490   5.462   2.715
  663   1HH2  ARG  34          1HH2      ARG  34  12.063   3.310  -0.013
  664   2HH2  ARG  34          2HH2      ARG  34  12.792   4.144   1.318
  665    H    GLY  35           H        GLY  35   3.438   2.729  -1.769
  666   1HA   GLY  35          1HA       GLY  35   1.429   1.436  -1.260
  667   2HA   GLY  35          2HA       GLY  35   1.714   1.767   0.436
  668    H    CYS  36           H        CYS  36   2.490   4.306  -1.885
  669    HA   CYS  36           HA       CYS  36   0.010   5.663  -1.111
  670   1HB   CYS  36          1HB       CYS  36   2.606   7.075  -1.671
  671   2HB   CYS  36          2HB       CYS  36   1.140   7.725  -0.932
  672    H    CYS  37           H        CYS  37  -0.270   7.659  -2.799
  673    HA   CYS  37           HA       CYS  37   0.221   6.503  -5.448
  674   1HB   CYS  37          1HB       CYS  37  -2.180   6.649  -4.524
  675   2HB   CYS  37          2HB       CYS  37  -2.045   8.383  -4.831
  676    H    PHE  38           H        PHE  38   1.285   7.834  -6.928
  677    HA   PHE  38           HA       PHE  38   2.264  10.343  -5.873
  678   1HB   PHE  38          1HB       PHE  38   3.602   8.488  -7.095
  679   2HB   PHE  38          2HB       PHE  38   2.728   8.930  -8.565
  680    HD1  PHE  38           HD1      PHE  38   5.145  10.126  -6.042
  681    HD2  PHE  38           HD2      PHE  38   3.376  10.828  -9.834
  682    HE1  PHE  38           HE1      PHE  38   6.871  11.885  -6.522
  683    HE2  PHE  38           HE2      PHE  38   5.101  12.587 -10.314
  684    HZ   PHE  38           HZ       PHE  38   6.828  13.094  -8.652
  685    H    ASP  39           H        ASP  39   1.424  12.312  -6.378
  686    HA   ASP  39           HA       ASP  39  -0.835  12.468  -8.000
  687   1HB   ASP  39          1HB       ASP  39  -0.601  14.074  -6.261
  688   2HB   ASP  39          2HB       ASP  39   1.040  14.510  -6.760
  689    H    SER  40           H        SER  40   1.666  14.941  -8.509
  690    HA   SER  40           HA       SER  40   3.113  15.239 -10.188
  691   1HB   SER  40          1HB       SER  40   2.782  12.698 -10.733
  692   2HB   SER  40          2HB       SER  40   1.689  13.277 -12.002
  693    HG   SER  40           HG       SER  40   4.478  13.987 -11.660
  694    H    ARG  41           H        ARG  41  -0.301  15.297 -10.088
  695    HA   ARG  41           HA       ARG  41  -0.553  16.769 -12.541
  696   1HB   ARG  41          1HB       ARG  41  -2.676  16.216 -10.422
  697   2HB   ARG  41          2HB       ARG  41  -2.963  16.701 -12.101
  698   1HG   ARG  41          1HG       ARG  41  -1.474  14.466 -12.510
  699   2HG   ARG  41          2HG       ARG  41  -2.228  14.030 -10.966
  700   1HD   ARG  41          1HD       ARG  41  -3.718  13.223 -12.637
  701   2HD   ARG  41          2HD       ARG  41  -4.470  14.722 -12.069
  702    HE   ARG  41           HE       ARG  41  -3.078  14.304 -14.669
  703   1HH1  ARG  41          1HH1      ARG  41  -4.847  16.448 -12.510
  704   2HH1  ARG  41          2HH1      ARG  41  -5.193  17.613 -13.744
  705   1HH2  ARG  41          1HH2      ARG  41  -3.532  15.843 -16.296
  706   2HH2  ARG  41          2HH2      ARG  41  -4.439  17.268 -15.912
  707    H    ILE  42           H        ILE  42  -1.382  17.249  -9.021
  708    HA   ILE  42           HA       ILE  42  -1.077  20.133  -9.481
  709    HB   ILE  42           HB       ILE  42  -2.443  19.106  -7.059
  710   1HG1  ILE  42          1HG1      ILE  42  -3.595  18.865  -9.839
  711   2HG1  ILE  42          2HG1      ILE  42  -3.428  17.594  -8.616
  712   1HG2  ILE  42          1HG2      ILE  42  -3.848  21.061  -7.427
  713   2HG2  ILE  42          2HG2      ILE  42  -2.126  21.506  -7.461
  714   3HG2  ILE  42          3HG2      ILE  42  -3.041  21.371  -8.982
  715   1HD1  ILE  42          1HD1      ILE  42  -5.406  19.861  -8.784
  716   2HD1  ILE  42          2HD1      ILE  42  -5.673  18.157  -8.348
  717   3HD1  ILE  42          3HD1      ILE  42  -4.931  19.270  -7.174
  718    HA   PRO  43           HA       PRO  43   2.492  19.598  -7.025
  719   1HB   PRO  43          1HB       PRO  43   3.465  22.135  -7.305
  720   2HB   PRO  43          2HB       PRO  43   3.785  20.847  -8.464
  721   1HG   PRO  43          1HG       PRO  43   1.924  23.131  -8.632
  722   2HG   PRO  43          2HG       PRO  43   2.592  22.125  -9.968
  723   1HD   PRO  43          1HD       PRO  43  -0.036  22.060  -8.832
  724   2HD   PRO  43          2HD       PRO  43   0.622  20.943 -10.035
  725    H    GLY  44           H        GLY  44  -0.195  21.504  -6.450
  726   1HA   GLY  44          1HA       GLY  44   0.808  22.511  -3.904
  727   2HA   GLY  44          2HA       GLY  44  -0.740  22.846  -4.653
  728    H    VAL  45           H        VAL  45  -0.565  19.616  -5.135
  729    HA   VAL  45           HA       VAL  45  -1.881  19.064  -2.572
  730    HB   VAL  45           HB       VAL  45  -2.751  18.759  -5.175
  731   1HG1  VAL  45          1HG1      VAL  45  -2.993  16.294  -5.463
  732   2HG1  VAL  45          2HG1      VAL  45  -1.311  16.860  -5.595
  733   3HG1  VAL  45          3HG1      VAL  45  -1.867  16.058  -4.106
  734   1HG2  VAL  45          1HG2      VAL  45  -4.256  16.955  -3.626
  735   2HG2  VAL  45          2HG2      VAL  45  -3.653  18.180  -2.484
  736   3HG2  VAL  45          3HG2      VAL  45  -4.590  18.679  -3.912
  737    HA   PRO  46           HA       PRO  46   1.052  16.020  -1.656
  738   1HB   PRO  46          1HB       PRO  46  -0.380  13.893  -0.710
  739   2HB   PRO  46          2HB       PRO  46  -0.044  15.333   0.250
  740   1HG   PRO  46          1HG       PRO  46  -2.524  14.501  -1.113
  741   2HG   PRO  46          2HG       PRO  46  -2.323  15.683   0.230
  742   1HD   PRO  46          1HD       PRO  46  -2.808  16.206  -2.543
  743   2HD   PRO  46          2HD       PRO  46  -2.459  17.403  -1.290
  744    H    TRP  47           H        TRP  47   2.415  15.176  -3.089
  745    HA   TRP  47           HA       TRP  47   1.231  13.594  -5.201
  746   1HB   TRP  47          1HB       TRP  47   4.137  13.769  -5.123
  747   2HB   TRP  47          2HB       TRP  47   3.002  14.177  -6.411
  748    HD1  TRP  47           HD1      TRP  47   1.933  16.765  -6.250
  749    HE1  TRP  47           HE1      TRP  47   2.922  19.039  -5.345
  750    HE3  TRP  47           HE3      TRP  47   5.604  14.655  -3.434
  751    HZ2  TRP  47           HZ2      TRP  47   5.079  19.684  -3.592
  752    HZ3  TRP  47           HZ3      TRP  47   7.108  16.178  -2.158
  753    HH2  TRP  47           HH2      TRP  47   6.891  18.612  -2.205
  754    H    CYS  48           H        CYS  48   1.092  12.644  -2.383
  755    HA   CYS  48           HA       CYS  48   1.963  10.011  -2.852
  756   1HB   CYS  48          1HB       CYS  48   4.086  11.359  -2.123
  757   2HB   CYS  48          2HB       CYS  48   3.395  11.198  -0.506
  758    H    PHE  49           H        PHE  49  -0.193   9.476  -2.319
  759    HA   PHE  49           HA       PHE  49  -0.845   9.833   0.503
  760   1HB   PHE  49          1HB       PHE  49  -3.290  10.122  -0.623
  761   2HB   PHE  49          2HB       PHE  49  -2.239  11.524  -0.391
  762    HD1  PHE  49           HD1      PHE  49  -0.536  11.871  -2.447
  763    HD2  PHE  49           HD2      PHE  49  -4.285   9.896  -2.668
  764    HE1  PHE  49           HE1      PHE  49  -0.632  12.330  -4.913
  765    HE2  PHE  49           HE2      PHE  49  -4.382  10.354  -5.134
  766    HZ   PHE  49           HZ       PHE  49  -2.554  11.565  -6.228
  767    H    LYS  50           H        LYS  50  -3.235   8.565   0.692
  768    HA   LYS  50           HA       LYS  50  -2.709   5.955  -0.549
  769   1HB   LYS  50          1HB       LYS  50  -3.403   6.737   2.246
  770   2HB   LYS  50          2HB       LYS  50  -4.035   5.205   1.620
  771   1HG   LYS  50          1HG       LYS  50  -2.026   4.236   1.916
  772   2HG   LYS  50          2HG       LYS  50  -1.253   5.439   0.868
  773   1HD   LYS  50          1HD       LYS  50  -1.685   6.855   3.216
  774   2HD   LYS  50          2HD       LYS  50  -1.298   5.236   3.822
  775   1HE   LYS  50          1HE       LYS  50   0.704   5.323   2.165
  776   2HE   LYS  50          2HE       LYS  50   0.389   7.061   2.068
  777   1HZ   LYS  50          1HZ       LYS  50   0.512   5.947   4.714
  778   2HZ   LYS  50          2HZ       LYS  50   1.923   5.946   3.893
  779   3HZ   LYS  50          3HZ       LYS  50   1.125   7.348   4.143
  780    HA   PRO  51           HA       PRO  51  -6.752   7.455  -1.926
  781   1HB   PRO  51          1HB       PRO  51  -6.345   7.175  -4.612
  782   2HB   PRO  51          2HB       PRO  51  -6.104   8.696  -3.754
  783   1HG   PRO  51          1HG       PRO  51  -4.128   6.746  -4.752
  784   2HG   PRO  51          2HG       PRO  51  -3.880   8.478  -4.326
  785   1HD   PRO  51          1HD       PRO  51  -3.119   6.153  -2.838
  786   2HD   PRO  51          2HD       PRO  51  -2.999   7.834  -2.303
  787    H    LEU  52           H        LEU  52  -6.224   5.570  -4.674
  788    HA   LEU  52           HA       LEU  52  -7.875   3.498  -3.448
  789   1HB   LEU  52          1HB       LEU  52  -8.778   3.114  -5.466
  790   2HB   LEU  52          2HB       LEU  52  -8.354   4.824  -5.667
  791    HG   LEU  52           HG       LEU  52  -6.106   3.399  -6.547
  792   1HD1  LEU  52          1HD1      LEU  52  -6.819   1.355  -7.090
  793   2HD1  LEU  52          2HD1      LEU  52  -8.532   1.803  -6.907
  794   3HD1  LEU  52          3HD1      LEU  52  -7.681   2.145  -8.432
  795   1HD2  LEU  52          1HD2      LEU  52  -6.307   4.894  -8.175
  796   2HD2  LEU  52          2HD2      LEU  52  -7.834   4.168  -8.732
  797   3HD2  LEU  52          3HD2      LEU  52  -7.851   5.402  -7.449
  798    H    GLN  53           H        GLN  53  -5.132   3.671  -2.632
  799    HA   GLN  53           HA       GLN  53  -3.307   2.299  -4.002
  800   1HB   GLN  53          1HB       GLN  53  -3.966   2.163  -1.040
  801   2HB   GLN  53          2HB       GLN  53  -2.485   1.469  -1.725
  802   1HG   GLN  53          1HG       GLN  53  -3.366   4.385  -1.841
  803   2HG   GLN  53          2HG       GLN  53  -2.039   3.734  -0.866
  804   1HE2  GLN  53          1HE2      GLN  53  -1.117   1.872  -2.837
  805   2HE2  GLN  53          2HE2      GLN  53  -0.326   2.758  -4.099
  806    H    GLU  54           H        GLU  54  -6.332   1.059  -2.728
  807    HA   GLU  54           HA       GLU  54  -5.924  -1.509  -2.239
  808   1HB   GLU  54          1HB       GLU  54  -8.178  -1.949  -3.117
  809   2HB   GLU  54          2HB       GLU  54  -8.142  -0.408  -2.243
  810   1HG   GLU  54          1HG       GLU  54  -8.392   0.844  -4.183
  811   2HG   GLU  54          2HG       GLU  54  -7.616  -0.372  -5.210
  812    H    ALA  55           H        ALA  55  -5.437   0.109  -5.333
  813    HA   ALA  55           HA       ALA  55  -5.712  -1.748  -7.220
  814   1HB   ALA  55          1HB       ALA  55  -3.049  -0.540  -7.380
  815   2HB   ALA  55          2HB       ALA  55  -4.480  -0.278  -8.406
  816   3HB   ALA  55          3HB       ALA  55  -4.292   0.637  -6.891
  817    H    GLU  56           H        GLU  56  -2.414  -1.402  -5.771
  818    HA   GLU  56           HA       GLU  56  -2.322  -4.320  -5.761
  819   1HB   GLU  56          1HB       GLU  56  -0.560  -2.336  -6.984
  820   2HB   GLU  56          2HB       GLU  56   0.336  -3.404  -5.892
  821   1HG   GLU  56          1HG       GLU  56  -0.027  -5.256  -7.205
  822   2HG   GLU  56          2HG       GLU  56  -1.639  -4.729  -7.707
  823    H    CYS  57           H        CYS  57  -3.111  -2.263  -3.643
  824    HA   CYS  57           HA       CYS  57  -0.923  -2.636  -1.758
  825   1HB   CYS  57          1HB       CYS  57  -2.042  -0.389  -2.174
  826   2HB   CYS  57          2HB       CYS  57  -3.439  -1.035  -1.307
  827    H    THR  58           H        THR  58  -4.557  -2.622  -1.515
  828    HA   THR  58           HA       THR  58  -4.773  -4.273   0.651
  829    HB   THR  58           HB       THR  58  -6.555  -2.892  -0.602
  830    HG1  THR  58           HG1      THR  58  -7.910  -4.216   0.572
  831   1HG2  THR  58          1HG2      THR  58  -6.000  -4.461  -2.779
  832   2HG2  THR  58          2HG2      THR  58  -7.297  -5.424  -2.030
  833   3HG2  THR  58          3HG2      THR  58  -7.600  -3.733  -2.498
  834    H    PHE  59           H        PHE  59  -3.965  -5.140  -2.682
  835    HA   PHE  59           HA       PHE  59  -4.511  -7.914  -2.278
  836   1HB   PHE  59          1HB       PHE  59  -3.348  -6.030  -4.323
  837   2HB   PHE  59          2HB       PHE  59  -2.821  -7.710  -4.457
  838    HD1  PHE  59           HD1      PHE  59  -4.261  -9.354  -5.366
  839    HD2  PHE  59           HD2      PHE  59  -5.778  -5.490  -4.486
  840    HE1  PHE  59           HE1      PHE  59  -6.371  -9.899  -6.611
  841    HE2  PHE  59           HE2      PHE  59  -7.889  -6.034  -5.732
  842    HZ   PHE  59           HZ       PHE  59  -8.160  -8.232  -6.780