*HEADER    TOXIN                                   25-NOV-03   1RL5              
*TITLE     NMR STRUCTURE WITH TIGHTLY BOUND WATER MOLECULE OF                    
*TITLE    2 CYTOTOXIN I FROM NAJA OXIANA IN AQUEOUS SOLUTION (MAJOR              
*TITLE    3 FORM)                                                                
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: CYTOTOXIN 1;                                               
*COMPND   3 CHAIN: A                                                             
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: NAJA OXIANA;                                    
*SOURCE   3 ORGANISM_COMMON: CENTRAL ASIAN COBRA;                                
*SOURCE   4 SECRETION: VENOME                                                    
*KEYWDS    S-TYPE CYTOTOXIN, MEMBRANE PERTURBATION, CIS/TRANS                    
*KEYWDS   2 ISOMERIZATION, BOUND WATER                                           
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    M.A.DUBINNYI, Y.E.PUSTOVALOVA, P.V.DUBOVSKII, Y.N.UTKIN,              
*AUTHOR   2 A.S.ARSENIEV                                                         
*REVDAT   1   15-FEB-05 1RL5    0                                                
#
# Distance constraints in format of CYANA-1.0.6
#
#######################################################
#                                                     #
# CONTENTS:                                           #
#                                                     #
# 1. Upper distance constraints from NOE values       #
# 2. Upper distance constraints for H-bonds           #
# 3. Lower distance constraints for H-bonds           #
# 4. Upper distance constraints for SS-bonds          #
# 5. Lower distance constraints for SS-bonds          #
#                                                     #
#######################################################
#
# 1. Upper distance constraints from NOE values
#
  2 LYS  HN      1 LEU  HA      2.50           
  2 LYS  HN      1 LEU  QB      6.38           
  2 LYS  QB      2 LYS  HN      3.55           
  3 CYS  HB3     3 CYS  HA      3.02           
  3 CYS  HN      2 LYS  HA      2.56           
  3 CYS  HN      2 LYS  QB      4.43           
  3 CYS  HN      3 CYS  HB2     3.10           
  3 CYS  HN      3 CYS  HB3     4.15           
  4 ASN  HD21    4 ASN  HB2     3.10           
  4 ASN  HN      3 CYS  HA      2.71           
  4 ASN  HN      3 CYS  HB2     5.50           
  4 ASN  HN      3 CYS  HB3     3.40           
  4 ASN  HN      4 ASN  HB2     2.98           
  4 ASN  HN      4 ASN  HB3     4.09           
  5 LYS  HB3     5 LYS  HA      2.99           
  5 LYS  HN      4 ASN  HA      2.53           
  5 LYS  HN      4 ASN  HB2     5.50           
  5 LYS  HN      5 LYS  HB2     2.80           
  5 LYS  QD      5 LYS  HN      5.72           
  5 LYS  QG      5 LYS  HN      5.69           
  6 LEU  HA      5 LYS  QE      6.38           
  6 LEU  HN      5 LYS  HA      2.92           
  6 LEU  HN      5 LYS  HB2     3.22           
  6 LEU  HN      5 LYS  HB3     2.80           
  6 LEU  HN      5 LYS  QD      5.42           
  6 LEU  HN      6 LEU  HB2     2.83           
  6 LEU  HN      6 LEU  HB3     3.10           
  6 LEU  QD1     6 LEU  HA      6.53           
  6 LEU  QD1     6 LEU  HN      6.53           
  6 LEU  QD2     6 LEU  HA      6.53           
  6 LEU  QD2     6 LEU  HN      6.53           
  6 LEU  QQD     6 LEU  HN      6.16           
  7 VAL  HN      5 LYS  HB2     3.25           
  7 VAL  HN      6 LEU  HB2     3.52           
  7 VAL  HN      6 LEU  HB3     3.07           
  7 VAL  HN      6 LEU  HN      3.25           
  7 VAL  HN      7 VAL  HB      2.83           
  8 PRO  HA      4 ASN  HB2     3.21           
  8 PRO  HA      4 ASN  HB3     2.93           
  8 PRO  HA      5 LYS  HN      3.67           
  8 PRO  HB3     4 ASN  HB3     4.00           
  8 PRO  HB3     8 PRO  HA      2.83           
  8 PRO  HD2     7 VAL  QG1     9.65           
  8 PRO  HD2     7 VAL  QG2     9.65           
  8 PRO  HD3     7 VAL  QG1     9.65           
  8 PRO  HD3     7 VAL  QG2     9.65           
  8 PRO  QD      7 VAL  HA      3.32           
  8 PRO  QD      7 VAL  HB      6.39           
  8 PRO  QD      7 VAL  QQG     7.37           
  9 ILE  HN      7 VAL  QQG     6.20           
  9 ILE  HN      8 PRO  HA      3.22           
  9 ILE  HN      8 PRO  HB3     4.54           
 10 ALA  HN      8 PRO  HA      3.49           
 10 ALA  HN      9 ILE  HA      3.34           
 10 ALA  HN      9 ILE  HN      2.83           
 11 TYR  HA      4 ASN  HA      2.68           
 11 TYR  HA      5 LYS  HN      2.95           
 11 TYR  HA      5 LYS  QG      5.07           
 11 TYR  HA     10 ALA  QB      6.53           
 11 TYR  HB2    11 TYR  HA      2.80           
 11 TYR  HB3     4 ASN  HA      2.77           
 11 TYR  HB3    11 TYR  HA      2.86           
 11 TYR  HN     10 ALA  HA      2.50           
 11 TYR  HN     11 TYR  HB2     4.15           
 11 TYR  HN     11 TYR  HB3     3.34           
 11 TYR  QD      2 LYS  HB2     7.64           
 11 TYR  QD      2 LYS  HB3     7.64           
 11 TYR  QD      2 LYS  QB      6.86           
 11 TYR  QD      2 LYS  QG      8.52           
 11 TYR  QD     10 ALA  HA      7.64           
 11 TYR  QE      2 LYS  HB2     6.73           
 11 TYR  QE      2 LYS  HB3     6.73           
 11 TYR  QE      2 LYS  QB      6.32           
 11 TYR  QE      2 LYS  QG      8.51           
 12 LYS  HN      3 CYS  HN      4.48           
 12 LYS  HN     11 TYR  HA      2.77           
 12 LYS  HN     11 TYR  HB2     2.98           
 12 LYS  HN     11 TYR  HB3     3.94           
 12 LYS  HN     11 TYR  QD      7.64           
 12 LYS  HN     12 LYS  HB2     3.49           
 12 LYS  QG     12 LYS  HN      6.38           
 13 THR  HA      2 LYS  HA      2.55           
 13 THR  HA      2 LYS  QB      4.92           
 13 THR  HN     12 LYS  HB2     3.49           
 13 THR  HN     12 LYS  HB3     2.59           
 14 CYS  HB3     1 LEU  QB      6.38           
 14 CYS  HB3    14 CYS  HA      2.80           
 14 CYS  HN      1 LEU  QB      6.38           
 14 CYS  HN      2 LYS  HA      3.34           
 14 CYS  HN     13 THR  HA      2.53           
 14 CYS  HN     13 THR  HB      4.69           
 14 CYS  HN     14 CYS  HB2     3.01           
 14 CYS  HN     14 CYS  HB3     3.85           
 15 PRO  HB2    15 PRO  HA      2.77           
 15 PRO  HB3    15 PRO  HA      2.90           
 15 PRO  HD2    14 CYS  HA      2.71           
 15 PRO  HD3    14 CYS  HA      2.71           
 15 PRO  QD     14 CYS  HA      2.44           
 15 PRO  QG     14 CYS  HA      6.39           
 16 GLU  HN     15 PRO  HA      2.50           
 16 GLU  HN     15 PRO  HB2     3.70           
 16 GLU  HN     16 GLU  HB2     2.74           
 16 GLU  HN     16 GLU  HB3     3.73           
 16 GLU  HN     16 GLU  HG2     2.77           
 17 GLY  HN     16 GLU  HA      2.50           
 17 GLY  HN     16 GLU  HB2     4.15           
 17 GLY  HN     16 GLU  HB3     3.70           
 17 GLY  HN     16 GLU  HG2     5.50           
 18 LYS  HN     16 GLU  HA      3.40           
 18 LYS  HN     17 GLY  HN      2.98           
 19 ASN  HB2    19 ASN  HA      2.80           
 19 ASN  HD21   19 ASN  HB3     3.28           
 19 ASN  HN     18 LYS  HA      2.50           
 19 ASN  HN     19 ASN  HB2     4.06           
 19 ASN  HN     19 ASN  HB3     2.77           
 20 LEU  HB2    20 LEU  HA      2.83           
 20 LEU  HB3    20 LEU  HA      2.83           
 20 LEU  HN     19 ASN  HA      3.55           
 20 LEU  HN     19 ASN  HB3     5.50           
 20 LEU  HN     19 ASN  HN      3.10           
 20 LEU  HN     20 LEU  HG      3.10           
 21 CYS  HB3    21 CYS  HA      2.62           
 21 CYS  HN     20 LEU  HA      2.50           
 21 CYS  HN     20 LEU  HB3     2.92           
 21 CYS  HN     20 LEU  HN      5.50           
 22 TYR  HN     21 CYS  HB3     2.95           
 23 LYS  HA     22 TYR  QE      6.73           
 23 LYS  HB3    22 TYR  HA      5.50           
 23 LYS  HB3    22 TYR  HN      4.90           
 23 LYS  HB3    23 LYS  HA      2.71           
 23 LYS  HN     22 TYR  HA      2.50           
 23 LYS  HN     22 TYR  QE      7.21           
 23 LYS  HN     23 LYS  HB3     3.25           
 24 MET  HA     22 TYR  QE      7.63           
 24 MET  HG2    22 TYR  QE      7.63           
 24 MET  HG2    24 MET  HA      4.14           
 24 MET  HG3    22 TYR  QE      5.47           
 24 MET  HG3    24 MET  HA      3.55           
 24 MET  HN     22 TYR  QE      6.88           
 24 MET  HN     23 LYS  HA      2.56           
 24 MET  HN     24 MET  HB2     3.13           
 24 MET  HN     24 MET  HG2     5.50           
 25 PHE  HB3    25 PHE  HA      3.05           
 25 PHE  HN     24 MET  HA      2.50           
 25 PHE  HN     24 MET  HB2     5.50           
 25 PHE  HN     24 MET  HB3     3.25           
 25 PHE  HN     24 MET  HG2     5.50           
 25 PHE  HN     25 PHE  HB2     3.01           
 25 PHE  HN     25 PHE  HB3     4.00           
 25 PHE  HZ     23 LYS  HB3     5.50           
 25 PHE  QD     24 MET  HA      7.56           
 25 PHE  QD     24 MET  HB2     7.62           
 25 PHE  QE     23 LYS  HB3     6.36           
 26 MET  HG2    26 MET  HA      3.30           
 26 MET  HG2    26 MET  HB2     3.04           
 26 MET  HG2    26 MET  HB3     2.65           
 26 MET  HN     25 PHE  HA      2.59           
 26 MET  HN     25 PHE  HB2     5.50           
 26 MET  HN     25 PHE  HB3     3.28           
 26 MET  HN     25 PHE  QD      7.62           
 26 MET  HN     26 MET  HB2     2.98           
 26 MET  HN     26 MET  HG2     3.67           
 26 MET  HN     26 MET  HG3     5.50           
 27 MET  HN     26 MET  HA      2.50           
 27 MET  HN     26 MET  HB3     3.61           
 27 MET  HN     27 MET  HB2     2.68           
 27 MET  HN     27 MET  HB3     3.43           
 27 MET  HN     27 MET  HG2     3.43           
 27 MET  HN     27 MET  HG3     5.05           
 28 SER  HB2    28 SER  HA      2.40           
 28 SER  HB3    28 SER  HA      3.05           
 28 SER  HN     26 MET  HA      4.78           
 28 SER  HN     26 MET  HB3     3.07           
 28 SER  HN     27 MET  HB2     3.76           
 28 SER  HN     27 MET  HB3     3.40           
 28 SER  HN     27 MET  HN      3.25           
 28 SER  HN     28 SER  HB2     2.98           
 28 SER  HN     28 SER  HB3     3.70           
 29 ASP  HB2    29 ASP  HA      3.02           
 29 ASP  HN     26 MET  HB2     3.46           
 29 ASP  HN     26 MET  HB3     4.48           
 29 ASP  HN     26 MET  HN      5.50           
 29 ASP  HN     28 SER  HN      3.55           
 29 ASP  HN     29 ASP  HB2     2.95           
 29 ASP  HN     29 ASP  HB3     3.64           
 30 LEU  HA     25 PHE  HB3     3.31           
 30 LEU  HN     29 ASP  HA      2.50           
 30 LEU  HN     29 ASP  HB2     5.11           
 30 LEU  HN     29 ASP  HN      4.36           
 30 LEU  HN     30 LEU  HB2     2.68           
 30 LEU  QD1    30 LEU  HN      4.40           
 30 LEU  QD2    25 PHE  HB2     4.13           
 30 LEU  QD2    25 PHE  HB3     4.28           
 30 LEU  QD2    25 PHE  QD      7.66           
 30 LEU  QD2    25 PHE  QE      8.65           
 30 LEU  QD2    27 MET  HA      4.49           
 30 LEU  QD2    29 ASP  HN      6.53           
 30 LEU  QD2    30 LEU  HN      5.48           
 31 THR  HA     25 PHE  QE      7.35           
 31 THR  HN     29 ASP  HA      2.92           
 32 ILE  HA     25 PHE  QE      6.72           
 32 ILE  HG22   32 ILE  HA      3.55           
 32 ILE  HN     31 THR  HN      2.65           
 32 ILE  HN     32 ILE  HB      3.01           
 32 ILE  QG1    31 THR  HA      6.38           
 32 ILE  QG1    32 ILE  HN      6.08           
 33 PRO  HA     25 PHE  HA      2.80           
 33 PRO  HA     25 PHE  QD      5.25           
 33 PRO  HA     25 PHE  QE      6.93           
 33 PRO  HA     26 MET  HN      5.17           
 33 PRO  HB2    25 PHE  QD      6.33           
 33 PRO  HB2    25 PHE  QE      7.62           
 33 PRO  HB3    25 PHE  HZ      5.50           
 33 PRO  HB3    25 PHE  QD      7.17           
 33 PRO  HB3    25 PHE  QE      6.78           
 33 PRO  HG3    25 PHE  HZ      3.10           
 33 PRO  HG3    25 PHE  QE      5.91           
 33 PRO  QD     25 PHE  QE      7.52           
 33 PRO  QD     32 ILE  HA      3.57           
 34 VAL  HA      6 LEU  QQD     6.30           
 34 VAL  HN     25 PHE  HA      3.11           
 34 VAL  HN     33 PRO  HA      2.50           
 35 LYS  HA      6 LEU  QD1     5.01           
 35 LYS  HA      6 LEU  QD2     5.01           
 35 LYS  HA      6 LEU  QQD     4.43           
 35 LYS  HB3    22 TYR  QE      6.58           
 35 LYS  HN      6 LEU  QQD     7.62           
 35 LYS  HN     24 MET  HB2     3.76           
 35 LYS  HN     24 MET  HN      3.25           
 35 LYS  HN     33 PRO  HA      4.00           
 35 LYS  HN     33 PRO  HB2     4.54           
 35 LYS  HN     34 VAL  HN      2.53           
 35 LYS  HN     35 LYS  HB2     3.76           
 35 LYS  QD     22 TYR  QE      8.51           
 35 LYS  QD     35 LYS  HN      6.38           
 35 LYS  QE      6 LEU  QQD     8.97           
 36 ARG  HA     23 LYS  HA      2.71           
 36 ARG  HA     24 MET  HN      3.83           
 36 ARG  HB2     5 LYS  HA      4.85           
 36 ARG  HB2     6 LEU  HA      3.34           
 36 ARG  HB2     6 LEU  HN      5.50           
 36 ARG  HB2     6 LEU  QQD     8.10           
 36 ARG  HB3     6 LEU  HA      5.50           
 36 ARG  HN      5 LYS  QE      5.51           
 36 ARG  HN      6 LEU  HA      3.70           
 36 ARG  HN      6 LEU  QQD     7.32           
 36 ARG  HN     35 LYS  HA      2.50           
 36 ARG  HN     35 LYS  HB3     3.58           
 36 ARG  HN     35 LYS  HN      5.50           
 36 ARG  HN     35 LYS  QE      6.38           
 36 ARG  HN     36 ARG  HB2     3.79           
 36 ARG  QD      6 LEU  HA      5.51           
 36 ARG  QD      6 LEU  QQD     8.97           
 36 ARG  QG      6 LEU  HA      5.12           
 36 ARG  QG     35 LYS  HN      4.64           
 36 ARG  QG     36 ARG  HN      4.43           
 37 GLY  HA1    22 TYR  QE      7.63           
 37 GLY  HA2    22 TYR  QE      6.85           
 37 GLY  HN     22 TYR  HN      3.25           
 37 GLY  HN     23 LYS  HA      4.21           
 37 GLY  HN     36 ARG  HA      2.65           
 37 GLY  HN     36 ARG  HB3     3.94           
 38 CYS  HA     21 CYS  HA      2.89           
 38 CYS  HA     22 TYR  HN      4.09           
 38 CYS  HA     22 TYR  QE      7.51           
 38 CYS  HB3    38 CYS  HA      2.71           
 38 CYS  HN     22 TYR  QE      6.73           
 38 CYS  HN     37 GLY  HA1     3.37           
 38 CYS  HN     37 GLY  HA2     2.71           
 38 CYS  HN     38 CYS  HB2     2.92           
 38 CYS  HN     38 CYS  HB3     3.79           
 39 ILE  HA     22 TYR  QE      6.22           
 39 ILE  HB     22 TYR  QE      4.81           
 39 ILE  HB     39 ILE  HA      2.74           
 39 ILE  HN     20 LEU  HB2     4.66           
 39 ILE  HN     20 LEU  HN      3.43           
 39 ILE  HN     21 CYS  HA      4.39           
 39 ILE  HN     22 TYR  QE      7.63           
 39 ILE  HN     38 CYS  HA      2.68           
 39 ILE  HN     38 CYS  HB2     5.50           
 39 ILE  HN     38 CYS  HB3     3.58           
 39 ILE  HN     39 ILE  HB      3.91           
 39 ILE  QD1    22 TYR  QE      7.52           
 39 ILE  QG1    22 TYR  QE      8.51           
 39 ILE  QG1    39 ILE  HA      3.45           
 39 ILE  QG2    20 LEU  HN      6.53           
 39 ILE  QG2    21 CYS  HA      6.53           
 39 ILE  QG2    22 TYR  QE      6.74           
 39 ILE  QG2    38 CYS  HA      6.53           
 39 ILE  QG2    39 ILE  HN      4.58           
 40 ASP  HA     18 LYS  HA      2.40           
 40 ASP  HA     39 ILE  QG2     6.53           
 40 ASP  HN     39 ILE  QD1     6.53           
 40 ASP  HN     39 ILE  QG2     6.41           
 40 ASP  HN     40 ASP  HA      2.83           
 40 ASP  QB     18 LYS  HA      5.26           
 40 ASP  QB     19 ASN  HN      6.38           
 41 VAL  HN     39 ILE  HA      5.50           
 41 VAL  HN     39 ILE  QD1     6.53           
 41 VAL  HN     39 ILE  QG1     3.80           
 41 VAL  HN     39 ILE  QG2     5.33           
 41 VAL  HN     40 ASP  HA      3.49           
 41 VAL  HN     40 ASP  HN      2.71           
 41 VAL  HN     41 VAL  HB      3.10           
 41 VAL  QG2    40 ASP  HA      6.53           
 41 VAL  QG2    41 VAL  HN      4.55           
 42 CYS  HA     39 ILE  QD1     5.38           
 42 CYS  HA     39 ILE  QG2     4.48           
 42 CYS  HA     41 VAL  QG1     6.53           
 42 CYS  HB2    42 CYS  HA      2.93           
 42 CYS  HB3    41 VAL  QG1     4.70           
 42 CYS  HN     41 VAL  HB      4.30           
 42 CYS  HN     41 VAL  HN      5.50           
 42 CYS  HN     41 VAL  QG1     3.80           
 42 CYS  HN     42 CYS  HB2     2.68           
 42 CYS  HN     42 CYS  HB3     2.92           
 43 PRO  HB2    43 PRO  HA      3.04           
 43 PRO  HD2    39 ILE  QD1     5.27           
 43 PRO  HD2    42 CYS  HA      3.02           
 43 PRO  HD3    39 ILE  HB      4.54           
 43 PRO  HD3    39 ILE  QD1     4.73           
 43 PRO  HD3    42 CYS  HA      2.40           
 43 PRO  HD3    42 CYS  HB2     5.50           
 43 PRO  HG3    39 ILE  QD1     5.03           
 44 LYS  HN     43 PRO  HA      2.53           
 44 LYS  HN     43 PRO  HB3     3.82           
 44 LYS  HN     44 LYS  HB2     3.01           
 45 ASN  HB3    45 ASN  HA      2.96           
 45 ASN  HD21   45 ASN  HB2     3.19           
 45 ASN  HN     44 LYS  HA      2.50           
 45 ASN  HN     44 LYS  HB2     4.06           
 45 ASN  HN     44 LYS  HB3     3.43           
 45 ASN  HN     44 LYS  HN      5.50           
 45 ASN  HN     44 LYS  QG      6.38           
 45 ASN  HN     45 ASN  HB2     2.92           
 45 ASN  HN     45 ASN  HB3     3.85           
 45 ASN  HN     45 ASN  HD21    5.50           
 46 SER  HB2    46 SER  HA      2.71           
 46 SER  HB3    46 SER  HA      2.62           
 46 SER  HN     45 ASN  HA      2.77           
 46 SER  HN     45 ASN  HB2     5.50           
 46 SER  HN     45 ASN  HB3     3.34           
 47 LEU  HA     46 SER  HA      5.50           
 47 LEU  HB3    47 LEU  HA      2.96           
 47 LEU  HN     46 SER  HA      2.89           
 47 LEU  HN     46 SER  HB2     2.65           
 47 LEU  HN     46 SER  HB3     3.76           
 47 LEU  HN     47 LEU  HB3     3.52           
 47 LEU  HN     47 LEU  HG      2.65           
 48 LEU  HA     27 MET  HB2     3.73           
 48 LEU  HB2    48 LEU  HA      2.99           
 48 LEU  HB3    48 LEU  HA      2.80           
 48 LEU  HN     47 LEU  HN      5.50           
 48 LEU  HN     48 LEU  HB2     2.74           
 49 VAL  HN     46 SER  HB3     5.50           
 49 VAL  HN     46 SER  HN      3.40           
 49 VAL  HN     48 LEU  HB2     3.61           
 49 VAL  HN     48 LEU  HN      2.68           
 50 LYS  HB2    25 PHE  HB2     4.66           
 50 LYS  HB2    25 PHE  QD      7.62           
 50 LYS  HB3    25 PHE  HB2     3.10           
 50 LYS  HB3    25 PHE  HB3     4.87           
 50 LYS  HB3    25 PHE  QD      5.91           
 50 LYS  HN     25 PHE  HB2     3.91           
 50 LYS  HN     25 PHE  HB3     5.50           
 50 LYS  HN     25 PHE  HN      3.10           
 50 LYS  HN     25 PHE  QD      7.62           
 50 LYS  HN     49 VAL  HA      2.50           
 50 LYS  HN     50 LYS  HB2     3.88           
 50 LYS  HN     50 LYS  HB3     2.65           
 51 TYR  HA     24 MET  HA      3.40           
 51 TYR  HA     25 PHE  HN      3.94           
 51 TYR  HA     25 PHE  QD      7.62           
 51 TYR  HB2    43 PRO  HD2     2.95           
 51 TYR  HB3    51 TYR  HA      3.08           
 51 TYR  HN     50 LYS  HB2     5.50           
 51 TYR  HN     50 LYS  HN      5.50           
 51 TYR  HN     50 LYS  QG      6.38           
 51 TYR  HN     51 TYR  HB2     2.86           
 51 TYR  HN     51 TYR  HB3     4.09           
 51 TYR  QD     24 MET  HA      7.64           
 51 TYR  QD     24 MET  HG2     7.64           
 51 TYR  QD     24 MET  HG3     7.64           
 51 TYR  QD     43 PRO  HB2     7.64           
 51 TYR  QD     43 PRO  HB3     7.46           
 51 TYR  QD     43 PRO  HD2     7.31           
 51 TYR  QD     43 PRO  HD3     7.64           
 51 TYR  QD     43 PRO  HG2     7.64           
 51 TYR  QD     45 ASN  HA      6.31           
 51 TYR  QE     24 MET  HB2     7.63           
 51 TYR  QE     24 MET  HG2     7.63           
 51 TYR  QE     24 MET  HG3     7.21           
 51 TYR  QE     43 PRO  HB2     7.51           
 51 TYR  QE     43 PRO  HB3     7.63           
 51 TYR  QE     43 PRO  HD2     7.63           
 51 TYR  QE     43 PRO  HG2     7.36           
 51 TYR  QE     45 ASN  HA      7.63           
 52 VAL  HB     23 LYS  HN      4.72           
 52 VAL  HB     25 PHE  QE      6.57           
 52 VAL  HN     23 LYS  HN      2.62           
 52 VAL  HN     24 MET  HA      3.49           
 52 VAL  HN     51 TYR  HA      2.50           
 52 VAL  HN     51 TYR  HB3     3.40           
 52 VAL  HN     52 VAL  HB      2.95           
 52 VAL  QG1    23 LYS  HN      6.53           
 52 VAL  QG1    25 PHE  QE      8.65           
 52 VAL  QG2    23 LYS  HN      6.53           
 52 VAL  QG2    25 PHE  HZ      6.14           
 52 VAL  QG2    25 PHE  QD      7.15           
 52 VAL  QG2    25 PHE  QE      6.52           
 52 VAL  QG2    52 VAL  HN      4.76           
 53 CYS  HA     22 TYR  HA      2.59           
 53 CYS  HA     23 LYS  HN      3.55           
 53 CYS  HB3    20 LEU  HB3     3.73           
 53 CYS  HB3    22 TYR  HA      5.50           
 53 CYS  HB3    53 CYS  HA      2.83           
 53 CYS  HN     52 VAL  HA      2.50           
 53 CYS  HN     52 VAL  HB      5.50           
 53 CYS  HN     52 VAL  HN      5.50           
 53 CYS  HN     52 VAL  QG1     4.70           
 53 CYS  HN     52 VAL  QG2     6.53           
 53 CYS  HN     53 CYS  HB2     3.04           
 54 CYS  HB2    54 CYS  HA      2.80           
 54 CYS  HB3    54 CYS  HA      2.80           
 54 CYS  HN     20 LEU  HB3     5.38           
 54 CYS  HN     21 CYS  HB2     4.69           
 54 CYS  HN     21 CYS  HN      3.16           
 54 CYS  HN     22 TYR  HA      3.70           
 54 CYS  HN     53 CYS  HA      2.59           
 54 CYS  HN     53 CYS  HB2     4.33           
 54 CYS  HN     53 CYS  HB3     3.13           
 54 CYS  QB     54 CYS  HA      2.58           
 55 ASN  HA     20 LEU  HA      2.93           
 55 ASN  HA     20 LEU  HB3     5.50           
 55 ASN  HA     21 CYS  HN      3.37           
 55 ASN  HB3    55 ASN  HA      2.59           
 55 ASN  HD22   55 ASN  HB2     3.49           
 55 ASN  HD22   55 ASN  HB3     3.64           
 55 ASN  HN     54 CYS  HA      2.50           
 55 ASN  HN     54 CYS  QB      4.40           
 55 ASN  HN     55 ASN  HB2     4.12           
 55 ASN  HN     55 ASN  HB3     3.40           
 56 THR  HN     55 ASN  HD21    3.94           
 56 THR  HN     55 ASN  HN      2.98           
 56 THR  QG2    56 THR  HN      4.85           
 57 ASP  HN     56 THR  HA      2.50           
 57 ASP  HN     56 THR  HB      2.65           
 57 ASP  HN     57 ASP  HB2     2.83           
 57 ASP  HN     57 ASP  HB3     3.70           
 58 ARG  HA      3 CYS  HA      2.40           
 58 ARG  HA      4 ASN  HN      3.13           
 58 ARG  HB3    58 ARG  HA      2.80           
 58 ARG  HN      2 LYS  HN      4.57           
 58 ARG  HN      2 LYS  QB      4.58           
 58 ARG  HN      3 CYS  HA      2.80           
 58 ARG  HN     57 ASP  HA      2.50           
 58 ARG  HN     57 ASP  HB2     5.50           
 58 ARG  HN     57 ASP  HB3     3.22           
 58 ARG  HN     57 ASP  HN      5.50           
 58 ARG  HN     58 ARG  HA      2.56           
 58 ARG  QG     58 ARG  HN      4.91           
 59 CYS  HB2    59 CYS  HA      2.74           
 59 CYS  HB3    59 CYS  HA      2.68           
 59 CYS  HN      4 ASN  HN      3.82           
 59 CYS  HN     58 ARG  HA      2.80           
 59 CYS  HN     58 ARG  HN      3.22           
 59 CYS  HN     59 CYS  HA      2.92           
 59 CYS  HN     59 CYS  HB3     2.59           
 60 ASN  HA     36 ARG  QD      5.42           
 60 ASN  HB2    22 TYR  HA      5.50           
 60 ASN  HB2    23 LYS  HB2     5.17           
 60 ASN  HB2    23 LYS  HB3     5.50           
 60 ASN  HB2    60 ASN  HA      2.83           
 60 ASN  HB3    21 CYS  HA      5.20           
 60 ASN  HB3    22 TYR  HN      4.63           
 60 ASN  HB3    60 ASN  HA      2.74           
 60 ASN  HN      4 ASN  HN      4.36           
 60 ASN  HN     60 ASN  HB3     3.28           
#
# 2. Upper distance constraints for H-bonds
#
  3 CYS  HN     12 LYS  O       2.20  9.00E+00
  3 CYS  HN     12 LYS  C       3.50  9.00E+00
  3 CYS  N      12 LYS  O       3.30  9.00E+00
  4 ASN  HN     60 ASN  O       2.20  9.00E+00
  4 ASN  HN     60 ASN  C       3.50  9.00E+00
  4 ASN  N      60 ASN  O       3.30  9.00E+00
  5 LYS  HN     10 ALA  O       2.20  9.00E+00
  5 LYS  HN     10 ALA  C       3.50  9.00E+00
  5 LYS  N      10 ALA  O       3.30  9.00E+00
  7 VAL  O      10 ALA  HN      2.20  9.00E+00
  7 VAL  C      10 ALA  HN      3.50  9.00E+00
  7 VAL  O      10 ALA  N       3.30  9.00E+00
  3 CYS  O      12 LYS  HN      2.20  9.00E+00
  3 CYS  C      12 LYS  HN      3.50  9.00E+00
  3 CYS  O      12 LYS  N       3.30  9.00E+00
  1 LEU  O      14 CYS  HN      2.20  9.00E+00
  1 LEU  C      14 CYS  HN      3.50  9.00E+00
  1 LEU  O      14 CYS  N       3.30  9.00E+00
 15 PRO  O      18 LYS  HN      2.20  9.00E+00
 15 PRO  C      18 LYS  HN      3.50  9.00E+00
 15 PRO  O      18 LYS  N       3.30  9.00E+00
 20 LEU  HN     39 ILE  O       2.20  9.00E+00
 20 LEU  HN     39 ILE  C       3.50  9.00E+00
 20 LEU  N      39 ILE  O       3.30  9.00E+00
 21 CYS  HN     54 CYS  O       2.20  9.00E+00
 21 CYS  HN     54 CYS  C       3.50  9.00E+00
 21 CYS  N      54 CYS  O       3.30  9.00E+00
 22 TYR  HN     37 GLY  O       2.20  9.00E+00
 22 TYR  HN     37 GLY  C       3.50  9.00E+00
 22 TYR  N      37 GLY  O       3.30  9.00E+00
 23 LYS  HN     52 VAL  O       2.20  9.00E+00
 23 LYS  HN     52 VAL  C       3.50  9.00E+00
 23 LYS  N      52 VAL  O       3.30  9.00E+00
 24 MET  HN     35 LYS  O       2.20  9.00E+00
 24 MET  HN     35 LYS  C       3.50  9.00E+00
 24 MET  N      35 LYS  O       3.30  9.00E+00
 25 PHE  HN     50 LYS  O       2.20  9.00E+00
 25 PHE  HN     50 LYS  C       3.50  9.00E+00
 25 PHE  N      50 LYS  O       3.30  9.00E+00
 27 MET  HN     48 LEU  O       2.20  9.00E+00
 27 MET  HN     48 LEU  C       3.50  9.00E+00
 27 MET  N      48 LEU  O       3.30  9.00E+00
 29 ASP  O      32 ILE  HN      2.20  9.00E+00
 29 ASP  C      32 ILE  HN      3.50  9.00E+00
 29 ASP  O      32 ILE  N       3.30  9.00E+00
 24 MET  O      34 VAL  HN      2.20  9.00E+00
 24 MET  C      34 VAL  HN      3.50  9.00E+00
 24 MET  O      34 VAL  N       3.30  9.00E+00
 24 MET  O      35 LYS  HN      2.20  9.00E+00
 24 MET  C      35 LYS  HN      3.50  9.00E+00
 24 MET  O      35 LYS  N       3.30  9.00E+00
 22 TYR  O      37 GLY  HN      2.20  9.00E+00
 22 TYR  C      37 GLY  HN      3.50  9.00E+00
 22 TYR  O      37 GLY  N       3.30  9.00E+00
 20 LEU  O      39 ILE  HN      2.20  9.00E+00
 20 LEU  C      39 ILE  HN      3.50  9.00E+00
 20 LEU  O      39 ILE  N       3.30  9.00E+00
 46 SER  HN     49 VAL  O       2.20  9.00E+00
 46 SER  HN     49 VAL  C       3.50  9.00E+00
 46 SER  N      49 VAL  O       3.30  9.00E+00
 25 PHE  O      50 LYS  HN      2.20  9.00E+00
 25 PHE  C      50 LYS  HN      3.50  9.00E+00
 25 PHE  O      50 LYS  N       3.30  9.00E+00
 23 LYS  O      52 VAL  HN      2.20  9.00E+00
 23 LYS  C      52 VAL  HN      3.50  9.00E+00
 23 LYS  O      52 VAL  N       3.30  9.00E+00
 21 CYS  O      54 CYS  HN      2.20  9.00E+00
 21 CYS  C      54 CYS  HN      3.50  9.00E+00
 21 CYS  O      54 CYS  N       3.30  9.00E+00
  2 LYS  O      58 ARG  HN      2.20  9.00E+00
  2 LYS  C      58 ARG  HN      3.50  9.00E+00
  2 LYS  O      58 ARG  N       3.30  9.00E+00
 45 ASN  OD1    51 TYR  HN      2.30  9.00E+00
 45 ASN  CG     51 TYR  HN      3.40  9.00E+00
 45 ASN  OD1    51 TYR  N       3.20  9.00E+00
  4 ASN  O      60 ASN  HD22    2.40  9.00E+00
  4 ASN  C      60 ASN  HD22    3.50  9.00E+00
  4 ASN  O      60 ASN  ND2     3.20  9.00E+00
 46 SER  OG     49 VAL  HN      2.40  9.00E+00
 46 SER  CB     49 VAL  HN      3.50  9.00E+00
 46 SER  OG     49 VAL  N       3.30  9.00E+00
 26 MET  N      61 HOH  O       3.40  9.00E+00
 26 MET  HN     61 HOH  O       2.30  9.00E+00
 26 MET  N      61 HOH  Q1      2.40  9.00E+00
 26 MET  HN     61 HOH  Q1      1.30  9.00E+00
 32 ILE  O      61 HOH  H2      2.10 
 32 ILE  O      61 HOH  O       3.10 
 32 ILE  C      61 HOH  H2      3.30 
 32 ILE  C      61 HOH  O       4.30 
 29 ASP  O      61 HOH  H1      2.10 
 29 ASP  O      61 HOH  O       3.10 
 29 ASP  C      61 HOH  H1      3.30 
 29 ASP  C      61 HOH  O       4.30 
#
# 3. Lower distance constraints for H-bonds
#
  3 CYS  HN     12 LYS  O       1.70  9.00E+00
  3 CYS  HN     12 LYS  C       2.60  9.00E+00
  3 CYS  N      12 LYS  O       2.60  9.00E+00
  4 ASN  HN     60 ASN  O       1.70  9.00E+00
  4 ASN  HN     60 ASN  C       2.60  9.00E+00
  4 ASN  N      60 ASN  O       2.60  9.00E+00
  5 LYS  HN     10 ALA  O       1.70  9.00E+00
  5 LYS  HN     10 ALA  C       2.60  9.00E+00
  5 LYS  N      10 ALA  O       2.60  9.00E+00
  7 VAL  O      10 ALA  HN      1.70  9.00E+00
  7 VAL  C      10 ALA  HN      2.60  9.00E+00
  7 VAL  O      10 ALA  N       2.60  9.00E+00
  3 CYS  O      12 LYS  HN      1.70  9.00E+00
  3 CYS  C      12 LYS  HN      2.60  9.00E+00
  3 CYS  O      12 LYS  N       2.60  9.00E+00
  1 LEU  O      14 CYS  HN      1.70  9.00E+00
  1 LEU  C      14 CYS  HN      2.60  9.00E+00
  1 LEU  O      14 CYS  N       2.60  9.00E+00
 15 PRO  O      18 LYS  HN      1.70  9.00E+00
 15 PRO  C      18 LYS  HN      2.60  9.00E+00
 15 PRO  O      18 LYS  N       2.60  9.00E+00
 20 LEU  HN     39 ILE  O       1.70  9.00E+00
 20 LEU  HN     39 ILE  C       2.60  9.00E+00
 20 LEU  N      39 ILE  O       2.60  9.00E+00
 21 CYS  HN     54 CYS  O       1.70  9.00E+00
 21 CYS  HN     54 CYS  C       2.60  9.00E+00
 21 CYS  N      54 CYS  O       2.60  9.00E+00
 22 TYR  HN     37 GLY  O       1.70  9.00E+00
 22 TYR  HN     37 GLY  C       2.60  9.00E+00
 22 TYR  N      37 GLY  O       2.60  9.00E+00
 23 LYS  HN     52 VAL  O       1.70  9.00E+00
 23 LYS  HN     52 VAL  C       2.60  9.00E+00
 23 LYS  N      52 VAL  O       2.60  9.00E+00
 24 MET  HN     35 LYS  O       1.70  9.00E+00
 24 MET  HN     35 LYS  C       2.60  9.00E+00
 24 MET  N      35 LYS  O       2.60  9.00E+00
 25 PHE  HN     50 LYS  O       1.70  9.00E+00
 25 PHE  HN     50 LYS  C       2.60  9.00E+00
 25 PHE  N      50 LYS  O       2.60  9.00E+00
 27 MET  HN     48 LEU  O       1.70  9.00E+00
 27 MET  HN     48 LEU  C       2.60  9.00E+00
 27 MET  N      48 LEU  O       2.60  9.00E+00
 29 ASP  O      32 ILE  HN      1.70  9.00E+00
 29 ASP  C      32 ILE  HN      2.60  9.00E+00
 29 ASP  O      32 ILE  N       2.60  9.00E+00
 24 MET  O      34 VAL  HN      1.70  9.00E+00
 24 MET  C      34 VAL  HN      2.60  9.00E+00
 24 MET  O      34 VAL  N       2.60  9.00E+00
 24 MET  O      35 LYS  HN      1.70  9.00E+00
 24 MET  C      35 LYS  HN      2.60  9.00E+00
 24 MET  O      35 LYS  N       2.60  9.00E+00
 22 TYR  O      37 GLY  HN      1.70  9.00E+00
 22 TYR  C      37 GLY  HN      2.60  9.00E+00
 22 TYR  O      37 GLY  N       2.60  9.00E+00
 20 LEU  O      39 ILE  HN      1.70  9.00E+00
 20 LEU  C      39 ILE  HN      2.60  9.00E+00
 20 LEU  O      39 ILE  N       2.60  9.00E+00
 46 SER  HN     49 VAL  O       1.70  9.00E+00
 46 SER  HN     49 VAL  C       2.60  9.00E+00
 46 SER  N      49 VAL  O       2.60  9.00E+00
 25 PHE  O      50 LYS  HN      1.70  9.00E+00
 25 PHE  C      50 LYS  HN      2.60  9.00E+00
 25 PHE  O      50 LYS  N       2.60  9.00E+00
 23 LYS  O      52 VAL  HN      1.70  9.00E+00
 23 LYS  C      52 VAL  HN      2.60  9.00E+00
 23 LYS  O      52 VAL  N       2.60  9.00E+00
 21 CYS  O      54 CYS  HN      1.70  9.00E+00
 21 CYS  C      54 CYS  HN      2.60  9.00E+00
 21 CYS  O      54 CYS  N       2.60  9.00E+00
  2 LYS  O      58 ARG  HN      1.70  9.00E+00
  2 LYS  C      58 ARG  HN      2.60  9.00E+00
  2 LYS  O      58 ARG  N       2.60  9.00E+00
 45 ASN  OD1    51 TYR  HN      1.80  9.00E+00
 45 ASN  CG     51 TYR  HN      2.40  9.00E+00
 45 ASN  OD1    51 TYR  N       2.70  9.00E+00
  4 ASN  O      60 ASN  HD22    1.70  9.00E+00
  4 ASN  C      60 ASN  HD22    2.40  9.00E+00
  4 ASN  O      60 ASN  ND2     2.70  9.00E+00
 46 SER  OG     49 VAL  HN      1.90  9.00E+00
 46 SER  CB     49 VAL  HN      2.30  9.00E+00
 46 SER  OG     49 VAL  N       2.70  9.00E+00
 26 MET  N      61 HOH  O       3.00  9.00E+00
 26 MET  HN     61 HOH  O       1.90  9.00E+00
 26 MET  N      61 HOH  Q1      2.00  9.00E+00
 26 MET  HN     61 HOH  Q1      0.90  9.00E+00
 32 ILE  O      61 HOH  H2      1.70 
 32 ILE  O      61 HOH  O       2.70 
 32 ILE  C      61 HOH  H2      2.90 
 32 ILE  C      61 HOH  O       3.80 
 29 ASP  O      61 HOH  H1      1.70 
 29 ASP  O      61 HOH  O       2.70 
 29 ASP  C      61 HOH  H1      2.90 
 29 ASP  C      61 HOH  O       3.80 
#
# 4. Upper distance constraints for SS-bonds
#
  3 CYS  SG     21 CYS  SG      2.10  9.00E+00
  3 CYS  SG     21 CYS  CB      3.10  9.00E+00
  3 CYS  CB     21 CYS  SG      3.10  9.00E+00
 14 CYS  SG     38 CYS  SG      2.10  9.00E+00
 14 CYS  SG     38 CYS  CB      3.10  9.00E+00
 14 CYS  CB     38 CYS  SG      3.10  9.00E+00
 42 CYS  SG     53 CYS  SG      2.10  9.00E+00
 42 CYS  SG     53 CYS  CB      3.10  9.00E+00
 42 CYS  CB     53 CYS  SG      3.10  9.00E+00
 54 CYS  SG     59 CYS  SG      2.10  9.00E+00
 54 CYS  SG     59 CYS  CB      3.10  9.00E+00
 54 CYS  CB     59 CYS  SG      3.10  9.00E+00
#
# 5. Lower distance constraints for SS-bonds
#
  3 CYS  SG     21 CYS  SG      2.00  9.00E+00
  3 CYS  SG     21 CYS  CB      2.60  9.00E+00
  3 CYS  CB     21 CYS  SG      2.60  9.00E+00
 14 CYS  SG     38 CYS  SG      2.00  9.00E+00
 14 CYS  SG     38 CYS  CB      2.60  9.00E+00
 14 CYS  CB     38 CYS  SG      2.60  9.00E+00
 42 CYS  SG     53 CYS  SG      2.00  9.00E+00
 42 CYS  SG     53 CYS  CB      2.60  9.00E+00
 42 CYS  CB     53 CYS  SG      2.60  9.00E+00
 54 CYS  SG     59 CYS  SG      2.00  9.00E+00
 54 CYS  SG     59 CYS  CB      2.60  9.00E+00
 54 CYS  CB     59 CYS  SG      2.60  9.00E+00

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    LEU   1           H1       LEU   1   7.768  12.443  -0.966
    2    HA   LEU   1           HA       LEU   1   6.798  10.967   0.379
    3   1HB   LEU   1          1HB       LEU   1   4.640  12.020  -0.884
    4   2HB   LEU   1          2HB       LEU   1   4.484  10.335  -1.343
    5    HG   LEU   1           HG       LEU   1   3.174  10.790   0.637
    6   1HD1  LEU   1          1HD1      LEU   1   3.779   8.935   1.897
    7   2HD1  LEU   1          2HD1      LEU   1   4.525   8.605   0.315
    8   3HD1  LEU   1          3HD1      LEU   1   5.522   9.209   1.660
    9   1HD2  LEU   1          1HD2      LEU   1   4.486  12.722   1.453
   10   2HD2  LEU   1          2HD2      LEU   1   4.120  11.539   2.733
   11   3HD2  LEU   1          3HD2      LEU   1   5.748  11.600   2.016
   12    H    LYS   2           H        LYS   2   8.055   9.186   0.466
   13    HA   LYS   2           HA       LYS   2   7.839   7.332  -1.803
   14   1HB   LYS   2          1HB       LYS   2  10.293   8.024  -0.160
   15   2HB   LYS   2          2HB       LYS   2  10.208   6.708  -1.313
   16   1HG   LYS   2          1HG       LYS   2  10.754   8.178  -2.949
   17   2HG   LYS   2          2HG       LYS   2   9.195   8.946  -2.722
   18   1HD   LYS   2          1HD       LYS   2  10.466  10.796  -2.231
   19   2HD   LYS   2          2HD       LYS   2  10.547  10.075  -0.636
   20   1HE   LYS   2          1HE       LYS   2  12.671   8.868  -1.362
   21   2HE   LYS   2          2HE       LYS   2  12.613   9.766  -2.865
   22   1HZ   LYS   2          1HZ       LYS   2  13.012  11.729  -1.777
   23   2HZ   LYS   2          2HZ       LYS   2  12.505  11.190  -0.321
   24   3HZ   LYS   2          3HZ       LYS   2  13.942  10.695  -0.920
   25    H    CYS   3           H        CYS   3   7.671   5.114  -1.310
   26    HA   CYS   3           HA       CYS   3   7.536   4.485   1.536
   27   1HB   CYS   3          1HB       CYS   3   5.343   4.220  -0.474
   28   2HB   CYS   3          2HB       CYS   3   5.521   2.956   0.728
   29    H    ASN   4           H        ASN   4   7.462   1.954   1.765
   30    HA   ASN   4           HA       ASN   4   9.604   0.969   0.228
   31   1HB   ASN   4          1HB       ASN   4   7.791  -0.808   1.896
   32   2HB   ASN   4          2HB       ASN   4   9.529  -0.913   1.691
   33   1HD2  ASN   4          1HD2      ASN   4  10.891   0.614   2.709
   34   2HD2  ASN   4          2HD2      ASN   4  10.404   1.463   4.138
   35    H    LYS   5           H        LYS   5   9.489  -1.070  -1.116
   36    HA   LYS   5           HA       LYS   5   6.960  -1.168  -2.565
   37   1HB   LYS   5          1HB       LYS   5   9.737  -2.158  -3.271
   38   2HB   LYS   5          2HB       LYS   5   8.321  -2.373  -4.280
   39   1HG   LYS   5          1HG       LYS   5   9.372   0.338  -3.339
   40   2HG   LYS   5          2HG       LYS   5   9.703  -0.359  -4.912
   41   1HD   LYS   5          1HD       LYS   5   6.958   0.396  -3.807
   42   2HD   LYS   5          2HD       LYS   5   7.826   1.221  -5.087
   43   1HE   LYS   5          1HE       LYS   5   7.744  -1.460  -5.957
   44   2HE   LYS   5          2HE       LYS   5   6.171  -1.212  -5.226
   45   1HZ   LYS   5          1HZ       LYS   5   7.389   0.432  -7.332
   46   2HZ   LYS   5          2HZ       LYS   5   6.089  -0.546  -7.478
   47   3HZ   LYS   5          3HZ       LYS   5   5.990   0.813  -6.580
   48    H    LEU   6           H        LEU   6   7.150  -3.765  -3.647
   49    HA   LEU   6           HA       LEU   6   5.801  -5.270  -1.866
   50   1HB   LEU   6          1HB       LEU   6   6.558  -5.566  -4.408
   51   2HB   LEU   6          2HB       LEU   6   7.687  -6.688  -3.676
   52    HG   LEU   6           HG       LEU   6   5.701  -7.845  -4.453
   53   1HD1  LEU   6          1HD1      LEU   6   5.287  -9.176  -2.558
   54   2HD1  LEU   6          2HD1      LEU   6   6.925  -8.524  -2.323
   55   3HD1  LEU   6          3HD1      LEU   6   5.552  -7.819  -1.438
   56   1HD2  LEU   6          1HD2      LEU   6   4.144  -5.917  -4.261
   57   2HD2  LEU   6          2HD2      LEU   6   3.489  -7.434  -3.600
   58   3HD2  LEU   6          3HD2      LEU   6   4.097  -6.174  -2.501
   59    H    VAL   7           H        VAL   7   9.389  -5.206  -2.334
   60    HA   VAL   7           HA       VAL   7   9.642  -6.848   0.067
   61    HB   VAL   7           HB       VAL   7  11.924  -5.941  -1.646
   62   1HG1  VAL   7          1HG1      VAL   7  11.485  -8.675  -0.454
   63   2HG1  VAL   7          2HG1      VAL   7  13.010  -7.854  -0.864
   64   3HG1  VAL   7          3HG1      VAL   7  12.064  -7.323   0.548
   65   1HG2  VAL   7          1HG2      VAL   7  10.638  -6.678  -3.418
   66   2HG2  VAL   7          2HG2      VAL   7  11.436  -8.190  -2.923
   67   3HG2  VAL   7          3HG2      VAL   7   9.756  -7.867  -2.430
   68    HA   PRO   8           HA       PRO   8  10.057  -2.948   2.162
   69   1HB   PRO   8          1HB       PRO   8  10.455  -4.807   4.521
   70   2HB   PRO   8          2HB       PRO   8   9.332  -3.449   4.336
   71   1HG   PRO   8          1HG       PRO   8   8.387  -6.002   4.154
   72   2HG   PRO   8          2HG       PRO   8   7.808  -4.787   2.990
   73   1HD   PRO   8          1HD       PRO   8  10.035  -6.870   2.536
   74   2HD   PRO   8          2HD       PRO   8   8.612  -6.523   1.517
   75    H    ILE   9           H        ILE   9  12.627  -4.718   1.210
   76    HA   ILE   9           HA       ILE   9  14.509  -3.591   3.129
   77    HB   ILE   9           HB       ILE   9  14.867  -5.877   2.681
   78   1HG1  ILE   9          1HG1      ILE   9  17.128  -5.889   1.720
   79   2HG1  ILE   9          2HG1      ILE   9  16.874  -4.287   1.055
   80   1HG2  ILE   9          1HG2      ILE   9  15.506  -6.216   0.012
   81   2HG2  ILE   9          2HG2      ILE   9  14.000  -6.727   0.811
   82   3HG2  ILE   9          3HG2      ILE   9  14.072  -5.163  -0.037
   83   1HD1  ILE   9          1HD1      ILE   9  16.389  -4.680   4.004
   84   2HD1  ILE   9          2HD1      ILE   9  18.070  -4.619   3.419
   85   3HD1  ILE   9          3HD1      ILE   9  16.979  -3.242   3.137
   86    H    ALA  10           H        ALA  10  12.853  -2.644   0.367
   87    HA   ALA  10           HA       ALA  10  14.745  -0.518  -0.075
   88   1HB   ALA  10          1HB       ALA  10  13.918  -2.103  -2.506
   89   2HB   ALA  10          2HB       ALA  10  15.290  -0.987  -2.298
   90   3HB   ALA  10          3HB       ALA  10  15.338  -2.606  -1.558
   91    H    TYR  11           H        TYR  11  13.690   1.355  -0.720
   92    HA   TYR  11           HA       TYR  11  10.847   1.030  -1.405
   93   1HB   TYR  11          1HB       TYR  11  10.507   3.054   0.031
   94   2HB   TYR  11          2HB       TYR  11  11.301   1.808   0.972
   95    HD1  TYR  11           HD1      TYR  11  11.955   4.914  -0.987
   96    HD2  TYR  11           HD2      TYR  11  13.390   2.211   2.004
   97    HE1  TYR  11           HE1      TYR  11  13.834   6.531  -0.418
   98    HE2  TYR  11           HE2      TYR  11  15.264   3.837   2.563
   99    HH   TYR  11           HH       TYR  11  15.480   6.974   0.914
  100    H    LYS  12           H        LYS  12   9.928   2.826  -2.675
  101    HA   LYS  12           HA       LYS  12  11.954   4.465  -3.999
  102   1HB   LYS  12          1HB       LYS  12   9.984   2.621  -5.372
  103   2HB   LYS  12          2HB       LYS  12  10.765   3.960  -6.188
  104   1HG   LYS  12          1HG       LYS  12  12.885   2.654  -4.866
  105   2HG   LYS  12          2HG       LYS  12  11.869   1.338  -5.426
  106   1HD   LYS  12          1HD       LYS  12  12.273   1.782  -7.657
  107   2HD   LYS  12          2HD       LYS  12  12.313   3.518  -7.419
  108   1HE   LYS  12          1HE       LYS  12  14.547   1.724  -6.382
  109   2HE   LYS  12          2HE       LYS  12  14.551   2.330  -8.026
  110   1HZ   LYS  12          1HZ       LYS  12  14.764   3.827  -5.542
  111   2HZ   LYS  12          2HZ       LYS  12  15.667   3.942  -6.897
  112   3HZ   LYS  12          3HZ       LYS  12  14.161   4.573  -6.865
  113    H    THR  13           H        THR  13  10.399   5.889  -5.733
  114    HA   THR  13           HA       THR  13   8.751   7.384  -3.875
  115    HB   THR  13           HB       THR  13  10.192   7.803  -6.457
  116    HG1  THR  13           HG1      THR  13  10.183   9.970  -5.224
  117   1HG2  THR  13          1HG2      THR  13   7.748   8.316  -7.055
  118   2HG2  THR  13          2HG2      THR  13   7.755   9.504  -5.730
  119   3HG2  THR  13          3HG2      THR  13   8.839   9.721  -7.124
  120    H    CYS  14           H        CYS  14   6.549   7.840  -4.088
  121    HA   CYS  14           HA       CYS  14   5.076   5.693  -5.210
  122   1HB   CYS  14          1HB       CYS  14   4.195   8.296  -3.948
  123   2HB   CYS  14          2HB       CYS  14   3.098   7.029  -4.458
  124    HA   PRO  15           HA       PRO  15   4.865   7.162  -9.353
  125   1HB   PRO  15          1HB       PRO  15   2.282   6.074  -9.914
  126   2HB   PRO  15          2HB       PRO  15   3.840   5.257 -10.121
  127   1HG   PRO  15          1HG       PRO  15   1.851   5.131  -7.764
  128   2HG   PRO  15          2HG       PRO  15   2.834   3.836  -8.488
  129   1HD   PRO  15          1HD       PRO  15   3.644   4.966  -6.142
  130   2HD   PRO  15          2HD       PRO  15   4.836   4.465  -7.372
  131    H    GLU  16           H        GLU  16   3.575   8.395 -10.990
  132    HA   GLU  16           HA       GLU  16   2.731  10.789  -9.852
  133   1HB   GLU  16          1HB       GLU  16   2.532   9.663 -12.672
  134   2HB   GLU  16          2HB       GLU  16   1.991  11.282 -12.275
  135   1HG   GLU  16          1HG       GLU  16   4.714  10.609 -11.264
  136   2HG   GLU  16          2HG       GLU  16   4.573  10.626 -13.011
  137    H    GLY  17           H        GLY  17   0.677  11.676  -9.475
  138   1HA   GLY  17          1HA       GLY  17  -1.618  11.779  -9.544
  139   2HA   GLY  17          2HA       GLY  17  -1.686  10.217 -10.333
  140    H    LYS  18           H        LYS  18   0.327   9.153  -8.205
  141    HA   LYS  18           HA       LYS  18  -1.678   8.844  -6.078
  142   1HB   LYS  18          1HB       LYS  18   0.405   6.826  -6.965
  143   2HB   LYS  18          2HB       LYS  18  -0.820   6.595  -5.734
  144   1HG   LYS  18          1HG       LYS  18  -2.606   6.632  -7.329
  145   2HG   LYS  18          2HG       LYS  18  -1.607   7.371  -8.565
  146   1HD   LYS  18          1HD       LYS  18  -0.182   5.250  -8.569
  147   2HD   LYS  18          2HD       LYS  18  -1.357   4.525  -7.488
  148   1HE   LYS  18          1HE       LYS  18  -2.323   5.781 -10.067
  149   2HE   LYS  18          2HE       LYS  18  -1.567   4.201 -10.125
  150   1HZ   LYS  18          1HZ       LYS  18  -3.583   3.484  -9.605
  151   2HZ   LYS  18          2HZ       LYS  18  -3.271   3.965  -8.076
  152   3HZ   LYS  18          3HZ       LYS  18  -4.111   4.938  -9.083
  153    H    ASN  19           H        ASN  19  -1.118  10.107  -4.384
  154    HA   ASN  19           HA       ASN  19   1.735  10.300  -3.830
  155   1HB   ASN  19          1HB       ASN  19   0.745  12.499  -4.208
  156   2HB   ASN  19          2HB       ASN  19  -0.616  12.137  -3.166
  157   1HD2  ASN  19          1HD2      ASN  19  -0.344  13.764  -1.741
  158   2HD2  ASN  19          2HD2      ASN  19   0.986  13.910  -0.641
  159    H    LEU  20           H        LEU  20  -1.077   8.678  -2.956
  160    HA   LEU  20           HA       LEU  20  -0.478   8.707  -0.093
  161   1HB   LEU  20          1HB       LEU  20  -2.887   7.959  -1.721
  162   2HB   LEU  20          2HB       LEU  20  -2.691   7.363  -0.085
  163    HG   LEU  20           HG       LEU  20  -2.774  10.282  -0.893
  164   1HD1  LEU  20          1HD1      LEU  20  -4.857   8.495   0.382
  165   2HD1  LEU  20          2HD1      LEU  20  -4.959  10.271   0.322
  166   3HD1  LEU  20          3HD1      LEU  20  -4.947   9.329  -1.188
  167   1HD2  LEU  20          1HD2      LEU  20  -3.215  10.257   1.785
  168   2HD2  LEU  20          2HD2      LEU  20  -2.053   8.918   1.624
  169   3HD2  LEU  20          3HD2      LEU  20  -1.630  10.540   1.025
  170    H    CYS  21           H        CYS  21  -0.218   6.684   1.064
  171    HA   CYS  21           HA       CYS  21   0.912   4.644  -0.696
  172   1HB   CYS  21          1HB       CYS  21   1.505   5.490   2.122
  173   2HB   CYS  21          2HB       CYS  21   1.895   3.865   1.597
  174    H    TYR  22           H        TYR  22   0.239   2.435  -0.428
  175    HA   TYR  22           HA       TYR  22  -1.981   2.017   1.441
  176   1HB   TYR  22          1HB       TYR  22  -3.318   1.181  -0.371
  177   2HB   TYR  22          2HB       TYR  22  -2.498   2.532  -1.128
  178    HD1  TYR  22           HD1      TYR  22  -0.485   2.099  -2.592
  179    HD2  TYR  22           HD2      TYR  22  -2.965  -1.061  -1.118
  180    HE1  TYR  22           HE1      TYR  22   0.446   0.532  -4.364
  181    HE2  TYR  22           HE2      TYR  22  -2.026  -2.617  -2.896
  182    HH   TYR  22           HH       TYR  22   0.703  -2.138  -4.448
  183    H    LYS  23           H        LYS  23  -2.306  -0.228   2.056
  184    HA   LYS  23           HA       LYS  23  -0.308  -2.113   1.149
  185   1HB   LYS  23          1HB       LYS  23   0.330  -2.632   3.547
  186   2HB   LYS  23          2HB       LYS  23   0.995  -1.162   2.863
  187   1HG   LYS  23          1HG       LYS  23  -1.353  -0.192   3.921
  188   2HG   LYS  23          2HG       LYS  23  -1.023  -1.499   5.041
  189   1HD   LYS  23          1HD       LYS  23   1.459  -0.102   4.546
  190   2HD   LYS  23          2HD       LYS  23   0.230   1.093   4.909
  191   1HE   LYS  23          1HE       LYS  23   0.698   0.599   7.095
  192   2HE   LYS  23          2HE       LYS  23  -0.339  -0.790   6.834
  193   1HZ   LYS  23          1HZ       LYS  23   1.645  -1.623   7.660
  194   2HZ   LYS  23          2HZ       LYS  23   1.740  -1.937   6.060
  195   3HZ   LYS  23          3HZ       LYS  23   2.583  -0.693   6.701
  196    H    MET  24           H        MET  24  -1.246  -4.080   0.910
  197    HA   MET  24           HA       MET  24  -3.792  -4.422   2.294
  198   1HB   MET  24          1HB       MET  24  -2.775  -5.741  -0.287
  199   2HB   MET  24          2HB       MET  24  -4.383  -5.927   0.383
  200   1HG   MET  24          1HG       MET  24  -5.030  -3.727  -0.181
  201   2HG   MET  24          2HG       MET  24  -3.382  -3.132  -0.196
  202   1HE   MET  24          1HE       MET  24  -4.525  -6.461  -1.538
  203   2HE   MET  24          2HE       MET  24  -5.902  -5.589  -2.252
  204   3HE   MET  24          3HE       MET  24  -4.634  -6.266  -3.304
  205    H    PHE  25           H        PHE  25  -4.275  -6.468   3.279
  206    HA   PHE  25           HA       PHE  25  -2.019  -8.329   3.392
  207   1HB   PHE  25          1HB       PHE  25  -3.796  -7.534   5.761
  208   2HB   PHE  25          2HB       PHE  25  -2.274  -8.401   5.832
  209    HD1  PHE  25           HD1      PHE  25  -3.608  -5.103   4.688
  210    HD2  PHE  25           HD2      PHE  25  -0.392  -7.229   6.463
  211    HE1  PHE  25           HE1      PHE  25  -2.394  -2.941   5.081
  212    HE2  PHE  25           HE2      PHE  25   0.821  -5.066   6.855
  213    HZ   PHE  25           HZ       PHE  25  -0.195  -2.948   6.160
  214    H    MET  26           H        MET  26  -2.608 -10.463   3.204
  215    HA   MET  26           HA       MET  26  -5.339 -10.977   2.653
  216   1HB   MET  26          1HB       MET  26  -2.857 -12.764   2.902
  217   2HB   MET  26          2HB       MET  26  -4.417 -13.369   2.377
  218   1HG   MET  26          1HG       MET  26  -4.385 -12.081   0.366
  219   2HG   MET  26          2HG       MET  26  -3.163 -10.982   0.975
  220   1HE   MET  26          1HE       MET  26  -3.583 -14.249  -1.267
  221   2HE   MET  26          2HE       MET  26  -2.564 -15.337  -0.294
  222   3HE   MET  26          3HE       MET  26  -4.011 -14.593   0.427
  223    H    MET  27           H        MET  27  -6.610 -12.760   3.707
  224    HA   MET  27           HA       MET  27  -6.706 -12.353   6.449
  225   1HB   MET  27          1HB       MET  27  -7.965 -14.242   4.444
  226   2HB   MET  27          2HB       MET  27  -8.164 -14.628   6.142
  227   1HG   MET  27          1HG       MET  27  -8.712 -11.786   5.295
  228   2HG   MET  27          2HG       MET  27  -9.884 -13.004   4.835
  229   1HE   MET  27          1HE       MET  27  -9.022 -10.653   8.040
  230   2HE   MET  27          2HE       MET  27  -9.921 -10.488   6.513
  231   3HE   MET  27          3HE       MET  27 -10.797 -10.783   8.034
  232    H    SER  28           H        SER  28  -5.070 -14.792   4.429
  233    HA   SER  28           HA       SER  28  -4.643 -16.658   6.439
  234   1HB   SER  28          1HB       SER  28  -4.313 -17.377   4.197
  235   2HB   SER  28          2HB       SER  28  -3.269 -16.023   3.814
  236    HG   SER  28           HG       SER  28  -1.604 -17.233   4.367
  237    H    ASP  29           H        ASP  29  -1.729 -15.285   4.926
  238    HA   ASP  29           HA       ASP  29  -0.497 -15.099   7.453
  239   1HB   ASP  29          1HB       ASP  29   0.496 -15.570   5.043
  240   2HB   ASP  29          2HB       ASP  29   0.575 -13.824   4.917
  241    H    LEU  30           H        LEU  30  -2.080 -13.483   8.417
  242    HA   LEU  30           HA       LEU  30  -2.223 -10.874   7.285
  243   1HB   LEU  30          1HB       LEU  30  -3.147 -12.140   9.851
  244   2HB   LEU  30          2HB       LEU  30  -3.276 -10.411   9.590
  245    HG   LEU  30           HG       LEU  30  -4.447 -12.382   7.627
  246   1HD1  LEU  30          1HD1      LEU  30  -6.612 -11.567   9.060
  247   2HD1  LEU  30          2HD1      LEU  30  -5.766 -13.116   9.290
  248   3HD1  LEU  30          3HD1      LEU  30  -5.392 -11.732  10.345
  249   1HD2  LEU  30          1HD2      LEU  30  -5.390  -9.589   8.276
  250   2HD2  LEU  30          2HD2      LEU  30  -4.108  -9.909   7.083
  251   3HD2  LEU  30          3HD2      LEU  30  -5.737 -10.584   6.842
  252    H    THR  31           H        THR  31   0.195 -12.580   8.962
  253    HA   THR  31           HA       THR  31   1.204 -10.261  10.386
  254    HB   THR  31           HB       THR  31   1.460 -13.173  10.467
  255    HG1  THR  31           HG1      THR  31   1.996 -12.487  12.616
  256   1HG2  THR  31          1HG2      THR  31   3.926 -12.982  11.277
  257   2HG2  THR  31          2HG2      THR  31   3.672 -13.043   9.517
  258   3HG2  THR  31          3HG2      THR  31   4.000 -11.486  10.316
  259    H    ILE  32           H        ILE  32   1.429 -11.681   7.229
  260    HA   ILE  32           HA       ILE  32   3.636  -9.838   6.675
  261    HB   ILE  32           HB       ILE  32   3.546 -12.443   5.240
  262   1HG1  ILE  32          1HG1      ILE  32   4.654 -12.109   8.042
  263   2HG1  ILE  32          2HG1      ILE  32   3.330 -13.150   7.561
  264   1HG2  ILE  32          1HG2      ILE  32   5.470 -11.700   4.427
  265   2HG2  ILE  32          2HG2      ILE  32   5.231 -10.181   5.324
  266   3HG2  ILE  32          3HG2      ILE  32   6.140 -11.520   6.065
  267   1HD1  ILE  32          1HD1      ILE  32   6.280 -13.443   6.990
  268   2HD1  ILE  32          2HD1      ILE  32   5.117 -14.662   7.560
  269   3HD1  ILE  32          3HD1      ILE  32   5.108 -14.152   5.855
  270    HA   PRO  33           HA       PRO  33   0.434  -8.268   4.071
  271   1HB   PRO  33          1HB       PRO  33   2.907  -6.975   2.826
  272   2HB   PRO  33          2HB       PRO  33   1.342  -6.242   3.211
  273   1HG   PRO  33          1HG       PRO  33   3.448  -5.858   4.899
  274   2HG   PRO  33          2HG       PRO  33   1.848  -6.215   5.593
  275   1HD   PRO  33          1HD       PRO  33   4.203  -8.142   5.244
  276   2HD   PRO  33          2HD       PRO  33   3.070  -7.979   6.615
  277    H    VAL  34           H        VAL  34  -0.140  -7.928   1.713
  278    HA   VAL  34           HA       VAL  34   0.988 -10.125   0.117
  279    HB   VAL  34           HB       VAL  34  -1.214 -10.703   0.847
  280   1HG1  VAL  34          1HG1      VAL  34  -1.729  -7.868   0.509
  281   2HG1  VAL  34          2HG1      VAL  34  -2.961  -8.843  -0.327
  282   3HG1  VAL  34          3HG1      VAL  34  -2.656  -9.093   1.409
  283   1HG2  VAL  34          1HG2      VAL  34  -0.790 -11.412  -1.383
  284   2HG2  VAL  34          2HG2      VAL  34  -2.441 -10.747  -1.378
  285   3HG2  VAL  34          3HG2      VAL  34  -1.097  -9.786  -2.038
  286    H    LYS  35           H        LYS  35  -0.151  -6.754   0.309
  287    HA   LYS  35           HA       LYS  35   1.222  -6.273  -2.220
  288   1HB   LYS  35          1HB       LYS  35  -1.510  -5.094  -1.678
  289   2HB   LYS  35          2HB       LYS  35  -0.573  -5.021  -3.157
  290   1HG   LYS  35          1HG       LYS  35  -1.476  -7.674  -1.966
  291   2HG   LYS  35          2HG       LYS  35  -2.501  -6.757  -3.052
  292   1HD   LYS  35          1HD       LYS  35  -0.828  -6.872  -4.839
  293   2HD   LYS  35          2HD       LYS  35   0.353  -7.580  -3.756
  294   1HE   LYS  35          1HE       LYS  35  -0.454  -9.667  -4.145
  295   2HE   LYS  35          2HE       LYS  35  -2.070  -9.181  -3.676
  296   1HZ   LYS  35          1HZ       LYS  35  -1.105  -9.657  -6.230
  297   2HZ   LYS  35          2HZ       LYS  35  -2.624  -9.248  -5.789
  298   3HZ   LYS  35          3HZ       LYS  35  -1.541  -8.085  -6.162
  299    H    ARG  36           H        ARG  36   2.230  -4.234  -2.340
  300    HA   ARG  36           HA       ARG  36   1.728  -2.390  -0.220
  301   1HB   ARG  36          1HB       ARG  36   4.149  -4.142  -0.300
  302   2HB   ARG  36          2HB       ARG  36   4.487  -2.443  -0.037
  303   1HG   ARG  36          1HG       ARG  36   2.662  -2.509   1.800
  304   2HG   ARG  36          2HG       ARG  36   2.700  -4.254   1.641
  305   1HD   ARG  36          1HD       ARG  36   4.929  -4.416   2.443
  306   2HD   ARG  36          2HD       ARG  36   5.301  -2.750   2.051
  307    HE   ARG  36           HE       ARG  36   3.177  -3.042   4.059
  308   1HH1  ARG  36          1HH1      ARG  36   6.644  -2.766   3.524
  309   2HH1  ARG  36          2HH1      ARG  36   6.974  -2.191   5.124
  310   1HH2  ARG  36          1HH2      ARG  36   3.612  -2.284   6.170
  311   2HH2  ARG  36          2HH2      ARG  36   5.237  -1.915   6.639
  312    H    GLY  37           H        GLY  37   1.547  -0.492  -1.375
  313   1HA   GLY  37          1HA       GLY  37   3.714   0.406  -3.028
  314   2HA   GLY  37          2HA       GLY  37   2.301  -0.048  -3.960
  315    H    CYS  38           H        CYS  38   1.903   2.146  -4.621
  316    HA   CYS  38           HA       CYS  38   0.864   3.796  -2.433
  317   1HB   CYS  38          1HB       CYS  38   2.058   4.910  -4.967
  318   2HB   CYS  38          2HB       CYS  38   1.616   5.770  -3.505
  319    H    ILE  39           H        ILE  39  -0.983   5.221  -3.136
  320    HA   ILE  39           HA       ILE  39  -2.213   4.518  -5.654
  321    HB   ILE  39           HB       ILE  39  -2.851   2.805  -3.831
  322   1HG1  ILE  39          1HG1      ILE  39  -5.353   3.897  -4.953
  323   2HG1  ILE  39          2HG1      ILE  39  -4.066   3.694  -6.124
  324   1HG2  ILE  39          1HG2      ILE  39  -4.538   3.377  -2.285
  325   2HG2  ILE  39          2HG2      ILE  39  -3.292   4.637  -2.128
  326   3HG2  ILE  39          3HG2      ILE  39  -4.791   4.975  -3.025
  327   1HD1  ILE  39          1HD1      ILE  39  -5.756   1.674  -5.094
  328   2HD1  ILE  39          2HD1      ILE  39  -4.316   1.443  -6.114
  329   3HD1  ILE  39          3HD1      ILE  39  -4.170   1.382  -4.342
  330    H    ASP  40           H        ASP  40  -4.463   5.806  -5.728
  331    HA   ASP  40           HA       ASP  40  -3.723   8.464  -4.847
  332   1HB   ASP  40          1HB       ASP  40  -5.629   9.121  -6.455
  333   2HB   ASP  40          2HB       ASP  40  -4.191   8.430  -7.181
  334    H    VAL  41           H        VAL  41  -6.579   6.215  -5.115
  335    HA   VAL  41           HA       VAL  41  -7.843   7.712  -2.928
  336    HB   VAL  41           HB       VAL  41  -9.385   5.760  -4.535
  337   1HG1  VAL  41          1HG1      VAL  41 -10.314   8.545  -4.169
  338   2HG1  VAL  41          2HG1      VAL  41 -11.151   7.003  -3.869
  339   3HG1  VAL  41          3HG1      VAL  41 -10.008   7.645  -2.665
  340   1HG2  VAL  41          1HG2      VAL  41  -8.214   8.288  -5.709
  341   2HG2  VAL  41          2HG2      VAL  41  -8.234   6.643  -6.390
  342   3HG2  VAL  41          3HG2      VAL  41  -9.739   7.589  -6.304
  343    H    CYS  42           H        CYS  42  -8.807   6.515  -1.174
  344    HA   CYS  42           HA       CYS  42  -7.249   4.239  -0.487
  345   1HB   CYS  42          1HB       CYS  42  -8.318   6.156   0.990
  346   2HB   CYS  42          2HB       CYS  42  -9.677   5.050   1.059
  347    HA   PRO  43           HA       PRO  43 -10.143   1.565  -2.561
  348   1HB   PRO  43          1HB       PRO  43  -8.309  -0.636  -1.676
  349   2HB   PRO  43          2HB       PRO  43  -8.739  -0.119  -3.316
  350   1HG   PRO  43          1HG       PRO  43  -6.244   0.422  -2.298
  351   2HG   PRO  43          2HG       PRO  43  -7.079   1.639  -3.292
  352   1HD   PRO  43          1HD       PRO  43  -7.040   1.505  -0.205
  353   2HD   PRO  43          2HD       PRO  43  -6.551   2.863  -1.255
  354    H    LYS  44           H        LYS  44 -11.752  -0.031  -2.265
  355    HA   LYS  44           HA       LYS  44 -12.762  -0.155   0.380
  356   1HB   LYS  44          1HB       LYS  44 -13.702  -1.717  -2.037
  357   2HB   LYS  44          2HB       LYS  44 -14.621  -1.313  -0.602
  358   1HG   LYS  44          1HG       LYS  44 -13.564   1.148  -1.659
  359   2HG   LYS  44          2HG       LYS  44 -14.251   0.259  -3.003
  360   1HD   LYS  44          1HD       LYS  44 -16.375   0.651  -2.291
  361   2HD   LYS  44          2HD       LYS  44 -16.011   0.085  -0.673
  362   1HE   LYS  44          1HE       LYS  44 -14.689   2.518  -0.695
  363   2HE   LYS  44          2HE       LYS  44 -16.051   2.866  -1.740
  364   1HZ   LYS  44          1HZ       LYS  44 -16.032   2.220   1.064
  365   2HZ   LYS  44          2HZ       LYS  44 -17.025   3.211   0.230
  366   3HZ   LYS  44          3HZ       LYS  44 -17.273   1.598   0.205
  367    H    ASN  45           H        ASN  45 -12.634  -1.752   1.914
  368    HA   ASN  45           HA       ASN  45 -10.657  -3.748   1.408
  369   1HB   ASN  45          1HB       ASN  45 -12.364  -3.569   3.922
  370   2HB   ASN  45          2HB       ASN  45 -10.710  -4.132   3.777
  371   1HD2  ASN  45          1HD2      ASN  45 -12.818  -1.443   4.147
  372   2HD2  ASN  45          2HD2      ASN  45 -11.635  -0.193   4.338
  373    H    SER  46           H        SER  46 -11.105  -6.107   1.804
  374    HA   SER  46           HA       SER  46 -13.927  -6.724   1.402
  375   1HB   SER  46          1HB       SER  46 -13.150  -8.718   0.081
  376   2HB   SER  46          2HB       SER  46 -12.749  -7.185  -0.666
  377    HG   SER  46           HG       SER  46 -11.060  -9.136  -0.165
  378    H    LEU  47           H        LEU  47 -14.225  -9.286   1.921
  379    HA   LEU  47           HA       LEU  47 -13.339  -9.541   4.653
  380   1HB   LEU  47          1HB       LEU  47 -15.223 -11.143   2.924
  381   2HB   LEU  47          2HB       LEU  47 -14.835 -11.560   4.581
  382    HG   LEU  47           HG       LEU  47 -16.018  -8.887   3.799
  383   1HD1  LEU  47          1HD1      LEU  47 -17.298 -11.382   3.603
  384   2HD1  LEU  47          2HD1      LEU  47 -17.900 -10.638   5.104
  385   3HD1  LEU  47          3HD1      LEU  47 -18.041  -9.765   3.559
  386   1HD2  LEU  47          1HD2      LEU  47 -15.356 -10.249   6.371
  387   2HD2  LEU  47          2HD2      LEU  47 -15.207  -8.538   5.903
  388   3HD2  LEU  47          3HD2      LEU  47 -16.803  -9.215   6.309
  389    H    LEU  48           H        LEU  48 -11.759  -9.993   1.858
  390    HA   LEU  48           HA       LEU  48 -10.627 -12.573   2.672
  391   1HB   LEU  48          1HB       LEU  48 -10.420 -11.173   0.005
  392   2HB   LEU  48          2HB       LEU  48  -9.815 -12.769   0.402
  393    HG   LEU  48           HG       LEU  48 -12.656 -12.581   0.973
  394   1HD1  LEU  48          1HD1      LEU  48 -12.351 -10.841  -0.900
  395   2HD1  LEU  48          2HD1      LEU  48 -12.020 -12.238  -1.952
  396   3HD1  LEU  48          3HD1      LEU  48 -13.585 -12.106  -1.114
  397   1HD2  LEU  48          1HD2      LEU  48 -12.734 -14.575  -0.466
  398   2HD2  LEU  48          2HD2      LEU  48 -11.036 -14.301  -0.926
  399   3HD2  LEU  48          3HD2      LEU  48 -11.450 -14.680   0.762
  400    H    VAL  49           H        VAL  49  -9.773  -9.257   1.478
  401    HA   VAL  49           HA       VAL  49  -7.319  -9.501   3.066
  402    HB   VAL  49           HB       VAL  49  -6.007  -8.587   1.362
  403   1HG1  VAL  49          1HG1      VAL  49  -6.502 -10.071  -0.657
  404   2HG1  VAL  49          2HG1      VAL  49  -6.302 -10.892   0.910
  405   3HG1  VAL  49          3HG1      VAL  49  -7.932 -10.637   0.240
  406   1HG2  VAL  49          1HG2      VAL  49  -7.244  -6.795   0.494
  407   2HG2  VAL  49          2HG2      VAL  49  -7.103  -7.917  -0.882
  408   3HG2  VAL  49          3HG2      VAL  49  -8.619  -7.834   0.048
  409    H    LYS  50           H        LYS  50  -6.539  -7.480   3.953
  410    HA   LYS  50           HA       LYS  50  -8.675  -5.468   4.053
  411   1HB   LYS  50          1HB       LYS  50  -8.299  -6.576   6.190
  412   2HB   LYS  50          2HB       LYS  50  -6.586  -6.220   6.117
  413   1HG   LYS  50          1HG       LYS  50  -6.894  -3.926   6.525
  414   2HG   LYS  50          2HG       LYS  50  -8.517  -3.915   5.865
  415   1HD   LYS  50          1HD       LYS  50  -9.477  -4.798   7.830
  416   2HD   LYS  50          2HD       LYS  50  -7.983  -5.553   8.349
  417   1HE   LYS  50          1HE       LYS  50  -7.195  -2.931   8.372
  418   2HE   LYS  50          2HE       LYS  50  -8.904  -2.723   8.700
  419   1HZ   LYS  50          1HZ       LYS  50  -7.990  -3.052  10.759
  420   2HZ   LYS  50          2HZ       LYS  50  -8.517  -4.557  10.407
  421   3HZ   LYS  50          3HZ       LYS  50  -6.931  -4.193  10.264
  422    H    TYR  51           H        TYR  51  -8.235  -3.374   3.460
  423    HA   TYR  51           HA       TYR  51  -5.516  -2.920   2.454
  424   1HB   TYR  51          1HB       TYR  51  -8.258  -1.584   1.998
  425   2HB   TYR  51          2HB       TYR  51  -6.791  -1.098   1.171
  426    HD1  TYR  51           HD1      TYR  51  -8.765  -4.242   1.773
  427    HD2  TYR  51           HD2      TYR  51  -6.477  -1.899  -0.981
  428    HE1  TYR  51           HE1      TYR  51  -9.232  -5.934  -0.066
  429    HE2  TYR  51           HE2      TYR  51  -6.952  -3.599  -2.811
  430    HH   TYR  51           HH       TYR  51  -8.794  -5.283  -3.266
  431    H    VAL  52           H        VAL  52  -4.293  -1.154   3.123
  432    HA   VAL  52           HA       VAL  52  -5.560   0.634   5.062
  433    HB   VAL  52           HB       VAL  52  -3.186  -1.144   5.433
  434   1HG1  VAL  52          1HG1      VAL  52  -2.469   0.344   7.344
  435   2HG1  VAL  52          2HG1      VAL  52  -2.138   0.985   5.717
  436   3HG1  VAL  52          3HG1      VAL  52  -3.515   1.610   6.658
  437   1HG2  VAL  52          1HG2      VAL  52  -4.507  -0.529   7.859
  438   2HG2  VAL  52          2HG2      VAL  52  -5.778  -0.759   6.635
  439   3HG2  VAL  52          3HG2      VAL  52  -4.579  -2.043   6.924
  440    H    CYS  53           H        CYS  53  -5.053   2.768   4.742
  441    HA   CYS  53           HA       CYS  53  -3.105   3.264   2.622
  442   1HB   CYS  53          1HB       CYS  53  -5.322   5.058   3.628
  443   2HB   CYS  53          2HB       CYS  53  -4.236   5.402   2.297
  444    H    CYS  54           H        CYS  54  -1.771   5.322   2.930
  445    HA   CYS  54           HA       CYS  54  -1.570   6.348   5.579
  446   1HB   CYS  54          1HB       CYS  54   0.892   5.692   5.765
  447   2HB   CYS  54          2HB       CYS  54  -0.323   4.503   6.191
  448    H    ASN  55           H        ASN  55  -0.528   8.391   5.497
  449    HA   ASN  55           HA       ASN  55   0.240   9.172   2.808
  450   1HB   ASN  55          1HB       ASN  55   0.101  11.545   4.089
  451   2HB   ASN  55          2HB       ASN  55  -1.337  10.765   3.460
  452   1HD2  ASN  55          1HD2      ASN  55   0.773  10.437   6.318
  453   2HD2  ASN  55          2HD2      ASN  55  -0.480  10.426   7.515
  454    H    THR  56           H        THR  56   1.710   7.862   5.391
  455    HA   THR  56           HA       THR  56   3.858   9.825   5.671
  456    HB   THR  56           HB       THR  56   4.554   8.165   7.495
  457    HG1  THR  56           HG1      THR  56   2.944   6.481   7.843
  458   1HG2  THR  56          1HG2      THR  56   1.694   8.543   8.155
  459   2HG2  THR  56          2HG2      THR  56   3.134   9.186   8.982
  460   3HG2  THR  56          3HG2      THR  56   2.462  10.038   7.570
  461    H    ASP  57           H        ASP  57   6.145   8.983   5.639
  462    HA   ASP  57           HA       ASP  57   6.448   7.618   3.153
  463   1HB   ASP  57          1HB       ASP  57   8.788   8.248   4.941
  464   2HB   ASP  57          2HB       ASP  57   8.661   8.393   3.198
  465    H    ARG  58           H        ARG  58   8.010   5.706   2.977
  466    HA   ARG  58           HA       ARG  58   8.287   3.591   3.467
  467   1HB   ARG  58          1HB       ARG  58   9.520   4.951   5.911
  468   2HB   ARG  58          2HB       ARG  58   9.765   3.253   5.553
  469   1HG   ARG  58          1HG       ARG  58  11.121   3.682   3.715
  470   2HG   ARG  58          2HG       ARG  58  10.281   5.161   3.297
  471   1HD   ARG  58          1HD       ARG  58  12.364   5.950   4.103
  472   2HD   ARG  58          2HD       ARG  58  11.312   6.149   5.490
  473    HE   ARG  58           HE       ARG  58  12.582   3.526   5.459
  474   1HH1  ARG  58          1HH1      ARG  58  13.070   6.904   6.314
  475   2HH1  ARG  58          2HH1      ARG  58  14.282   6.560   7.504
  476   1HH2  ARG  58          1HH2      ARG  58  14.180   3.072   7.029
  477   2HH2  ARG  58          2HH2      ARG  58  14.916   4.366   7.914
  478    H    CYS  59           H        CYS  59   5.633   4.352   4.161
  479    HA   CYS  59           HA       CYS  59   5.122   3.371   6.815
  480   1HB   CYS  59          1HB       CYS  59   2.815   3.911   6.381
  481   2HB   CYS  59          2HB       CYS  59   3.847   5.258   5.945
  482    H    ASN  60           H        ASN  60   4.538   2.445   3.359
  483    HA   ASN  60           HA       ASN  60   3.799  -0.197   4.328
  484   1HB   ASN  60          1HB       ASN  60   2.717  -0.523   2.140
  485   2HB   ASN  60          2HB       ASN  60   2.160   0.993   2.820
  486   1HD2  ASN  60          1HD2      ASN  60   4.113  -0.557   0.402
  487   2HD2  ASN  60          2HD2      ASN  60   4.420   0.820  -0.603
  488   1H    HOH  61          1H        HOH  61  -0.955 -11.737   4.200
  489   2H    HOH  61          2H        HOH  61  -0.006 -11.274   3.116
  Start of MODEL    2
    1   1H    LEU   1           H1       LEU   1   7.936  12.529  -0.508
    2    HA   LEU   1           HA       LEU   1   6.678  10.917   0.333
    3   1HB   LEU   1          1HB       LEU   1   5.185  12.264  -1.543
    4   2HB   LEU   1          2HB       LEU   1   4.933  10.590  -1.998
    5    HG   LEU   1           HG       LEU   1   3.170  11.260  -0.524
    6   1HD1  LEU   1          1HD1      LEU   1   3.589   9.025  -0.131
    7   2HD1  LEU   1          2HD1      LEU   1   5.179   9.337   0.604
    8   3HD1  LEU   1          3HD1      LEU   1   3.693   9.712   1.507
    9   1HD2  LEU   1          1HD2      LEU   1   5.377  12.476   1.045
   10   2HD2  LEU   1          2HD2      LEU   1   3.714  13.043   0.757
   11   3HD2  LEU   1          3HD2      LEU   1   4.027  11.777   1.970
   12    H    LYS   2           H        LYS   2   8.461   9.403   0.314
   13    HA   LYS   2           HA       LYS   2   8.237   7.419  -1.838
   14   1HB   LYS   2          1HB       LYS   2  10.604   7.789   0.005
   15   2HB   LYS   2          2HB       LYS   2  10.526   6.885  -1.494
   16   1HG   LYS   2          1HG       LYS   2  11.278   8.753  -2.544
   17   2HG   LYS   2          2HG       LYS   2   9.696   9.453  -2.262
   18   1HD   LYS   2          1HD       LYS   2  10.826  11.058  -1.094
   19   2HD   LYS   2          2HD       LYS   2  10.886   9.871   0.194
   20   1HE   LYS   2          1HE       LYS   2  13.108   9.165  -0.406
   21   2HE   LYS   2          2HE       LYS   2  13.023   9.943  -1.973
   22   1HZ   LYS   2          1HZ       LYS   2  14.286  11.159  -0.247
   23   2HZ   LYS   2          2HZ       LYS   2  13.111  12.043  -0.955
   24   3HZ   LYS   2          3HZ       LYS   2  12.887  11.441   0.547
   25    H    CYS   3           H        CYS   3   8.022   5.211  -1.309
   26    HA   CYS   3           HA       CYS   3   7.666   4.654   1.533
   27   1HB   CYS   3          1HB       CYS   3   5.645   4.326  -0.641
   28   2HB   CYS   3          2HB       CYS   3   5.720   3.104   0.612
   29    H    ASN   4           H        ASN   4   7.577   2.132   1.825
   30    HA   ASN   4           HA       ASN   4   9.812   1.111   0.425
   31   1HB   ASN   4          1HB       ASN   4   7.986  -0.594   2.152
   32   2HB   ASN   4          2HB       ASN   4   9.729  -0.683   1.994
   33   1HD2  ASN   4          1HD2      ASN   4   7.569  -0.137   4.180
   34   2HD2  ASN   4          2HD2      ASN   4   8.244   1.154   5.118
   35    H    LYS   5           H        LYS   5   9.631  -1.274  -0.500
   36    HA   LYS   5           HA       LYS   5   7.305  -1.316  -2.256
   37   1HB   LYS   5          1HB       LYS   5   9.956  -2.781  -2.396
   38   2HB   LYS   5          2HB       LYS   5   8.661  -2.938  -3.565
   39   1HG   LYS   5          1HG       LYS   5   9.964  -0.271  -2.849
   40   2HG   LYS   5          2HG       LYS   5  10.481  -1.266  -4.194
   41   1HD   LYS   5          1HD       LYS   5   7.739   0.016  -3.816
   42   2HD   LYS   5          2HD       LYS   5   8.932   0.429  -5.030
   43   1HE   LYS   5          1HE       LYS   5   8.591  -2.308  -5.451
   44   2HE   LYS   5          2HE       LYS   5   6.978  -1.802  -4.994
   45   1HZ   LYS   5          1HZ       LYS   5   8.050  -1.521  -7.430
   46   2HZ   LYS   5          2HZ       LYS   5   6.750  -0.696  -6.884
   47   3HZ   LYS   5          3HZ       LYS   5   8.235  -0.017  -6.820
   48    H    LEU   6           H        LEU   6   7.473  -4.162  -2.836
   49    HA   LEU   6           HA       LEU   6   5.597  -5.169  -1.191
   50   1HB   LEU   6          1HB       LEU   6   6.917  -6.055  -3.346
   51   2HB   LEU   6          2HB       LEU   6   7.683  -7.063  -2.134
   52    HG   LEU   6           HG       LEU   6   5.394  -7.819  -1.411
   53   1HD1  LEU   6          1HD1      LEU   6   3.729  -6.458  -2.070
   54   2HD1  LEU   6          2HD1      LEU   6   4.616  -5.885  -3.503
   55   3HD1  LEU   6          3HD1      LEU   6   3.766  -7.448  -3.550
   56   1HD2  LEU   6          1HD2      LEU   6   6.656  -9.320  -2.724
   57   2HD2  LEU   6          2HD2      LEU   6   5.040  -9.263  -3.468
   58   3HD2  LEU   6          3HD2      LEU   6   6.392  -8.373  -4.207
   59    H    VAL   7           H        VAL   7   9.127  -5.017  -0.620
   60    HA   VAL   7           HA       VAL   7   8.571  -5.795   2.145
   61    HB   VAL   7           HB       VAL   7  11.065  -6.722   0.768
   62   1HG1  VAL   7          1HG1      VAL   7  10.574  -8.639   2.495
   63   2HG1  VAL   7          2HG1      VAL   7  11.252  -7.088   3.046
   64   3HG1  VAL   7          3HG1      VAL   7   9.515  -7.421   3.247
   65   1HG2  VAL   7          1HG2      VAL   7   8.426  -8.226   0.756
   66   2HG2  VAL   7          2HG2      VAL   7   9.233  -7.515  -0.663
   67   3HG2  VAL   7          3HG2      VAL   7   9.997  -8.861   0.214
   68    HA   PRO   8           HA       PRO   8  10.705  -2.127   3.040
   69   1HB   PRO   8          1HB       PRO   8  11.726  -3.502   5.533
   70   2HB   PRO   8          2HB       PRO   8  10.750  -2.032   5.377
   71   1HG   PRO   8          1HG       PRO   8   9.566  -4.354   6.190
   72   2HG   PRO   8          2HG       PRO   8   8.718  -3.319   5.019
   73   1HD   PRO   8          1HD       PRO   8  10.427  -5.809   4.383
   74   2HD   PRO   8          2HD       PRO   8   8.754  -5.451   3.874
   75    H    ILE   9           H        ILE   9  12.506  -4.572   1.813
   76    HA   ILE   9           HA       ILE   9  15.085  -3.490   2.630
   77    HB   ILE   9           HB       ILE   9  14.961  -5.845   2.716
   78   1HG1  ILE   9          1HG1      ILE   9  16.367  -5.718   0.118
   79   2HG1  ILE   9          2HG1      ILE   9  16.872  -4.515   1.288
   80   1HG2  ILE   9          1HG2      ILE   9  13.398  -6.879   1.517
   81   2HG2  ILE   9          2HG2      ILE   9  13.308  -5.548   0.338
   82   3HG2  ILE   9          3HG2      ILE   9  14.537  -6.822   0.151
   83   1HD1  ILE   9          1HD1      ILE   9  17.264  -6.279   2.982
   84   2HD1  ILE   9          2HD1      ILE   9  16.698  -7.515   1.833
   85   3HD1  ILE   9          3HD1      ILE   9  18.195  -6.611   1.502
   86    H    ALA  10           H        ALA  10  12.659  -2.799   0.419
   87    HA   ALA  10           HA       ALA  10  14.511  -1.271  -1.177
   88   1HB   ALA  10          1HB       ALA  10  13.716  -2.205  -3.314
   89   2HB   ALA  10          2HB       ALA  10  14.493  -3.464  -2.324
   90   3HB   ALA  10          3HB       ALA  10  12.718  -3.388  -2.434
   91    H    TYR  11           H        TYR  11  13.618   0.720  -1.370
   92    HA   TYR  11           HA       TYR  11  10.678   0.854  -1.372
   93   1HB   TYR  11          1HB       TYR  11  11.018   2.938  -0.018
   94   2HB   TYR  11          2HB       TYR  11  11.797   1.590   0.786
   95    HD1  TYR  11           HD1      TYR  11  12.323   4.743  -1.008
   96    HD2  TYR  11           HD2      TYR  11  14.253   1.406   0.849
   97    HE1  TYR  11           HE1      TYR  11  14.521   6.021  -0.981
   98    HE2  TYR  11           HE2      TYR  11  16.444   2.695   0.871
   99    HH   TYR  11           HH       TYR  11  16.651   5.925  -0.586
  100    H    LYS  12           H        LYS  12   9.734   2.568  -2.628
  101    HA   LYS  12           HA       LYS  12  11.605   3.990  -4.363
  102   1HB   LYS  12          1HB       LYS  12   9.238   2.370  -5.350
  103   2HB   LYS  12          2HB       LYS  12  10.207   3.451  -6.332
  104   1HG   LYS  12          1HG       LYS  12  12.242   2.001  -5.395
  105   2HG   LYS  12          2HG       LYS  12  10.996   0.812  -5.078
  106   1HD   LYS  12          1HD       LYS  12  11.479   0.186  -7.247
  107   2HD   LYS  12          2HD       LYS  12  10.291   1.421  -7.615
  108   1HE   LYS  12          1HE       LYS  12  11.958   2.276  -8.943
  109   2HE   LYS  12          2HE       LYS  12  12.527   2.989  -7.446
  110   1HZ   LYS  12          1HZ       LYS  12  13.685   0.684  -7.239
  111   2HZ   LYS  12          2HZ       LYS  12  13.550   0.683  -8.867
  112   3HZ   LYS  12          3HZ       LYS  12  14.361   1.884  -8.115
  113    H    THR  13           H        THR  13   9.960   5.501  -5.862
  114    HA   THR  13           HA       THR  13   8.549   7.043  -3.822
  115    HB   THR  13           HB       THR  13  10.066   7.554  -6.324
  116    HG1  THR  13           HG1      THR  13   9.092   9.257  -4.149
  117   1HG2  THR  13          1HG2      THR  13   7.672   8.206  -7.000
  118   2HG2  THR  13          2HG2      THR  13   7.676   9.331  -5.620
  119   3HG2  THR  13          3HG2      THR  13   8.829   9.557  -6.958
  120    H    CYS  14           H        CYS  14   6.394   7.732  -4.015
  121    HA   CYS  14           HA       CYS  14   4.734   5.790  -5.231
  122   1HB   CYS  14          1HB       CYS  14   4.110   8.416  -3.868
  123   2HB   CYS  14          2HB       CYS  14   2.888   7.304  -4.452
  124    HA   PRO  15           HA       PRO  15   5.173   7.683  -9.268
  125   1HB   PRO  15          1HB       PRO  15   3.049   6.123 -10.368
  126   2HB   PRO  15          2HB       PRO  15   4.768   5.696 -10.346
  127   1HG   PRO  15          1HG       PRO  15   2.513   4.878  -8.398
  128   2HG   PRO  15          2HG       PRO  15   3.855   3.907  -9.047
  129   1HD   PRO  15          1HD       PRO  15   4.045   4.876  -6.513
  130   2HD   PRO  15          2HD       PRO  15   5.485   4.813  -7.565
  131    H    GLU  16           H        GLU  16   3.891   8.788 -10.998
  132    HA   GLU  16           HA       GLU  16   2.350  10.788  -9.847
  133   1HB   GLU  16          1HB       GLU  16   2.522  10.005 -12.791
  134   2HB   GLU  16          2HB       GLU  16   2.006  11.560 -12.168
  135   1HG   GLU  16          1HG       GLU  16   4.716  10.491 -11.353
  136   2HG   GLU  16          2HG       GLU  16   4.527  11.174 -12.954
  137    H    GLY  17           H        GLY  17   0.209  10.864  -9.309
  138   1HA   GLY  17          1HA       GLY  17  -2.055  10.503 -10.181
  139   2HA   GLY  17          2HA       GLY  17  -1.571   8.866 -10.573
  140    H    LYS  18           H        LYS  18   0.177   9.103  -7.904
  141    HA   LYS  18           HA       LYS  18  -2.013   8.863  -5.996
  142   1HB   LYS  18          1HB       LYS  18  -0.912   6.730  -5.138
  143   2HB   LYS  18          2HB       LYS  18  -1.854   6.606  -6.611
  144   1HG   LYS  18          1HG       LYS  18   0.556   7.166  -7.728
  145   2HG   LYS  18          2HG       LYS  18   1.126   6.439  -6.240
  146   1HD   LYS  18          1HD       LYS  18   0.866   4.456  -7.346
  147   2HD   LYS  18          2HD       LYS  18  -0.831   4.637  -6.951
  148   1HE   LYS  18          1HE       LYS  18  -0.945   6.059  -9.180
  149   2HE   LYS  18          2HE       LYS  18   0.573   5.274  -9.565
  150   1HZ   LYS  18          1HZ       LYS  18  -1.857   3.812  -8.802
  151   2HZ   LYS  18          2HZ       LYS  18  -1.405   4.083 -10.347
  152   3HZ   LYS  18          3HZ       LYS  18  -0.467   3.170  -9.371
  153    H    ASN  19           H        ASN  19  -1.536   9.897  -4.121
  154    HA   ASN  19           HA       ASN  19   1.269  10.609  -3.782
  155   1HB   ASN  19          1HB       ASN  19  -0.068  12.615  -4.037
  156   2HB   ASN  19          2HB       ASN  19  -1.323  12.007  -2.976
  157   1HD2  ASN  19          1HD2      ASN  19  -1.327  13.521  -1.441
  158   2HD2  ASN  19          2HD2      ASN  19  -0.003  13.905  -0.393
  159    H    LEU  20           H        LEU  20  -1.419   8.778  -2.604
  160    HA   LEU  20           HA       LEU  20  -0.358   8.724   0.122
  161   1HB   LEU  20          1HB       LEU  20  -2.992   7.843  -1.059
  162   2HB   LEU  20          2HB       LEU  20  -2.504   7.499   0.589
  163    HG   LEU  20           HG       LEU  20  -2.249  10.339  -0.049
  164   1HD1  LEU  20          1HD1      LEU  20  -4.716   8.940  -0.864
  165   2HD1  LEU  20          2HD1      LEU  20  -4.959  10.363   0.178
  166   3HD1  LEU  20          3HD1      LEU  20  -4.068  10.523  -1.355
  167   1HD2  LEU  20          1HD2      LEU  20  -3.147  10.642   2.073
  168   2HD2  LEU  20          2HD2      LEU  20  -4.058   9.113   2.021
  169   3HD2  LEU  20          3HD2      LEU  20  -2.289   9.088   2.213
  170    H    CYS  21           H        CYS  21  -0.053   6.606   1.176
  171    HA   CYS  21           HA       CYS  21   0.888   4.676  -0.804
  172   1HB   CYS  21          1HB       CYS  21   1.760   5.395   1.966
  173   2HB   CYS  21          2HB       CYS  21   2.024   3.758   1.398
  174    H    TYR  22           H        TYR  22   0.180   2.479  -0.662
  175    HA   TYR  22           HA       TYR  22  -1.819   1.914   1.405
  176   1HB   TYR  22          1HB       TYR  22  -3.413   1.381  -0.281
  177   2HB   TYR  22          2HB       TYR  22  -2.555   2.678  -1.089
  178    HD1  TYR  22           HD1      TYR  22  -3.598  -0.719  -1.303
  179    HD2  TYR  22           HD2      TYR  22  -0.554   1.984  -2.620
  180    HE1  TYR  22           HE1      TYR  22  -3.029  -2.284  -3.224
  181    HE2  TYR  22           HE2      TYR  22   0.005   0.410  -4.536
  182    HH   TYR  22           HH       TYR  22  -1.372  -2.780  -4.709
  183    H    LYS  23           H        LYS  23  -2.087  -0.354   1.884
  184    HA   LYS  23           HA       LYS  23  -0.229  -2.154   0.559
  185   1HB   LYS  23          1HB       LYS  23   0.515  -2.954   2.881
  186   2HB   LYS  23          2HB       LYS  23   1.230  -1.484   2.250
  187   1HG   LYS  23          1HG       LYS  23  -0.933  -0.409   3.527
  188   2HG   LYS  23          2HG       LYS  23  -0.701  -1.837   4.515
  189   1HD   LYS  23          1HD       LYS  23   1.910  -0.863   4.188
  190   2HD   LYS  23          2HD       LYS  23   0.957   0.600   4.328
  191   1HE   LYS  23          1HE       LYS  23  -0.096  -1.113   6.320
  192   2HE   LYS  23          2HE       LYS  23   1.634  -1.377   6.393
  193   1HZ   LYS  23          1HZ       LYS  23   0.385   1.282   6.414
  194   2HZ   LYS  23          2HZ       LYS  23   0.864   0.480   7.754
  195   3HZ   LYS  23          3HZ       LYS  23   1.967   0.950   6.645
  196    H    MET  24           H        MET  24  -1.179  -4.099   0.193
  197    HA   MET  24           HA       MET  24  -3.738  -4.492   1.509
  198   1HB   MET  24          1HB       MET  24  -2.449  -5.715  -0.993
  199   2HB   MET  24          2HB       MET  24  -4.008  -6.229  -0.379
  200   1HG   MET  24          1HG       MET  24  -4.736  -3.748  -0.535
  201   2HG   MET  24          2HG       MET  24  -3.259  -3.466  -1.436
  202   1HE   MET  24          1HE       MET  24  -3.284  -5.458  -4.402
  203   2HE   MET  24          2HE       MET  24  -3.791  -3.758  -4.541
  204   3HE   MET  24          3HE       MET  24  -2.580  -4.229  -3.325
  205    H    PHE  25           H        PHE  25  -4.071  -6.142   2.965
  206    HA   PHE  25           HA       PHE  25  -1.917  -8.128   3.166
  207   1HB   PHE  25          1HB       PHE  25  -3.759  -6.966   5.341
  208   2HB   PHE  25          2HB       PHE  25  -2.416  -8.055   5.624
  209    HD1  PHE  25           HD1      PHE  25  -0.169  -7.018   4.283
  210    HD2  PHE  25           HD2      PHE  25  -3.324  -4.846   6.108
  211    HE1  PHE  25           HE1      PHE  25   1.361  -5.052   4.589
  212    HE2  PHE  25           HE2      PHE  25  -1.794  -2.881   6.415
  213    HZ   PHE  25           HZ       PHE  25   0.530  -3.008   5.651
  214    H    MET  26           H        MET  26  -2.511 -10.296   3.434
  215    HA   MET  26           HA       MET  26  -5.182 -10.874   2.648
  216   1HB   MET  26          1HB       MET  26  -2.844 -12.676   3.491
  217   2HB   MET  26          2HB       MET  26  -4.321 -13.260   2.752
  218   1HG   MET  26          1HG       MET  26  -3.853 -12.131   0.669
  219   2HG   MET  26          2HG       MET  26  -2.600 -11.144   1.395
  220   1HE   MET  26          1HE       MET  26  -3.921 -14.237   0.230
  221   2HE   MET  26          2HE       MET  26  -2.573 -14.680  -0.845
  222   3HE   MET  26          3HE       MET  26  -2.799 -15.535   0.701
  223    H    MET  27           H        MET  27  -6.657 -12.344   3.829
  224    HA   MET  27           HA       MET  27  -6.932 -11.554   6.478
  225   1HB   MET  27          1HB       MET  27  -8.197 -13.590   4.627
  226   2HB   MET  27          2HB       MET  27  -8.557 -13.731   6.336
  227   1HG   MET  27          1HG       MET  27  -8.827 -11.046   4.936
  228   2HG   MET  27          2HG       MET  27 -10.111 -12.233   4.824
  229   1HE   MET  27          1HE       MET  27 -10.821  -9.282   7.413
  230   2HE   MET  27          2HE       MET  27 -10.514  -9.595   5.688
  231   3HE   MET  27          3HE       MET  27 -11.905 -10.356   6.497
  232    H    SER  28           H        SER  28  -5.425 -14.405   4.935
  233    HA   SER  28           HA       SER  28  -5.268 -15.918   7.284
  234   1HB   SER  28          1HB       SER  28  -5.064 -17.102   5.231
  235   2HB   SER  28          2HB       SER  28  -3.860 -15.995   4.601
  236    HG   SER  28           HG       SER  28  -2.991 -18.085   5.338
  237    H    ASP  29           H        ASP  29  -2.202 -15.357   5.608
  238    HA   ASP  29           HA       ASP  29  -0.961 -14.749   8.064
  239   1HB   ASP  29          1HB       ASP  29  -0.052 -15.934   5.871
  240   2HB   ASP  29          2HB       ASP  29   0.310 -14.302   5.345
  241    H    LEU  30           H        LEU  30  -2.127 -12.718   8.648
  242    HA   LEU  30           HA       LEU  30  -1.978 -10.475   6.893
  243   1HB   LEU  30          1HB       LEU  30  -2.634 -10.424   9.829
  244   2HB   LEU  30          2HB       LEU  30  -3.138  -9.304   8.579
  245    HG   LEU  30           HG       LEU  30  -4.106 -11.852   7.798
  246   1HD1  LEU  30          1HD1      LEU  30  -3.727 -11.901  10.558
  247   2HD1  LEU  30          2HD1      LEU  30  -5.453 -11.520  10.351
  248   3HD1  LEU  30          3HD1      LEU  30  -4.767 -12.980   9.597
  249   1HD2  LEU  30          1HD2      LEU  30  -5.456  -9.386   8.920
  250   2HD2  LEU  30          2HD2      LEU  30  -5.203  -9.811   7.211
  251   3HD2  LEU  30          3HD2      LEU  30  -6.326 -10.766   8.209
  252    H    THR  31           H        THR  31   0.218 -12.055   9.012
  253    HA   THR  31           HA       THR  31   1.675  -9.631   9.666
  254    HB   THR  31           HB       THR  31   1.465 -11.402  11.362
  255    HG1  THR  31           HG1      THR  31   3.620 -11.052  11.759
  256   1HG2  THR  31          1HG2      THR  31   2.763 -13.147   9.206
  257   2HG2  THR  31          2HG2      THR  31   2.708 -13.590  10.930
  258   3HG2  THR  31          3HG2      THR  31   1.197 -13.427  10.004
  259    H    ILE  32           H        ILE  32   1.262 -11.270   6.860
  260    HA   ILE  32           HA       ILE  32   3.938 -10.509   5.993
  261    HB   ILE  32           HB       ILE  32   2.788 -13.249   5.967
  262   1HG1  ILE  32          1HG1      ILE  32   5.698 -12.752   5.801
  263   2HG1  ILE  32          2HG1      ILE  32   4.915 -12.075   7.216
  264   1HG2  ILE  32          1HG2      ILE  32   4.299 -13.809   4.017
  265   2HG2  ILE  32          2HG2      ILE  32   2.808 -12.920   3.624
  266   3HG2  ILE  32          3HG2      ILE  32   4.367 -12.062   3.680
  267   1HD1  ILE  32          1HD1      ILE  32   4.735 -14.980   6.293
  268   2HD1  ILE  32          2HD1      ILE  32   5.660 -14.373   7.688
  269   3HD1  ILE  32          3HD1      ILE  32   3.881 -14.306   7.702
  270    HA   PRO  33           HA       PRO  33   0.912  -8.395   3.447
  271   1HB   PRO  33          1HB       PRO  33   3.561  -7.399   2.307
  272   2HB   PRO  33          2HB       PRO  33   2.094  -6.482   2.687
  273   1HG   PRO  33          1HG       PRO  33   4.196  -6.409   4.419
  274   2HG   PRO  33          2HG       PRO  33   2.552  -6.584   5.077
  275   1HD   PRO  33          1HD       PRO  33   4.646  -8.791   4.681
  276   2HD   PRO  33          2HD       PRO  33   3.558  -8.504   6.069
  277    H    VAL  34           H        VAL  34   0.125  -8.299   1.287
  278    HA   VAL  34           HA       VAL  34   1.220 -10.438  -0.399
  279    HB   VAL  34           HB       VAL  34  -0.969 -10.977   0.262
  280   1HG1  VAL  34          1HG1      VAL  34  -1.724  -8.893   1.196
  281   2HG1  VAL  34          2HG1      VAL  34  -1.719  -8.113  -0.404
  282   3HG1  VAL  34          3HG1      VAL  34  -2.897  -9.399  -0.044
  283   1HG2  VAL  34          1HG2      VAL  34  -0.622 -11.390  -2.086
  284   2HG2  VAL  34          2HG2      VAL  34  -2.287 -10.804  -1.862
  285   3HG2  VAL  34          3HG2      VAL  34  -1.037  -9.708  -2.494
  286    H    LYS  35           H        LYS  35  -0.073  -7.070  -0.335
  287    HA   LYS  35           HA       LYS  35   1.556  -6.539  -2.693
  288   1HB   LYS  35          1HB       LYS  35  -1.295  -5.554  -2.582
  289   2HB   LYS  35          2HB       LYS  35  -0.185  -5.546  -3.938
  290   1HG   LYS  35          1HG       LYS  35  -0.194  -8.204  -3.515
  291   2HG   LYS  35          2HG       LYS  35  -1.742  -7.852  -2.771
  292   1HD   LYS  35          1HD       LYS  35  -2.744  -7.329  -4.777
  293   2HD   LYS  35          2HD       LYS  35  -1.323  -6.515  -5.399
  294   1HE   LYS  35          1HE       LYS  35  -0.714  -9.336  -5.125
  295   2HE   LYS  35          2HE       LYS  35  -2.232  -9.179  -5.984
  296   1HZ   LYS  35          1HZ       LYS  35  -0.034  -7.447  -6.754
  297   2HZ   LYS  35          2HZ       LYS  35   0.014  -9.010  -7.223
  298   3HZ   LYS  35          3HZ       LYS  35  -1.238  -8.061  -7.671
  299    H    ARG  36           H        ARG  36   2.314  -4.373  -2.811
  300    HA   ARG  36           HA       ARG  36   1.409  -2.577  -0.780
  301   1HB   ARG  36          1HB       ARG  36   4.114  -3.914  -0.725
  302   2HB   ARG  36          2HB       ARG  36   4.047  -2.222  -0.276
  303   1HG   ARG  36          1HG       ARG  36   1.995  -3.025   1.241
  304   2HG   ARG  36          2HG       ARG  36   2.754  -4.596   1.079
  305   1HD   ARG  36          1HD       ARG  36   4.940  -3.545   1.873
  306   2HD   ARG  36          2HD       ARG  36   4.060  -2.061   2.179
  307    HE   ARG  36           HE       ARG  36   2.745  -4.306   3.452
  308   1HH1  ARG  36          1HH1      ARG  36   5.488  -2.128   3.782
  309   2HH1  ARG  36          2HH1      ARG  36   5.573  -2.289   5.504
  310   1HH2  ARG  36          1HH2      ARG  36   2.856  -4.520   5.725
  311   2HH2  ARG  36          2HH2      ARG  36   4.066  -3.659   6.617
  312    H    GLY  37           H        GLY  37   1.435  -0.497  -1.626
  313   1HA   GLY  37          1HA       GLY  37   3.494   0.421  -3.376
  314   2HA   GLY  37          2HA       GLY  37   2.029   0.037  -4.259
  315    H    CYS  38           H        CYS  38   1.452   2.178  -4.797
  316    HA   CYS  38           HA       CYS  38   0.599   3.759  -2.488
  317   1HB   CYS  38          1HB       CYS  38   1.782   4.952  -4.997
  318   2HB   CYS  38          2HB       CYS  38   1.300   5.795  -3.538
  319    H    ILE  39           H        ILE  39  -1.192   5.344  -3.143
  320    HA   ILE  39           HA       ILE  39  -2.521   4.777  -5.626
  321    HB   ILE  39           HB       ILE  39  -3.135   2.930  -3.954
  322   1HG1  ILE  39          1HG1      ILE  39  -5.645   4.216  -4.873
  323   2HG1  ILE  39          2HG1      ILE  39  -4.414   4.000  -6.101
  324   1HG2  ILE  39          1HG2      ILE  39  -4.817   5.176  -2.810
  325   2HG2  ILE  39          2HG2      ILE  39  -4.916   3.453  -2.378
  326   3HG2  ILE  39          3HG2      ILE  39  -3.446   4.381  -2.000
  327   1HD1  ILE  39          1HD1      ILE  39  -4.202   1.560  -5.218
  328   2HD1  ILE  39          2HD1      ILE  39  -5.741   1.877  -4.382
  329   3HD1  ILE  39          3HD1      ILE  39  -5.657   1.974  -6.157
  330    H    ASP  40           H        ASP  40  -4.789   6.065  -5.510
  331    HA   ASP  40           HA       ASP  40  -3.992   8.659  -4.503
  332   1HB   ASP  40          1HB       ASP  40  -4.611   8.958  -6.727
  333   2HB   ASP  40          2HB       ASP  40  -5.766   7.641  -6.696
  334    H    VAL  41           H        VAL  41  -6.790   6.344  -4.664
  335    HA   VAL  41           HA       VAL  41  -7.967   7.750  -2.368
  336    HB   VAL  41           HB       VAL  41  -9.563   5.836  -3.972
  337   1HG1  VAL  41          1HG1      VAL  41  -9.952   8.219  -2.276
  338   2HG1  VAL  41          2HG1      VAL  41 -11.005   8.148  -3.709
  339   3HG1  VAL  41          3HG1      VAL  41 -11.005   6.808  -2.538
  340   1HG2  VAL  41          1HG2      VAL  41 -10.065   7.731  -5.625
  341   2HG2  VAL  41          2HG2      VAL  41  -8.534   8.456  -5.079
  342   3HG2  VAL  41          3HG2      VAL  41  -8.536   6.847  -5.840
  343    H    CYS  42           H        CYS  42  -8.696   6.509  -0.570
  344    HA   CYS  42           HA       CYS  42  -7.115   4.192  -0.130
  345   1HB   CYS  42          1HB       CYS  42  -7.889   6.025   1.540
  346   2HB   CYS  42          2HB       CYS  42  -9.364   5.085   1.652
  347    HA   PRO  43           HA       PRO  43 -10.232   1.685  -2.136
  348   1HB   PRO  43          1HB       PRO  43  -8.292  -0.528  -1.447
  349   2HB   PRO  43          2HB       PRO  43  -8.976  -0.078  -3.019
  350   1HG   PRO  43          1HG       PRO  43  -6.380   0.551  -2.450
  351   2HG   PRO  43          2HG       PRO  43  -7.399   1.755  -3.274
  352   1HD   PRO  43          1HD       PRO  43  -6.781   1.618  -0.254
  353   2HD   PRO  43          2HD       PRO  43  -6.583   3.001  -1.364
  354    H    LYS  44           H        LYS  44 -11.829   0.084  -1.765
  355    HA   LYS  44           HA       LYS  44 -12.584  -0.134   0.971
  356   1HB   LYS  44          1HB       LYS  44 -13.780  -1.251  -1.580
  357   2HB   LYS  44          2HB       LYS  44 -14.513  -1.416   0.003
  358   1HG   LYS  44          1HG       LYS  44 -13.758   1.364  -0.425
  359   2HG   LYS  44          2HG       LYS  44 -14.706   0.804  -1.787
  360   1HD   LYS  44          1HD       LYS  44 -16.405  -0.120  -0.102
  361   2HD   LYS  44          2HD       LYS  44 -15.500   0.695   1.158
  362   1HE   LYS  44          1HE       LYS  44 -15.910   2.883   0.145
  363   2HE   LYS  44          2HE       LYS  44 -16.595   2.150  -1.292
  364   1HZ   LYS  44          1HZ       LYS  44 -18.391   2.753   0.012
  365   2HZ   LYS  44          2HZ       LYS  44 -18.265   1.148   0.282
  366   3HZ   LYS  44          3HZ       LYS  44 -17.730   2.208   1.403
  367    H    ASN  45           H        ASN  45 -12.605  -1.952   2.319
  368    HA   ASN  45           HA       ASN  45 -10.633  -3.889   1.601
  369   1HB   ASN  45          1HB       ASN  45 -12.358  -3.969   4.110
  370   2HB   ASN  45          2HB       ASN  45 -10.716  -4.550   3.912
  371   1HD2  ASN  45          1HD2      ASN  45 -12.493  -2.248   5.310
  372   2HD2  ASN  45          2HD2      ASN  45 -11.381  -0.924   5.389
  373    H    SER  46           H        SER  46 -11.114  -6.290   1.821
  374    HA   SER  46           HA       SER  46 -13.927  -6.824   1.261
  375   1HB   SER  46          1HB       SER  46 -13.115  -8.719  -0.192
  376   2HB   SER  46          2HB       SER  46 -12.696  -7.130  -0.798
  377    HG   SER  46           HG       SER  46 -10.571  -7.473   0.379
  378    H    LEU  47           H        LEU  47 -14.322  -9.385   1.578
  379    HA   LEU  47           HA       LEU  47 -13.557  -9.893   4.299
  380   1HB   LEU  47          1HB       LEU  47 -15.341 -11.307   2.323
  381   2HB   LEU  47          2HB       LEU  47 -15.015 -11.931   3.929
  382    HG   LEU  47           HG       LEU  47 -16.216  -9.200   3.405
  383   1HD1  LEU  47          1HD1      LEU  47 -17.580 -11.850   3.931
  384   2HD1  LEU  47          2HD1      LEU  47 -18.372 -10.268   4.122
  385   3HD1  LEU  47          3HD1      LEU  47 -17.772 -10.776   2.525
  386   1HD2  LEU  47          1HD2      LEU  47 -17.017  -9.837   5.880
  387   2HD2  LEU  47          2HD2      LEU  47 -15.483 -10.739   5.841
  388   3HD2  LEU  47          3HD2      LEU  47 -15.492  -8.984   5.541
  389    H    LEU  48           H        LEU  48 -11.886 -10.167   1.488
  390    HA   LEU  48           HA       LEU  48 -10.738 -12.767   2.207
  391   1HB   LEU  48          1HB       LEU  48 -10.468 -11.203  -0.363
  392   2HB   LEU  48          2HB       LEU  48  -9.831 -12.805  -0.043
  393    HG   LEU  48           HG       LEU  48 -11.713 -13.290  -1.270
  394   1HD1  LEU  48          1HD1      LEU  48 -13.128 -13.247   1.378
  395   2HD1  LEU  48          2HD1      LEU  48 -13.136 -14.487   0.101
  396   3HD1  LEU  48          3HD1      LEU  48 -11.703 -14.285   1.136
  397   1HD2  LEU  48          1HD2      LEU  48 -12.624 -11.125  -1.599
  398   2HD2  LEU  48          2HD2      LEU  48 -13.931 -12.129  -0.925
  399   3HD2  LEU  48          3HD2      LEU  48 -13.071 -10.971   0.117
  400    H    VAL  49           H        VAL  49  -9.802  -9.431   1.111
  401    HA   VAL  49           HA       VAL  49  -7.488  -9.676   2.892
  402    HB   VAL  49           HB       VAL  49  -6.028  -8.785   1.272
  403   1HG1  VAL  49          1HG1      VAL  49  -6.147 -11.086   0.890
  404   2HG1  VAL  49          2HG1      VAL  49  -7.791 -10.992   0.215
  405   3HG1  VAL  49          3HG1      VAL  49  -6.406 -10.395  -0.730
  406   1HG2  VAL  49          1HG2      VAL  49  -6.584  -7.719  -0.703
  407   2HG2  VAL  49          2HG2      VAL  49  -8.140  -8.571  -0.854
  408   3HG2  VAL  49          3HG2      VAL  49  -7.955  -7.259   0.335
  409    H    LYS  50           H        LYS  50  -6.561  -7.467   3.442
  410    HA   LYS  50           HA       LYS  50  -8.743  -5.498   3.461
  411   1HB   LYS  50          1HB       LYS  50  -8.381  -6.533   5.670
  412   2HB   LYS  50          2HB       LYS  50  -6.697  -6.054   5.631
  413   1HG   LYS  50          1HG       LYS  50  -8.275  -3.717   5.030
  414   2HG   LYS  50          2HG       LYS  50  -8.990  -4.487   6.432
  415   1HD   LYS  50          1HD       LYS  50  -6.043  -4.430   6.582
  416   2HD   LYS  50          2HD       LYS  50  -6.726  -2.824   6.429
  417   1HE   LYS  50          1HE       LYS  50  -8.434  -3.809   8.299
  418   2HE   LYS  50          2HE       LYS  50  -7.048  -4.821   8.653
  419   1HZ   LYS  50          1HZ       LYS  50  -6.676  -1.948   8.341
  420   2HZ   LYS  50          2HZ       LYS  50  -7.252  -2.538   9.751
  421   3HZ   LYS  50          3HZ       LYS  50  -5.788  -3.012   9.205
  422    H    TYR  51           H        TYR  51  -8.237  -3.368   2.937
  423    HA   TYR  51           HA       TYR  51  -5.538  -3.030   1.840
  424   1HB   TYR  51          1HB       TYR  51  -8.254  -1.620   1.468
  425   2HB   TYR  51          2HB       TYR  51  -6.797  -1.125   0.630
  426    HD1  TYR  51           HD1      TYR  51  -6.585  -1.837  -1.562
  427    HD2  TYR  51           HD2      TYR  51  -8.727  -4.303   1.201
  428    HE1  TYR  51           HE1      TYR  51  -7.106  -3.486  -3.425
  429    HE2  TYR  51           HE2      TYR  51  -9.239  -5.944  -0.671
  430    HH   TYR  51           HH       TYR  51  -7.713  -6.303  -3.219
  431    H    VAL  52           H        VAL  52  -4.123  -1.713   2.870
  432    HA   VAL  52           HA       VAL  52  -5.251   0.110   4.873
  433    HB   VAL  52           HB       VAL  52  -2.729  -1.481   4.655
  434   1HG1  VAL  52          1HG1      VAL  52  -3.026   1.134   6.159
  435   2HG1  VAL  52          2HG1      VAL  52  -1.795  -0.089   6.554
  436   3HG1  VAL  52          3HG1      VAL  52  -1.792   0.692   4.955
  437   1HG2  VAL  52          1HG2      VAL  52  -3.260  -1.759   7.141
  438   2HG2  VAL  52          2HG2      VAL  52  -4.811  -0.958   6.789
  439   3HG2  VAL  52          3HG2      VAL  52  -4.400  -2.494   5.988
  440    H    CYS  53           H        CYS  53  -4.192   2.251   5.094
  441    HA   CYS  53           HA       CYS  53  -2.835   3.087   2.653
  442   1HB   CYS  53          1HB       CYS  53  -5.154   4.606   3.861
  443   2HB   CYS  53          2HB       CYS  53  -4.200   5.086   2.472
  444    H    CYS  54           H        CYS  54  -1.705   5.251   3.024
  445    HA   CYS  54           HA       CYS  54  -1.500   6.198   5.689
  446   1HB   CYS  54          1HB       CYS  54   1.007   5.720   5.820
  447   2HB   CYS  54          2HB       CYS  54  -0.111   4.437   6.240
  448    H    ASN  55           H        ASN  55  -0.102   8.164   5.731
  449    HA   ASN  55           HA       ASN  55   0.398   9.109   3.017
  450   1HB   ASN  55          1HB       ASN  55   0.140  11.444   4.349
  451   2HB   ASN  55          2HB       ASN  55  -1.255  10.606   3.701
  452   1HD2  ASN  55          1HD2      ASN  55   0.865  10.368   6.560
  453   2HD2  ASN  55          2HD2      ASN  55  -0.387  10.251   7.751
  454    H    THR  56           H        THR  56   1.921   7.838   5.602
  455    HA   THR  56           HA       THR  56   3.978   9.894   5.897
  456    HB   THR  56           HB       THR  56   4.743   8.053   7.638
  457    HG1  THR  56           HG1      THR  56   3.260   6.396   7.763
  458   1HG2  THR  56          1HG2      THR  56   2.171   9.684   7.825
  459   2HG2  THR  56          2HG2      THR  56   2.732   8.677   9.181
  460   3HG2  THR  56          3HG2      THR  56   3.741  10.021   8.593
  461    H    ASP  57           H        ASP  57   6.292   9.213   5.815
  462    HA   ASP  57           HA       ASP  57   6.691   7.923   3.331
  463   1HB   ASP  57          1HB       ASP  57   8.959   8.475   5.238
  464   2HB   ASP  57          2HB       ASP  57   8.907   8.690   3.500
  465    H    ARG  58           H        ARG  58   8.191   6.003   3.066
  466    HA   ARG  58           HA       ARG  58   8.431   3.858   3.454
  467   1HB   ARG  58          1HB       ARG  58   9.754   5.107   5.909
  468   2HB   ARG  58          2HB       ARG  58   9.951   3.414   5.497
  469   1HG   ARG  58          1HG       ARG  58  10.913   4.025   3.298
  470   2HG   ARG  58          2HG       ARG  58  10.630   5.725   3.616
  471   1HD   ARG  58          1HD       ARG  58  12.841   5.613   4.307
  472   2HD   ARG  58          2HD       ARG  58  12.078   5.190   5.827
  473    HE   ARG  58           HE       ARG  58  12.337   2.739   4.583
  474   1HH1  ARG  58          1HH1      ARG  58  14.597   5.349   5.264
  475   2HH1  ARG  58          2HH1      ARG  58  15.970   4.300   5.387
  476   1HH2  ARG  58          1HH2      ARG  58  14.148   1.355   4.747
  477   2HH2  ARG  58          2HH2      ARG  58  15.713   2.012   5.092
  478    H    CYS  59           H        CYS  59   5.807   4.598   4.231
  479    HA   CYS  59           HA       CYS  59   5.327   3.582   6.869
  480   1HB   CYS  59          1HB       CYS  59   3.001   4.060   6.429
  481   2HB   CYS  59          2HB       CYS  59   4.005   5.435   6.012
  482    H    ASN  60           H        ASN  60   4.657   2.645   3.424
  483    HA   ASN  60           HA       ASN  60   3.993  -0.007   4.402
  484   1HB   ASN  60          1HB       ASN  60   2.848  -0.350   2.292
  485   2HB   ASN  60          2HB       ASN  60   2.402   1.257   2.828
  486   1HD2  ASN  60          1HD2      ASN  60   4.474  -0.605   0.691
  487   2HD2  ASN  60          2HD2      ASN  60   4.798   0.635  -0.473
  488   1H    HOH  61          1H        HOH  61  -0.853 -11.891   3.939
  489   2H    HOH  61          2H        HOH  61  -0.165 -11.178   2.795
  Start of MODEL    3
    1   1H    LEU   1           H1       LEU   1   5.973  12.224  -1.915
    2    HA   LEU   1           HA       LEU   1   6.845  11.159   0.669
    3   1HB   LEU   1          1HB       LEU   1   4.235  10.943  -0.835
    4   2HB   LEU   1          2HB       LEU   1   4.597  10.050   0.628
    5    HG   LEU   1           HG       LEU   1   4.700  13.069   0.516
    6   1HD1  LEU   1          1HD1      LEU   1   2.369  11.347   0.401
    7   2HD1  LEU   1          2HD1      LEU   1   2.368  12.348   1.872
    8   3HD1  LEU   1          3HD1      LEU   1   2.492  13.118   0.272
    9   1HD2  LEU   1          1HD2      LEU   1   5.775  11.559   2.387
   10   2HD2  LEU   1          2HD2      LEU   1   4.888  13.046   2.800
   11   3HD2  LEU   1          3HD2      LEU   1   4.094  11.463   2.966
   12    H    LYS   2           H        LYS   2   7.993   9.306   0.721
   13    HA   LYS   2           HA       LYS   2   7.739   7.542  -1.615
   14   1HB   LYS   2          1HB       LYS   2  10.258   8.166  -0.043
   15   2HB   LYS   2          2HB       LYS   2  10.127   6.998  -1.342
   16   1HG   LYS   2          1HG       LYS   2  10.655   8.699  -2.756
   17   2HG   LYS   2          2HG       LYS   2   9.026   9.291  -2.493
   18   1HD   LYS   2          1HD       LYS   2   9.748  11.062  -1.247
   19   2HD   LYS   2          2HD       LYS   2  10.833  10.065  -0.299
   20   1HE   LYS   2          1HE       LYS   2  11.749  10.404  -3.093
   21   2HE   LYS   2          2HE       LYS   2  11.603  11.929  -2.242
   22   1HZ   LYS   2          1HZ       LYS   2  12.826  10.626  -0.398
   23   2HZ   LYS   2          2HZ       LYS   2  13.307   9.659  -1.622
   24   3HZ   LYS   2          3HZ       LYS   2  13.672  11.250  -1.647
   25    H    CYS   3           H        CYS   3   7.684   5.298  -1.204
   26    HA   CYS   3           HA       CYS   3   7.673   4.567   1.621
   27   1HB   CYS   3          1HB       CYS   3   5.436   4.260  -0.335
   28   2HB   CYS   3          2HB       CYS   3   5.705   2.976   0.827
   29    H    ASN   4           H        ASN   4   7.576   1.971   1.682
   30    HA   ASN   4           HA       ASN   4   9.762   1.152   0.076
   31   1HB   ASN   4          1HB       ASN   4   8.068  -0.742   1.746
   32   2HB   ASN   4          2HB       ASN   4   9.797  -0.797   1.461
   33   1HD2  ASN   4          1HD2      ASN   4  11.188   0.450   2.639
   34   2HD2  ASN   4          2HD2      ASN   4  10.737   1.333   4.059
   35    H    LYS   5           H        LYS   5   9.665  -0.898  -1.291
   36    HA   LYS   5           HA       LYS   5   7.112  -1.003  -2.699
   37   1HB   LYS   5          1HB       LYS   5   9.871  -1.989  -3.485
   38   2HB   LYS   5          2HB       LYS   5   8.434  -2.114  -4.478
   39   1HG   LYS   5          1HG       LYS   5   8.950   0.621  -3.417
   40   2HG   LYS   5          2HG       LYS   5  10.189   0.026  -4.503
   41   1HD   LYS   5          1HD       LYS   5   8.652   1.047  -5.979
   42   2HD   LYS   5          2HD       LYS   5   8.220  -0.648  -6.084
   43   1HE   LYS   5          1HE       LYS   5   6.329  -0.356  -4.587
   44   2HE   LYS   5          2HE       LYS   5   6.855   1.251  -4.127
   45   1HZ   LYS   5          1HZ       LYS   5   5.637   1.990  -5.785
   46   2HZ   LYS   5          2HZ       LYS   5   6.641   1.275  -6.856
   47   3HZ   LYS   5          3HZ       LYS   5   5.310   0.487  -6.332
   48    H    LEU   6           H        LEU   6   7.258  -3.559  -3.825
   49    HA   LEU   6           HA       LEU   6   5.999  -5.115  -2.018
   50   1HB   LEU   6          1HB       LEU   6   6.624  -5.339  -4.602
   51   2HB   LEU   6          2HB       LEU   6   7.792  -6.477  -3.961
   52    HG   LEU   6           HG       LEU   6   5.749  -7.599  -4.676
   53   1HD1  LEU   6          1HD1      LEU   6   6.220  -9.098  -3.115
   54   2HD1  LEU   6          2HD1      LEU   6   6.974  -7.837  -2.109
   55   3HD1  LEU   6          3HD1      LEU   6   5.238  -8.188  -1.941
   56   1HD2  LEU   6          1HD2      LEU   6   3.669  -6.918  -4.233
   57   2HD2  LEU   6          2HD2      LEU   6   4.023  -6.651  -2.509
   58   3HD2  LEU   6          3HD2      LEU   6   4.418  -5.393  -3.704
   59    H    VAL   7           H        VAL   7   9.559  -5.034  -2.671
   60    HA   VAL   7           HA       VAL   7   9.938  -6.741  -0.334
   61    HB   VAL   7           HB       VAL   7  11.544  -5.988  -2.741
   62   1HG1  VAL   7          1HG1      VAL   7  13.397  -7.381  -1.349
   63   2HG1  VAL   7          2HG1      VAL   7  13.334  -5.602  -1.400
   64   3HG1  VAL   7          3HG1      VAL   7  12.631  -6.480  -0.020
   65   1HG2  VAL   7          1HG2      VAL   7  11.525  -8.697  -1.471
   66   2HG2  VAL   7          2HG2      VAL   7  10.038  -8.131  -2.268
   67   3HG2  VAL   7          3HG2      VAL   7  11.556  -8.237  -3.190
   68    HA   PRO   8           HA       PRO   8  10.443  -2.913   1.866
   69   1HB   PRO   8          1HB       PRO   8  11.000  -4.850   4.131
   70   2HB   PRO   8          2HB       PRO   8   9.856  -3.499   4.062
   71   1HG   PRO   8          1HG       PRO   8   8.926  -6.053   3.846
   72   2HG   PRO   8          2HG       PRO   8   8.265  -4.805   2.764
   73   1HD   PRO   8          1HD       PRO   8  10.477  -6.847   2.100
   74   2HD   PRO   8          2HD       PRO   8   8.994  -6.473   1.180
   75    H    ILE   9           H        ILE   9  12.972  -4.623   0.709
   76    HA   ILE   9           HA       ILE   9  14.950  -3.531   2.548
   77    HB   ILE   9           HB       ILE   9  14.771  -5.816   0.796
   78   1HG1  ILE   9          1HG1      ILE   9  16.935  -6.316   2.208
   79   2HG1  ILE   9          2HG1      ILE   9  16.440  -4.905   3.121
   80   1HG2  ILE   9          1HG2      ILE   9  16.068  -4.378  -0.744
   81   2HG2  ILE   9          2HG2      ILE   9  17.303  -4.174   0.521
   82   3HG2  ILE   9          3HG2      ILE   9  16.988  -5.787  -0.164
   83   1HD1  ILE   9          1HD1      ILE   9  15.528  -7.078   4.030
   84   2HD1  ILE   9          2HD1      ILE   9  14.264  -5.896   3.617
   85   3HD1  ILE   9          3HD1      ILE   9  14.595  -7.263   2.526
   86    H    ALA  10           H        ALA  10  13.121  -2.507  -0.065
   87    HA   ALA  10           HA       ALA  10  14.976  -0.360  -0.565
   88   1HB   ALA  10          1HB       ALA  10  15.241  -0.720  -2.900
   89   2HB   ALA  10          2HB       ALA  10  15.568  -2.300  -2.149
   90   3HB   ALA  10          3HB       ALA  10  13.997  -1.992  -2.927
   91    H    TYR  11           H        TYR  11  13.870   1.531  -1.019
   92    HA   TYR  11           HA       TYR  11  10.993   1.225  -1.554
   93   1HB   TYR  11          1HB       TYR  11  10.731   3.165   0.010
   94   2HB   TYR  11          2HB       TYR  11  11.582   1.872   0.832
   95    HD1  TYR  11           HD1      TYR  11  13.826   2.161   1.619
   96    HD2  TYR  11           HD2      TYR  11  12.013   5.156  -0.840
   97    HE1  TYR  11           HE1      TYR  11  15.724   3.764   2.159
   98    HE2  TYR  11           HE2      TYR  11  13.917   6.749  -0.292
   99    HH   TYR  11           HH       TYR  11  16.726   5.652   1.490
  100    H    LYS  12           H        LYS  12   9.996   3.069  -2.678
  101    HA   LYS  12           HA       LYS  12  11.933   4.801  -4.016
  102   1HB   LYS  12          1HB       LYS  12   9.890   3.034  -5.386
  103   2HB   LYS  12          2HB       LYS  12  10.654   4.405  -6.165
  104   1HG   LYS  12          1HG       LYS  12  12.685   2.772  -4.858
  105   2HG   LYS  12          2HG       LYS  12  11.693   1.759  -5.888
  106   1HD   LYS  12          1HD       LYS  12  12.900   2.509  -7.657
  107   2HD   LYS  12          2HD       LYS  12  12.133   4.070  -7.443
  108   1HE   LYS  12          1HE       LYS  12  14.031   5.016  -6.591
  109   2HE   LYS  12          2HE       LYS  12  14.339   3.657  -5.529
  110   1HZ   LYS  12          1HZ       LYS  12  16.035   3.848  -7.188
  111   2HZ   LYS  12          2HZ       LYS  12  15.212   2.457  -7.427
  112   3HZ   LYS  12          3HZ       LYS  12  14.948   3.740  -8.402
  113    H    THR  13           H        THR  13  10.177   6.221  -5.634
  114    HA   THR  13           HA       THR  13   8.601   7.576  -3.587
  115    HB   THR  13           HB       THR  13   9.036   9.482  -4.848
  116    HG1  THR  13           HG1      THR  13   8.073   9.208  -6.826
  117   1HG2  THR  13          1HG2      THR  13  11.218   9.464  -5.704
  118   2HG2  THR  13          2HG2      THR  13  11.264   7.958  -4.757
  119   3HG2  THR  13          3HG2      THR  13  10.992   7.897  -6.516
  120    H    CYS  14           H        CYS  14   6.392   8.102  -3.817
  121    HA   CYS  14           HA       CYS  14   4.904   6.020  -4.990
  122   1HB   CYS  14          1HB       CYS  14   4.054   8.672  -3.811
  123   2HB   CYS  14          2HB       CYS  14   2.938   7.427  -4.336
  124    HA   PRO  15           HA       PRO  15   5.314   7.709  -9.119
  125   1HB   PRO  15          1HB       PRO  15   3.345   5.937 -10.178
  126   2HB   PRO  15          2HB       PRO  15   5.089   5.638 -10.086
  127   1HG   PRO  15          1HG       PRO  15   2.838   4.771  -8.152
  128   2HG   PRO  15          2HG       PRO  15   4.265   3.864  -8.708
  129   1HD   PRO  15          1HD       PRO  15   4.306   4.988  -6.231
  130   2HD   PRO  15          2HD       PRO  15   5.780   4.966  -7.239
  131    H    GLU  16           H        GLU  16   3.894   8.472 -11.002
  132    HA   GLU  16           HA       GLU  16   2.317  10.538 -10.079
  133   1HB   GLU  16          1HB       GLU  16   2.586   9.257 -12.827
  134   2HB   GLU  16          2HB       GLU  16   1.620  10.693 -12.553
  135   1HG   GLU  16          1HG       GLU  16   4.521  10.561 -11.647
  136   2HG   GLU  16          2HG       GLU  16   4.109  10.999 -13.294
  137    H    GLY  17           H        GLY  17   0.060  10.864  -9.933
  138   1HA   GLY  17          1HA       GLY  17  -2.167  10.253 -10.301
  139   2HA   GLY  17          2HA       GLY  17  -1.679   8.599 -10.612
  140    H    LYS  18           H        LYS  18   0.211   8.574  -8.236
  141    HA   LYS  18           HA       LYS  18  -1.869   8.116  -6.237
  142   1HB   LYS  18          1HB       LYS  18   0.983   7.107  -6.435
  143   2HB   LYS  18          2HB       LYS  18  -0.113   6.749  -5.116
  144   1HG   LYS  18          1HG       LYS  18  -0.567   4.907  -6.439
  145   2HG   LYS  18          2HG       LYS  18  -1.739   6.010  -7.130
  146   1HD   LYS  18          1HD       LYS  18   0.404   6.684  -8.659
  147   2HD   LYS  18          2HD       LYS  18   0.863   5.037  -8.276
  148   1HE   LYS  18          1HE       LYS  18  -1.920   5.710  -9.316
  149   2HE   LYS  18          2HE       LYS  18  -0.582   5.419 -10.408
  150   1HZ   LYS  18          1HZ       LYS  18  -0.276   3.275  -9.294
  151   2HZ   LYS  18          2HZ       LYS  18  -1.606   3.548  -8.388
  152   3HZ   LYS  18          3HZ       LYS  18  -1.739   3.402 -10.008
  153    H    ASN  19           H        ASN  19  -1.227   8.631  -3.907
  154    HA   ASN  19           HA       ASN  19   0.575  10.882  -3.772
  155   1HB   ASN  19          1HB       ASN  19  -1.529  12.040  -4.089
  156   2HB   ASN  19          2HB       ASN  19  -2.386  10.935  -3.033
  157   1HD2  ASN  19          1HD2      ASN  19  -3.157  12.535  -1.715
  158   2HD2  ASN  19          2HD2      ASN  19  -2.178  13.421  -0.593
  159    H    LEU  20           H        LEU  20  -1.745   8.625  -2.140
  160    HA   LEU  20           HA       LEU  20  -0.121   8.772   0.289
  161   1HB   LEU  20          1HB       LEU  20  -2.824   7.487  -0.092
  162   2HB   LEU  20          2HB       LEU  20  -1.996   7.801   1.420
  163    HG   LEU  20           HG       LEU  20  -2.309  10.272  -0.043
  164   1HD1  LEU  20          1HD1      LEU  20  -4.787  10.417   0.065
  165   2HD1  LEU  20          2HD1      LEU  20  -4.191   9.270  -1.159
  166   3HD1  LEU  20          3HD1      LEU  20  -4.841   8.666   0.385
  167   1HD2  LEU  20          1HD2      LEU  20  -2.241   9.407   2.581
  168   2HD2  LEU  20          2HD2      LEU  20  -2.595  11.060   2.023
  169   3HD2  LEU  20          3HD2      LEU  20  -3.928   9.930   2.364
  170    H    CYS  21           H        CYS  21  -0.040   6.502   1.474
  171    HA   CYS  21           HA       CYS  21   0.982   4.659  -0.546
  172   1HB   CYS  21          1HB       CYS  21   1.657   5.108   2.352
  173   2HB   CYS  21          2HB       CYS  21   2.077   3.609   1.546
  174    H    TYR  22           H        TYR  22   0.317   2.421  -0.474
  175    HA   TYR  22           HA       TYR  22  -1.917   1.867   1.351
  176   1HB   TYR  22          1HB       TYR  22  -3.218   1.204  -0.529
  177   2HB   TYR  22          2HB       TYR  22  -2.279   2.491  -1.259
  178    HD1  TYR  22           HD1      TYR  22  -2.965  -1.073  -1.229
  179    HD2  TYR  22           HD2      TYR  22  -0.272   1.925  -2.667
  180    HE1  TYR  22           HE1      TYR  22  -2.066  -2.701  -2.963
  181    HE2  TYR  22           HE2      TYR  22   0.618   0.287  -4.396
  182    HH   TYR  22           HH       TYR  22  -0.933  -2.370  -5.324
  183    H    LYS  23           H        LYS  23  -2.297  -0.461   1.720
  184    HA   LYS  23           HA       LYS  23  -0.266  -2.276   0.806
  185   1HB   LYS  23          1HB       LYS  23   0.298  -2.891   3.244
  186   2HB   LYS  23          2HB       LYS  23   1.084  -1.498   2.529
  187   1HG   LYS  23          1HG       LYS  23  -0.639  -0.002   3.581
  188   2HG   LYS  23          2HG       LYS  23  -1.392  -1.402   4.318
  189   1HD   LYS  23          1HD       LYS  23   0.080  -1.330   6.040
  190   2HD   LYS  23          2HD       LYS  23   1.425  -1.504   4.930
  191   1HE   LYS  23          1HE       LYS  23   1.815   0.799   4.805
  192   2HE   LYS  23          2HE       LYS  23   0.139   1.213   5.106
  193   1HZ   LYS  23          1HZ       LYS  23   1.281  -0.143   7.304
  194   2HZ   LYS  23          2HZ       LYS  23   2.138   1.196   6.934
  195   3HZ   LYS  23          3HZ       LYS  23   0.541   1.312   7.259
  196    H    MET  24           H        MET  24  -1.097  -4.326   0.663
  197    HA   MET  24           HA       MET  24  -3.700  -4.669   1.941
  198   1HB   MET  24          1HB       MET  24  -2.564  -5.818  -0.668
  199   2HB   MET  24          2HB       MET  24  -4.107  -6.304   0.006
  200   1HG   MET  24          1HG       MET  24  -5.119  -4.218  -0.430
  201   2HG   MET  24          2HG       MET  24  -3.596  -3.352  -0.411
  202   1HE   MET  24          1HE       MET  24  -5.789  -5.544  -3.560
  203   2HE   MET  24          2HE       MET  24  -4.516  -6.683  -3.059
  204   3HE   MET  24          3HE       MET  24  -5.629  -6.002  -1.848
  205    H    PHE  25           H        PHE  25  -4.212  -6.771   2.839
  206    HA   PHE  25           HA       PHE  25  -1.988  -8.647   2.970
  207   1HB   PHE  25          1HB       PHE  25  -3.604  -7.759   5.418
  208   2HB   PHE  25          2HB       PHE  25  -2.099  -8.655   5.415
  209    HD1  PHE  25           HD1      PHE  25  -3.413  -5.355   4.252
  210    HD2  PHE  25           HD2      PHE  25  -0.176  -7.507   5.955
  211    HE1  PHE  25           HE1      PHE  25  -2.137  -3.212   4.534
  212    HE2  PHE  25           HE2      PHE  25   1.099  -5.364   6.238
  213    HZ   PHE  25           HZ       PHE  25   0.104  -3.242   5.525
  214    H    MET  26           H        MET  26  -2.672 -10.807   3.807
  215    HA   MET  26           HA       MET  26  -5.233 -11.421   2.747
  216   1HB   MET  26          1HB       MET  26  -3.132 -13.099   4.231
  217   2HB   MET  26          2HB       MET  26  -4.543 -13.780   3.447
  218   1HG   MET  26          1HG       MET  26  -3.717 -12.592   1.283
  219   2HG   MET  26          2HG       MET  26  -2.204 -12.337   2.132
  220   1HE   MET  26          1HE       MET  26  -4.279 -14.672   0.020
  221   2HE   MET  26          2HE       MET  26  -3.954 -16.302   0.656
  222   3HE   MET  26          3HE       MET  26  -4.911 -15.147   1.614
  223    H    MET  27           H        MET  27  -6.874 -12.764   3.968
  224    HA   MET  27           HA       MET  27  -7.604 -11.427   6.288
  225   1HB   MET  27          1HB       MET  27  -8.500 -13.890   4.771
  226   2HB   MET  27          2HB       MET  27  -9.138 -13.671   6.389
  227   1HG   MET  27          1HG       MET  27  -9.220 -11.371   4.409
  228   2HG   MET  27          2HG       MET  27 -10.435 -12.631   4.333
  229   1HE   MET  27          1HE       MET  27 -11.002  -9.100   5.749
  230   2HE   MET  27          2HE       MET  27  -9.790  -9.242   7.046
  231   3HE   MET  27          3HE       MET  27  -9.342  -9.612   5.363
  232    H    SER  28           H        SER  28  -5.793 -14.451   5.700
  233    HA   SER  28           HA       SER  28  -5.997 -15.346   8.361
  234   1HB   SER  28          1HB       SER  28  -5.552 -16.979   6.661
  235   2HB   SER  28          2HB       SER  28  -4.201 -16.065   6.018
  236    HG   SER  28           HG       SER  28  -4.316 -17.387   8.594
  237    H    ASP  29           H        ASP  29  -2.728 -15.222   7.051
  238    HA   ASP  29           HA       ASP  29  -1.843 -13.896   9.381
  239   1HB   ASP  29          1HB       ASP  29  -0.668 -15.697   7.823
  240   2HB   ASP  29          2HB       ASP  29  -0.153 -14.302   6.896
  241    H    LEU  30           H        LEU  30  -2.802 -11.743   9.263
  242    HA   LEU  30           HA       LEU  30  -2.469 -10.157   6.915
  243   1HB   LEU  30          1HB       LEU  30  -3.233  -9.188   9.659
  244   2HB   LEU  30          2HB       LEU  30  -3.619  -8.474   8.106
  245    HG   LEU  30           HG       LEU  30  -4.705 -11.091   8.066
  246   1HD1  LEU  30          1HD1      LEU  30  -5.343  -9.633  10.644
  247   2HD1  LEU  30          2HD1      LEU  30  -6.221 -11.044  10.008
  248   3HD1  LEU  30          3HD1      LEU  30  -4.512 -11.199  10.481
  249   1HD2  LEU  30          1HD2      LEU  30  -5.654  -9.277   6.836
  250   2HD2  LEU  30          2HD2      LEU  30  -6.871  -9.834   8.011
  251   3HD2  LEU  30          3HD2      LEU  30  -5.948  -8.344   8.323
  252    H    THR  31           H        THR  31  -0.298 -11.249   9.212
  253    HA   THR  31           HA       THR  31   1.179  -8.764   9.461
  254    HB   THR  31           HB       THR  31   0.974 -11.351  10.815
  255    HG1  THR  31           HG1      THR  31   2.420  -8.834  11.264
  256   1HG2  THR  31          1HG2      THR  31   3.384 -11.515  11.437
  257   2HG2  THR  31          2HG2      THR  31   3.168 -11.834   9.699
  258   3HG2  THR  31          3HG2      THR  31   3.778 -10.254  10.244
  259    H    ILE  32           H        ILE  32   0.717 -10.941   6.993
  260    HA   ILE  32           HA       ILE  32   3.450 -10.462   6.029
  261    HB   ILE  32           HB       ILE  32   1.858 -12.796   5.075
  262   1HG1  ILE  32          1HG1      ILE  32   1.804 -12.742   7.628
  263   2HG1  ILE  32          2HG1      ILE  32   2.418 -14.195   6.865
  264   1HG2  ILE  32          1HG2      ILE  32   3.773 -12.725   3.856
  265   2HG2  ILE  32          2HG2      ILE  32   4.699 -11.909   5.138
  266   3HG2  ILE  32          3HG2      ILE  32   4.378 -13.657   5.246
  267   1HD1  ILE  32          1HD1      ILE  32   4.154 -11.921   7.932
  268   2HD1  ILE  32          2HD1      ILE  32   3.862 -13.470   8.759
  269   3HD1  ILE  32          3HD1      ILE  32   4.749 -13.438   7.215
  270    HA   PRO  33           HA       PRO  33   0.743  -7.902   3.482
  271   1HB   PRO  33          1HB       PRO  33   3.513  -7.094   2.507
  272   2HB   PRO  33          2HB       PRO  33   2.126  -6.069   2.913
  273   1HG   PRO  33          1HG       PRO  33   4.183  -6.314   4.691
  274   2HG   PRO  33          2HG       PRO  33   2.510  -6.347   5.297
  275   1HD   PRO  33          1HD       PRO  33   4.366  -8.744   4.818
  276   2HD   PRO  33          2HD       PRO  33   3.285  -8.416   6.199
  277    H    VAL  34           H        VAL  34  -0.092  -7.879   1.410
  278    HA   VAL  34           HA       VAL  34   1.075  -9.874  -0.398
  279    HB   VAL  34           HB       VAL  34  -1.090 -10.254  -1.234
  280   1HG1  VAL  34          1HG1      VAL  34  -0.869 -11.448   0.779
  281   2HG1  VAL  34          2HG1      VAL  34  -1.048  -9.984   1.776
  282   3HG1  VAL  34          3HG1      VAL  34  -2.455 -10.651   0.912
  283   1HG2  VAL  34          1HG2      VAL  34  -2.206  -8.288  -1.580
  284   2HG2  VAL  34          2HG2      VAL  34  -3.024  -8.809  -0.087
  285   3HG2  VAL  34          3HG2      VAL  34  -1.718  -7.601  -0.011
  286    H    LYS  35           H        LYS  35  -0.155  -6.524  -0.050
  287    HA   LYS  35           HA       LYS  35   1.187  -5.923  -2.584
  288   1HB   LYS  35          1HB       LYS  35  -1.461  -4.689  -1.799
  289   2HB   LYS  35          2HB       LYS  35  -0.609  -4.539  -3.322
  290   1HG   LYS  35          1HG       LYS  35  -0.953  -7.351  -2.819
  291   2HG   LYS  35          2HG       LYS  35  -2.494  -6.579  -2.507
  292   1HD   LYS  35          1HD       LYS  35  -2.849  -6.148  -4.717
  293   2HD   LYS  35          2HD       LYS  35  -1.233  -5.505  -4.937
  294   1HE   LYS  35          1HE       LYS  35  -0.355  -7.893  -4.988
  295   2HE   LYS  35          2HE       LYS  35  -2.012  -8.460  -4.927
  296   1HZ   LYS  35          1HZ       LYS  35  -0.646  -7.069  -7.076
  297   2HZ   LYS  35          2HZ       LYS  35  -1.649  -8.356  -7.146
  298   3HZ   LYS  35          3HZ       LYS  35  -2.258  -6.858  -6.927
  299    H    ARG  36           H        ARG  36   2.448  -4.082  -2.553
  300    HA   ARG  36           HA       ARG  36   2.096  -2.303  -0.318
  301   1HB   ARG  36          1HB       ARG  36   4.429  -4.140  -0.702
  302   2HB   ARG  36          2HB       ARG  36   4.848  -2.484  -0.313
  303   1HG   ARG  36          1HG       ARG  36   2.885  -2.853   1.531
  304   2HG   ARG  36          2HG       ARG  36   3.396  -4.520   1.352
  305   1HD   ARG  36          1HD       ARG  36   5.537  -4.111   2.211
  306   2HD   ARG  36          2HD       ARG  36   5.556  -2.443   1.671
  307    HE   ARG  36           HE       ARG  36   3.507  -2.561   3.583
  308   1HH1  ARG  36          1HH1      ARG  36   6.964  -3.214   3.524
  309   2HH1  ARG  36          2HH1      ARG  36   7.198  -2.813   5.194
  310   1HH2  ARG  36          1HH2      ARG  36   3.815  -2.033   5.785
  311   2HH2  ARG  36          2HH2      ARG  36   5.394  -2.137   6.489
  312    H    GLY  37           H        GLY  37   1.843  -0.369  -1.407
  313   1HA   GLY  37          1HA       GLY  37   3.968   0.641  -3.034
  314   2HA   GLY  37          2HA       GLY  37   2.569   0.195  -3.990
  315    H    CYS  38           H        CYS  38   1.886   2.286  -4.563
  316    HA   CYS  38           HA       CYS  38   0.912   3.865  -2.299
  317   1HB   CYS  38          1HB       CYS  38   2.093   5.021  -4.829
  318   2HB   CYS  38          2HB       CYS  38   1.484   5.912  -3.449
  319    H    ILE  39           H        ILE  39  -0.974   5.303  -2.975
  320    HA   ILE  39           HA       ILE  39  -2.261   4.548  -5.449
  321    HB   ILE  39           HB       ILE  39  -2.820   2.840  -3.603
  322   1HG1  ILE  39          1HG1      ILE  39  -5.410   3.775  -4.558
  323   2HG1  ILE  39          2HG1      ILE  39  -4.199   3.828  -5.825
  324   1HG2  ILE  39          1HG2      ILE  39  -4.726   5.021  -2.731
  325   2HG2  ILE  39          2HG2      ILE  39  -4.504   3.402  -2.024
  326   3HG2  ILE  39          3HG2      ILE  39  -3.219   4.625  -1.870
  327   1HD1  ILE  39          1HD1      ILE  39  -3.554   1.412  -4.918
  328   2HD1  ILE  39          2HD1      ILE  39  -5.206   1.452  -4.257
  329   3HD1  ILE  39          3HD1      ILE  39  -4.945   1.618  -6.010
  330    H    ASP  40           H        ASP  40  -4.405   5.854  -5.650
  331    HA   ASP  40           HA       ASP  40  -3.752   8.501  -4.684
  332   1HB   ASP  40          1HB       ASP  40  -4.312   7.814  -7.169
  333   2HB   ASP  40          2HB       ASP  40  -5.979   7.807  -6.631
  334    H    VAL  41           H        VAL  41  -6.277   5.944  -4.704
  335    HA   VAL  41           HA       VAL  41  -7.730   7.482  -2.666
  336    HB   VAL  41           HB       VAL  41  -9.221   5.586  -4.390
  337   1HG1  VAL  41          1HG1      VAL  41 -10.588   8.001  -4.198
  338   2HG1  VAL  41          2HG1      VAL  41 -10.818   6.570  -3.165
  339   3HG1  VAL  41          3HG1      VAL  41  -9.726   7.876  -2.646
  340   1HG2  VAL  41          1HG2      VAL  41  -8.347   8.312  -5.406
  341   2HG2  VAL  41          2HG2      VAL  41  -7.833   6.736  -6.055
  342   3HG2  VAL  41          3HG2      VAL  41  -9.536   7.237  -6.181
  343    H    CYS  42           H        CYS  42  -8.529   6.282  -0.894
  344    HA   CYS  42           HA       CYS  42  -7.053   3.909  -0.384
  345   1HB   CYS  42          1HB       CYS  42  -7.892   5.812   1.228
  346   2HB   CYS  42          2HB       CYS  42  -9.334   4.821   1.331
  347    HA   PRO  43           HA       PRO  43 -10.177   1.502  -2.493
  348   1HB   PRO  43          1HB       PRO  43  -8.360  -0.778  -1.692
  349   2HB   PRO  43          2HB       PRO  43  -8.955  -0.322  -3.297
  350   1HG   PRO  43          1HG       PRO  43  -6.364   0.211  -2.621
  351   2HG   PRO  43          2HG       PRO  43  -7.296   1.443  -3.504
  352   1HD   PRO  43          1HD       PRO  43  -6.818   1.323  -0.457
  353   2HD   PRO  43          2HD       PRO  43  -6.516   2.682  -1.575
  354    H    LYS  44           H        LYS  44 -11.697  -0.294  -2.213
  355    HA   LYS  44           HA       LYS  44 -12.728  -0.307   0.449
  356   1HB   LYS  44          1HB       LYS  44 -13.661  -1.805  -2.018
  357   2HB   LYS  44          2HB       LYS  44 -14.566  -1.590  -0.531
  358   1HG   LYS  44          1HG       LYS  44 -13.518   0.915  -1.805
  359   2HG   LYS  44          2HG       LYS  44 -14.787   0.082  -2.682
  360   1HD   LYS  44          1HD       LYS  44 -16.238   0.118  -0.662
  361   2HD   LYS  44          2HD       LYS  44 -14.963   0.888   0.261
  362   1HE   LYS  44          1HE       LYS  44 -15.707   2.259  -2.294
  363   2HE   LYS  44          2HE       LYS  44 -16.941   2.266  -1.049
  364   1HZ   LYS  44          1HZ       LYS  44 -14.332   2.871  -0.071
  365   2HZ   LYS  44          2HZ       LYS  44 -14.876   3.954  -1.166
  366   3HZ   LYS  44          3HZ       LYS  44 -15.745   3.649   0.182
  367    H    ASN  45           H        ASN  45 -12.813  -2.013   1.932
  368    HA   ASN  45           HA       ASN  45 -10.718  -3.916   1.563
  369   1HB   ASN  45          1HB       ASN  45 -12.616  -3.202   3.835
  370   2HB   ASN  45          2HB       ASN  45 -11.641  -4.656   3.934
  371   1HD2  ASN  45          1HD2      ASN  45 -11.195  -2.946   5.838
  372   2HD2  ASN  45          2HD2      ASN  45  -9.724  -2.050   5.645
  373    H    SER  46           H        SER  46 -11.077  -6.281   1.681
  374    HA   SER  46           HA       SER  46 -13.833  -6.993   1.038
  375   1HB   SER  46          1HB       SER  46 -12.887  -8.850  -0.336
  376   2HB   SER  46          2HB       SER  46 -12.411  -7.271  -0.926
  377    HG   SER  46           HG       SER  46 -10.385  -7.589   0.392
  378    H    LEU  47           H        LEU  47 -14.168  -9.520   1.461
  379    HA   LEU  47           HA       LEU  47 -13.369  -9.928   4.209
  380   1HB   LEU  47          1HB       LEU  47 -15.283 -11.367   2.372
  381   2HB   LEU  47          2HB       LEU  47 -14.947 -11.874   4.016
  382    HG   LEU  47           HG       LEU  47 -15.990  -9.115   3.349
  383   1HD1  LEU  47          1HD1      LEU  47 -17.398 -11.358   2.753
  384   2HD1  LEU  47          2HD1      LEU  47 -17.893 -11.091   4.442
  385   3HD1  LEU  47          3HD1      LEU  47 -18.125  -9.807   3.232
  386   1HD2  LEU  47          1HD2      LEU  47 -16.614  -9.012   5.673
  387   2HD2  LEU  47          2HD2      LEU  47 -16.098 -10.697   5.931
  388   3HD2  LEU  47          3HD2      LEU  47 -14.891  -9.445   5.551
  389    H    LEU  48           H        LEU  48 -11.597 -10.187   1.608
  390    HA   LEU  48           HA       LEU  48 -10.550 -12.827   2.358
  391   1HB   LEU  48          1HB       LEU  48 -10.501 -11.601  -0.401
  392   2HB   LEU  48          2HB       LEU  48  -9.881 -13.173   0.063
  393    HG   LEU  48           HG       LEU  48 -12.729 -12.792   0.705
  394   1HD1  LEU  48          1HD1      LEU  48 -12.304 -13.243  -2.196
  395   2HD1  LEU  48          2HD1      LEU  48 -13.635 -12.434  -1.334
  396   3HD1  LEU  48          3HD1      LEU  48 -12.100 -11.575  -1.610
  397   1HD2  LEU  48          1HD2      LEU  48 -12.927 -15.029  -0.053
  398   2HD2  LEU  48          2HD2      LEU  48 -11.390 -14.942  -0.946
  399   3HD2  LEU  48          3HD2      LEU  48 -11.387 -14.930   0.833
  400    H    VAL  49           H        VAL  49  -9.885  -9.500   1.134
  401    HA   VAL  49           HA       VAL  49  -7.261  -9.723   2.423
  402    HB   VAL  49           HB       VAL  49  -6.729  -9.964   0.162
  403   1HG1  VAL  49          1HG1      VAL  49  -7.666  -8.678  -1.666
  404   2HG1  VAL  49          2HG1      VAL  49  -8.988  -9.406  -0.722
  405   3HG1  VAL  49          3HG1      VAL  49  -8.605  -7.678  -0.530
  406   1HG2  VAL  49          1HG2      VAL  49  -5.233  -8.381   1.025
  407   2HG2  VAL  49          2HG2      VAL  49  -5.802  -7.643  -0.492
  408   3HG2  VAL  49          3HG2      VAL  49  -6.464  -7.096   1.067
  409    H    LYS  50           H        LYS  50  -6.473  -7.745   3.349
  410    HA   LYS  50           HA       LYS  50  -8.593  -5.730   3.630
  411   1HB   LYS  50          1HB       LYS  50  -8.193  -7.018   5.689
  412   2HB   LYS  50          2HB       LYS  50  -6.497  -6.583   5.650
  413   1HG   LYS  50          1HG       LYS  50  -6.923  -4.582   6.629
  414   2HG   LYS  50          2HG       LYS  50  -8.083  -4.167   5.383
  415   1HD   LYS  50          1HD       LYS  50  -9.895  -5.254   6.569
  416   2HD   LYS  50          2HD       LYS  50  -8.790  -6.044   7.678
  417   1HE   LYS  50          1HE       LYS  50  -8.564  -3.070   7.619
  418   2HE   LYS  50          2HE       LYS  50 -10.104  -3.669   8.202
  419   1HZ   LYS  50          1HZ       LYS  50  -7.443  -4.258   9.270
  420   2HZ   LYS  50          2HZ       LYS  50  -8.711  -3.577  10.041
  421   3HZ   LYS  50          3HZ       LYS  50  -8.743  -5.165   9.661
  422    H    TYR  51           H        TYR  51  -8.079  -3.582   3.270
  423    HA   TYR  51           HA       TYR  51  -5.357  -3.144   2.255
  424   1HB   TYR  51          1HB       TYR  51  -8.035  -1.666   1.869
  425   2HB   TYR  51          2HB       TYR  51  -6.552  -1.269   1.022
  426    HD1  TYR  51           HD1      TYR  51  -8.765  -4.254   1.594
  427    HD2  TYR  51           HD2      TYR  51  -6.307  -2.067  -1.141
  428    HE1  TYR  51           HE1      TYR  51  -9.386  -5.870  -0.267
  429    HE2  TYR  51           HE2      TYR  51  -6.937  -3.690  -2.993
  430    HH   TYR  51           HH       TYR  51  -7.769  -5.776  -3.349
  431    H    VAL  52           H        VAL  52  -4.105  -1.443   3.033
  432    HA   VAL  52           HA       VAL  52  -5.353   0.266   5.054
  433    HB   VAL  52           HB       VAL  52  -3.065  -1.622   5.372
  434   1HG1  VAL  52          1HG1      VAL  52  -1.887   0.414   5.742
  435   2HG1  VAL  52          2HG1      VAL  52  -3.237   1.112   6.667
  436   3HG1  VAL  52          3HG1      VAL  52  -2.292  -0.233   7.350
  437   1HG2  VAL  52          1HG2      VAL  52  -4.433  -2.479   6.909
  438   2HG2  VAL  52          2HG2      VAL  52  -4.433  -0.935   7.794
  439   3HG2  VAL  52          3HG2      VAL  52  -5.641  -1.232   6.521
  440    H    CYS  53           H        CYS  53  -4.866   2.392   4.755
  441    HA   CYS  53           HA       CYS  53  -2.817   2.942   2.748
  442   1HB   CYS  53          1HB       CYS  53  -5.046   4.729   3.746
  443   2HB   CYS  53          2HB       CYS  53  -3.909   5.107   2.466
  444    H    CYS  54           H        CYS  54  -1.518   5.026   3.184
  445    HA   CYS  54           HA       CYS  54  -1.377   5.910   5.883
  446   1HB   CYS  54          1HB       CYS  54   1.074   5.249   6.111
  447   2HB   CYS  54          2HB       CYS  54  -0.144   4.029   6.426
  448    H    ASN  55           H        ASN  55  -0.440   7.985   5.892
  449    HA   ASN  55           HA       ASN  55   0.421   8.889   3.278
  450   1HB   ASN  55          1HB       ASN  55   0.260  11.186   4.725
  451   2HB   ASN  55          2HB       ASN  55  -1.141  10.472   3.953
  452   1HD2  ASN  55          1HD2      ASN  55   0.770   9.699   6.862
  453   2HD2  ASN  55          2HD2      ASN  55  -0.546   9.677   7.989
  454    H    THR  56           H        THR  56   1.876   7.428   5.761
  455    HA   THR  56           HA       THR  56   3.991   9.392   6.225
  456    HB   THR  56           HB       THR  56   4.691   7.497   7.873
  457    HG1  THR  56           HG1      THR  56   3.224   5.790   7.928
  458   1HG2  THR  56          1HG2      THR  56   1.871   8.661   8.167
  459   2HG2  THR  56          2HG2      THR  56   2.862   7.989   9.484
  460   3HG2  THR  56          3HG2      THR  56   3.367   9.487   8.665
  461    H    ASP  57           H        ASP  57   6.282   8.667   6.093
  462    HA   ASP  57           HA       ASP  57   6.633   7.472   3.537
  463   1HB   ASP  57          1HB       ASP  57   8.927   8.040   5.414
  464   2HB   ASP  57          2HB       ASP  57   8.851   8.255   3.677
  465    H    ARG  58           H        ARG  58   8.199   5.597   3.217
  466    HA   ARG  58           HA       ARG  58   8.494   3.452   3.555
  467   1HB   ARG  58          1HB       ARG  58   9.786   4.683   6.034
  468   2HB   ARG  58          2HB       ARG  58  10.015   3.001   5.602
  469   1HG   ARG  58          1HG       ARG  58  10.630   4.084   3.205
  470   2HG   ARG  58          2HG       ARG  58  11.008   5.476   4.201
  471   1HD   ARG  58          1HD       ARG  58  12.106   3.098   5.462
  472   2HD   ARG  58          2HD       ARG  58  12.604   3.128   3.781
  473    HE   ARG  58           HE       ARG  58  12.972   5.754   4.760
  474   1HH1  ARG  58          1HH1      ARG  58  14.234   2.536   5.416
  475   2HH1  ARG  58          2HH1      ARG  58  15.774   3.112   5.962
  476   1HH2  ARG  58          1HH2      ARG  58  15.003   6.515   5.480
  477   2HH2  ARG  58          2HH2      ARG  58  16.215   5.390   5.999
  478    H    CYS  59           H        CYS  59   5.852   4.141   4.366
  479    HA   CYS  59           HA       CYS  59   5.415   2.988   6.961
  480   1HB   CYS  59          1HB       CYS  59   3.089   3.512   6.605
  481   2HB   CYS  59          2HB       CYS  59   4.092   4.902   6.239
  482    H    ASN  60           H        ASN  60   4.676   2.275   3.477
  483    HA   ASN  60           HA       ASN  60   4.014  -0.431   4.299
  484   1HB   ASN  60          1HB       ASN  60   2.827  -0.635   2.194
  485   2HB   ASN  60          2HB       ASN  60   2.395   0.933   2.847
  486   1HD2  ASN  60          1HD2      ASN  60   4.314  -0.798   0.493
  487   2HD2  ASN  60          2HD2      ASN  60   4.652   0.524  -0.574
  488   1H    HOH  61          1H        HOH  61  -1.000 -12.652   4.915
  489   2H    HOH  61          2H        HOH  61  -0.253 -12.107   3.717
  Start of MODEL    4
    1   1H    LEU   1           H1       LEU   1   7.629  12.419  -1.047
    2    HA   LEU   1           HA       LEU   1   6.865  11.096   0.628
    3   1HB   LEU   1          1HB       LEU   1   4.415  11.887  -0.474
    4   2HB   LEU   1          2HB       LEU   1   4.367  10.135  -0.475
    5    HG   LEU   1           HG       LEU   1   3.374  10.997   1.552
    6   1HD1  LEU   1          1HD1      LEU   1   5.651  10.041   2.989
    7   2HD1  LEU   1          2HD1      LEU   1   4.135   9.196   2.594
    8   3HD1  LEU   1          3HD1      LEU   1   5.511   9.128   1.468
    9   1HD2  LEU   1          1HD2      LEU   1   4.765  13.142   1.502
   10   2HD2  LEU   1          2HD2      LEU   1   4.407  12.431   3.094
   11   3HD2  LEU   1          3HD2      LEU   1   6.015  12.209   2.362
   12    H    LYS   2           H        LYS   2   8.035   9.261   0.659
   13    HA   LYS   2           HA       LYS   2   7.744   7.483  -1.663
   14   1HB   LYS   2          1HB       LYS   2  10.222   8.019   0.003
   15   2HB   LYS   2          2HB       LYS   2  10.100   6.831  -1.279
   16   1HG   LYS   2          1HG       LYS   2  10.755   8.487  -2.694
   17   2HG   LYS   2          2HG       LYS   2   9.136   9.134  -2.522
   18   1HD   LYS   2          1HD       LYS   2   9.868  10.921  -1.314
   19   2HD   LYS   2          2HD       LYS   2  10.825   9.910  -0.249
   20   1HE   LYS   2          1HE       LYS   2  12.604  10.947  -1.262
   21   2HE   LYS   2          2HE       LYS   2  12.352   9.750  -2.516
   22   1HZ   LYS   2          1HZ       LYS   2  12.428  12.122  -3.238
   23   2HZ   LYS   2          2HZ       LYS   2  11.140  11.274  -3.775
   24   3HZ   LYS   2          3HZ       LYS   2  10.966  12.332  -2.543
   25    H    CYS   3           H        CYS   3   7.613   5.232  -1.262
   26    HA   CYS   3           HA       CYS   3   7.427   4.508   1.560
   27   1HB   CYS   3          1HB       CYS   3   5.302   4.254  -0.524
   28   2HB   CYS   3          2HB       CYS   3   5.469   2.964   0.650
   29    H    ASN   4           H        ASN   4   7.318   1.937   1.657
   30    HA   ASN   4           HA       ASN   4   9.516   1.059   0.072
   31   1HB   ASN   4          1HB       ASN   4   7.862  -0.723   1.902
   32   2HB   ASN   4          2HB       ASN   4   9.574  -0.833   1.546
   33   1HD2  ASN   4          1HD2      ASN   4  11.033   0.310   2.684
   34   2HD2  ASN   4          2HD2      ASN   4  10.668   1.330   4.036
   35    H    LYS   5           H        LYS   5   9.377  -1.121  -1.121
   36    HA   LYS   5           HA       LYS   5   6.814  -1.268  -2.506
   37   1HB   LYS   5          1HB       LYS   5   9.560  -2.342  -3.217
   38   2HB   LYS   5          2HB       LYS   5   8.118  -2.579  -4.183
   39   1HG   LYS   5          1HG       LYS   5   9.159   0.178  -3.385
   40   2HG   LYS   5          2HG       LYS   5   9.588  -0.611  -4.889
   41   1HD   LYS   5          1HD       LYS   5   6.735   0.041  -4.010
   42   2HD   LYS   5          2HD       LYS   5   7.670   0.980  -5.156
   43   1HE   LYS   5          1HE       LYS   5   7.755  -1.784  -5.997
   44   2HE   LYS   5          2HE       LYS   5   6.085  -1.377  -5.656
   45   1HZ   LYS   5          1HZ       LYS   5   7.886  -0.166  -7.593
   46   2HZ   LYS   5          2HZ       LYS   5   6.348  -0.676  -7.793
   47   3HZ   LYS   5          3HZ       LYS   5   6.648   0.719  -7.000
   48    H    LEU   6           H        LEU   6   6.869  -3.899  -3.432
   49    HA   LEU   6           HA       LEU   6   5.595  -5.278  -1.494
   50   1HB   LEU   6          1HB       LEU   6   6.164  -5.709  -4.067
   51   2HB   LEU   6          2HB       LEU   6   7.308  -6.834  -3.362
   52    HG   LEU   6           HG       LEU   6   4.934  -7.370  -2.000
   53   1HD1  LEU   6          1HD1      LEU   6   3.353  -6.378  -3.288
   54   2HD1  LEU   6          2HD1      LEU   6   4.364  -6.397  -4.752
   55   3HD1  LEU   6          3HD1      LEU   6   3.536  -7.881  -4.224
   56   1HD2  LEU   6          1HD2      LEU   6   6.725  -8.676  -3.901
   57   2HD2  LEU   6          2HD2      LEU   6   5.915  -9.319  -2.453
   58   3HD2  LEU   6          3HD2      LEU   6   5.050  -9.268  -4.008
   59    H    VAL   7           H        VAL   7   9.143  -5.351  -2.210
   60    HA   VAL   7           HA       VAL   7   9.516  -6.898   0.236
   61    HB   VAL   7           HB       VAL   7  11.077  -6.384  -2.256
   62   1HG1  VAL   7          1HG1      VAL   7  12.255  -6.833   0.472
   63   2HG1  VAL   7          2HG1      VAL   7  13.026  -7.571  -0.952
   64   3HG1  VAL   7          3HG1      VAL   7  12.830  -5.805  -0.861
   65   1HG2  VAL   7          1HG2      VAL   7   9.638  -8.404  -1.944
   66   2HG2  VAL   7          2HG2      VAL   7  11.352  -8.781  -2.243
   67   3HG2  VAL   7          3HG2      VAL   7  10.690  -8.895  -0.595
   68    HA   PRO   8           HA       PRO   8  10.167  -2.946   2.156
   69   1HB   PRO   8          1HB       PRO   8  10.733  -4.738   4.534
   70   2HB   PRO   8          2HB       PRO   8   9.623  -3.364   4.400
   71   1HG   PRO   8          1HG       PRO   8   8.620  -5.900   4.379
   72   2HG   PRO   8          2HG       PRO   8   7.967  -4.709   3.229
   73   1HD   PRO   8          1HD       PRO   8  10.107  -6.855   2.658
   74   2HD   PRO   8          2HD       PRO   8   8.613  -6.501   1.747
   75    H    ILE   9           H        ILE   9  12.630  -4.812   1.079
   76    HA   ILE   9           HA       ILE   9  14.674  -3.629   2.785
   77    HB   ILE   9           HB       ILE   9  14.401  -6.039   1.220
   78   1HG1  ILE   9          1HG1      ILE   9  14.998  -5.774   3.657
   79   2HG1  ILE   9          2HG1      ILE   9  16.002  -6.880   2.741
   80   1HG2  ILE   9          1HG2      ILE   9  15.715  -4.726  -0.435
   81   2HG2  ILE   9          2HG2      ILE   9  16.987  -4.519   0.794
   82   3HG2  ILE   9          3HG2      ILE   9  16.576  -6.148   0.203
   83   1HD1  ILE   9          1HD1      ILE   9  16.766  -3.961   3.158
   84   2HD1  ILE   9          2HD1      ILE   9  17.250  -5.254   4.280
   85   3HD1  ILE   9          3HD1      ILE   9  17.805  -5.289   2.590
   86    H    ALA  10           H        ALA  10  12.808  -2.743   0.160
   87    HA   ALA  10           HA       ALA  10  14.719  -0.710  -0.559
   88   1HB   ALA  10          1HB       ALA  10  15.351  -1.516  -2.565
   89   2HB   ALA  10          2HB       ALA  10  14.653  -3.076  -2.069
   90   3HB   ALA  10          3HB       ALA  10  13.673  -1.918  -3.002
   91    H    TYR  11           H        TYR  11  13.653   1.186  -1.017
   92    HA   TYR  11           HA       TYR  11  10.760   0.950  -1.504
   93   1HB   TYR  11          1HB       TYR  11  10.587   2.962  -0.022
   94   2HB   TYR  11          2HB       TYR  11  11.417   1.683   0.841
   95    HD1  TYR  11           HD1      TYR  11  13.989   1.745   0.909
   96    HD2  TYR  11           HD2      TYR  11  11.600   5.073  -0.325
   97    HE1  TYR  11           HE1      TYR  11  15.941   3.316   1.343
   98    HE2  TYR  11           HE2      TYR  11  13.560   6.633   0.111
   99    HH   TYR  11           HH       TYR  11  16.504   5.448   1.622
  100    H    LYS  12           H        LYS  12   9.807   2.864  -2.617
  101    HA   LYS  12           HA       LYS  12  11.789   4.392  -4.126
  102   1HB   LYS  12          1HB       LYS  12   9.597   2.662  -5.276
  103   2HB   LYS  12          2HB       LYS  12  10.250   4.025  -6.159
  104   1HG   LYS  12          1HG       LYS  12  12.365   3.045  -6.403
  105   2HG   LYS  12          2HG       LYS  12  12.213   2.088  -4.943
  106   1HD   LYS  12          1HD       LYS  12  10.402   0.723  -6.141
  107   2HD   LYS  12          2HD       LYS  12  10.815   1.587  -7.609
  108   1HE   LYS  12          1HE       LYS  12  13.195   0.499  -6.231
  109   2HE   LYS  12          2HE       LYS  12  12.049  -0.750  -6.676
  110   1HZ   LYS  12          1HZ       LYS  12  13.326   1.205  -8.445
  111   2HZ   LYS  12          2HZ       LYS  12  13.424  -0.423  -8.509
  112   3HZ   LYS  12          3HZ       LYS  12  12.033   0.328  -8.918
  113    H    THR  13           H        THR  13  10.073   5.904  -5.690
  114    HA   THR  13           HA       THR  13   8.627   7.371  -3.605
  115    HB   THR  13           HB       THR  13   9.282   9.275  -4.769
  116    HG1  THR  13           HG1      THR  13   8.311   9.140  -6.763
  117   1HG2  THR  13          1HG2      THR  13  11.477   9.088  -5.571
  118   2HG2  THR  13          2HG2      THR  13  11.357   7.551  -4.683
  119   3HG2  THR  13          3HG2      THR  13  11.132   7.578  -6.448
  120    H    CYS  14           H        CYS  14   6.464   7.866  -3.715
  121    HA   CYS  14           HA       CYS  14   4.886   6.058  -5.162
  122   1HB   CYS  14          1HB       CYS  14   4.145   8.595  -3.693
  123   2HB   CYS  14          2HB       CYS  14   2.986   7.453  -4.344
  124    HA   PRO  15           HA       PRO  15   5.322   8.121  -9.089
  125   1HB   PRO  15          1HB       PRO  15   3.084   6.765 -10.232
  126   2HB   PRO  15          2HB       PRO  15   4.769   6.222 -10.258
  127   1HG   PRO  15          1HG       PRO  15   2.487   5.462  -8.319
  128   2HG   PRO  15          2HG       PRO  15   3.757   4.437  -9.029
  129   1HD   PRO  15          1HD       PRO  15   4.031   5.274  -6.454
  130   2HD   PRO  15          2HD       PRO  15   5.454   5.161  -7.524
  131    H    GLU  16           H        GLU  16   3.919   9.226 -10.843
  132    HA   GLU  16           HA       GLU  16   2.679  11.388  -9.620
  133   1HB   GLU  16          1HB       GLU  16   2.685  10.440 -12.517
  134   2HB   GLU  16          2HB       GLU  16   2.022  11.981 -12.011
  135   1HG   GLU  16          1HG       GLU  16   4.087  12.921 -11.902
  136   2HG   GLU  16          2HG       GLU  16   4.678  11.641 -10.860
  137    H    GLY  17           H        GLY  17   0.502  11.955  -9.311
  138   1HA   GLY  17          1HA       GLY  17  -1.780  11.734  -9.514
  139   2HA   GLY  17          2HA       GLY  17  -1.580  10.207 -10.350
  140    H    LYS  18           H        LYS  18   0.458   9.351  -8.164
  141    HA   LYS  18           HA       LYS  18  -1.538   8.791  -6.082
  142   1HB   LYS  18          1HB       LYS  18   0.627   6.866  -6.941
  143   2HB   LYS  18          2HB       LYS  18  -0.743   6.557  -5.895
  144   1HG   LYS  18          1HG       LYS  18  -1.663   5.721  -7.835
  145   2HG   LYS  18          2HG       LYS  18  -2.102   7.398  -8.088
  146   1HD   LYS  18          1HD       LYS  18   0.333   7.538  -9.193
  147   2HD   LYS  18          2HD       LYS  18   0.127   5.806  -9.366
  148   1HE   LYS  18          1HE       LYS  18  -2.298   6.594 -10.305
  149   2HE   LYS  18          2HE       LYS  18  -1.389   8.042 -10.688
  150   1HZ   LYS  18          1HZ       LYS  18  -1.014   5.345 -11.695
  151   2HZ   LYS  18          2HZ       LYS  18  -1.022   6.761 -12.508
  152   3HZ   LYS  18          3HZ       LYS  18   0.283   6.334 -11.624
  153    H    ASN  19           H        ASN  19  -0.975  10.154  -4.444
  154    HA   ASN  19           HA       ASN  19   1.870  10.350  -3.879
  155   1HB   ASN  19          1HB       ASN  19   0.825  12.534  -4.190
  156   2HB   ASN  19          2HB       ASN  19  -0.519  12.111  -3.147
  157   1HD2  ASN  19          1HD2      ASN  19  -0.458  12.779  -1.145
  158   2HD2  ASN  19          2HD2      ASN  19   0.940  13.251  -0.237
  159    H    LEU  20           H        LEU  20  -1.040   8.809  -2.950
  160    HA   LEU  20           HA       LEU  20  -0.380   8.741  -0.117
  161   1HB   LEU  20          1HB       LEU  20  -2.755   7.991  -1.781
  162   2HB   LEU  20          2HB       LEU  20  -2.547   7.272  -0.196
  163    HG   LEU  20           HG       LEU  20  -2.559  10.263  -0.652
  164   1HD1  LEU  20          1HD1      LEU  20  -4.864   8.390  -0.097
  165   2HD1  LEU  20          2HD1      LEU  20  -4.921  10.133   0.263
  166   3HD1  LEU  20          3HD1      LEU  20  -4.688   9.577  -1.412
  167   1HD2  LEU  20          1HD2      LEU  20  -2.469   8.478   1.742
  168   2HD2  LEU  20          2HD2      LEU  20  -1.632  10.016   1.422
  169   3HD2  LEU  20          3HD2      LEU  20  -3.357  10.016   1.858
  170    H    CYS  21           H        CYS  21  -0.576   6.467   0.941
  171    HA   CYS  21           HA       CYS  21   0.812   4.568  -0.808
  172   1HB   CYS  21          1HB       CYS  21   1.385   5.384   2.022
  173   2HB   CYS  21          2HB       CYS  21   1.782   3.763   1.486
  174    H    TYR  22           H        TYR  22   0.151   2.351  -0.579
  175    HA   TYR  22           HA       TYR  22  -2.073   1.886   1.273
  176   1HB   TYR  22          1HB       TYR  22  -3.392   1.054  -0.562
  177   2HB   TYR  22          2HB       TYR  22  -2.598   2.442  -1.280
  178    HD1  TYR  22           HD1      TYR  22  -0.839   2.165  -2.952
  179    HD2  TYR  22           HD2      TYR  22  -2.723  -1.233  -1.162
  180    HE1  TYR  22           HE1      TYR  22   0.130   0.665  -4.762
  181    HE2  TYR  22           HE2      TYR  22  -1.748  -2.722  -2.978
  182    HH   TYR  22           HH       TYR  22   0.693  -2.116  -4.683
  183    H    LYS  23           H        LYS  23  -2.440  -0.419   1.748
  184    HA   LYS  23           HA       LYS  23  -0.426  -2.264   0.843
  185   1HB   LYS  23          1HB       LYS  23   0.832  -1.198   2.599
  186   2HB   LYS  23          2HB       LYS  23  -0.507  -1.327   3.722
  187   1HG   LYS  23          1HG       LYS  23  -0.327  -3.730   3.833
  188   2HG   LYS  23          2HG       LYS  23   0.711  -3.795   2.422
  189   1HD   LYS  23          1HD       LYS  23   1.830  -4.026   4.764
  190   2HD   LYS  23          2HD       LYS  23   2.594  -2.967   3.595
  191   1HE   LYS  23          1HE       LYS  23   1.673  -0.984   4.643
  192   2HE   LYS  23          2HE       LYS  23   0.574  -1.928   5.628
  193   1HZ   LYS  23          1HZ       LYS  23   3.245  -1.262   6.143
  194   2HZ   LYS  23          2HZ       LYS  23   2.154  -1.957   7.139
  195   3HZ   LYS  23          3HZ       LYS  23   3.079  -2.887   6.166
  196    H    MET  24           H        MET  24  -1.440  -4.166   0.495
  197    HA   MET  24           HA       MET  24  -3.998  -4.502   1.831
  198   1HB   MET  24          1HB       MET  24  -2.806  -6.044  -0.539
  199   2HB   MET  24          2HB       MET  24  -4.477  -6.094  -0.011
  200   1HG   MET  24          1HG       MET  24  -4.654  -3.609  -0.505
  201   2HG   MET  24          2HG       MET  24  -3.023  -3.656  -1.146
  202   1HE   MET  24          1HE       MET  24  -5.046  -3.134  -4.165
  203   2HE   MET  24          2HE       MET  24  -3.877  -2.572  -2.946
  204   3HE   MET  24          3HE       MET  24  -3.348  -3.661  -4.252
  205    H    PHE  25           H        PHE  25  -4.419  -6.230   3.208
  206    HA   PHE  25           HA       PHE  25  -2.206  -8.129   3.548
  207   1HB   PHE  25          1HB       PHE  25  -4.143  -6.789   5.526
  208   2HB   PHE  25          2HB       PHE  25  -3.109  -8.126   5.988
  209    HD1  PHE  25           HD1      PHE  25  -3.308  -4.577   5.434
  210    HD2  PHE  25           HD2      PHE  25  -0.613  -7.819   5.911
  211    HE1  PHE  25           HE1      PHE  25  -1.461  -2.963   5.965
  212    HE2  PHE  25           HE2      PHE  25   1.235  -6.205   6.441
  213    HZ   PHE  25           HZ       PHE  25   0.789  -3.796   6.462
  214    H    MET  26           H        MET  26  -2.727 -10.284   3.460
  215    HA   MET  26           HA       MET  26  -5.450 -10.889   2.830
  216   1HB   MET  26          1HB       MET  26  -2.896 -12.575   3.056
  217   2HB   MET  26          2HB       MET  26  -4.434 -13.240   2.545
  218   1HG   MET  26          1HG       MET  26  -4.489 -11.875   0.555
  219   2HG   MET  26          2HG       MET  26  -3.210 -10.831   1.140
  220   1HE   MET  26          1HE       MET  26  -4.136 -14.495   0.375
  221   2HE   MET  26          2HE       MET  26  -3.964 -13.695  -1.205
  222   3HE   MET  26          3HE       MET  26  -2.827 -14.979  -0.731
  223    H    MET  27           H        MET  27  -6.658 -12.687   3.905
  224    HA   MET  27           HA       MET  27  -6.706 -12.296   6.654
  225   1HB   MET  27          1HB       MET  27  -7.985 -14.181   4.658
  226   2HB   MET  27          2HB       MET  27  -8.136 -14.592   6.355
  227   1HG   MET  27          1HG       MET  27  -8.771 -11.764   5.473
  228   2HG   MET  27          2HG       MET  27  -9.947 -13.029   5.177
  229   1HE   MET  27          1HE       MET  27 -11.181 -14.133   8.556
  230   2HE   MET  27          2HE       MET  27 -11.394 -14.084   6.789
  231   3HE   MET  27          3HE       MET  27 -10.042 -15.000   7.498
  232    H    SER  28           H        SER  28  -5.095 -14.709   4.577
  233    HA   SER  28           HA       SER  28  -4.592 -16.575   6.571
  234   1HB   SER  28          1HB       SER  28  -4.349 -17.215   4.264
  235   2HB   SER  28          2HB       SER  28  -3.214 -15.919   3.942
  236    HG   SER  28           HG       SER  28  -1.594 -17.133   4.653
  237    H    ASP  29           H        ASP  29  -1.756 -15.127   4.966
  238    HA   ASP  29           HA       ASP  29  -0.411 -14.982   7.429
  239   1HB   ASP  29          1HB       ASP  29   0.489 -15.328   4.976
  240   2HB   ASP  29          2HB       ASP  29   0.467 -13.578   4.881
  241    H    LEU  30           H        LEU  30  -2.134 -13.470   8.442
  242    HA   LEU  30           HA       LEU  30  -2.331 -10.812   7.463
  243   1HB   LEU  30          1HB       LEU  30  -3.209 -12.238   9.959
  244   2HB   LEU  30          2HB       LEU  30  -3.375 -10.500   9.803
  245    HG   LEU  30           HG       LEU  30  -4.516 -12.374   7.732
  246   1HD1  LEU  30          1HD1      LEU  30  -6.717 -11.939   9.051
  247   2HD1  LEU  30          2HD1      LEU  30  -5.611 -13.228   9.582
  248   3HD1  LEU  30          3HD1      LEU  30  -5.628 -11.664  10.432
  249   1HD2  LEU  30          1HD2      LEU  30  -4.227  -9.854   7.356
  250   2HD2  LEU  30          2HD2      LEU  30  -5.829 -10.565   7.043
  251   3HD2  LEU  30          3HD2      LEU  30  -5.536  -9.656   8.546
  252    H    THR  31           H        THR  31   0.199 -12.494   8.911
  253    HA   THR  31           HA       THR  31   1.127 -10.287  10.548
  254    HB   THR  31           HB       THR  31   2.945 -11.903  11.082
  255    HG1  THR  31           HG1      THR  31   2.565 -12.669   8.647
  256   1HG2  THR  31          1HG2      THR  31   1.209 -12.617  12.474
  257   2HG2  THR  31          2HG2      THR  31   0.069 -12.807  11.119
  258   3HG2  THR  31          3HG2      THR  31   1.313 -14.046  11.417
  259    H    ILE  32           H        ILE  32   1.501 -11.538   7.276
  260    HA   ILE  32           HA       ILE  32   3.429  -9.377   6.822
  261    HB   ILE  32           HB       ILE  32   3.659 -11.894   5.249
  262   1HG1  ILE  32          1HG1      ILE  32   4.208 -11.670   8.158
  263   2HG1  ILE  32          2HG1      ILE  32   3.798 -13.072   7.189
  264   1HG2  ILE  32          1HG2      ILE  32   6.006 -11.239   5.160
  265   2HG2  ILE  32          2HG2      ILE  32   4.952  -9.901   4.643
  266   3HG2  ILE  32          3HG2      ILE  32   5.685  -9.881   6.266
  267   1HD1  ILE  32          1HD1      ILE  32   6.510 -11.666   7.207
  268   2HD1  ILE  32          2HD1      ILE  32   6.132 -13.218   7.993
  269   3HD1  ILE  32          3HD1      ILE  32   6.095 -13.087   6.219
  270    HA   PRO  33           HA       PRO  33   0.339  -8.067   4.039
  271   1HB   PRO  33          1HB       PRO  33   2.014  -6.454   2.422
  272   2HB   PRO  33          2HB       PRO  33   1.258  -5.959   3.947
  273   1HG   PRO  33          1HG       PRO  33   4.120  -6.981   3.409
  274   2HG   PRO  33          2HG       PRO  33   3.561  -5.713   4.524
  275   1HD   PRO  33          1HD       PRO  33   4.174  -8.237   5.460
  276   2HD   PRO  33          2HD       PRO  33   2.926  -7.216   6.224
  277    H    VAL  34           H        VAL  34  -0.262  -7.782   1.675
  278    HA   VAL  34           HA       VAL  34   0.914  -9.983   0.122
  279    HB   VAL  34           HB       VAL  34  -1.271 -10.597   0.823
  280   1HG1  VAL  34          1HG1      VAL  34  -3.244  -9.066   0.058
  281   2HG1  VAL  34          2HG1      VAL  34  -2.357  -8.673   1.551
  282   3HG1  VAL  34          3HG1      VAL  34  -2.011  -7.782   0.048
  283   1HG2  VAL  34          1HG2      VAL  34  -0.655 -11.048  -1.551
  284   2HG2  VAL  34          2HG2      VAL  34  -2.411 -10.914  -1.287
  285   3HG2  VAL  34          3HG2      VAL  34  -1.515  -9.562  -2.021
  286    H    LYS  35           H        LYS  35  -0.241  -6.619   0.243
  287    HA   LYS  35           HA       LYS  35   1.096  -6.196  -2.319
  288   1HB   LYS  35          1HB       LYS  35  -1.597  -4.961  -1.709
  289   2HB   LYS  35          2HB       LYS  35  -0.700  -4.909  -3.215
  290   1HG   LYS  35          1HG       LYS  35  -1.562  -7.563  -2.006
  291   2HG   LYS  35          2HG       LYS  35  -2.665  -6.626  -2.994
  292   1HD   LYS  35          1HD       LYS  35  -0.818  -6.577  -4.794
  293   2HD   LYS  35          2HD       LYS  35   0.041  -7.758  -3.825
  294   1HE   LYS  35          1HE       LYS  35  -1.209  -9.044  -5.413
  295   2HE   LYS  35          2HE       LYS  35  -2.085  -9.208  -3.905
  296   1HZ   LYS  35          1HZ       LYS  35  -2.739  -7.271  -6.017
  297   2HZ   LYS  35          2HZ       LYS  35  -3.529  -8.675  -5.750
  298   3HZ   LYS  35          3HZ       LYS  35  -3.574  -7.487  -4.631
  299    H    ARG  36           H        ARG  36   2.165  -4.200  -2.488
  300    HA   ARG  36           HA       ARG  36   1.767  -2.322  -0.365
  301   1HB   ARG  36          1HB       ARG  36   4.191  -4.078  -0.591
  302   2HB   ARG  36          2HB       ARG  36   4.508  -2.385  -0.267
  303   1HG   ARG  36          1HG       ARG  36   2.540  -2.744   1.548
  304   2HG   ARG  36          2HG       ARG  36   3.070  -4.411   1.438
  305   1HD   ARG  36          1HD       ARG  36   5.417  -2.717   1.600
  306   2HD   ARG  36          2HD       ARG  36   4.312  -2.254   2.878
  307    HE   ARG  36           HE       ARG  36   4.677  -5.159   2.608
  308   1HH1  ARG  36          1HH1      ARG  36   5.828  -2.213   4.150
  309   2HH1  ARG  36          2HH1      ARG  36   6.577  -3.046   5.473
  310   1HH2  ARG  36          1HH2      ARG  36   5.664  -6.259   4.352
  311   2HH2  ARG  36          2HH2      ARG  36   6.483  -5.362   5.588
  312    H    GLY  37           H        GLY  37   1.455  -0.495  -1.614
  313   1HA   GLY  37          1HA       GLY  37   3.587   0.394  -3.344
  314   2HA   GLY  37          2HA       GLY  37   2.123  -0.054  -4.197
  315    H    CYS  38           H        CYS  38   1.906   2.222  -4.842
  316    HA   CYS  38           HA       CYS  38   0.863   3.846  -2.635
  317   1HB   CYS  38          1HB       CYS  38   2.263   4.864  -5.116
  318   2HB   CYS  38          2HB       CYS  38   1.615   5.838  -3.812
  319    H    ILE  39           H        ILE  39  -0.894   5.396  -3.379
  320    HA   ILE  39           HA       ILE  39  -2.102   4.834  -5.922
  321    HB   ILE  39           HB       ILE  39  -2.816   2.951  -4.412
  322   1HG1  ILE  39          1HG1      ILE  39  -5.293   4.420  -5.153
  323   2HG1  ILE  39          2HG1      ILE  39  -4.112   4.200  -6.428
  324   1HG2  ILE  39          1HG2      ILE  39  -4.507   3.378  -2.726
  325   2HG2  ILE  39          2HG2      ILE  39  -3.015   4.267  -2.338
  326   3HG2  ILE  39          3HG2      ILE  39  -4.409   5.129  -3.032
  327   1HD1  ILE  39          1HD1      ILE  39  -4.027   1.701  -5.623
  328   2HD1  ILE  39          2HD1      ILE  39  -5.567   2.086  -4.817
  329   3HD1  ILE  39          3HD1      ILE  39  -5.424   2.244  -6.584
  330    H    ASP  40           H        ASP  40  -4.368   6.120  -5.921
  331    HA   ASP  40           HA       ASP  40  -3.626   8.712  -4.878
  332   1HB   ASP  40          1HB       ASP  40  -5.373   9.566  -6.436
  333   2HB   ASP  40          2HB       ASP  40  -4.176   8.593  -7.268
  334    H    VAL  41           H        VAL  41  -6.292   6.270  -4.979
  335    HA   VAL  41           HA       VAL  41  -7.561   7.701  -2.746
  336    HB   VAL  41           HB       VAL  41  -8.622   6.507  -5.236
  337   1HG1  VAL  41          1HG1      VAL  41 -10.145   6.272  -2.618
  338   2HG1  VAL  41          2HG1      VAL  41 -10.786   5.925  -4.242
  339   3HG1  VAL  41          3HG1      VAL  41  -9.483   4.919  -3.565
  340   1HG2  VAL  41          1HG2      VAL  41 -10.293   8.387  -3.744
  341   2HG2  VAL  41          2HG2      VAL  41  -8.643   8.999  -4.011
  342   3HG2  VAL  41          3HG2      VAL  41  -9.641   8.496  -5.397
  343    H    CYS  42           H        CYS  42  -8.718   6.246  -1.188
  344    HA   CYS  42           HA       CYS  42  -6.987   4.094  -0.517
  345   1HB   CYS  42          1HB       CYS  42  -8.378   5.757   0.989
  346   2HB   CYS  42          2HB       CYS  42  -9.623   4.535   0.829
  347    HA   PRO  43           HA       PRO  43  -9.192   1.195  -3.032
  348   1HB   PRO  43          1HB       PRO  43  -7.607  -0.852  -1.475
  349   2HB   PRO  43          2HB       PRO  43  -7.675  -0.574  -3.223
  350   1HG   PRO  43          1HG       PRO  43  -5.473   0.226  -1.821
  351   2HG   PRO  43          2HG       PRO  43  -6.140   1.307  -3.068
  352   1HD   PRO  43          1HD       PRO  43  -6.669   1.449  -0.029
  353   2HD   PRO  43          2HD       PRO  43  -6.085   2.741  -1.112
  354    H    LYS  44           H        LYS  44 -10.270  -1.107  -2.880
  355    HA   LYS  44           HA       LYS  44 -12.446  -0.810  -1.110
  356   1HB   LYS  44          1HB       LYS  44 -11.595  -3.025  -2.990
  357   2HB   LYS  44          2HB       LYS  44 -13.074  -3.082  -2.054
  358   1HG   LYS  44          1HG       LYS  44 -13.787  -0.898  -3.078
  359   2HG   LYS  44          2HG       LYS  44 -12.322  -0.885  -4.040
  360   1HD   LYS  44          1HD       LYS  44 -13.308  -2.199  -5.600
  361   2HD   LYS  44          2HD       LYS  44 -13.551  -3.460  -4.406
  362   1HE   LYS  44          1HE       LYS  44 -15.436  -1.080  -4.521
  363   2HE   LYS  44          2HE       LYS  44 -15.649  -2.429  -5.619
  364   1HZ   LYS  44          1HZ       LYS  44 -16.912  -2.785  -3.657
  365   2HZ   LYS  44          2HZ       LYS  44 -15.701  -3.879  -3.668
  366   3HZ   LYS  44          3HZ       LYS  44 -15.617  -2.577  -2.686
  367    H    ASN  45           H        ASN  45 -13.142  -3.047   0.108
  368    HA   ASN  45           HA       ASN  45 -10.873  -4.183   1.436
  369   1HB   ASN  45          1HB       ASN  45 -12.895  -2.375   2.829
  370   2HB   ASN  45          2HB       ASN  45 -12.067  -3.634   3.725
  371   1HD2  ASN  45          1HD2      ASN  45 -11.858  -0.554   2.223
  372   2HD2  ASN  45          2HD2      ASN  45 -10.228  -0.151   2.650
  373    H    SER  46           H        SER  46 -11.397  -6.347   1.883
  374    HA   SER  46           HA       SER  46 -14.244  -6.960   2.027
  375   1HB   SER  46          1HB       SER  46 -13.787  -9.077   0.810
  376   2HB   SER  46          2HB       SER  46 -13.405  -7.673  -0.164
  377    HG   SER  46           HG       SER  46 -11.118  -7.977   0.682
  378    H    LEU  47           H        LEU  47 -14.466  -9.389   2.954
  379    HA   LEU  47           HA       LEU  47 -13.088  -9.324   5.471
  380   1HB   LEU  47          1HB       LEU  47 -15.177 -11.173   4.317
  381   2HB   LEU  47          2HB       LEU  47 -14.526 -11.313   5.937
  382    HG   LEU  47           HG       LEU  47 -15.782  -8.730   5.040
  383   1HD1  LEU  47          1HD1      LEU  47 -17.180 -11.298   5.686
  384   2HD1  LEU  47          2HD1      LEU  47 -17.890  -9.759   6.228
  385   3HD1  LEU  47          3HD1      LEU  47 -17.587 -10.039   4.496
  386   1HD2  LEU  47          1HD2      LEU  47 -15.665 -10.058   7.761
  387   2HD2  LEU  47          2HD2      LEU  47 -14.497  -8.852   7.168
  388   3HD2  LEU  47          3HD2      LEU  47 -16.206  -8.405   7.383
  389    H    LEU  48           H        LEU  48 -12.200 -10.311   2.420
  390    HA   LEU  48           HA       LEU  48 -10.819 -12.701   3.377
  391   1HB   LEU  48          1HB       LEU  48 -11.121 -11.625   0.571
  392   2HB   LEU  48          2HB       LEU  48 -10.396 -13.154   1.028
  393    HG   LEU  48           HG       LEU  48 -12.835 -13.469   2.154
  394   1HD1  LEU  48          1HD1      LEU  48 -14.430 -12.681   0.248
  395   2HD1  LEU  48          2HD1      LEU  48 -13.958 -11.548   1.538
  396   3HD1  LEU  48          3HD1      LEU  48 -13.167 -11.463  -0.055
  397   1HD2  LEU  48          1HD2      LEU  48 -13.413 -14.530  -0.202
  398   2HD2  LEU  48          2HD2      LEU  48 -11.698 -14.174  -0.515
  399   3HD2  LEU  48          3HD2      LEU  48 -12.155 -15.217   0.853
  400    H    VAL  49           H        VAL  49 -10.238  -9.534   1.714
  401    HA   VAL  49           HA       VAL  49  -7.531  -9.631   2.839
  402    HB   VAL  49           HB       VAL  49  -8.371  -9.543   0.047
  403   1HG1  VAL  49          1HG1      VAL  49  -6.444  -7.417   1.040
  404   2HG1  VAL  49          2HG1      VAL  49  -6.681  -7.869  -0.665
  405   3HG1  VAL  49          3HG1      VAL  49  -8.020  -7.148   0.258
  406   1HG2  VAL  49          1HG2      VAL  49  -5.569  -9.761   1.167
  407   2HG2  VAL  49          2HG2      VAL  49  -6.725 -11.114   1.216
  408   3HG2  VAL  49          3HG2      VAL  49  -6.218 -10.433  -0.348
  409    H    LYS  50           H        LYS  50  -6.946  -7.795   3.925
  410    HA   LYS  50           HA       LYS  50  -8.894  -5.612   3.832
  411   1HB   LYS  50          1HB       LYS  50  -8.323  -6.880   5.998
  412   2HB   LYS  50          2HB       LYS  50  -6.783  -6.046   5.947
  413   1HG   LYS  50          1HG       LYS  50  -7.705  -4.076   6.626
  414   2HG   LYS  50          2HG       LYS  50  -9.010  -4.191   5.462
  415   1HD   LYS  50          1HD       LYS  50  -9.525  -6.208   7.419
  416   2HD   LYS  50          2HD       LYS  50  -9.049  -4.780   8.315
  417   1HE   LYS  50          1HE       LYS  50 -11.225  -4.862   6.169
  418   2HE   LYS  50          2HE       LYS  50 -11.515  -4.847   7.898
  419   1HZ   LYS  50          1HZ       LYS  50 -10.177  -2.732   7.886
  420   2HZ   LYS  50          2HZ       LYS  50 -10.346  -2.723   6.262
  421   3HZ   LYS  50          3HZ       LYS  50 -11.667  -2.653   7.221
  422    H    TYR  51           H        TYR  51  -7.966  -3.357   4.051
  423    HA   TYR  51           HA       TYR  51  -5.349  -3.185   2.728
  424   1HB   TYR  51          1HB       TYR  51  -7.910  -1.540   2.245
  425   2HB   TYR  51          2HB       TYR  51  -6.407  -1.337   1.366
  426    HD1  TYR  51           HD1      TYR  51  -6.225  -2.330  -0.724
  427    HD2  TYR  51           HD2      TYR  51  -8.902  -4.037   2.143
  428    HE1  TYR  51           HE1      TYR  51  -7.015  -4.016  -2.455
  429    HE2  TYR  51           HE2      TYR  51  -9.684  -5.717   0.403
  430    HH   TYR  51           HH       TYR  51  -9.270  -6.587  -1.569
  431    H    VAL  52           H        VAL  52  -4.070  -1.372   3.299
  432    HA   VAL  52           HA       VAL  52  -5.215   0.366   5.357
  433    HB   VAL  52           HB       VAL  52  -2.419  -0.672   5.622
  434   1HG1  VAL  52          1HG1      VAL  52  -3.203   1.243   6.991
  435   2HG1  VAL  52          2HG1      VAL  52  -4.478   0.206   7.674
  436   3HG1  VAL  52          3HG1      VAL  52  -2.765  -0.173   7.977
  437   1HG2  VAL  52          1HG2      VAL  52  -4.857  -2.085   6.754
  438   2HG2  VAL  52          2HG2      VAL  52  -3.886  -2.669   5.381
  439   3HG2  VAL  52          3HG2      VAL  52  -3.151  -2.530   6.996
  440    H    CYS  53           H        CYS  53  -5.081   2.413   4.615
  441    HA   CYS  53           HA       CYS  53  -3.057   2.981   2.615
  442   1HB   CYS  53          1HB       CYS  53  -5.365   4.689   3.567
  443   2HB   CYS  53          2HB       CYS  53  -4.299   5.044   2.222
  444    H    CYS  54           H        CYS  54  -1.743   5.014   2.864
  445    HA   CYS  54           HA       CYS  54  -1.612   6.122   5.509
  446   1HB   CYS  54          1HB       CYS  54   0.900   5.653   5.613
  447   2HB   CYS  54          2HB       CYS  54  -0.210   4.378   6.078
  448    H    ASN  55           H        ASN  55   0.013   7.998   5.497
  449    HA   ASN  55           HA       ASN  55   0.413   8.917   2.760
  450   1HB   ASN  55          1HB       ASN  55  -0.253  11.153   3.386
  451   2HB   ASN  55          2HB       ASN  55  -1.484  10.096   4.051
  452   1HD2  ASN  55          1HD2      ASN  55  -1.070   9.293   6.301
  453   2HD2  ASN  55          2HD2      ASN  55  -0.454  10.419   7.465
  454    H    THR  56           H        THR  56   1.871   7.780   5.490
  455    HA   THR  56           HA       THR  56   3.966   9.808   5.655
  456    HB   THR  56           HB       THR  56   4.655   8.404   7.633
  457    HG1  THR  56           HG1      THR  56   3.756   6.377   7.673
  458   1HG2  THR  56          1HG2      THR  56   3.121   9.768   8.674
  459   2HG2  THR  56          2HG2      THR  56   1.970   9.633   7.323
  460   3HG2  THR  56          3HG2      THR  56   2.026   8.368   8.573
  461    H    ASP  57           H        ASP  57   6.264   9.112   5.630
  462    HA   ASP  57           HA       ASP  57   6.694   7.672   3.253
  463   1HB   ASP  57          1HB       ASP  57   8.433   8.954   5.370
  464   2HB   ASP  57          2HB       ASP  57   9.187   7.884   4.206
  465    H    ARG  58           H        ARG  58   8.185   5.707   3.131
  466    HA   ARG  58           HA       ARG  58   8.330   3.569   3.595
  467   1HB   ARG  58          1HB       ARG  58   9.529   4.825   6.112
  468   2HB   ARG  58          2HB       ARG  58   9.733   3.133   5.703
  469   1HG   ARG  58          1HG       ARG  58  10.508   4.200   3.336
  470   2HG   ARG  58          2HG       ARG  58  10.890   5.567   4.364
  471   1HD   ARG  58          1HD       ARG  58  11.990   3.593   5.882
  472   2HD   ARG  58          2HD       ARG  58  12.122   2.826   4.311
  473    HE   ARG  58           HE       ARG  58  13.063   5.422   3.890
  474   1HH1  ARG  58          1HH1      ARG  58  13.915   2.770   6.041
  475   2HH1  ARG  58          2HH1      ARG  58  15.584   3.222   6.145
  476   1HH2  ARG  58          1HH2      ARG  58  15.264   6.018   4.026
  477   2HH2  ARG  58          2HH2      ARG  58  16.357   5.082   4.991
  478    H    CYS  59           H        CYS  59   5.689   4.367   4.164
  479    HA   CYS  59           HA       CYS  59   5.028   3.445   6.807
  480   1HB   CYS  59          1HB       CYS  59   2.757   4.013   6.246
  481   2HB   CYS  59          2HB       CYS  59   3.833   5.336   5.837
  482    H    ASN  60           H        ASN  60   4.528   2.475   3.343
  483    HA   ASN  60           HA       ASN  60   3.794  -0.160   4.339
  484   1HB   ASN  60          1HB       ASN  60   2.637  -0.503   2.214
  485   2HB   ASN  60          2HB       ASN  60   2.136   1.056   2.841
  486   1HD2  ASN  60          1HD2      ASN  60   4.009  -0.646   0.457
  487   2HD2  ASN  60          2HD2      ASN  60   4.325   0.678  -0.615
  488   1H    HOH  61          1H        HOH  61  -1.002 -11.558   4.294
  489   2H    HOH  61          2H        HOH  61  -0.122 -10.921   3.240
  Start of MODEL    5
    1   1H    LEU   1           H1       LEU   1   7.962  11.766   0.624
    2    HA   LEU   1           HA       LEU   1   5.938  10.756   0.524
    3   1HB   LEU   1          1HB       LEU   1   4.424  10.980  -1.356
    4   2HB   LEU   1          2HB       LEU   1   4.928  12.538  -0.735
    5    HG   LEU   1           HG       LEU   1   6.745  11.937  -2.806
    6   1HD1  LEU   1          1HD1      LEU   1   4.615  10.315  -3.287
    7   2HD1  LEU   1          2HD1      LEU   1   4.133  11.785  -4.166
    8   3HD1  LEU   1          3HD1      LEU   1   5.680  10.991  -4.542
    9   1HD2  LEU   1          1HD2      LEU   1   4.372  13.732  -3.209
   10   2HD2  LEU   1          2HD2      LEU   1   5.589  14.121  -1.969
   11   3HD2  LEU   1          3HD2      LEU   1   6.074  13.968  -3.675
   12    H    LYS   2           H        LYS   2   7.911   9.214   0.651
   13    HA   LYS   2           HA       LYS   2   7.782   7.470  -1.708
   14   1HB   LYS   2          1HB       LYS   2  10.196   8.029   0.043
   15   2HB   LYS   2          2HB       LYS   2  10.129   6.842  -1.245
   16   1HG   LYS   2          1HG       LYS   2  10.233   8.433  -2.911
   17   2HG   LYS   2          2HG       LYS   2   9.235   9.576  -2.033
   18   1HD   LYS   2          1HD       LYS   2  11.814   9.134  -0.685
   19   2HD   LYS   2          2HD       LYS   2  12.037   9.682  -2.334
   20   1HE   LYS   2          1HE       LYS   2  11.774  11.762  -1.378
   21   2HE   LYS   2          2HE       LYS   2  10.071  11.409  -1.596
   22   1HZ   LYS   2          1HZ       LYS   2  11.457  11.759   0.784
   23   2HZ   LYS   2          2HZ       LYS   2   9.858  11.502   0.575
   24   3HZ   LYS   2          3HZ       LYS   2  10.869  10.236   0.775
   25    H    CYS   3           H        CYS   3   7.600   5.234  -1.314
   26    HA   CYS   3           HA       CYS   3   7.394   4.485   1.497
   27   1HB   CYS   3          1HB       CYS   3   5.249   4.310  -0.573
   28   2HB   CYS   3          2HB       CYS   3   5.395   2.998   0.579
   29    H    ASN   4           H        ASN   4   7.567   2.051   1.745
   30    HA   ASN   4           HA       ASN   4   9.647   1.106   0.161
   31   1HB   ASN   4          1HB       ASN   4   7.815  -0.710   1.780
   32   2HB   ASN   4          2HB       ASN   4   9.544  -0.859   1.538
   33   1HD2  ASN   4          1HD2      ASN   4   8.129  -0.865   4.012
   34   2HD2  ASN   4          2HD2      ASN   4   8.682   0.467   4.971
   35    H    LYS   5           H        LYS   5   9.564  -0.959  -1.189
   36    HA   LYS   5           HA       LYS   5   7.086  -1.006  -2.727
   37   1HB   LYS   5          1HB       LYS   5   9.899  -1.952  -3.327
   38   2HB   LYS   5          2HB       LYS   5   8.531  -2.282  -4.371
   39   1HG   LYS   5          1HG       LYS   5   9.010   0.569  -3.486
   40   2HG   LYS   5          2HG       LYS   5  10.049  -0.105  -4.726
   41   1HD   LYS   5          1HD       LYS   5   8.282   0.859  -5.972
   42   2HD   LYS   5          2HD       LYS   5   7.854  -0.840  -5.924
   43   1HE   LYS   5          1HE       LYS   5   6.027  -0.489  -4.559
   44   2HE   LYS   5          2HE       LYS   5   6.826   0.762  -3.626
   45   1HZ   LYS   5          1HZ       LYS   5   5.338   1.964  -4.813
   46   2HZ   LYS   5          2HZ       LYS   5   6.601   2.055  -5.843
   47   3HZ   LYS   5          3HZ       LYS   5   5.387   1.003  -6.132
   48    H    LEU   6           H        LEU   6   7.223  -3.578  -3.822
   49    HA   LEU   6           HA       LEU   6   5.824  -5.078  -2.068
   50   1HB   LEU   6          1HB       LEU   6   6.573  -5.347  -4.616
   51   2HB   LEU   6          2HB       LEU   6   7.672  -6.511  -3.906
   52    HG   LEU   6           HG       LEU   6   5.001  -6.911  -2.866
   53   1HD1  LEU   6          1HD1      LEU   6   4.388  -5.826  -5.044
   54   2HD1  LEU   6          2HD1      LEU   6   5.209  -7.171  -5.875
   55   3HD1  LEU   6          3HD1      LEU   6   3.796  -7.492  -4.841
   56   1HD2  LEU   6          1HD2      LEU   6   6.121  -8.937  -4.673
   57   2HD2  LEU   6          2HD2      LEU   6   7.233  -8.417  -3.384
   58   3HD2  LEU   6          3HD2      LEU   6   5.625  -9.057  -2.967
   59    H    VAL   7           H        VAL   7   9.413  -5.100  -2.536
   60    HA   VAL   7           HA       VAL   7   9.620  -6.789  -0.162
   61    HB   VAL   7           HB       VAL   7  12.020  -5.973  -1.690
   62   1HG1  VAL   7          1HG1      VAL   7  11.900  -7.647   0.227
   63   2HG1  VAL   7          2HG1      VAL   7  11.072  -8.741  -0.908
   64   3HG1  VAL   7          3HG1      VAL   7  12.731  -8.193  -1.249
   65   1HG2  VAL   7          1HG2      VAL   7  11.464  -7.797  -3.418
   66   2HG2  VAL   7          2HG2      VAL   7   9.770  -7.571  -2.921
   67   3HG2  VAL   7          3HG2      VAL   7  10.685  -6.209  -3.612
   68    HA   PRO   8           HA       PRO   8  10.152  -2.944   2.002
   69   1HB   PRO   8          1HB       PRO   8  10.542  -4.862   4.317
   70   2HB   PRO   8          2HB       PRO   8   9.449  -3.475   4.177
   71   1HG   PRO   8          1HG       PRO   8   8.442  -5.999   3.955
   72   2HG   PRO   8          2HG       PRO   8   7.874  -4.746   2.827
   73   1HD   PRO   8          1HD       PRO   8  10.039  -6.874   2.293
   74   2HD   PRO   8          2HD       PRO   8   8.614  -6.460   1.300
   75    H    ILE   9           H        ILE   9  12.667  -4.685   0.937
   76    HA   ILE   9           HA       ILE   9  14.605  -3.694   2.874
   77    HB   ILE   9           HB       ILE   9  16.157  -5.141   1.880
   78   1HG1  ILE   9          1HG1      ILE   9  15.072  -4.488  -0.522
   79   2HG1  ILE   9          2HG1      ILE   9  16.234  -5.774  -0.271
   80   1HG2  ILE   9          1HG2      ILE   9  15.028  -7.336   1.934
   81   2HG2  ILE   9          2HG2      ILE   9  14.552  -6.284   3.288
   82   3HG2  ILE   9          3HG2      ILE   9  13.452  -6.508   1.905
   83   1HD1  ILE   9          1HD1      ILE   9  13.218  -6.194  -0.103
   84   2HD1  ILE   9          2HD1      ILE   9  14.177  -6.471  -1.577
   85   3HD1  ILE   9          3HD1      ILE   9  14.477  -7.452  -0.122
   86    H    ALA  10           H        ALA  10  12.927  -2.619   0.146
   87    HA   ALA  10           HA       ALA  10  14.810  -0.461  -0.180
   88   1HB   ALA  10          1HB       ALA  10  13.995  -1.804  -2.733
   89   2HB   ALA  10          2HB       ALA  10  15.459  -0.866  -2.354
   90   3HB   ALA  10          3HB       ALA  10  15.308  -2.547  -1.787
   91    H    TYR  11           H        TYR  11  13.744   1.438  -0.709
   92    HA   TYR  11           HA       TYR  11  10.896   1.135  -1.388
   93   1HB   TYR  11          1HB       TYR  11  10.588   3.126   0.103
   94   2HB   TYR  11          2HB       TYR  11  11.399   1.857   0.998
   95    HD1  TYR  11           HD1      TYR  11  13.912   1.993   1.331
   96    HD2  TYR  11           HD2      TYR  11  11.616   5.246  -0.235
   97    HE1  TYR  11           HE1      TYR  11  15.797   3.604   1.892
   98    HE2  TYR  11           HE2      TYR  11  13.510   6.847   0.331
   99    HH   TYR  11           HH       TYR  11  16.474   5.649   1.889
  100    H    LYS  12           H        LYS  12   9.957   2.979  -2.583
  101    HA   LYS  12           HA       LYS  12  11.964   4.632  -3.916
  102   1HB   LYS  12          1HB       LYS  12   9.924   2.871  -5.300
  103   2HB   LYS  12          2HB       LYS  12  10.759   4.192  -6.092
  104   1HG   LYS  12          1HG       LYS  12  12.510   2.287  -4.589
  105   2HG   LYS  12          2HG       LYS  12  11.711   1.620  -5.998
  106   1HD   LYS  12          1HD       LYS  12  13.278   2.603  -7.308
  107   2HD   LYS  12          2HD       LYS  12  12.659   4.169  -6.825
  108   1HE   LYS  12          1HE       LYS  12  14.324   4.502  -5.225
  109   2HE   LYS  12          2HE       LYS  12  14.491   2.791  -4.881
  110   1HZ   LYS  12          1HZ       LYS  12  16.242   4.071  -6.289
  111   2HZ   LYS  12          2HZ       LYS  12  15.889   2.509  -6.613
  112   3HZ   LYS  12          3HZ       LYS  12  15.243   3.699  -7.526
  113    H    THR  13           H        THR  13  10.258   6.010  -5.642
  114    HA   THR  13           HA       THR  13   8.665   7.472  -3.682
  115    HB   THR  13           HB       THR  13   9.150   8.312  -6.555
  116    HG1  THR  13           HG1      THR  13  11.259   7.785  -5.954
  117   1HG2  THR  13          1HG2      THR  13   8.147   9.579  -4.226
  118   2HG2  THR  13          2HG2      THR  13   9.824  10.160  -4.370
  119   3HG2  THR  13          3HG2      THR  13   8.684  10.391  -5.717
  120    H    CYS  14           H        CYS  14   6.468   7.955  -3.917
  121    HA   CYS  14           HA       CYS  14   4.978   5.869  -5.062
  122   1HB   CYS  14          1HB       CYS  14   4.038   8.570  -4.077
  123   2HB   CYS  14          2HB       CYS  14   3.018   7.184  -4.405
  124    HA   PRO  15           HA       PRO  15   5.087   7.174  -9.274
  125   1HB   PRO  15          1HB       PRO  15   2.597   5.971  -9.985
  126   2HB   PRO  15          2HB       PRO  15   4.190   5.200 -10.031
  127   1HG   PRO  15          1HG       PRO  15   2.022   5.108  -7.834
  128   2HG   PRO  15          2HG       PRO  15   3.092   3.814  -8.424
  129   1HD   PRO  15          1HD       PRO  15   3.687   5.061  -6.073
  130   2HD   PRO  15          2HD       PRO  15   4.985   4.545  -7.185
  131    H    GLU  16           H        GLU  16   3.752   8.205 -11.082
  132    HA   GLU  16           HA       GLU  16   2.867  10.668 -10.169
  133   1HB   GLU  16          1HB       GLU  16   2.614   9.277 -12.865
  134   2HB   GLU  16          2HB       GLU  16   2.090  10.929 -12.606
  135   1HG   GLU  16          1HG       GLU  16   4.854  10.254 -11.652
  136   2HG   GLU  16          2HG       GLU  16   4.618  10.267 -13.389
  137    H    GLY  17           H        GLY  17   0.808  11.554  -9.825
  138   1HA   GLY  17          1HA       GLY  17  -1.488  11.621  -9.857
  139   2HA   GLY  17          2HA       GLY  17  -1.549   9.993 -10.501
  140    H    LYS  18           H        LYS  18   0.454   9.031  -8.386
  141    HA   LYS  18           HA       LYS  18  -1.553   8.624  -6.324
  142   1HB   LYS  18          1HB       LYS  18   1.129   7.275  -6.363
  143   2HB   LYS  18          2HB       LYS  18  -0.407   6.685  -5.761
  144   1HG   LYS  18          1HG       LYS  18   0.419   7.021  -8.677
  145   2HG   LYS  18          2HG       LYS  18   0.074   5.519  -7.841
  146   1HD   LYS  18          1HD       LYS  18  -2.308   6.318  -7.492
  147   2HD   LYS  18          2HD       LYS  18  -1.938   7.737  -8.451
  148   1HE   LYS  18          1HE       LYS  18  -1.046   5.759 -10.143
  149   2HE   LYS  18          2HE       LYS  18  -2.342   4.907  -9.327
  150   1HZ   LYS  18          1HZ       LYS  18  -3.239   6.024 -11.175
  151   2HZ   LYS  18          2HZ       LYS  18  -3.761   6.839  -9.861
  152   3HZ   LYS  18          3HZ       LYS  18  -2.554   7.451 -10.775
  153    H    ASN  19           H        ASN  19  -1.107   8.972  -4.061
  154    HA   ASN  19           HA       ASN  19   1.236  10.571  -3.528
  155   1HB   ASN  19          1HB       ASN  19  -0.453  12.284  -3.994
  156   2HB   ASN  19          2HB       ASN  19  -1.646  11.457  -3.011
  157   1HD2  ASN  19          1HD2      ASN  19  -2.015  12.404  -1.171
  158   2HD2  ASN  19          2HD2      ASN  19  -0.877  13.227  -0.158
  159    H    LEU  20           H        LEU  20  -1.776   8.912  -2.426
  160    HA   LEU  20           HA       LEU  20  -0.774   8.674   0.272
  161   1HB   LEU  20          1HB       LEU  20  -3.323   8.095  -1.159
  162   2HB   LEU  20          2HB       LEU  20  -2.981   7.196   0.306
  163    HG   LEU  20           HG       LEU  20  -3.055  10.219   0.102
  164   1HD1  LEU  20          1HD1      LEU  20  -5.250   8.908  -0.207
  165   2HD1  LEU  20          2HD1      LEU  20  -5.090   8.509   1.521
  166   3HD1  LEU  20          3HD1      LEU  20  -5.205  10.210   1.007
  167   1HD2  LEU  20          1HD2      LEU  20  -3.323   9.670   2.737
  168   2HD2  LEU  20          2HD2      LEU  20  -2.241   8.345   2.241
  169   3HD2  LEU  20          3HD2      LEU  20  -1.772  10.037   1.943
  170    H    CYS  21           H        CYS  21  -0.405   6.603   1.332
  171    HA   CYS  21           HA       CYS  21   0.631   4.666  -0.592
  172   1HB   CYS  21          1HB       CYS  21   1.411   5.443   2.190
  173   2HB   CYS  21          2HB       CYS  21   1.737   3.809   1.647
  174    H    TYR  22           H        TYR  22   0.002   2.440  -0.402
  175    HA   TYR  22           HA       TYR  22  -2.082   1.887   1.587
  176   1HB   TYR  22          1HB       TYR  22  -3.463   0.980  -0.210
  177   2HB   TYR  22          2HB       TYR  22  -2.882   2.514  -0.827
  178    HD1  TYR  22           HD1      TYR  22  -1.780   2.605  -2.893
  179    HD2  TYR  22           HD2      TYR  22  -2.078  -1.142  -0.848
  180    HE1  TYR  22           HE1      TYR  22  -0.810   1.414  -4.919
  181    HE2  TYR  22           HE2      TYR  22  -1.106  -2.319  -2.881
  182    HH   TYR  22           HH       TYR  22   0.058  -1.970  -4.776
  183    H    LYS  23           H        LYS  23  -2.418  -0.457   1.965
  184    HA   LYS  23           HA       LYS  23  -0.474  -2.256   0.872
  185   1HB   LYS  23          1HB       LYS  23   0.372  -2.849   3.228
  186   2HB   LYS  23          2HB       LYS  23   1.049  -1.443   2.432
  187   1HG   LYS  23          1HG       LYS  23   0.003   0.060   3.865
  188   2HG   LYS  23          2HG       LYS  23  -1.399  -0.965   4.098
  189   1HD   LYS  23          1HD       LYS  23  -0.509  -1.929   5.960
  190   2HD   LYS  23          2HD       LYS  23   1.016  -2.249   5.157
  191   1HE   LYS  23          1HE       LYS  23   1.003   0.554   5.506
  192   2HE   LYS  23          2HE       LYS  23   0.304  -0.062   6.990
  193   1HZ   LYS  23          1HZ       LYS  23   2.574  -0.101   7.329
  194   2HZ   LYS  23          2HZ       LYS  23   2.243  -1.659   6.968
  195   3HZ   LYS  23          3HZ       LYS  23   2.920  -0.686   5.845
  196    H    MET  24           H        MET  24  -1.724  -3.977   0.409
  197    HA   MET  24           HA       MET  24  -4.040  -4.415   2.083
  198   1HB   MET  24          1HB       MET  24  -3.097  -5.379  -0.653
  199   2HB   MET  24          2HB       MET  24  -4.399  -6.225   0.160
  200   1HG   MET  24          1HG       MET  24  -5.602  -4.642  -1.090
  201   2HG   MET  24          2HG       MET  24  -5.454  -3.811   0.446
  202   1HE   MET  24          1HE       MET  24  -3.450  -1.383   0.573
  203   2HE   MET  24          2HE       MET  24  -4.557  -0.630  -0.600
  204   3HE   MET  24          3HE       MET  24  -5.178  -1.809   0.580
  205    H    PHE  25           H        PHE  25  -4.257  -6.135   3.489
  206    HA   PHE  25           HA       PHE  25  -2.056  -8.079   3.457
  207   1HB   PHE  25          1HB       PHE  25  -3.814  -6.886   5.682
  208   2HB   PHE  25          2HB       PHE  25  -2.717  -8.223   5.965
  209    HD1  PHE  25           HD1      PHE  25  -2.332  -6.003   7.643
  210    HD2  PHE  25           HD2      PHE  25  -0.942  -6.506   3.665
  211    HE1  PHE  25           HE1      PHE  25  -0.470  -4.381   8.089
  212    HE2  PHE  25           HE2      PHE  25   0.921  -4.883   4.112
  213    HZ   PHE  25           HZ       PHE  25   1.134  -3.840   6.318
  214    H    MET  26           H        MET  26  -2.557 -10.260   3.446
  215    HA   MET  26           HA       MET  26  -5.228 -10.904   2.782
  216   1HB   MET  26          1HB       MET  26  -2.725 -12.585   3.346
  217   2HB   MET  26          2HB       MET  26  -4.229 -13.283   2.779
  218   1HG   MET  26          1HG       MET  26  -4.118 -12.085   0.683
  219   2HG   MET  26          2HG       MET  26  -2.864 -11.013   1.273
  220   1HE   MET  26          1HE       MET  26  -2.169 -13.628  -1.589
  221   2HE   MET  26          2HE       MET  26  -2.984 -14.867  -0.604
  222   3HE   MET  26          3HE       MET  26  -3.754 -13.282  -0.857
  223    H    MET  27           H        MET  27  -6.632 -12.448   3.914
  224    HA   MET  27           HA       MET  27  -6.811 -11.887   6.621
  225   1HB   MET  27          1HB       MET  27  -8.086 -13.823   4.671
  226   2HB   MET  27          2HB       MET  27  -8.369 -14.105   6.378
  227   1HG   MET  27          1HG       MET  27  -8.786 -11.337   5.192
  228   2HG   MET  27          2HG       MET  27 -10.036 -12.557   5.053
  229   1HE   MET  27          1HE       MET  27 -11.372 -13.183   8.433
  230   2HE   MET  27          2HE       MET  27 -12.022 -12.325   7.015
  231   3HE   MET  27          3HE       MET  27 -11.043 -13.795   6.793
  232    H    SER  28           H        SER  28  -5.229 -14.524   4.815
  233    HA   SER  28           HA       SER  28  -4.962 -16.247   6.996
  234   1HB   SER  28          1HB       SER  28  -4.705 -17.185   4.819
  235   2HB   SER  28          2HB       SER  28  -3.545 -15.967   4.328
  236    HG   SER  28           HG       SER  28  -3.046 -18.388   5.412
  237    H    ASP  29           H        ASP  29  -1.966 -15.250   5.360
  238    HA   ASP  29           HA       ASP  29  -0.711 -14.898   7.857
  239   1HB   ASP  29          1HB       ASP  29   0.229 -15.682   5.505
  240   2HB   ASP  29          2HB       ASP  29   0.447 -13.967   5.213
  241    H    LEU  30           H        LEU  30  -2.046 -13.074   8.728
  242    HA   LEU  30           HA       LEU  30  -2.082 -10.595   7.314
  243   1HB   LEU  30          1HB       LEU  30  -2.942 -11.475  10.062
  244   2HB   LEU  30          2HB       LEU  30  -3.019  -9.800   9.553
  245    HG   LEU  30           HG       LEU  30  -4.341 -11.936   7.899
  246   1HD1  LEU  30          1HD1      LEU  30  -4.940 -11.832  10.520
  247   2HD1  LEU  30          2HD1      LEU  30  -6.020 -10.553   9.914
  248   3HD1  LEU  30          3HD1      LEU  30  -6.131 -12.201   9.251
  249   1HD2  LEU  30          1HD2      LEU  30  -4.024  -9.512   7.147
  250   2HD2  LEU  30          2HD2      LEU  30  -5.664 -10.198   7.045
  251   3HD2  LEU  30          3HD2      LEU  30  -5.240  -9.096   8.378
  252    H    THR  31           H        THR  31   0.230 -12.289   9.214
  253    HA   THR  31           HA       THR  31   1.494  -9.870  10.209
  254    HB   THR  31           HB       THR  31   1.383 -11.890  11.638
  255    HG1  THR  31           HG1      THR  31   3.673 -11.836  12.035
  256   1HG2  THR  31          1HG2      THR  31   1.376 -13.691   9.946
  257   2HG2  THR  31          2HG2      THR  31   2.972 -13.172   9.354
  258   3HG2  THR  31          3HG2      THR  31   2.812 -13.874  10.982
  259    H    ILE  32           H        ILE  32   1.232 -11.198   7.212
  260    HA   ILE  32           HA       ILE  32   3.766 -10.021   6.446
  261    HB   ILE  32           HB       ILE  32   3.135 -12.917   6.272
  262   1HG1  ILE  32          1HG1      ILE  32   4.817 -12.066   7.841
  263   2HG1  ILE  32          2HG1      ILE  32   5.521 -13.138   6.646
  264   1HG2  ILE  32          1HG2      ILE  32   3.158 -12.710   3.985
  265   2HG2  ILE  32          2HG2      ILE  32   4.243 -11.299   4.009
  266   3HG2  ILE  32          3HG2      ILE  32   4.892 -12.927   4.321
  267   1HD1  ILE  32          1HD1      ILE  32   5.557 -10.405   5.642
  268   2HD1  ILE  32          2HD1      ILE  32   6.317 -10.482   7.250
  269   3HD1  ILE  32          3HD1      ILE  32   6.922 -11.510   5.929
  270    HA   PRO  33           HA       PRO  33   0.617  -8.236   3.872
  271   1HB   PRO  33          1HB       PRO  33   3.170  -7.168   2.579
  272   2HB   PRO  33          2HB       PRO  33   1.672  -6.305   2.969
  273   1HG   PRO  33          1HG       PRO  33   3.825  -6.053   4.622
  274   2HG   PRO  33          2HG       PRO  33   2.214  -6.271   5.343
  275   1HD   PRO  33          1HD       PRO  33   4.402  -8.388   4.992
  276   2HD   PRO  33          2HD       PRO  33   3.325  -8.099   6.386
  277    H    VAL  34           H        VAL  34   0.145  -7.852   1.461
  278    HA   VAL  34           HA       VAL  34   1.142 -10.123  -0.110
  279    HB   VAL  34           HB       VAL  34  -0.992 -10.782   0.666
  280   1HG1  VAL  34          1HG1      VAL  34  -1.872  -7.975  -0.040
  281   2HG1  VAL  34          2HG1      VAL  34  -3.032  -9.305   0.196
  282   3HG1  VAL  34          3HG1      VAL  34  -1.961  -8.809   1.531
  283   1HG2  VAL  34          1HG2      VAL  34  -0.609 -10.064  -2.140
  284   2HG2  VAL  34          2HG2      VAL  34  -1.258 -11.556  -1.419
  285   3HG2  VAL  34          3HG2      VAL  34  -2.329 -10.161  -1.691
  286    H    LYS  35           H        LYS  35  -0.250  -6.814   0.033
  287    HA   LYS  35           HA       LYS  35   1.143  -6.263  -2.471
  288   1HB   LYS  35          1HB       LYS  35  -1.680  -5.279  -2.053
  289   2HB   LYS  35          2HB       LYS  35  -0.720  -5.261  -3.519
  290   1HG   LYS  35          1HG       LYS  35  -0.692  -7.935  -3.060
  291   2HG   LYS  35          2HG       LYS  35  -2.188  -7.550  -2.234
  292   1HD   LYS  35          1HD       LYS  35  -3.132  -7.742  -4.311
  293   2HD   LYS  35          2HD       LYS  35  -2.533  -6.113  -4.552
  294   1HE   LYS  35          1HE       LYS  35  -0.748  -6.808  -5.891
  295   2HE   LYS  35          2HE       LYS  35  -0.611  -8.364  -5.097
  296   1HZ   LYS  35          1HZ       LYS  35  -3.108  -8.189  -6.321
  297   2HZ   LYS  35          2HZ       LYS  35  -1.968  -7.781  -7.419
  298   3HZ   LYS  35          3HZ       LYS  35  -1.884  -9.220  -6.653
  299    H    ARG  36           H        ARG  36   2.182  -4.297  -2.469
  300    HA   ARG  36           HA       ARG  36   1.375  -2.397  -0.462
  301   1HB   ARG  36          1HB       ARG  36   4.314  -3.168  -0.706
  302   2HB   ARG  36          2HB       ARG  36   3.564  -2.193   0.543
  303   1HG   ARG  36          1HG       ARG  36   2.403  -4.117   1.472
  304   2HG   ARG  36          2HG       ARG  36   2.824  -5.117   0.096
  305   1HD   ARG  36          1HD       ARG  36   4.308  -5.668   1.976
  306   2HD   ARG  36          2HD       ARG  36   5.252  -4.923   0.701
  307    HE   ARG  36           HE       ARG  36   5.738  -3.168   2.155
  308   1HH1  ARG  36          1HH1      ARG  36   2.789  -4.746   3.252
  309   2HH1  ARG  36          2HH1      ARG  36   2.656  -3.784   4.686
  310   1HH2  ARG  36          1HH2      ARG  36   5.562  -1.899   4.048
  311   2HH2  ARG  36          2HH2      ARG  36   4.244  -2.154   5.142
  312    H    GLY  37           H        GLY  37   1.468  -0.322  -1.316
  313   1HA   GLY  37          1HA       GLY  37   3.487   0.613  -3.027
  314   2HA   GLY  37          2HA       GLY  37   2.130   0.095  -4.009
  315    H    CYS  38           H        CYS  38   2.341   2.604  -4.427
  316    HA   CYS  38           HA       CYS  38   0.769   3.999  -2.391
  317   1HB   CYS  38          1HB       CYS  38   2.402   5.296  -4.570
  318   2HB   CYS  38          2HB       CYS  38   1.692   6.050  -3.156
  319    H    ILE  39           H        ILE  39  -0.947   5.481  -3.253
  320    HA   ILE  39           HA       ILE  39  -1.688   5.182  -6.005
  321    HB   ILE  39           HB       ILE  39  -2.483   3.078  -4.817
  322   1HG1  ILE  39          1HG1      ILE  39  -4.795   4.565  -6.023
  323   2HG1  ILE  39          2HG1      ILE  39  -3.368   4.275  -6.997
  324   1HG2  ILE  39          1HG2      ILE  39  -3.655   5.040  -3.087
  325   2HG2  ILE  39          2HG2      ILE  39  -4.949   4.093  -3.861
  326   3HG2  ILE  39          3HG2      ILE  39  -3.664   3.265  -2.951
  327   1HD1  ILE  39          1HD1      ILE  39  -5.175   2.471  -7.131
  328   2HD1  ILE  39          2HD1      ILE  39  -3.544   1.881  -6.731
  329   3HD1  ILE  39          3HD1      ILE  39  -4.767   2.053  -5.449
  330    H    ASP  40           H        ASP  40  -3.963   6.360  -6.285
  331    HA   ASP  40           HA       ASP  40  -3.577   8.857  -4.937
  332   1HB   ASP  40          1HB       ASP  40  -4.084   8.592  -7.429
  333   2HB   ASP  40          2HB       ASP  40  -5.697   8.070  -6.988
  334    H    VAL  41           H        VAL  41  -6.089   6.279  -5.374
  335    HA   VAL  41           HA       VAL  41  -7.426   7.323  -2.977
  336    HB   VAL  41           HB       VAL  41  -9.031   5.906  -5.028
  337   1HG1  VAL  41          1HG1      VAL  41 -10.549   6.596  -3.533
  338   2HG1  VAL  41          2HG1      VAL  41  -9.409   7.737  -2.780
  339   3HG1  VAL  41          3HG1      VAL  41 -10.333   8.224  -4.222
  340   1HG2  VAL  41          1HG2      VAL  41  -7.987   8.726  -5.430
  341   2HG2  VAL  41          2HG2      VAL  41  -7.794   7.328  -6.515
  342   3HG2  VAL  41          3HG2      VAL  41  -9.401   8.056  -6.278
  343    H    CYS  42           H        CYS  42  -7.316   5.886  -1.338
  344    HA   CYS  42           HA       CYS  42  -6.286   3.321  -1.727
  345   1HB   CYS  42          1HB       CYS  42  -6.513   4.932   0.396
  346   2HB   CYS  42          2HB       CYS  42  -7.905   3.912   0.702
  347    HA   PRO  43           HA       PRO  43 -10.019   1.333  -2.939
  348   1HB   PRO  43          1HB       PRO  43  -8.734  -1.290  -2.360
  349   2HB   PRO  43          2HB       PRO  43  -9.146  -0.564  -3.923
  350   1HG   PRO  43          1HG       PRO  43  -6.514  -0.795  -3.096
  351   2HG   PRO  43          2HG       PRO  43  -7.054   0.619  -4.029
  352   1HD   PRO  43          1HD       PRO  43  -6.831   0.428  -0.951
  353   2HD   PRO  43          2HD       PRO  43  -6.056   1.612  -2.039
  354    H    LYS  44           H        LYS  44 -11.633  -0.484  -2.444
  355    HA   LYS  44           HA       LYS  44 -12.518  -0.094   0.244
  356   1HB   LYS  44          1HB       LYS  44 -13.676  -1.836  -1.952
  357   2HB   LYS  44          2HB       LYS  44 -14.483  -1.346  -0.475
  358   1HG   LYS  44          1HG       LYS  44 -14.177   1.076  -1.177
  359   2HG   LYS  44          2HG       LYS  44 -13.518   0.510  -2.699
  360   1HD   LYS  44          1HD       LYS  44 -16.144  -0.688  -1.918
  361   2HD   LYS  44          2HD       LYS  44 -16.181   1.026  -2.283
  362   1HE   LYS  44          1HE       LYS  44 -14.639  -0.680  -4.206
  363   2HE   LYS  44          2HE       LYS  44 -16.373  -0.933  -4.188
  364   1HZ   LYS  44          1HZ       LYS  44 -16.359   0.820  -5.534
  365   2HZ   LYS  44          2HZ       LYS  44 -16.214   1.718  -4.179
  366   3HZ   LYS  44          3HZ       LYS  44 -14.890   1.351  -5.060
  367    H    ASN  45           H        ASN  45 -12.689  -1.631   1.915
  368    HA   ASN  45           HA       ASN  45 -10.694  -3.664   1.729
  369   1HB   ASN  45          1HB       ASN  45 -12.618  -3.164   4.051
  370   2HB   ASN  45          2HB       ASN  45 -11.045  -3.934   4.126
  371   1HD2  ASN  45          1HD2      ASN  45 -12.796  -0.944   3.781
  372   2HD2  ASN  45          2HD2      ASN  45 -11.490   0.153   4.089
  373    H    SER  46           H        SER  46 -11.172  -5.983   2.173
  374    HA   SER  46           HA       SER  46 -13.981  -6.630   1.735
  375   1HB   SER  46          1HB       SER  46 -13.197  -8.625   0.426
  376   2HB   SER  46          2HB       SER  46 -12.801  -7.097  -0.334
  377    HG   SER  46           HG       SER  46 -10.717  -7.560  -0.184
  378    H    LEU  47           H        LEU  47 -14.321  -9.134   2.334
  379    HA   LEU  47           HA       LEU  47 -13.331  -9.378   5.033
  380   1HB   LEU  47          1HB       LEU  47 -15.356 -10.920   3.414
  381   2HB   LEU  47          2HB       LEU  47 -14.905 -11.344   5.053
  382    HG   LEU  47           HG       LEU  47 -16.016  -8.629   4.311
  383   1HD1  LEU  47          1HD1      LEU  47 -17.984 -10.088   5.692
  384   2HD1  LEU  47          2HD1      LEU  47 -18.011  -9.545   3.996
  385   3HD1  LEU  47          3HD1      LEU  47 -17.390 -11.163   4.403
  386   1HD2  LEU  47          1HD2      LEU  47 -16.445  -9.691   7.012
  387   2HD2  LEU  47          2HD2      LEU  47 -14.733  -9.442   6.596
  388   3HD2  LEU  47          3HD2      LEU  47 -15.883  -8.089   6.477
  389    H    LEU  48           H        LEU  48 -11.885  -9.922   2.189
  390    HA   LEU  48           HA       LEU  48 -10.730 -12.470   3.086
  391   1HB   LEU  48          1HB       LEU  48 -10.908 -11.399   0.268
  392   2HB   LEU  48          2HB       LEU  48 -10.205 -12.927   0.759
  393    HG   LEU  48           HG       LEU  48 -12.998 -12.590   1.621
  394   1HD1  LEU  48          1HD1      LEU  48 -12.292 -11.875  -1.096
  395   2HD1  LEU  48          2HD1      LEU  48 -13.344 -13.310  -1.060
  396   3HD1  LEU  48          3HD1      LEU  48 -13.865 -11.804  -0.267
  397   1HD2  LEU  48          1HD2      LEU  48 -11.175 -14.674   1.119
  398   2HD2  LEU  48          2HD2      LEU  48 -12.871 -14.804   1.643
  399   3HD2  LEU  48          3HD2      LEU  48 -12.469 -14.849  -0.091
  400    H    VAL  49           H        VAL  49 -10.119  -9.249   1.572
  401    HA   VAL  49           HA       VAL  49  -7.431  -9.394   2.733
  402    HB   VAL  49           HB       VAL  49  -8.218  -9.167  -0.069
  403   1HG1  VAL  49          1HG1      VAL  49  -6.206  -7.153   0.990
  404   2HG1  VAL  49          2HG1      VAL  49  -6.634  -7.436  -0.715
  405   3HG1  VAL  49          3HG1      VAL  49  -7.842  -6.762   0.407
  406   1HG2  VAL  49          1HG2      VAL  49  -6.676 -10.869   0.775
  407   2HG2  VAL  49          2HG2      VAL  49  -5.868  -9.824  -0.418
  408   3HG2  VAL  49          3HG2      VAL  49  -5.552  -9.601   1.319
  409    H    LYS  50           H        LYS  50  -6.893  -7.622   3.936
  410    HA   LYS  50           HA       LYS  50  -8.854  -5.452   3.924
  411   1HB   LYS  50          1HB       LYS  50  -8.390  -6.721   6.040
  412   2HB   LYS  50          2HB       LYS  50  -6.747  -6.109   6.002
  413   1HG   LYS  50          1HG       LYS  50  -7.420  -4.157   6.934
  414   2HG   LYS  50          2HG       LYS  50  -8.514  -3.868   5.596
  415   1HD   LYS  50          1HD       LYS  50 -10.357  -4.593   6.766
  416   2HD   LYS  50          2HD       LYS  50  -9.488  -5.909   7.529
  417   1HE   LYS  50          1HE       LYS  50  -8.317  -3.606   8.652
  418   2HE   LYS  50          2HE       LYS  50 -10.014  -3.188   8.535
  419   1HZ   LYS  50          1HZ       LYS  50 -10.482  -4.596  10.150
  420   2HZ   LYS  50          2HZ       LYS  50  -9.653  -5.829   9.472
  421   3HZ   LYS  50          3HZ       LYS  50  -8.881  -4.754  10.429
  422    H    TYR  51           H        TYR  51  -8.287  -3.328   3.478
  423    HA   TYR  51           HA       TYR  51  -5.592  -3.019   2.361
  424   1HB   TYR  51          1HB       TYR  51  -8.286  -1.546   2.097
  425   2HB   TYR  51          2HB       TYR  51  -6.826  -0.986   1.307
  426    HD1  TYR  51           HD1      TYR  51  -6.571  -1.542  -0.927
  427    HD2  TYR  51           HD2      TYR  51  -8.785  -4.182   1.610
  428    HE1  TYR  51           HE1      TYR  51  -7.080  -3.041  -2.917
  429    HE2  TYR  51           HE2      TYR  51  -9.286  -5.671  -0.388
  430    HH   TYR  51           HH       TYR  51  -7.620  -5.460  -3.253
  431    H    VAL  52           H        VAL  52  -4.119  -1.845   3.477
  432    HA   VAL  52           HA       VAL  52  -5.168  -0.047   5.546
  433    HB   VAL  52           HB       VAL  52  -2.747  -1.784   5.302
  434   1HG1  VAL  52          1HG1      VAL  52  -2.867   0.888   6.666
  435   2HG1  VAL  52          2HG1      VAL  52  -1.951  -0.436   7.424
  436   3HG1  VAL  52          3HG1      VAL  52  -1.526   0.115   5.786
  437   1HG2  VAL  52          1HG2      VAL  52  -3.594  -2.827   7.103
  438   2HG2  VAL  52          2HG2      VAL  52  -3.970  -1.296   7.931
  439   3HG2  VAL  52          3HG2      VAL  52  -5.100  -1.957   6.723
  440    H    CYS  53           H        CYS  53  -5.027   2.098   5.160
  441    HA   CYS  53           HA       CYS  53  -3.320   2.923   2.956
  442   1HB   CYS  53          1HB       CYS  53  -5.313   4.641   4.428
  443   2HB   CYS  53          2HB       CYS  53  -4.603   4.910   2.849
  444    H    CYS  54           H        CYS  54  -2.036   5.006   3.296
  445    HA   CYS  54           HA       CYS  54  -1.522   5.833   5.956
  446   1HB   CYS  54          1HB       CYS  54   0.904   5.184   5.945
  447   2HB   CYS  54          2HB       CYS  54  -0.241   3.892   6.247
  448    H    ASN  55           H        ASN  55  -0.571   7.906   5.874
  449    HA   ASN  55           HA       ASN  55   0.004   8.813   3.172
  450   1HB   ASN  55          1HB       ASN  55  -0.204  11.140   4.497
  451   2HB   ASN  55          2HB       ASN  55  -1.638  10.286   3.961
  452   1HD2  ASN  55          1HD2      ASN  55   0.684  10.188   6.667
  453   2HD2  ASN  55          2HD2      ASN  55  -0.476  10.049   7.946
  454    H    THR  56           H        THR  56   1.619   7.534   5.710
  455    HA   THR  56           HA       THR  56   3.702   9.575   5.904
  456    HB   THR  56           HB       THR  56   4.506   8.046   7.747
  457    HG1  THR  56           HG1      THR  56   3.585   6.027   7.735
  458   1HG2  THR  56          1HG2      THR  56   1.523   8.740   7.785
  459   2HG2  THR  56          2HG2      THR  56   2.418   8.150   9.205
  460   3HG2  THR  56          3HG2      THR  56   2.850   9.711   8.467
  461    H    ASP  57           H        ASP  57   6.001   8.889   5.727
  462    HA   ASP  57           HA       ASP  57   6.282   7.532   3.255
  463   1HB   ASP  57          1HB       ASP  57   8.622   8.194   5.048
  464   2HB   ASP  57          2HB       ASP  57   8.517   8.295   3.303
  465    H    ARG  58           H        ARG  58   7.979   5.697   3.034
  466    HA   ARG  58           HA       ARG  58   8.306   3.570   3.449
  467   1HB   ARG  58          1HB       ARG  58   9.450   4.881   5.962
  468   2HB   ARG  58          2HB       ARG  58   9.760   3.208   5.547
  469   1HG   ARG  58          1HG       ARG  58  11.591   4.152   4.494
  470   2HG   ARG  58          2HG       ARG  58  10.445   4.293   3.176
  471   1HD   ARG  58          1HD       ARG  58  10.131   6.606   3.505
  472   2HD   ARG  58          2HD       ARG  58  10.575   6.536   5.200
  473    HE   ARG  58           HE       ARG  58  12.838   5.773   3.594
  474   1HH1  ARG  58          1HH1      ARG  58  10.941   8.603   4.478
  475   2HH1  ARG  58          2HH1      ARG  58  12.251   9.712   4.243
  476   1HH2  ARG  58          1HH2      ARG  58  14.565   7.236   3.283
  477   2HH2  ARG  58          2HH2      ARG  58  14.326   8.930   3.558
  478    H    CYS  59           H        CYS  59   5.616   4.279   4.166
  479    HA   CYS  59           HA       CYS  59   5.110   3.135   6.755
  480   1HB   CYS  59          1HB       CYS  59   2.798   3.669   6.345
  481   2HB   CYS  59          2HB       CYS  59   3.813   5.053   5.991
  482    H    ASN  60           H        ASN  60   4.498   2.415   3.250
  483    HA   ASN  60           HA       ASN  60   3.827  -0.296   4.061
  484   1HB   ASN  60          1HB       ASN  60   2.705  -0.506   1.888
  485   2HB   ASN  60          2HB       ASN  60   2.153   0.974   2.647
  486   1HD2  ASN  60          1HD2      ASN  60   4.285  -0.418   0.233
  487   2HD2  ASN  60          2HD2      ASN  60   4.498   0.994  -0.746
  488   1H    HOH  61          1H        HOH  61  -0.854 -11.638   4.109
  489   2H    HOH  61          2H        HOH  61  -0.124 -10.887   3.016
  Start of MODEL    6
    1   1H    LEU   1           H1       LEU   1   7.032  12.805  -0.966
    2    HA   LEU   1           HA       LEU   1   6.828  11.038   0.428
    3   1HB   LEU   1          1HB       LEU   1   4.494  11.364  -1.330
    4   2HB   LEU   1          2HB       LEU   1   4.547   9.832  -0.480
    5    HG   LEU   1           HG       LEU   1   3.248  11.395   0.795
    6   1HD1  LEU   1          1HD1      LEU   1   5.554  10.075   1.801
    7   2HD1  LEU   1          2HD1      LEU   1   5.394  11.622   2.667
    8   3HD1  LEU   1          3HD1      LEU   1   4.038  10.469   2.646
    9   1HD2  LEU   1          1HD2      LEU   1   4.712  13.376  -0.256
   10   2HD2  LEU   1          2HD2      LEU   1   3.744  13.563   1.227
   11   3HD2  LEU   1          3HD2      LEU   1   5.495  13.263   1.340
   12    H    LYS   2           H        LYS   2   8.273   9.402   0.530
   13    HA   LYS   2           HA       LYS   2   8.222   7.470  -1.680
   14   1HB   LYS   2          1HB       LYS   2  10.509   7.901   0.248
   15   2HB   LYS   2          2HB       LYS   2  10.523   7.046  -1.282
   16   1HG   LYS   2          1HG       LYS   2  10.339   9.066  -2.553
   17   2HG   LYS   2          2HG       LYS   2   9.789   9.993  -1.170
   18   1HD   LYS   2          1HD       LYS   2  12.021   9.774  -0.103
   19   2HD   LYS   2          2HD       LYS   2  12.579   8.770  -1.427
   20   1HE   LYS   2          1HE       LYS   2  13.273  10.685  -2.439
   21   2HE   LYS   2          2HE       LYS   2  11.583  11.038  -2.741
   22   1HZ   LYS   2          1HZ       LYS   2  13.304  12.060  -0.643
   23   2HZ   LYS   2          2HZ       LYS   2  12.218  12.851  -1.571
   24   3HZ   LYS   2          3HZ       LYS   2  11.706  11.925  -0.326
   25    H    CYS   3           H        CYS   3   8.062   5.250  -1.224
   26    HA   CYS   3           HA       CYS   3   7.702   4.578   1.590
   27   1HB   CYS   3          1HB       CYS   3   5.680   4.312  -0.588
   28   2HB   CYS   3          2HB       CYS   3   5.791   3.020   0.592
   29    H    ASN   4           H        ASN   4   7.667   2.042   1.779
   30    HA   ASN   4           HA       ASN   4   9.909   1.130   0.303
   31   1HB   ASN   4          1HB       ASN   4   8.182  -0.664   2.041
   32   2HB   ASN   4          2HB       ASN   4   9.920  -0.706   1.826
   33   1HD2  ASN   4          1HD2      ASN   4   7.971  -0.387   4.157
   34   2HD2  ASN   4          2HD2      ASN   4   8.592   0.940   5.082
   35    H    LYS   5           H        LYS   5   9.761  -1.245  -0.666
   36    HA   LYS   5           HA       LYS   5   7.395  -1.299  -2.368
   37   1HB   LYS   5          1HB       LYS   5  10.004  -2.826  -2.614
   38   2HB   LYS   5          2HB       LYS   5   8.715  -2.771  -3.798
   39   1HG   LYS   5          1HG       LYS   5   9.455  -0.055  -3.057
   40   2HG   LYS   5          2HG       LYS   5  10.897  -0.945  -3.505
   41   1HD   LYS   5          1HD       LYS   5   9.733   0.205  -5.448
   42   2HD   LYS   5          2HD       LYS   5   9.993  -1.513  -5.678
   43   1HE   LYS   5          1HE       LYS   5   7.752  -1.962  -5.734
   44   2HE   LYS   5          2HE       LYS   5   7.425  -0.956  -4.337
   45   1HZ   LYS   5          1HZ       LYS   5   8.054   0.822  -6.256
   46   2HZ   LYS   5          2HZ       LYS   5   7.223  -0.309  -7.091
   47   3HZ   LYS   5          3HZ       LYS   5   6.537   0.421  -5.801
   48    H    LEU   6           H        LEU   6   7.730  -4.177  -2.971
   49    HA   LEU   6           HA       LEU   6   5.849  -5.257  -1.372
   50   1HB   LEU   6          1HB       LEU   6   7.267  -6.095  -3.483
   51   2HB   LEU   6          2HB       LEU   6   8.046  -7.058  -2.242
   52    HG   LEU   6           HG       LEU   6   5.751  -7.888  -1.571
   53   1HD1  LEU   6          1HD1      LEU   6   4.469  -7.437  -4.101
   54   2HD1  LEU   6          2HD1      LEU   6   3.907  -7.039  -2.459
   55   3HD1  LEU   6          3HD1      LEU   6   4.904  -5.876  -3.365
   56   1HD2  LEU   6          1HD2      LEU   6   5.644  -9.547  -3.340
   57   2HD2  LEU   6          2HD2      LEU   6   6.640  -8.519  -4.400
   58   3HD2  LEU   6          3HD2      LEU   6   7.339  -9.209  -2.915
   59    H    VAL   7           H        VAL   7   9.351  -4.939  -0.704
   60    HA   VAL   7           HA       VAL   7   8.755  -5.629   2.067
   61    HB   VAL   7           HB       VAL   7  10.718  -6.986   0.247
   62   1HG1  VAL   7          1HG1      VAL   7  11.819  -5.932   2.365
   63   2HG1  VAL   7          2HG1      VAL   7  10.966  -7.227   3.240
   64   3HG1  VAL   7          3HG1      VAL   7  12.143  -7.638   1.968
   65   1HG2  VAL   7          1HG2      VAL   7   9.833  -8.899   1.898
   66   2HG2  VAL   7          2HG2      VAL   7   8.464  -7.769   2.042
   67   3HG2  VAL   7          3HG2      VAL   7   8.934  -8.399   0.445
   68    HA   PRO   8           HA       PRO   8  11.013  -2.012   2.842
   69   1HB   PRO   8          1HB       PRO   8  12.059  -3.370   5.339
   70   2HB   PRO   8          2HB       PRO   8  11.142  -1.863   5.178
   71   1HG   PRO   8          1HG       PRO   8   9.878  -4.105   6.074
   72   2HG   PRO   8          2HG       PRO   8   9.049  -3.072   4.887
   73   1HD   PRO   8          1HD       PRO   8  10.638  -5.650   4.299
   74   2HD   PRO   8          2HD       PRO   8   8.975  -5.233   3.802
   75    H    ILE   9           H        ILE   9  12.693  -4.412   1.502
   76    HA   ILE   9           HA       ILE   9  15.335  -3.474   2.297
   77    HB   ILE   9           HB       ILE   9  15.083  -5.835   2.274
   78   1HG1  ILE   9          1HG1      ILE   9  16.774  -6.491   0.566
   79   2HG1  ILE   9          2HG1      ILE   9  16.625  -4.905  -0.165
   80   1HG2  ILE   9          1HG2      ILE   9  14.544  -7.000   0.053
   81   2HG2  ILE   9          2HG2      ILE   9  13.197  -6.277   0.965
   82   3HG2  ILE   9          3HG2      ILE   9  13.865  -5.434  -0.453
   83   1HD1  ILE   9          1HD1      ILE   9  17.022  -4.638   2.713
   84   2HD1  ILE   9          2HD1      ILE   9  18.308  -5.635   1.991
   85   3HD1  ILE   9          3HD1      ILE   9  18.006  -3.991   1.378
   86    H    ALA  10           H        ALA  10  12.857  -2.732   0.093
   87    HA   ALA  10           HA       ALA  10  14.685  -1.090  -1.415
   88   1HB   ALA  10          1HB       ALA  10  13.874  -3.648  -2.410
   89   2HB   ALA  10          2HB       ALA  10  13.023  -2.402  -3.356
   90   3HB   ALA  10          3HB       ALA  10  14.799  -2.379  -3.249
   91    H    TYR  11           H        TYR  11  13.728   0.874  -1.619
   92    HA   TYR  11           HA       TYR  11  10.786   0.914  -1.625
   93   1HB   TYR  11          1HB       TYR  11  11.051   2.983  -0.230
   94   2HB   TYR  11          2HB       TYR  11  11.874   1.647   0.551
   95    HD1  TYR  11           HD1      TYR  11  12.326   4.805  -1.289
   96    HD2  TYR  11           HD2      TYR  11  14.304   1.590   0.724
   97    HE1  TYR  11           HE1      TYR  11  14.479   6.156  -1.230
   98    HE2  TYR  11           HE2      TYR  11  16.450   2.951   0.777
   99    HH   TYR  11           HH       TYR  11  17.178   5.163   0.663
  100    H    LYS  12           H        LYS  12   9.806   2.710  -2.787
  101    HA   LYS  12           HA       LYS  12  11.648   4.138  -4.548
  102   1HB   LYS  12          1HB       LYS  12   9.544   2.183  -5.349
  103   2HB   LYS  12          2HB       LYS  12   9.669   3.650  -6.299
  104   1HG   LYS  12          1HG       LYS  12  12.352   2.811  -5.897
  105   2HG   LYS  12          2HG       LYS  12  11.465   1.337  -6.230
  106   1HD   LYS  12          1HD       LYS  12  10.551   3.410  -8.049
  107   2HD   LYS  12          2HD       LYS  12  12.302   3.348  -8.097
  108   1HE   LYS  12          1HE       LYS  12  12.155   0.836  -8.430
  109   2HE   LYS  12          2HE       LYS  12  10.411   0.982  -8.507
  110   1HZ   LYS  12          1HZ       LYS  12  11.099   1.095 -10.686
  111   2HZ   LYS  12          2HZ       LYS  12  10.880   2.671 -10.319
  112   3HZ   LYS  12          3HZ       LYS  12  12.388   2.047 -10.373
  113    H    THR  13           H        THR  13   9.792   5.582  -6.022
  114    HA   THR  13           HA       THR  13   8.538   7.152  -3.883
  115    HB   THR  13           HB       THR  13   9.877   7.703  -6.513
  116    HG1  THR  13           HG1      THR  13  10.853   8.316  -4.514
  117   1HG2  THR  13          1HG2      THR  13   8.699  10.075  -6.249
  118   2HG2  THR  13          2HG2      THR  13   7.891   8.800  -7.193
  119   3HG2  THR  13          3HG2      THR  13   7.386   9.123  -5.516
  120    H    CYS  14           H        CYS  14   6.378   7.746  -3.908
  121    HA   CYS  14           HA       CYS  14   4.668   5.879  -5.112
  122   1HB   CYS  14          1HB       CYS  14   4.112   8.526  -3.761
  123   2HB   CYS  14          2HB       CYS  14   2.861   7.420  -4.297
  124    HA   PRO  15           HA       PRO  15   5.007   7.726  -9.179
  125   1HB   PRO  15          1HB       PRO  15   2.846   6.169 -10.205
  126   2HB   PRO  15          2HB       PRO  15   4.562   5.731 -10.225
  127   1HG   PRO  15          1HG       PRO  15   2.355   4.949  -8.209
  128   2HG   PRO  15          2HG       PRO  15   3.673   3.962  -8.882
  129   1HD   PRO  15          1HD       PRO  15   3.932   4.959  -6.364
  130   2HD   PRO  15          2HD       PRO  15   5.345   4.871  -7.452
  131    H    GLU  16           H        GLU  16   3.477   8.602 -10.980
  132    HA   GLU  16           HA       GLU  16   2.160  10.781  -9.886
  133   1HB   GLU  16          1HB       GLU  16   2.055   9.588 -12.689
  134   2HB   GLU  16          2HB       GLU  16   1.371  11.146 -12.271
  135   1HG   GLU  16          1HG       GLU  16   4.231  10.649 -11.473
  136   2HG   GLU  16          2HG       GLU  16   3.907  10.871 -13.181
  137    H    GLY  17           H        GLY  17  -0.016  11.237  -9.465
  138   1HA   GLY  17          1HA       GLY  17  -2.305  10.865  -9.623
  139   2HA   GLY  17          2HA       GLY  17  -2.021   9.237 -10.204
  140    H    LYS  18           H        LYS  18   0.085   8.731  -8.061
  141    HA   LYS  18           HA       LYS  18  -1.822   8.309  -5.871
  142   1HB   LYS  18          1HB       LYS  18   0.724   6.752  -6.351
  143   2HB   LYS  18          2HB       LYS  18  -0.620   6.339  -5.308
  144   1HG   LYS  18          1HG       LYS  18  -2.093   5.960  -7.208
  145   2HG   LYS  18          2HG       LYS  18  -0.932   6.649  -8.325
  146   1HD   LYS  18          1HD       LYS  18   0.363   4.740  -8.386
  147   2HD   LYS  18          2HD       LYS  18   0.109   4.380  -6.690
  148   1HE   LYS  18          1HE       LYS  18  -2.380   3.851  -7.445
  149   2HE   LYS  18          2HE       LYS  18  -1.684   3.728  -9.048
  150   1HZ   LYS  18          1HZ       LYS  18   0.023   2.273  -7.676
  151   2HZ   LYS  18          2HZ       LYS  18  -1.312   2.012  -6.772
  152   3HZ   LYS  18          3HZ       LYS  18  -1.318   1.647  -8.364
  153    H    ASN  19           H        ASN  19  -1.573   9.582  -4.124
  154    HA   ASN  19           HA       ASN  19   1.072  10.746  -3.767
  155   1HB   ASN  19          1HB       ASN  19  -0.610  12.478  -4.056
  156   2HB   ASN  19          2HB       ASN  19  -1.722  11.681  -2.961
  157   1HD2  ASN  19          1HD2      ASN  19  -1.766  12.269  -0.920
  158   2HD2  ASN  19          2HD2      ASN  19  -0.586  13.227  -0.089
  159    H    LEU  20           H        LEU  20  -1.517   8.745  -2.429
  160    HA   LEU  20           HA       LEU  20  -0.230   8.733   0.197
  161   1HB   LEU  20          1HB       LEU  20  -2.909   7.626  -0.652
  162   2HB   LEU  20          2HB       LEU  20  -2.274   7.676   0.981
  163    HG   LEU  20           HG       LEU  20  -2.161  10.336   0.099
  164   1HD1  LEU  20          1HD1      LEU  20  -3.617  10.474  -1.596
  165   2HD1  LEU  20          2HD1      LEU  20  -4.334   8.884  -1.244
  166   3HD1  LEU  20          3HD1      LEU  20  -4.865  10.321  -0.336
  167   1HD2  LEU  20          1HD2      LEU  20  -4.430  10.211   1.640
  168   2HD2  LEU  20          2HD2      LEU  20  -3.563   8.729   2.112
  169   3HD2  LEU  20          3HD2      LEU  20  -2.761  10.311   2.252
  170    H    CYS  21           H        CYS  21  -0.030   6.539   1.272
  171    HA   CYS  21           HA       CYS  21   0.938   4.665  -0.747
  172   1HB   CYS  21          1HB       CYS  21   1.760   5.309   2.049
  173   2HB   CYS  21          2HB       CYS  21   1.991   3.669   1.478
  174    H    TYR  22           H        TYR  22   0.309   2.409  -0.582
  175    HA   TYR  22           HA       TYR  22  -1.851   1.870   1.326
  176   1HB   TYR  22          1HB       TYR  22  -3.284   1.289  -0.472
  177   2HB   TYR  22          2HB       TYR  22  -2.333   2.522  -1.276
  178    HD1  TYR  22           HD1      TYR  22  -3.161  -1.013  -1.135
  179    HD2  TYR  22           HD2      TYR  22  -0.458   1.851  -2.806
  180    HE1  TYR  22           HE1      TYR  22  -2.446  -2.704  -2.894
  181    HE2  TYR  22           HE2      TYR  22   0.249   0.151  -4.559
  182    HH   TYR  22           HH       TYR  22  -1.301  -2.194  -5.520
  183    H    LYS  23           H        LYS  23  -2.256  -0.485   1.625
  184    HA   LYS  23           HA       LYS  23  -0.262  -2.277   0.593
  185   1HB   LYS  23          1HB       LYS  23   0.549  -2.959   2.846
  186   2HB   LYS  23          2HB       LYS  23   1.064  -1.357   2.359
  187   1HG   LYS  23          1HG       LYS  23  -1.084  -0.524   3.636
  188   2HG   LYS  23          2HG       LYS  23  -1.071  -2.110   4.382
  189   1HD   LYS  23          1HD       LYS  23   0.440  -1.316   5.873
  190   2HD   LYS  23          2HD       LYS  23   1.610  -1.253   4.569
  191   1HE   LYS  23          1HE       LYS  23   1.587   1.019   4.563
  192   2HE   LYS  23          2HE       LYS  23  -0.157   1.057   4.393
  193   1HZ   LYS  23          1HZ       LYS  23   1.287   1.679   6.625
  194   2HZ   LYS  23          2HZ       LYS  23  -0.337   1.557   6.514
  195   3HZ   LYS  23          3HZ       LYS  23   0.548   0.270   6.991
  196    H    MET  24           H        MET  24  -1.310  -4.136   0.144
  197    HA   MET  24           HA       MET  24  -3.785  -4.582   1.613
  198   1HB   MET  24          1HB       MET  24  -2.784  -5.568  -1.115
  199   2HB   MET  24          2HB       MET  24  -4.295  -6.101  -0.401
  200   1HG   MET  24          1HG       MET  24  -5.244  -3.879  -0.493
  201   2HG   MET  24          2HG       MET  24  -3.686  -3.143  -0.813
  202   1HE   MET  24          1HE       MET  24  -4.525  -6.588  -2.519
  203   2HE   MET  24          2HE       MET  24  -6.102  -5.898  -2.068
  204   3HE   MET  24          3HE       MET  24  -5.661  -6.063  -3.785
  205    H    PHE  25           H        PHE  25  -4.071  -6.431   2.842
  206    HA   PHE  25           HA       PHE  25  -1.977  -8.471   2.600
  207   1HB   PHE  25          1HB       PHE  25  -3.389  -7.580   5.173
  208   2HB   PHE  25          2HB       PHE  25  -1.937  -8.553   5.056
  209    HD1  PHE  25           HD1      PHE  25  -0.437  -6.892   3.033
  210    HD2  PHE  25           HD2      PHE  25  -2.633  -5.792   6.492
  211    HE1  PHE  25           HE1      PHE  25   0.968  -4.825   3.267
  212    HE2  PHE  25           HE2      PHE  25  -1.229  -3.725   6.727
  213    HZ   PHE  25           HZ       PHE  25   0.555  -3.266   5.112
  214    H    MET  26           H        MET  26  -2.664 -10.616   3.587
  215    HA   MET  26           HA       MET  26  -5.339 -11.128   2.697
  216   1HB   MET  26          1HB       MET  26  -3.071 -12.897   3.760
  217   2HB   MET  26          2HB       MET  26  -4.613 -13.547   3.240
  218   1HG   MET  26          1HG       MET  26  -4.103 -12.145   1.017
  219   2HG   MET  26          2HG       MET  26  -2.446 -12.246   1.577
  220   1HE   MET  26          1HE       MET  26  -5.599 -13.812   0.677
  221   2HE   MET  26          2HE       MET  26  -5.178 -15.349  -0.116
  222   3HE   MET  26          3HE       MET  26  -5.438 -15.297   1.645
  223    H    MET  27           H        MET  27  -6.878 -12.465   4.023
  224    HA   MET  27           HA       MET  27  -7.234 -11.278   6.514
  225   1HB   MET  27          1HB       MET  27  -8.466 -13.562   4.948
  226   2HB   MET  27          2HB       MET  27  -8.891 -13.427   6.642
  227   1HG   MET  27          1HG       MET  27  -9.099 -11.060   4.729
  228   2HG   MET  27          2HG       MET  27 -10.418 -12.189   4.960
  229   1HE   MET  27          1HE       MET  27 -11.076  -8.950   6.035
  230   2HE   MET  27          2HE       MET  27  -9.697  -8.537   7.081
  231   3HE   MET  27          3HE       MET  27  -9.413  -9.139   5.431
  232    H    SER  28           H        SER  28  -5.732 -14.352   5.468
  233    HA   SER  28           HA       SER  28  -5.658 -15.457   8.048
  234   1HB   SER  28          1HB       SER  28  -5.514 -16.945   6.166
  235   2HB   SER  28          2HB       SER  28  -4.183 -16.051   5.458
  236    HG   SER  28           HG       SER  28  -3.983 -18.175   7.020
  237    H    ASP  29           H        ASP  29  -2.588 -15.254   6.277
  238    HA   ASP  29           HA       ASP  29  -1.301 -14.317   8.602
  239   1HB   ASP  29          1HB       ASP  29  -0.452 -15.838   6.597
  240   2HB   ASP  29          2HB       ASP  29  -0.047 -14.309   5.843
  241    H    LEU  30           H        LEU  30  -2.442 -12.196   8.865
  242    HA   LEU  30           HA       LEU  30  -2.262 -10.248   6.798
  243   1HB   LEU  30          1HB       LEU  30  -2.858  -9.743   9.705
  244   2HB   LEU  30          2HB       LEU  30  -3.354  -8.802   8.313
  245    HG   LEU  30           HG       LEU  30  -4.395 -11.426   7.951
  246   1HD1  LEU  30          1HD1      LEU  30  -5.925 -11.012  10.188
  247   2HD1  LEU  30          2HD1      LEU  30  -4.609 -12.202  10.038
  248   3HD1  LEU  30          3HD1      LEU  30  -4.290 -10.610  10.770
  249   1HD2  LEU  30          1HD2      LEU  30  -5.379  -9.405   7.044
  250   2HD2  LEU  30          2HD2      LEU  30  -6.562 -10.255   8.067
  251   3HD2  LEU  30          3HD2      LEU  30  -5.732  -8.806   8.683
  252    H    THR  31           H        THR  31  -0.068 -11.528   9.124
  253    HA   THR  31           HA       THR  31   1.462  -9.071   9.342
  254    HB   THR  31           HB       THR  31   1.212 -10.534  11.315
  255    HG1  THR  31           HG1      THR  31   3.824 -10.910  10.037
  256   1HG2  THR  31          1HG2      THR  31   2.500 -12.627   9.487
  257   2HG2  THR  31          2HG2      THR  31   2.423 -12.779  11.259
  258   3HG2  THR  31          3HG2      THR  31   0.921 -12.752  10.301
  259    H    ILE  32           H        ILE  32   0.939 -10.970   6.800
  260    HA   ILE  32           HA       ILE  32   3.696 -10.634   5.895
  261    HB   ILE  32           HB       ILE  32   2.211 -13.160   6.179
  262   1HG1  ILE  32          1HG1      ILE  32   5.164 -12.599   5.803
  263   2HG1  ILE  32          2HG1      ILE  32   4.349 -12.527   7.352
  264   1HG2  ILE  32          1HG2      ILE  32   1.975 -13.341   3.913
  265   2HG2  ILE  32          2HG2      ILE  32   3.382 -12.309   3.564
  266   3HG2  ILE  32          3HG2      ILE  32   3.622 -13.988   4.104
  267   1HD1  ILE  32          1HD1      ILE  32   4.160 -14.810   7.517
  268   2HD1  ILE  32          2HD1      ILE  32   3.827 -15.007   5.779
  269   3HD1  ILE  32          3HD1      ILE  32   5.501 -14.795   6.346
  270    HA   PRO  33           HA       PRO  33   0.780  -8.405   3.232
  271   1HB   PRO  33          1HB       PRO  33   3.472  -7.275   2.361
  272   2HB   PRO  33          2HB       PRO  33   1.952  -6.424   2.685
  273   1HG   PRO  33          1HG       PRO  33   3.935  -6.380   4.557
  274   2HG   PRO  33          2HG       PRO  33   2.255  -6.626   5.092
  275   1HD   PRO  33          1HD       PRO  33   4.425  -8.767   4.724
  276   2HD   PRO  33          2HD       PRO  33   3.263  -8.562   6.063
  277    H    VAL  34           H        VAL  34   0.257  -8.204   0.980
  278    HA   VAL  34           HA       VAL  34   1.655 -10.186  -0.683
  279    HB   VAL  34           HB       VAL  34  -0.439 -10.696  -1.715
  280   1HG1  VAL  34          1HG1      VAL  34  -1.311 -10.696   1.139
  281   2HG1  VAL  34          2HG1      VAL  34  -1.276 -12.018  -0.053
  282   3HG1  VAL  34          3HG1      VAL  34   0.227 -11.503   0.749
  283   1HG2  VAL  34          1HG2      VAL  34  -1.261  -8.153  -0.575
  284   2HG2  VAL  34          2HG2      VAL  34  -2.001  -9.107  -1.883
  285   3HG2  VAL  34          3HG2      VAL  34  -2.427  -9.442  -0.188
  286    H    LYS  35           H        LYS  35   0.200  -6.946  -0.368
  287    HA   LYS  35           HA       LYS  35   1.600  -6.216  -2.825
  288   1HB   LYS  35          1HB       LYS  35  -1.217  -5.271  -2.259
  289   2HB   LYS  35          2HB       LYS  35  -0.267  -5.026  -3.712
  290   1HG   LYS  35          1HG       LYS  35  -0.234  -7.796  -3.481
  291   2HG   LYS  35          2HG       LYS  35  -1.822  -7.408  -2.850
  292   1HD   LYS  35          1HD       LYS  35  -1.521  -5.768  -5.152
  293   2HD   LYS  35          2HD       LYS  35  -0.865  -7.326  -5.614
  294   1HE   LYS  35          1HE       LYS  35  -3.190  -8.026  -4.217
  295   2HE   LYS  35          2HE       LYS  35  -3.669  -6.562  -5.053
  296   1HZ   LYS  35          1HZ       LYS  35  -3.397  -9.070  -6.126
  297   2HZ   LYS  35          2HZ       LYS  35  -3.729  -7.686  -6.927
  298   3HZ   LYS  35          3HZ       LYS  35  -2.184  -8.191  -6.777
  299    H    ARG  36           H        ARG  36   2.540  -4.163  -2.772
  300    HA   ARG  36           HA       ARG  36   1.854  -2.454  -0.586
  301   1HB   ARG  36          1HB       ARG  36   4.458  -3.971  -0.751
  302   2HB   ARG  36          2HB       ARG  36   4.531  -2.313  -0.189
  303   1HG   ARG  36          1HG       ARG  36   2.309  -3.646   1.120
  304   2HG   ARG  36          2HG       ARG  36   3.742  -4.640   1.291
  305   1HD   ARG  36          1HD       ARG  36   4.400  -1.819   1.729
  306   2HD   ARG  36          2HD       ARG  36   3.089  -2.312   2.783
  307    HE   ARG  36           HE       ARG  36   5.854  -3.357   2.806
  308   1HH1  ARG  36          1HH1      ARG  36   2.550  -3.726   3.961
  309   2HH1  ARG  36          2HH1      ARG  36   2.998  -4.709   5.315
  310   1HH2  ARG  36          1HH2      ARG  36   6.445  -4.654   4.592
  311   2HH2  ARG  36          2HH2      ARG  36   5.228  -5.241   5.676
  312    H    GLY  37           H        GLY  37   1.567  -0.537  -1.689
  313   1HA   GLY  37          1HA       GLY  37   3.752   0.522  -3.264
  314   2HA   GLY  37          2HA       GLY  37   2.318   0.124  -4.190
  315    H    CYS  38           H        CYS  38   1.593   2.205  -4.693
  316    HA   CYS  38           HA       CYS  38   0.709   3.749  -2.373
  317   1HB   CYS  38          1HB       CYS  38   1.878   4.998  -4.864
  318   2HB   CYS  38          2HB       CYS  38   1.342   5.819  -3.411
  319    H    ILE  39           H        ILE  39  -1.098   5.333  -3.069
  320    HA   ILE  39           HA       ILE  39  -2.417   4.670  -5.538
  321    HB   ILE  39           HB       ILE  39  -3.040   2.883  -3.838
  322   1HG1  ILE  39          1HG1      ILE  39  -5.599   4.098  -4.611
  323   2HG1  ILE  39          2HG1      ILE  39  -4.430   4.067  -5.916
  324   1HG2  ILE  39          1HG2      ILE  39  -4.373   3.334  -2.023
  325   2HG2  ILE  39          2HG2      ILE  39  -3.319   4.769  -2.030
  326   3HG2  ILE  39          3HG2      ILE  39  -4.966   4.871  -2.695
  327   1HD1  ILE  39          1HD1      ILE  39  -5.557   1.969  -6.061
  328   2HD1  ILE  39          2HD1      ILE  39  -4.007   1.589  -5.275
  329   3HD1  ILE  39          3HD1      ILE  39  -5.490   1.721  -4.300
  330    H    ASP  40           H        ASP  40  -4.623   5.990  -5.573
  331    HA   ASP  40           HA       ASP  40  -3.867   8.605  -4.580
  332   1HB   ASP  40          1HB       ASP  40  -4.468   8.084  -7.056
  333   2HB   ASP  40          2HB       ASP  40  -6.127   7.933  -6.510
  334    H    VAL  41           H        VAL  41  -6.480   6.125  -4.642
  335    HA   VAL  41           HA       VAL  41  -7.819   7.613  -2.489
  336    HB   VAL  41           HB       VAL  41  -9.406   5.812  -4.229
  337   1HG1  VAL  41          1HG1      VAL  41 -10.239   8.586  -3.525
  338   2HG1  VAL  41          2HG1      VAL  41 -11.169   7.068  -3.514
  339   3HG1  VAL  41          3HG1      VAL  41 -10.043   7.433  -2.184
  340   1HG2  VAL  41          1HG2      VAL  41  -8.126   6.930  -5.945
  341   2HG2  VAL  41          2HG2      VAL  41  -9.760   7.635  -5.903
  342   3HG2  VAL  41          3HG2      VAL  41  -8.393   8.513  -5.176
  343    H    CYS  42           H        CYS  42  -8.634   6.356  -0.751
  344    HA   CYS  42           HA       CYS  42  -7.181   3.946  -0.351
  345   1HB   CYS  42          1HB       CYS  42  -7.951   5.797   1.345
  346   2HB   CYS  42          2HB       CYS  42  -9.417   4.840   1.434
  347    HA   PRO  43           HA       PRO  43 -10.395   1.672  -2.474
  348   1HB   PRO  43          1HB       PRO  43  -8.598  -0.671  -1.849
  349   2HB   PRO  43          2HB       PRO  43  -9.209  -0.106  -3.414
  350   1HG   PRO  43          1HG       PRO  43  -6.595   0.333  -2.741
  351   2HG   PRO  43          2HG       PRO  43  -7.513   1.627  -3.546
  352   1HD   PRO  43          1HD       PRO  43  -7.014   1.334  -0.513
  353   2HD   PRO  43          2HD       PRO  43  -6.679   2.741  -1.560
  354    H    LYS  44           H        LYS  44 -11.906  -0.150  -2.235
  355    HA   LYS  44           HA       LYS  44 -12.871  -0.266   0.451
  356   1HB   LYS  44          1HB       LYS  44 -13.903  -1.760  -1.971
  357   2HB   LYS  44          2HB       LYS  44 -14.769  -1.388  -0.495
  358   1HG   LYS  44          1HG       LYS  44 -15.389   0.630  -1.319
  359   2HG   LYS  44          2HG       LYS  44 -13.714   1.085  -1.556
  360   1HD   LYS  44          1HD       LYS  44 -13.707  -0.133  -3.753
  361   2HD   LYS  44          2HD       LYS  44 -15.392  -0.551  -3.517
  362   1HE   LYS  44          1HE       LYS  44 -14.372   2.327  -3.566
  363   2HE   LYS  44          2HE       LYS  44 -14.982   1.499  -4.985
  364   1HZ   LYS  44          1HZ       LYS  44 -16.434   2.731  -2.968
  365   2HZ   LYS  44          2HZ       LYS  44 -17.000   2.008  -4.319
  366   3HZ   LYS  44          3HZ       LYS  44 -16.817   1.143  -2.945
  367    H    ASN  45           H        ASN  45 -12.710  -1.909   1.935
  368    HA   ASN  45           HA       ASN  45 -10.757  -3.897   1.315
  369   1HB   ASN  45          1HB       ASN  45 -12.398  -3.723   3.881
  370   2HB   ASN  45          2HB       ASN  45 -10.788  -4.384   3.683
  371   1HD2  ASN  45          1HD2      ASN  45 -12.734  -1.513   3.931
  372   2HD2  ASN  45          2HD2      ASN  45 -11.464  -0.365   4.195
  373    H    SER  46           H        SER  46 -11.205  -6.265   1.674
  374    HA   SER  46           HA       SER  46 -14.043  -6.862   1.353
  375   1HB   SER  46          1HB       SER  46 -13.400  -8.745  -0.122
  376   2HB   SER  46          2HB       SER  46 -12.862  -7.212  -0.776
  377    HG   SER  46           HG       SER  46 -11.366  -9.369  -0.291
  378    H    LEU  47           H        LEU  47 -14.312  -9.450   1.779
  379    HA   LEU  47           HA       LEU  47 -13.289  -9.809   4.457
  380   1HB   LEU  47          1HB       LEU  47 -15.273 -11.367   2.798
  381   2HB   LEU  47          2HB       LEU  47 -14.831 -11.765   4.447
  382    HG   LEU  47           HG       LEU  47 -15.884  -9.022   3.818
  383   1HD1  LEU  47          1HD1      LEU  47 -17.344 -11.505   3.438
  384   2HD1  LEU  47          2HD1      LEU  47 -18.095 -10.478   4.683
  385   3HD1  LEU  47          3HD1      LEU  47 -17.807  -9.831   3.049
  386   1HD2  LEU  47          1HD2      LEU  47 -15.420 -10.694   6.208
  387   2HD2  LEU  47          2HD2      LEU  47 -15.385  -8.926   6.009
  388   3HD2  LEU  47          3HD2      LEU  47 -16.941  -9.767   6.202
  389    H    LEU  48           H        LEU  48 -11.824 -10.132   1.615
  390    HA   LEU  48           HA       LEU  48 -10.702 -12.770   2.254
  391   1HB   LEU  48          1HB       LEU  48 -10.652 -11.295  -0.381
  392   2HB   LEU  48          2HB       LEU  48 -10.033 -12.904  -0.068
  393    HG   LEU  48           HG       LEU  48 -12.749 -12.938   0.734
  394   1HD1  LEU  48          1HD1      LEU  48 -13.124 -10.893  -0.529
  395   2HD1  LEU  48          2HD1      LEU  48 -12.391 -11.628  -1.976
  396   3HD1  LEU  48          3HD1      LEU  48 -13.916 -12.275  -1.324
  397   1HD2  LEU  48          1HD2      LEU  48 -12.780 -14.834  -0.475
  398   2HD2  LEU  48          2HD2      LEU  48 -12.066 -14.062  -1.911
  399   3HD2  LEU  48          3HD2      LEU  48 -11.021 -14.573  -0.564
  400    H    VAL  49           H        VAL  49  -9.910  -9.411   1.148
  401    HA   VAL  49           HA       VAL  49  -7.340  -9.747   2.523
  402    HB   VAL  49           HB       VAL  49  -6.170  -8.720   0.778
  403   1HG1  VAL  49          1HG1      VAL  49  -7.462 -11.115   0.378
  404   2HG1  VAL  49          2HG1      VAL  49  -7.876 -10.212  -1.100
  405   3HG1  VAL  49          3HG1      VAL  49  -6.170 -10.454  -0.653
  406   1HG2  VAL  49          1HG2      VAL  49  -7.863  -6.943   0.324
  407   2HG2  VAL  49          2HG2      VAL  49  -7.151  -7.641  -1.151
  408   3HG2  VAL  49          3HG2      VAL  49  -8.788  -8.120  -0.640
  409    H    LYS  50           H        LYS  50  -6.415  -7.684   3.307
  410    HA   LYS  50           HA       LYS  50  -8.544  -5.706   3.744
  411   1HB   LYS  50          1HB       LYS  50  -7.959  -7.036   5.762
  412   2HB   LYS  50          2HB       LYS  50  -6.305  -6.475   5.639
  413   1HG   LYS  50          1HG       LYS  50  -6.952  -4.171   6.017
  414   2HG   LYS  50          2HG       LYS  50  -8.650  -4.536   5.786
  415   1HD   LYS  50          1HD       LYS  50  -8.668  -5.920   7.842
  416   2HD   LYS  50          2HD       LYS  50  -6.947  -5.671   8.054
  417   1HE   LYS  50          1HE       LYS  50  -8.121  -4.115   9.518
  418   2HE   LYS  50          2HE       LYS  50  -7.359  -3.187   8.242
  419   1HZ   LYS  50          1HZ       LYS  50 -10.179  -4.011   8.310
  420   2HZ   LYS  50          2HZ       LYS  50  -9.609  -2.499   8.543
  421   3HZ   LYS  50          3HZ       LYS  50  -9.478  -3.203   7.075
  422    H    TYR  51           H        TYR  51  -8.077  -3.555   3.348
  423    HA   TYR  51           HA       TYR  51  -5.432  -3.091   2.158
  424   1HB   TYR  51          1HB       TYR  51  -8.146  -1.638   1.985
  425   2HB   TYR  51          2HB       TYR  51  -6.729  -1.193   1.055
  426    HD1  TYR  51           HD1      TYR  51  -6.619  -1.930  -1.140
  427    HD2  TYR  51           HD2      TYR  51  -8.837  -4.238   1.698
  428    HE1  TYR  51           HE1      TYR  51  -7.339  -3.522  -2.987
  429    HE2  TYR  51           HE2      TYR  51  -9.550  -5.822  -0.157
  430    HH   TYR  51           HH       TYR  51  -9.843  -5.724  -2.592
  431    H    VAL  52           H        VAL  52  -4.120  -1.417   2.878
  432    HA   VAL  52           HA       VAL  52  -5.221   0.265   5.007
  433    HB   VAL  52           HB       VAL  52  -2.440  -0.826   5.209
  434   1HG1  VAL  52          1HG1      VAL  52  -4.503   0.202   7.179
  435   2HG1  VAL  52          2HG1      VAL  52  -2.963  -0.547   7.663
  436   3HG1  VAL  52          3HG1      VAL  52  -2.962   0.960   6.714
  437   1HG2  VAL  52          1HG2      VAL  52  -4.989  -2.305   5.820
  438   2HG2  VAL  52          2HG2      VAL  52  -3.489  -2.894   5.066
  439   3HG2  VAL  52          3HG2      VAL  52  -3.537  -2.569   6.815
  440    H    CYS  53           H        CYS  53  -4.773   2.401   4.711
  441    HA   CYS  53           HA       CYS  53  -2.829   2.996   2.606
  442   1HB   CYS  53          1HB       CYS  53  -5.078   4.760   3.589
  443   2HB   CYS  53          2HB       CYS  53  -4.026   5.051   2.219
  444    H    CYS  54           H        CYS  54  -1.618   5.139   2.980
  445    HA   CYS  54           HA       CYS  54  -1.481   6.038   5.691
  446   1HB   CYS  54          1HB       CYS  54   1.037   5.590   5.781
  447   2HB   CYS  54          2HB       CYS  54  -0.062   4.280   6.163
  448    H    ASN  55           H        ASN  55   0.137   7.923   5.810
  449    HA   ASN  55           HA       ASN  55   0.516   9.029   3.139
  450   1HB   ASN  55          1HB       ASN  55  -0.141  11.213   3.932
  451   2HB   ASN  55          2HB       ASN  55  -1.361  10.112   4.540
  452   1HD2  ASN  55          1HD2      ASN  55  -0.929   9.163   6.722
  453   2HD2  ASN  55          2HD2      ASN  55  -0.288  10.199   7.952
  454    H    THR  56           H        THR  56   2.003   7.706   5.773
  455    HA   THR  56           HA       THR  56   4.110   9.713   6.040
  456    HB   THR  56           HB       THR  56   4.834   8.015   7.858
  457    HG1  THR  56           HG1      THR  56   3.248   6.359   8.208
  458   1HG2  THR  56          1HG2      THR  56   2.216   9.524   7.830
  459   2HG2  THR  56          2HG2      THR  56   2.502   8.376   9.160
  460   3HG2  THR  56          3HG2      THR  56   3.622   9.735   8.900
  461    H    ASP  57           H        ASP  57   6.403   9.007   5.947
  462    HA   ASP  57           HA       ASP  57   6.786   7.683   3.487
  463   1HB   ASP  57          1HB       ASP  57   8.599   8.849   5.621
  464   2HB   ASP  57          2HB       ASP  57   9.292   7.904   4.319
  465    H    ARG  58           H        ARG  58   8.320   5.750   3.263
  466    HA   ARG  58           HA       ARG  58   8.503   3.597   3.640
  467   1HB   ARG  58          1HB       ARG  58   9.774   4.873   6.098
  468   2HB   ARG  58          2HB       ARG  58   9.881   3.146   5.826
  469   1HG   ARG  58          1HG       ARG  58  11.351   3.370   4.063
  470   2HG   ARG  58          2HG       ARG  58  10.571   4.816   3.454
  471   1HD   ARG  58          1HD       ARG  58  12.735   5.514   4.254
  472   2HD   ARG  58          2HD       ARG  58  11.577   6.089   5.437
  473    HE   ARG  58           HE       ARG  58  12.305   3.552   6.357
  474   1HH1  ARG  58          1HH1      ARG  58  14.021   6.524   5.582
  475   2HH1  ARG  58          2HH1      ARG  58  15.289   6.242   6.727
  476   1HH2  ARG  58          1HH2      ARG  58  13.978   3.178   7.868
  477   2HH2  ARG  58          2HH2      ARG  58  15.264   4.325   8.036
  478    H    CYS  59           H        CYS  59   5.859   4.357   4.298
  479    HA   CYS  59           HA       CYS  59   5.256   3.315   6.907
  480   1HB   CYS  59          1HB       CYS  59   2.963   3.863   6.394
  481   2HB   CYS  59          2HB       CYS  59   4.013   5.219   6.040
  482    H    ASN  60           H        ASN  60   4.693   2.472   3.417
  483    HA   ASN  60           HA       ASN  60   3.919  -0.181   4.307
  484   1HB   ASN  60          1HB       ASN  60   2.974  -0.461   2.041
  485   2HB   ASN  60          2HB       ASN  60   2.378   1.034   2.734
  486   1HD2  ASN  60          1HD2      ASN  60   4.428  -0.448   0.365
  487   2HD2  ASN  60          2HD2      ASN  60   4.806   0.961  -0.571
  488   1H    HOH  61          1H        HOH  61  -0.896 -12.536   4.152
  489   2H    HOH  61          2H        HOH  61  -0.292 -11.747   3.009
  Start of MODEL    7
    1   1H    LEU   1           H1       LEU   1   6.530  11.993  -2.236
    2    HA   LEU   1           HA       LEU   1   6.963  11.039   0.510
    3   1HB   LEU   1          1HB       LEU   1   4.515  11.352  -1.126
    4   2HB   LEU   1          2HB       LEU   1   4.642   9.864  -0.207
    5    HG   LEU   1           HG       LEU   1   3.404  11.495   1.060
    6   1HD1  LEU   1          1HD1      LEU   1   5.576  11.802   2.847
    7   2HD1  LEU   1          2HD1      LEU   1   4.299  10.562   2.860
    8   3HD1  LEU   1          3HD1      LEU   1   5.823  10.261   1.990
    9   1HD2  LEU   1          1HD2      LEU   1   3.819  13.650   0.676
   10   2HD2  LEU   1          2HD2      LEU   1   5.153  13.490   1.845
   11   3HD2  LEU   1          3HD2      LEU   1   5.472  13.320   0.102
   12    H    LYS   2           H        LYS   2   7.920   9.078   0.716
   13    HA   LYS   2           HA       LYS   2   7.893   7.354  -1.659
   14   1HB   LYS   2          1HB       LYS   2  10.266   8.019   0.108
   15   2HB   LYS   2          2HB       LYS   2  10.245   6.719  -1.067
   16   1HG   LYS   2          1HG       LYS   2  10.319   8.159  -2.880
   17   2HG   LYS   2          2HG       LYS   2   9.354   9.388  -2.086
   18   1HD   LYS   2          1HD       LYS   2  11.200  10.500  -1.360
   19   2HD   LYS   2          2HD       LYS   2  11.906   9.040  -0.695
   20   1HE   LYS   2          1HE       LYS   2  13.370   8.929  -2.422
   21   2HE   LYS   2          2HE       LYS   2  12.047   8.829  -3.566
   22   1HZ   LYS   2          1HZ       LYS   2  12.467  10.887  -4.170
   23   2HZ   LYS   2          2HZ       LYS   2  12.273  11.454  -2.651
   24   3HZ   LYS   2          3HZ       LYS   2  13.743  10.953  -3.154
   25    H    CYS   3           H        CYS   3   7.762   5.107  -1.250
   26    HA   CYS   3           HA       CYS   3   7.452   4.394   1.564
   27   1HB   CYS   3          1HB       CYS   3   5.450   3.987  -0.640
   28   2HB   CYS   3          2HB       CYS   3   5.538   2.857   0.697
   29    H    ASN   4           H        ASN   4   7.511   1.885   1.767
   30    HA   ASN   4           HA       ASN   4   9.757   1.005   0.323
   31   1HB   ASN   4          1HB       ASN   4   7.919  -0.815   1.931
   32   2HB   ASN   4          2HB       ASN   4   9.657  -0.935   1.741
   33   1HD2  ASN   4          1HD2      ASN   4   7.301  -0.181   3.837
   34   2HD2  ASN   4          2HD2      ASN   4   8.103   0.931   4.895
   35    H    LYS   5           H        LYS   5   9.669  -1.326  -0.751
   36    HA   LYS   5           HA       LYS   5   7.389  -1.318  -2.567
   37   1HB   LYS   5          1HB       LYS   5  10.107  -2.651  -2.713
   38   2HB   LYS   5          2HB       LYS   5   8.841  -2.870  -3.903
   39   1HG   LYS   5          1HG       LYS   5   9.444  -0.025  -3.220
   40   2HG   LYS   5          2HG       LYS   5  10.747  -0.884  -4.016
   41   1HD   LYS   5          1HD       LYS   5   9.426   0.086  -5.776
   42   2HD   LYS   5          2HD       LYS   5   9.061  -1.627  -5.790
   43   1HE   LYS   5          1HE       LYS   5   6.995  -0.229  -5.969
   44   2HE   LYS   5          2HE       LYS   5   6.971  -1.253  -4.547
   45   1HZ   LYS   5          1HZ       LYS   5   8.195   1.242  -4.021
   46   2HZ   LYS   5          2HZ       LYS   5   6.673   1.435  -4.582
   47   3HZ   LYS   5          3HZ       LYS   5   6.945   0.520  -3.255
   48    H    LEU   6           H        LEU   6   7.594  -4.098  -3.328
   49    HA   LEU   6           HA       LEU   6   5.729  -5.248  -1.763
   50   1HB   LEU   6          1HB       LEU   6   7.060  -5.952  -3.977
   51   2HB   LEU   6          2HB       LEU   6   7.837  -7.040  -2.843
   52    HG   LEU   6           HG       LEU   6   5.875  -7.983  -4.104
   53   1HD1  LEU   6          1HD1      LEU   6   6.561  -9.221  -2.243
   54   2HD1  LEU   6          2HD1      LEU   6   5.985  -7.992  -1.091
   55   3HD1  LEU   6          3HD1      LEU   6   4.815  -8.986  -1.992
   56   1HD2  LEU   6          1HD2      LEU   6   4.604  -5.657  -3.489
   57   2HD2  LEU   6          2HD2      LEU   6   3.788  -7.160  -3.983
   58   3HD2  LEU   6          3HD2      LEU   6   3.933  -6.752  -2.256
   59    H    VAL   7           H        VAL   7   9.242  -5.040  -1.158
   60    HA   VAL   7           HA       VAL   7   8.703  -6.078   1.525
   61    HB   VAL   7           HB       VAL   7  11.240  -6.781   0.094
   62   1HG1  VAL   7          1HG1      VAL   7  10.648  -8.887   1.667
   63   2HG1  VAL   7          2HG1      VAL   7  11.525  -7.452   2.249
   64   3HG1  VAL   7          3HG1      VAL   7   9.778  -7.610   2.551
   65   1HG2  VAL   7          1HG2      VAL   7   8.561  -8.145  -0.226
   66   2HG2  VAL   7          2HG2      VAL   7   9.712  -7.636  -1.484
   67   3HG2  VAL   7          3HG2      VAL   7  10.097  -9.020  -0.432
   68    HA   PRO   8           HA       PRO   8  10.663  -2.391   2.716
   69   1HB   PRO   8          1HB       PRO   8  11.617  -3.894   5.161
   70   2HB   PRO   8          2HB       PRO   8  10.607  -2.442   5.054
   71   1HG   PRO   8          1HG       PRO   8   9.452  -4.838   5.671
   72   2HG   PRO   8          2HG       PRO   8   8.629  -3.755   4.524
   73   1HD   PRO   8          1HD       PRO   8  10.438  -6.156   3.822
   74   2HD   PRO   8          2HD       PRO   8   8.778  -5.817   3.261
   75    H    ILE   9           H        ILE   9  12.589  -4.722   1.439
   76    HA   ILE   9           HA       ILE   9  15.094  -3.606   2.422
   77    HB   ILE   9           HB       ILE   9  14.206  -6.147   1.382
   78   1HG1  ILE   9          1HG1      ILE   9  16.770  -6.484   2.282
   79   2HG1  ILE   9          2HG1      ILE   9  16.307  -5.016   3.122
   80   1HG2  ILE   9          1HG2      ILE   9  15.173  -5.368  -0.729
   81   2HG2  ILE   9          2HG2      ILE   9  16.701  -4.995   0.102
   82   3HG2  ILE   9          3HG2      ILE   9  16.139  -6.680  -0.013
   83   1HD1  ILE   9          1HD1      ILE   9  14.743  -7.638   3.124
   84   2HD1  ILE   9          2HD1      ILE   9  15.705  -6.986   4.472
   85   3HD1  ILE   9          3HD1      ILE   9  14.229  -6.143   3.943
   86    H    ALA  10           H        ALA  10  12.746  -2.877   0.143
   87    HA   ALA  10           HA       ALA  10  14.617  -1.226  -1.300
   88   1HB   ALA  10          1HB       ALA  10  13.639  -2.111  -3.516
   89   2HB   ALA  10          2HB       ALA  10  14.842  -3.134  -2.694
   90   3HB   ALA  10          3HB       ALA  10  13.110  -3.527  -2.577
   91    H    TYR  11           H        TYR  11  13.673   0.742  -1.530
   92    HA   TYR  11           HA       TYR  11  10.735   0.797  -1.647
   93   1HB   TYR  11          1HB       TYR  11  10.925   2.800  -0.150
   94   2HB   TYR  11          2HB       TYR  11  11.702   1.429   0.617
   95    HD1  TYR  11           HD1      TYR  11  12.342   4.569  -1.261
   96    HD2  TYR  11           HD2      TYR  11  14.037   1.452   1.128
   97    HE1  TYR  11           HE1      TYR  11  14.488   5.909  -1.024
   98    HE2  TYR  11           HE2      TYR  11  16.178   2.803   1.358
   99    HH   TYR  11           HH       TYR  11  16.978   5.257  -0.596
  100    H    LYS  12           H        LYS  12   9.820   2.613  -2.809
  101    HA   LYS  12           HA       LYS  12  11.755   4.144  -4.373
  102   1HB   LYS  12          1HB       LYS  12   9.497   2.474  -5.507
  103   2HB   LYS  12          2HB       LYS  12  10.304   3.745  -6.403
  104   1HG   LYS  12          1HG       LYS  12  12.069   1.718  -5.059
  105   2HG   LYS  12          2HG       LYS  12  11.141   1.159  -6.436
  106   1HD   LYS  12          1HD       LYS  12  12.668   2.106  -7.815
  107   2HD   LYS  12          2HD       LYS  12  12.200   3.685  -7.215
  108   1HE   LYS  12          1HE       LYS  12  13.816   3.317  -5.258
  109   2HE   LYS  12          2HE       LYS  12  14.375   1.871  -6.074
  110   1HZ   LYS  12          1HZ       LYS  12  15.218   4.418  -6.524
  111   2HZ   LYS  12          2HZ       LYS  12  15.580   3.104  -7.423
  112   3HZ   LYS  12          3HZ       LYS  12  14.323   4.059  -7.842
  113    H    THR  13           H        THR  13  10.204   5.771  -5.819
  114    HA   THR  13           HA       THR  13   8.754   7.215  -3.752
  115    HB   THR  13           HB       THR  13   9.182   8.151  -6.605
  116    HG1  THR  13           HG1      THR  13  11.393   8.425  -6.068
  117   1HG2  THR  13          1HG2      THR  13   8.186   9.472  -4.457
  118   2HG2  THR  13          2HG2      THR  13   9.919   9.682  -4.112
  119   3HG2  THR  13          3HG2      THR  13   9.237  10.284  -5.643
  120    H    CYS  14           H        CYS  14   6.604   8.028  -4.014
  121    HA   CYS  14           HA       CYS  14   4.892   6.056  -5.087
  122   1HB   CYS  14          1HB       CYS  14   4.339   8.807  -3.963
  123   2HB   CYS  14          2HB       CYS  14   3.090   7.679  -4.448
  124    HA   PRO  15           HA       PRO  15   5.401   7.586  -9.267
  125   1HB   PRO  15          1HB       PRO  15   3.242   5.995 -10.245
  126   2HB   PRO  15          2HB       PRO  15   4.949   5.525 -10.176
  127   1HG   PRO  15          1HG       PRO  15   2.663   4.938  -8.181
  128   2HG   PRO  15          2HG       PRO  15   3.981   3.879  -8.735
  129   1HD   PRO  15          1HD       PRO  15   4.183   5.056  -6.291
  130   2HD   PRO  15          2HD       PRO  15   5.627   4.863  -7.323
  131    H    GLU  16           H        GLU  16   4.103   8.515 -11.121
  132    HA   GLU  16           HA       GLU  16   2.686  10.699 -10.193
  133   1HB   GLU  16          1HB       GLU  16   2.845   9.474 -12.980
  134   2HB   GLU  16          2HB       GLU  16   2.141  11.043 -12.646
  135   1HG   GLU  16          1HG       GLU  16   4.693  11.003 -11.342
  136   2HG   GLU  16          2HG       GLU  16   4.943  10.335 -12.943
  137    H    GLY  17           H        GLY  17   0.480  11.172  -9.999
  138   1HA   GLY  17          1HA       GLY  17  -1.786  10.782 -10.460
  139   2HA   GLY  17          2HA       GLY  17  -1.433   9.111 -10.849
  140    H    LYS  18           H        LYS  18   0.425   8.903  -8.410
  141    HA   LYS  18           HA       LYS  18  -1.728   8.377  -6.519
  142   1HB   LYS  18          1HB       LYS  18   1.152   7.435  -6.637
  143   2HB   LYS  18          2HB       LYS  18   0.031   7.030  -5.352
  144   1HG   LYS  18          1HG       LYS  18  -0.264   5.195  -6.769
  145   2HG   LYS  18          2HG       LYS  18  -1.548   6.244  -7.333
  146   1HD   LYS  18          1HD       LYS  18   0.782   7.033  -8.779
  147   2HD   LYS  18          2HD       LYS  18   0.798   5.281  -8.775
  148   1HE   LYS  18          1HE       LYS  18  -1.700   5.410  -9.478
  149   2HE   LYS  18          2HE       LYS  18  -1.420   7.113  -9.780
  150   1HZ   LYS  18          1HZ       LYS  18   0.244   6.559 -11.354
  151   2HZ   LYS  18          2HZ       LYS  18   0.189   4.969 -10.981
  152   3HZ   LYS  18          3HZ       LYS  18  -1.083   5.679 -11.721
  153    H    ASN  19           H        ASN  19  -1.317   8.882  -4.173
  154    HA   ASN  19           HA       ASN  19   0.485  11.111  -3.826
  155   1HB   ASN  19          1HB       ASN  19  -1.573  12.292  -4.323
  156   2HB   ASN  19          2HB       ASN  19  -2.532  11.184  -3.361
  157   1HD2  ASN  19          1HD2      ASN  19  -1.154  14.163  -3.453
  158   2HD2  ASN  19          2HD2      ASN  19  -1.053  14.544  -1.767
  159    H    LEU  20           H        LEU  20  -1.990   8.838  -2.471
  160    HA   LEU  20           HA       LEU  20  -0.614   8.932   0.108
  161   1HB   LEU  20          1HB       LEU  20  -3.347   7.971  -0.730
  162   2HB   LEU  20          2HB       LEU  20  -2.666   7.651   0.853
  163    HG   LEU  20           HG       LEU  20  -2.704  10.493  -0.043
  164   1HD1  LEU  20          1HD1      LEU  20  -5.238   9.563   1.178
  165   2HD1  LEU  20          2HD1      LEU  20  -4.933  10.846  -0.017
  166   3HD1  LEU  20          3HD1      LEU  20  -4.985   9.142  -0.532
  167   1HD2  LEU  20          1HD2      LEU  20  -2.580  10.960   2.159
  168   2HD2  LEU  20          2HD2      LEU  20  -3.694   9.648   2.617
  169   3HD2  LEU  20          3HD2      LEU  20  -1.989   9.284   2.262
  170    H    CYS  21           H        CYS  21  -0.353   6.771   1.247
  171    HA   CYS  21           HA       CYS  21   0.594   4.854  -0.742
  172   1HB   CYS  21          1HB       CYS  21   1.491   5.600   2.007
  173   2HB   CYS  21          2HB       CYS  21   1.745   3.951   1.471
  174    H    TYR  22           H        TYR  22  -0.004   2.604  -0.505
  175    HA   TYR  22           HA       TYR  22  -2.105   2.097   1.481
  176   1HB   TYR  22          1HB       TYR  22  -3.484   1.214  -0.288
  177   2HB   TYR  22          2HB       TYR  22  -2.769   2.626  -1.038
  178    HD1  TYR  22           HD1      TYR  22  -0.954   2.385  -2.709
  179    HD2  TYR  22           HD2      TYR  22  -2.904  -1.026  -1.013
  180    HE1  TYR  22           HE1      TYR  22  -0.026   0.920  -4.569
  181    HE2  TYR  22           HE2      TYR  22  -1.969  -2.478  -2.879
  182    HH   TYR  22           HH       TYR  22   0.525  -1.703  -4.687
  183    H    LYS  23           H        LYS  23  -2.030   0.081   2.453
  184    HA   LYS  23           HA       LYS  23  -0.098  -1.816   1.337
  185   1HB   LYS  23          1HB       LYS  23   0.545  -2.308   3.764
  186   2HB   LYS  23          2HB       LYS  23   1.195  -0.855   3.030
  187   1HG   LYS  23          1HG       LYS  23  -0.936   0.329   4.041
  188   2HG   LYS  23          2HG       LYS  23  -1.053  -1.095   5.057
  189   1HD   LYS  23          1HD       LYS  23   1.600   0.351   4.831
  190   2HD   LYS  23          2HD       LYS  23   0.349   1.009   5.867
  191   1HE   LYS  23          1HE       LYS  23   0.233  -1.549   6.728
  192   2HE   LYS  23          2HE       LYS  23   1.886  -1.569   6.143
  193   1HZ   LYS  23          1HZ       LYS  23   2.502  -0.393   7.883
  194   2HZ   LYS  23          2HZ       LYS  23   1.392   0.774   7.612
  195   3HZ   LYS  23          3HZ       LYS  23   0.999  -0.534   8.507
  196    H    MET  24           H        MET  24  -1.304  -3.525   0.710
  197    HA   MET  24           HA       MET  24  -3.673  -4.109   2.269
  198   1HB   MET  24          1HB       MET  24  -2.739  -5.476  -0.303
  199   2HB   MET  24          2HB       MET  24  -4.374  -5.396   0.322
  200   1HG   MET  24          1HG       MET  24  -4.291  -2.862   0.008
  201   2HG   MET  24          2HG       MET  24  -2.739  -3.062  -0.781
  202   1HE   MET  24          1HE       MET  24  -5.231  -2.176  -3.527
  203   2HE   MET  24          2HE       MET  24  -6.322  -2.395  -2.139
  204   3HE   MET  24          3HE       MET  24  -4.751  -1.586  -1.918
  205    H    PHE  25           H        PHE  25  -4.157  -6.354   2.939
  206    HA   PHE  25           HA       PHE  25  -1.861  -8.132   2.995
  207   1HB   PHE  25          1HB       PHE  25  -3.472  -7.154   5.429
  208   2HB   PHE  25          2HB       PHE  25  -2.229  -8.388   5.500
  209    HD1  PHE  25           HD1      PHE  25  -2.676  -4.839   4.429
  210    HD2  PHE  25           HD2      PHE  25  -0.081  -7.763   6.080
  211    HE1  PHE  25           HE1      PHE  25  -0.940  -3.071   4.833
  212    HE2  PHE  25           HE2      PHE  25   1.653  -5.995   6.486
  213    HZ   PHE  25           HZ       PHE  25   1.203  -3.670   5.857
  214    H    MET  26           H        MET  26  -2.441 -10.299   2.937
  215    HA   MET  26           HA       MET  26  -5.159 -10.811   2.355
  216   1HB   MET  26          1HB       MET  26  -2.721 -12.629   2.778
  217   2HB   MET  26          2HB       MET  26  -4.269 -13.221   2.208
  218   1HG   MET  26          1HG       MET  26  -4.095 -12.095   0.134
  219   2HG   MET  26          2HG       MET  26  -2.979 -10.897   0.757
  220   1HE   MET  26          1HE       MET  26  -2.414 -13.432  -2.031
  221   2HE   MET  26          2HE       MET  26  -2.318 -14.906  -1.037
  222   3HE   MET  26          3HE       MET  26  -3.742 -13.845  -0.921
  223    H    MET  27           H        MET  27  -6.519 -12.468   3.459
  224    HA   MET  27           HA       MET  27  -6.639 -11.956   6.188
  225   1HB   MET  27          1HB       MET  27  -7.973 -13.837   4.223
  226   2HB   MET  27          2HB       MET  27  -8.218 -14.154   5.929
  227   1HG   MET  27          1HG       MET  27  -8.602 -11.325   4.933
  228   2HG   MET  27          2HG       MET  27  -9.847 -12.506   4.575
  229   1HE   MET  27          1HE       MET  27  -9.661 -14.366   7.687
  230   2HE   MET  27          2HE       MET  27 -11.293 -13.656   7.717
  231   3HE   MET  27          3HE       MET  27 -10.578 -14.177   6.173
  232    H    SER  28           H        SER  28  -5.159 -14.583   4.270
  233    HA   SER  28           HA       SER  28  -4.843 -16.371   6.372
  234   1HB   SER  28          1HB       SER  28  -4.579 -17.254   4.192
  235   2HB   SER  28          2HB       SER  28  -3.494 -15.972   3.693
  236    HG   SER  28           HG       SER  28  -2.715 -17.742   5.816
  237    H    ASP  29           H        ASP  29  -1.942 -15.045   4.717
  238    HA   ASP  29           HA       ASP  29  -0.562 -14.979   7.170
  239   1HB   ASP  29          1HB       ASP  29   0.291 -15.341   4.696
  240   2HB   ASP  29          2HB       ASP  29   0.355 -13.592   4.630
  241    H    LEU  30           H        LEU  30  -2.243 -13.405   8.185
  242    HA   LEU  30           HA       LEU  30  -2.288 -10.728   7.218
  243   1HB   LEU  30          1HB       LEU  30  -3.327 -12.127   9.669
  244   2HB   LEU  30          2HB       LEU  30  -3.414 -10.384   9.508
  245    HG   LEU  30           HG       LEU  30  -4.528 -12.148   7.341
  246   1HD1  LEU  30          1HD1      LEU  30  -5.440 -12.971   9.494
  247   2HD1  LEU  30          2HD1      LEU  30  -6.052 -11.333   9.829
  248   3HD1  LEU  30          3HD1      LEU  30  -6.674 -12.248   8.435
  249   1HD2  LEU  30          1HD2      LEU  30  -5.540 -10.285   6.564
  250   2HD2  LEU  30          2HD2      LEU  30  -5.840  -9.629   8.192
  251   3HD2  LEU  30          3HD2      LEU  30  -4.229  -9.472   7.451
  252    H    THR  31           H        THR  31   0.088 -12.562   8.747
  253    HA   THR  31           HA       THR  31   1.067 -10.420  10.440
  254    HB   THR  31           HB       THR  31   1.356 -13.319  10.169
  255    HG1  THR  31           HG1      THR  31   0.984 -12.550  12.232
  256   1HG2  THR  31          1HG2      THR  31   3.577 -13.115   9.312
  257   2HG2  THR  31          2HG2      THR  31   3.863 -11.590  10.184
  258   3HG2  THR  31          3HG2      THR  31   3.822 -13.132  11.075
  259    H    ILE  32           H        ILE  32   1.389 -11.533   7.149
  260    HA   ILE  32           HA       ILE  32   3.520  -9.553   6.815
  261    HB   ILE  32           HB       ILE  32   3.612 -12.007   5.144
  262   1HG1  ILE  32          1HG1      ILE  32   4.547 -11.934   8.027
  263   2HG1  ILE  32          2HG1      ILE  32   3.309 -12.975   7.353
  264   1HG2  ILE  32          1HG2      ILE  32   6.028 -11.560   5.259
  265   2HG2  ILE  32          2HG2      ILE  32   5.108 -10.151   4.678
  266   3HG2  ILE  32          3HG2      ILE  32   5.716 -10.190   6.351
  267   1HD1  ILE  32          1HD1      ILE  32   5.148 -13.804   5.705
  268   2HD1  ILE  32          2HD1      ILE  32   6.297 -13.023   6.816
  269   3HD1  ILE  32          3HD1      ILE  32   5.253 -14.341   7.399
  270    HA   PRO  33           HA       PRO  33   0.647  -7.892   3.994
  271   1HB   PRO  33          1HB       PRO  33   2.521  -6.491   2.390
  272   2HB   PRO  33          2HB       PRO  33   1.800  -5.903   3.898
  273   1HG   PRO  33          1HG       PRO  33   4.534  -7.254   3.420
  274   2HG   PRO  33          2HG       PRO  33   4.106  -5.918   4.515
  275   1HD   PRO  33          1HD       PRO  33   4.411  -8.472   5.497
  276   2HD   PRO  33          2HD       PRO  33   3.246  -7.323   6.208
  277    H    VAL  34           H        VAL  34   0.106  -7.532   1.623
  278    HA   VAL  34           HA       VAL  34   1.114  -9.782   0.023
  279    HB   VAL  34           HB       VAL  34  -1.063 -10.345   0.866
  280   1HG1  VAL  34          1HG1      VAL  34  -2.703  -8.345  -0.427
  281   2HG1  VAL  34          2HG1      VAL  34  -2.669  -8.852   1.279
  282   3HG1  VAL  34          3HG1      VAL  34  -1.569  -7.574   0.707
  283   1HG2  VAL  34          1HG2      VAL  34  -2.361 -10.423  -1.338
  284   2HG2  VAL  34          2HG2      VAL  34  -0.993  -9.534  -2.049
  285   3HG2  VAL  34          3HG2      VAL  34  -0.733 -11.143  -1.336
  286    H    LYS  35           H        LYS  35  -0.112  -6.428   0.225
  287    HA   LYS  35           HA       LYS  35   1.189  -5.937  -2.344
  288   1HB   LYS  35          1HB       LYS  35  -1.533  -4.784  -1.715
  289   2HB   LYS  35          2HB       LYS  35  -0.654  -4.724  -3.230
  290   1HG   LYS  35          1HG       LYS  35  -0.766  -7.448  -2.822
  291   2HG   LYS  35          2HG       LYS  35  -2.260  -6.950  -2.054
  292   1HD   LYS  35          1HD       LYS  35  -3.136  -6.018  -4.058
  293   2HD   LYS  35          2HD       LYS  35  -1.555  -5.869  -4.797
  294   1HE   LYS  35          1HE       LYS  35  -1.969  -8.657  -4.179
  295   2HE   LYS  35          2HE       LYS  35  -3.415  -8.071  -4.977
  296   1HZ   LYS  35          1HZ       LYS  35  -1.474  -8.862  -6.387
  297   2HZ   LYS  35          2HZ       LYS  35  -2.221  -7.480  -6.832
  298   3HZ   LYS  35          3HZ       LYS  35  -0.784  -7.419  -6.058
  299    H    ARG  36           H        ARG  36   2.289  -3.981  -2.442
  300    HA   ARG  36           HA       ARG  36   1.797  -2.100  -0.330
  301   1HB   ARG  36          1HB       ARG  36   4.382  -3.657  -0.665
  302   2HB   ARG  36          2HB       ARG  36   4.442  -2.023  -0.036
  303   1HG   ARG  36          1HG       ARG  36   2.617  -2.784   1.656
  304   2HG   ARG  36          2HG       ARG  36   2.988  -4.420   1.151
  305   1HD   ARG  36          1HD       ARG  36   5.212  -4.320   1.997
  306   2HD   ARG  36          2HD       ARG  36   5.237  -2.568   2.001
  307    HE   ARG  36           HE       ARG  36   3.158  -3.489   3.763
  308   1HH1  ARG  36          1HH1      ARG  36   6.664  -3.284   3.547
  309   2HH1  ARG  36          2HH1      ARG  36   6.894  -3.232   5.262
  310   1HH2  ARG  36          1HH2      ARG  36   3.461  -3.422   6.027
  311   2HH2  ARG  36          2HH2      ARG  36   5.060  -3.312   6.683
  312    H    GLY  37           H        GLY  37   1.715  -0.114  -1.333
  313   1HA   GLY  37          1HA       GLY  37   3.744   0.827  -3.058
  314   2HA   GLY  37          2HA       GLY  37   2.374   0.292  -4.011
  315    H    CYS  38           H        CYS  38   2.109   2.583  -4.648
  316    HA   CYS  38           HA       CYS  38   0.808   4.114  -2.512
  317   1HB   CYS  38          1HB       CYS  38   2.196   5.284  -4.926
  318   2HB   CYS  38          2HB       CYS  38   1.533   6.147  -3.552
  319    H    ILE  39           H        ILE  39  -1.031   5.499  -3.313
  320    HA   ILE  39           HA       ILE  39  -2.043   4.928  -5.937
  321    HB   ILE  39           HB       ILE  39  -2.658   2.950  -4.439
  322   1HG1  ILE  39          1HG1      ILE  39  -5.217   3.969  -5.453
  323   2HG1  ILE  39          2HG1      ILE  39  -3.902   4.158  -6.598
  324   1HG2  ILE  39          1HG2      ILE  39  -4.004   3.171  -2.661
  325   2HG2  ILE  39          2HG2      ILE  39  -3.473   4.869  -2.676
  326   3HG2  ILE  39          3HG2      ILE  39  -5.011   4.411  -3.446
  327   1HD1  ILE  39          1HD1      ILE  39  -4.764   1.575  -5.222
  328   2HD1  ILE  39          2HD1      ILE  39  -4.902   1.969  -6.952
  329   3HD1  ILE  39          3HD1      ILE  39  -3.298   1.722  -6.221
  330    H    ASP  40           H        ASP  40  -4.180   6.156  -6.267
  331    HA   ASP  40           HA       ASP  40  -3.774   8.729  -5.123
  332   1HB   ASP  40          1HB       ASP  40  -4.380   8.616  -7.463
  333   2HB   ASP  40          2HB       ASP  40  -5.746   7.570  -7.133
  334    H    VAL  41           H        VAL  41  -6.322   6.142  -5.178
  335    HA   VAL  41           HA       VAL  41  -7.478   7.382  -2.779
  336    HB   VAL  41           HB       VAL  41  -9.229   5.826  -4.597
  337   1HG1  VAL  41          1HG1      VAL  41  -9.830   6.982  -2.364
  338   2HG1  VAL  41          2HG1      VAL  41  -9.784   8.496  -3.300
  339   3HG1  VAL  41          3HG1      VAL  41 -10.924   7.205  -3.750
  340   1HG2  VAL  41          1HG2      VAL  41  -8.319   8.645  -5.270
  341   2HG2  VAL  41          2HG2      VAL  41  -7.994   7.175  -6.220
  342   3HG2  VAL  41          3HG2      VAL  41  -9.662   7.773  -6.050
  343    H    CYS  42           H        CYS  42  -7.662   6.034  -1.041
  344    HA   CYS  42           HA       CYS  42  -6.498   3.469  -1.243
  345   1HB   CYS  42          1HB       CYS  42  -6.674   5.197   0.754
  346   2HB   CYS  42          2HB       CYS  42  -8.125   4.287   1.126
  347    HA   PRO  43           HA       PRO  43 -10.271   1.477  -2.383
  348   1HB   PRO  43          1HB       PRO  43  -8.862  -1.122  -2.030
  349   2HB   PRO  43          2HB       PRO  43  -9.417  -0.340  -3.521
  350   1HG   PRO  43          1HG       PRO  43  -6.724  -0.517  -2.909
  351   2HG   PRO  43          2HG       PRO  43  -7.378   0.923  -3.724
  352   1HD   PRO  43          1HD       PRO  43  -6.918   0.587  -0.685
  353   2HD   PRO  43          2HD       PRO  43  -6.255   1.844  -1.764
  354    H    LYS  44           H        LYS  44 -11.893  -0.221  -1.836
  355    HA   LYS  44           HA       LYS  44 -12.455  -0.094   0.960
  356   1HB   LYS  44          1HB       LYS  44 -13.893  -1.371  -1.382
  357   2HB   LYS  44          2HB       LYS  44 -14.504  -1.386   0.260
  358   1HG   LYS  44          1HG       LYS  44 -14.989   0.886   0.258
  359   2HG   LYS  44          2HG       LYS  44 -13.642   1.286  -0.789
  360   1HD   LYS  44          1HD       LYS  44 -14.830   0.780  -2.754
  361   2HD   LYS  44          2HD       LYS  44 -15.894  -0.356  -1.949
  362   1HE   LYS  44          1HE       LYS  44 -17.402   1.272  -1.372
  363   2HE   LYS  44          2HE       LYS  44 -16.148   2.397  -0.887
  364   1HZ   LYS  44          1HZ       LYS  44 -16.942   1.825  -3.659
  365   2HZ   LYS  44          2HZ       LYS  44 -17.301   3.177  -2.819
  366   3HZ   LYS  44          3HZ       LYS  44 -15.752   2.854  -3.221
  367    H    ASN  45           H        ASN  45 -12.580  -1.826   2.458
  368    HA   ASN  45           HA       ASN  45 -10.669  -3.862   1.884
  369   1HB   ASN  45          1HB       ASN  45 -12.427  -3.623   4.374
  370   2HB   ASN  45          2HB       ASN  45 -10.873  -4.422   4.248
  371   1HD2  ASN  45          1HD2      ASN  45 -12.357  -1.796   5.411
  372   2HD2  ASN  45          2HD2      ASN  45 -11.080  -0.626   5.409
  373    H    SER  46           H        SER  46 -11.172  -6.201   2.015
  374    HA   SER  46           HA       SER  46 -14.019  -6.731   1.655
  375   1HB   SER  46          1HB       SER  46 -13.350  -8.589   0.124
  376   2HB   SER  46          2HB       SER  46 -12.862  -7.016  -0.475
  377    HG   SER  46           HG       SER  46 -11.295  -9.122  -0.142
  378    H    LEU  47           H        LEU  47 -14.356  -9.322   1.960
  379    HA   LEU  47           HA       LEU  47 -13.390  -9.832   4.631
  380   1HB   LEU  47          1HB       LEU  47 -15.367 -11.256   2.847
  381   2HB   LEU  47          2HB       LEU  47 -14.952 -11.778   4.468
  382    HG   LEU  47           HG       LEU  47 -16.032  -9.011   3.925
  383   1HD1  LEU  47          1HD1      LEU  47 -17.980 -10.931   4.959
  384   2HD1  LEU  47          2HD1      LEU  47 -18.137  -9.708   3.675
  385   3HD1  LEU  47          3HD1      LEU  47 -17.439 -11.303   3.305
  386   1HD2  LEU  47          1HD2      LEU  47 -14.885  -9.602   6.113
  387   2HD2  LEU  47          2HD2      LEU  47 -16.530  -8.934   6.230
  388   3HD2  LEU  47          3HD2      LEU  47 -16.262 -10.682   6.431
  389    H    LEU  48           H        LEU  48 -11.871 -10.043   1.803
  390    HA   LEU  48           HA       LEU  48 -10.783 -12.715   2.357
  391   1HB   LEU  48          1HB       LEU  48 -10.694 -11.152  -0.227
  392   2HB   LEU  48          2HB       LEU  48 -10.089 -12.775   0.038
  393    HG   LEU  48           HG       LEU  48 -12.938 -12.449   0.709
  394   1HD1  LEU  48          1HD1      LEU  48 -12.300 -10.957  -1.423
  395   2HD1  LEU  48          2HD1      LEU  48 -12.477 -12.536  -2.225
  396   3HD1  LEU  48          3HD1      LEU  48 -13.829 -11.858  -1.286
  397   1HD2  LEU  48          1HD2      LEU  48 -11.275 -14.547   0.272
  398   2HD2  LEU  48          2HD2      LEU  48 -13.047 -14.622   0.136
  399   3HD2  LEU  48          3HD2      LEU  48 -12.051 -14.402  -1.323
  400    H    VAL  49           H        VAL  49  -9.919  -9.354   1.291
  401    HA   VAL  49           HA       VAL  49  -7.397  -9.728   2.743
  402    HB   VAL  49           HB       VAL  49  -6.171  -8.687   1.028
  403   1HG1  VAL  49          1HG1      VAL  49  -7.746 -11.033   0.476
  404   2HG1  VAL  49          2HG1      VAL  49  -7.469 -10.135  -1.035
  405   3HG1  VAL  49          3HG1      VAL  49  -6.087 -10.645  -0.036
  406   1HG2  VAL  49          1HG2      VAL  49  -7.829  -6.936   0.465
  407   2HG2  VAL  49          2HG2      VAL  49  -7.130  -7.701  -0.982
  408   3HG2  VAL  49          3HG2      VAL  49  -8.770  -8.141  -0.447
  409    H    LYS  50           H        LYS  50  -6.498  -7.732   3.635
  410    HA   LYS  50           HA       LYS  50  -8.600  -5.711   3.995
  411   1HB   LYS  50          1HB       LYS  50  -7.964  -7.103   6.005
  412   2HB   LYS  50          2HB       LYS  50  -6.366  -6.391   5.925
  413   1HG   LYS  50          1HG       LYS  50  -7.411  -4.100   6.086
  414   2HG   LYS  50          2HG       LYS  50  -8.986  -4.853   6.248
  415   1HD   LYS  50          1HD       LYS  50  -7.217  -6.107   8.152
  416   2HD   LYS  50          2HD       LYS  50  -7.013  -4.373   8.299
  417   1HE   LYS  50          1HE       LYS  50  -9.789  -5.613   8.187
  418   2HE   LYS  50          2HE       LYS  50  -8.905  -5.522   9.697
  419   1HZ   LYS  50          1HZ       LYS  50  -8.691  -3.046   8.564
  420   2HZ   LYS  50          2HZ       LYS  50 -10.250  -3.476   8.330
  421   3HZ   LYS  50          3HZ       LYS  50  -9.623  -3.461   9.838
  422    H    TYR  51           H        TYR  51  -7.968  -3.476   3.995
  423    HA   TYR  51           HA       TYR  51  -5.329  -3.042   2.764
  424   1HB   TYR  51          1HB       TYR  51  -8.050  -1.645   2.368
  425   2HB   TYR  51          2HB       TYR  51  -6.576  -1.177   1.544
  426    HD1  TYR  51           HD1      TYR  51  -5.713  -4.225   1.188
  427    HD2  TYR  51           HD2      TYR  51  -9.227  -1.973   0.247
  428    HE1  TYR  51           HE1      TYR  51  -6.255  -5.845  -0.695
  429    HE2  TYR  51           HE2      TYR  51  -9.759  -3.602  -1.632
  430    HH   TYR  51           HH       TYR  51  -9.057  -6.259  -1.962
  431    H    VAL  52           H        VAL  52  -4.186  -1.154   3.386
  432    HA   VAL  52           HA       VAL  52  -5.424   0.401   5.534
  433    HB   VAL  52           HB       VAL  52  -2.943  -1.248   5.613
  434   1HG1  VAL  52          1HG1      VAL  52  -1.781   0.704   6.005
  435   2HG1  VAL  52          2HG1      VAL  52  -3.191   1.535   6.704
  436   3HG1  VAL  52          3HG1      VAL  52  -2.321   0.308   7.654
  437   1HG2  VAL  52          1HG2      VAL  52  -5.411  -1.208   6.951
  438   2HG2  VAL  52          2HG2      VAL  52  -3.986  -2.201   7.342
  439   3HG2  VAL  52          3HG2      VAL  52  -4.221  -0.627   8.142
  440    H    CYS  53           H        CYS  53  -5.054   2.588   5.375
  441    HA   CYS  53           HA       CYS  53  -3.508   3.391   3.049
  442   1HB   CYS  53          1HB       CYS  53  -5.242   5.173   4.750
  443   2HB   CYS  53          2HB       CYS  53  -4.677   5.446   3.114
  444    H    CYS  54           H        CYS  54  -2.040   5.340   3.312
  445    HA   CYS  54           HA       CYS  54  -1.252   6.085   5.927
  446   1HB   CYS  54          1HB       CYS  54   1.103   5.258   5.725
  447   2HB   CYS  54          2HB       CYS  54  -0.106   4.042   6.088
  448    H    ASN  55           H        ASN  55  -0.313   8.133   5.759
  449    HA   ASN  55           HA       ASN  55   0.251   8.975   3.032
  450   1HB   ASN  55          1HB       ASN  55   0.079  11.336   4.230
  451   2HB   ASN  55          2HB       ASN  55  -1.391  10.455   3.864
  452   1HD2  ASN  55          1HD2      ASN  55   1.110  10.717   6.383
  453   2HD2  ASN  55          2HD2      ASN  55   0.056  10.604   7.754
  454    H    THR  56           H        THR  56   1.826   7.752   5.655
  455    HA   THR  56           HA       THR  56   3.982   9.724   5.729
  456    HB   THR  56           HB       THR  56   4.673   8.485   7.724
  457    HG1  THR  56           HG1      THR  56   4.220   6.324   7.594
  458   1HG2  THR  56          1HG2      THR  56   2.848   8.897   9.118
  459   2HG2  THR  56          2HG2      THR  56   2.283   9.784   7.682
  460   3HG2  THR  56          3HG2      THR  56   1.695   8.132   7.996
  461    H    ASP  57           H        ASP  57   6.270   8.835   5.709
  462    HA   ASP  57           HA       ASP  57   6.528   7.426   3.264
  463   1HB   ASP  57          1HB       ASP  57   8.480   8.547   5.310
  464   2HB   ASP  57          2HB       ASP  57   9.053   7.596   3.954
  465    H    ARG  58           H        ARG  58   8.085   5.459   3.129
  466    HA   ARG  58           HA       ARG  58   8.222   3.319   3.581
  467   1HB   ARG  58          1HB       ARG  58   9.389   4.588   6.103
  468   2HB   ARG  58          2HB       ARG  58   9.559   2.880   5.752
  469   1HG   ARG  58          1HG       ARG  58  10.465   3.724   3.405
  470   2HG   ARG  58          2HG       ARG  58  10.711   5.243   4.243
  471   1HD   ARG  58          1HD       ARG  58  11.697   2.869   5.744
  472   2HD   ARG  58          2HD       ARG  58  12.516   3.133   4.218
  473    HE   ARG  58           HE       ARG  58  12.377   5.663   5.454
  474   1HH1  ARG  58          1HH1      ARG  58  13.800   2.525   6.168
  475   2HH1  ARG  58          2HH1      ARG  58  15.104   3.185   7.097
  476   1HH2  ARG  58          1HH2      ARG  58  14.098   6.535   6.679
  477   2HH2  ARG  58          2HH2      ARG  58  15.275   5.481   7.390
  478    H    CYS  59           H        CYS  59   5.572   4.199   4.157
  479    HA   CYS  59           HA       CYS  59   4.874   3.192   6.757
  480   1HB   CYS  59          1HB       CYS  59   2.621   3.842   6.212
  481   2HB   CYS  59          2HB       CYS  59   3.734   5.150   5.857
  482    H    ASN  60           H        ASN  60   4.351   2.373   3.257
  483    HA   ASN  60           HA       ASN  60   3.384  -0.220   4.109
  484   1HB   ASN  60          1HB       ASN  60   2.705  -0.470   1.699
  485   2HB   ASN  60          2HB       ASN  60   2.004   0.958   2.433
  486   1HD2  ASN  60          1HD2      ASN  60   4.741  -0.202   0.512
  487   2HD2  ASN  60          2HD2      ASN  60   5.004   1.242  -0.409
  488   1H    HOH  61          1H        HOH  61  -0.926 -11.564   4.024
  489   2H    HOH  61          2H        HOH  61   0.161 -11.151   3.055
  Start of MODEL    8
    1   1H    LEU   1           H1       LEU   1   5.371  12.655  -1.008
    2    HA   LEU   1           HA       LEU   1   6.451  11.066   0.508
    3   1HB   LEU   1          1HB       LEU   1   3.686  10.759  -0.526
    4   2HB   LEU   1          2HB       LEU   1   4.297   9.467   0.488
    5    HG   LEU   1           HG       LEU   1   2.989  11.250   1.674
    6   1HD1  LEU   1          1HD1      LEU   1   4.679  11.489   3.557
    7   2HD1  LEU   1          2HD1      LEU   1   4.307   9.833   3.022
    8   3HD1  LEU   1          3HD1      LEU   1   5.822  10.614   2.509
    9   1HD2  LEU   1          1HD2      LEU   1   3.908  13.159   0.358
   10   2HD2  LEU   1          2HD2      LEU   1   3.959  13.398   2.122
   11   3HD2  LEU   1          3HD2      LEU   1   5.444  12.969   1.238
   12    H    LYS   2           H        LYS   2   7.511   9.114   0.778
   13    HA   LYS   2           HA       LYS   2   7.483   7.338  -1.558
   14   1HB   LYS   2          1HB       LYS   2   9.934   8.045   0.078
   15   2HB   LYS   2          2HB       LYS   2   9.871   6.999  -1.327
   16   1HG   LYS   2          1HG       LYS   2  10.464   8.929  -2.434
   17   2HG   LYS   2          2HG       LYS   2   8.734   9.210  -2.421
   18   1HD   LYS   2          1HD       LYS   2   8.882  10.916  -0.884
   19   2HD   LYS   2          2HD       LYS   2  10.119  10.104   0.055
   20   1HE   LYS   2          1HE       LYS   2  11.852  11.075  -1.124
   21   2HE   LYS   2          2HE       LYS   2  11.000  11.003  -2.653
   22   1HZ   LYS   2          1HZ       LYS   2  10.228  12.865  -0.524
   23   2HZ   LYS   2          2HZ       LYS   2  11.315  13.254  -1.677
   24   3HZ   LYS   2          3HZ       LYS   2   9.777  12.899  -2.093
   25    H    CYS   3           H        CYS   3   7.537   5.106  -1.116
   26    HA   CYS   3           HA       CYS   3   7.563   4.397   1.712
   27   1HB   CYS   3          1HB       CYS   3   5.315   4.004  -0.211
   28   2HB   CYS   3          2HB       CYS   3   5.654   2.718   0.929
   29    H    ASN   4           H        ASN   4   7.573   1.799   1.787
   30    HA   ASN   4           HA       ASN   4   9.803   1.056   0.239
   31   1HB   ASN   4          1HB       ASN   4   8.051  -0.904   1.772
   32   2HB   ASN   4          2HB       ASN   4   9.787  -0.958   1.544
   33   1HD2  ASN   4          1HD2      ASN   4   7.629  -0.626   3.821
   34   2HD2  ASN   4          2HD2      ASN   4   8.356   0.520   4.898
   35    H    LYS   5           H        LYS   5   9.827  -0.936  -1.206
   36    HA   LYS   5           HA       LYS   5   7.351  -1.055  -2.744
   37   1HB   LYS   5          1HB       LYS   5  10.205  -1.836  -3.396
   38   2HB   LYS   5          2HB       LYS   5   8.846  -2.147  -4.457
   39   1HG   LYS   5          1HG       LYS   5   9.210   0.657  -3.396
   40   2HG   LYS   5          2HG       LYS   5  10.292   0.106  -4.660
   41   1HD   LYS   5          1HD       LYS   5   8.473   1.104  -5.833
   42   2HD   LYS   5          2HD       LYS   5   8.182  -0.619  -5.967
   43   1HE   LYS   5          1HE       LYS   5   6.336  -0.568  -4.557
   44   2HE   LYS   5          2HE       LYS   5   6.985   0.725  -3.569
   45   1HZ   LYS   5          1HZ       LYS   5   5.074   1.123  -5.279
   46   2HZ   LYS   5          2HZ       LYS   5   6.178   2.283  -4.961
   47   3HZ   LYS   5          3HZ       LYS   5   6.317   1.370  -6.308
   48    H    LEU   6           H        LEU   6   7.614  -3.558  -3.954
   49    HA   LEU   6           HA       LEU   6   6.316  -5.215  -2.269
   50   1HB   LEU   6          1HB       LEU   6   7.072  -5.324  -4.827
   51   2HB   LEU   6          2HB       LEU   6   8.237  -6.456  -4.171
   52    HG   LEU   6           HG       LEU   6   5.674  -7.130  -3.099
   53   1HD1  LEU   6          1HD1      LEU   6   4.281  -6.401  -4.699
   54   2HD1  LEU   6          2HD1      LEU   6   5.591  -6.161  -5.879
   55   3HD1  LEU   6          3HD1      LEU   6   4.903  -7.784  -5.632
   56   1HD2  LEU   6          1HD2      LEU   6   6.103  -9.269  -4.156
   57   2HD2  LEU   6          2HD2      LEU   6   7.363  -8.543  -5.182
   58   3HD2  LEU   6          3HD2      LEU   6   7.596  -8.640  -3.420
   59    H    VAL   7           H        VAL   7   9.899  -4.993  -2.730
   60    HA   VAL   7           HA       VAL   7  10.215  -6.787  -0.448
   61    HB   VAL   7           HB       VAL   7  12.460  -5.686  -2.095
   62   1HG1  VAL   7          1HG1      VAL   7  12.195  -8.533  -1.200
   63   2HG1  VAL   7          2HG1      VAL   7  13.645  -7.514  -1.358
   64   3HG1  VAL   7          3HG1      VAL   7  12.540  -7.284   0.019
   65   1HG2  VAL   7          1HG2      VAL   7  10.268  -7.418  -3.074
   66   2HG2  VAL   7          2HG2      VAL   7  11.419  -6.399  -3.971
   67   3HG2  VAL   7          3HG2      VAL   7  11.913  -8.011  -3.403
   68    HA   PRO   8           HA       PRO   8  10.496  -3.031   1.912
   69   1HB   PRO   8          1HB       PRO   8  10.986  -5.036   4.132
   70   2HB   PRO   8          2HB       PRO   8   9.811  -3.712   4.050
   71   1HG   PRO   8          1HG       PRO   8   8.963  -6.280   3.694
   72   2HG   PRO   8          2HG       PRO   8   8.326  -5.010   2.624
   73   1HD   PRO   8          1HD       PRO   8  10.625  -6.969   2.005
   74   2HD   PRO   8          2HD       PRO   8   9.182  -6.599   1.022
   75    H    ILE   9           H        ILE   9  13.121  -4.587   0.800
   76    HA   ILE   9           HA       ILE   9  14.981  -3.568   2.798
   77    HB   ILE   9           HB       ILE   9  15.479  -5.758   2.143
   78   1HG1  ILE   9          1HG1      ILE   9  17.394  -4.444   0.286
   79   2HG1  ILE   9          2HG1      ILE   9  17.304  -3.781   1.905
   80   1HG2  ILE   9          1HG2      ILE   9  14.557  -4.867  -0.508
   81   2HG2  ILE   9          2HG2      ILE   9  15.965  -5.955  -0.536
   82   3HG2  ILE   9          3HG2      ILE   9  14.463  -6.463   0.273
   83   1HD1  ILE   9          1HD1      ILE   9  18.973  -5.508   1.986
   84   2HD1  ILE   9          2HD1      ILE   9  17.534  -6.189   2.781
   85   3HD1  ILE   9          3HD1      ILE   9  17.930  -6.654   1.109
   86    H    ALA  10           H        ALA  10  13.265  -2.470   0.102
   87    HA   ALA  10           HA       ALA  10  15.015  -0.190  -0.105
   88   1HB   ALA  10          1HB       ALA  10  15.150  -2.357  -2.013
   89   2HB   ALA  10          2HB       ALA  10  14.497  -0.905  -2.807
   90   3HB   ALA  10          3HB       ALA  10  16.071  -0.834  -1.979
   91    H    TYR  11           H        TYR  11  13.853   1.663  -0.637
   92    HA   TYR  11           HA       TYR  11  11.026   1.204  -1.318
   93   1HB   TYR  11          1HB       TYR  11  10.611   3.164   0.187
   94   2HB   TYR  11          2HB       TYR  11  11.491   1.933   1.072
   95    HD1  TYR  11           HD1      TYR  11  13.985   2.209   1.421
   96    HD2  TYR  11           HD2      TYR  11  11.528   5.339  -0.150
   97    HE1  TYR  11           HE1      TYR  11  15.780   3.916   1.994
   98    HE2  TYR  11           HE2      TYR  11  13.331   7.035   0.428
   99    HH   TYR  11           HH       TYR  11  15.228   7.112   2.196
  100    H    LYS  12           H        LYS  12   9.984   2.971  -2.522
  101    HA   LYS  12           HA       LYS  12  11.879   4.776  -3.823
  102   1HB   LYS  12          1HB       LYS  12  10.009   2.856  -5.233
  103   2HB   LYS  12          2HB       LYS  12  10.712   4.257  -6.015
  104   1HG   LYS  12          1HG       LYS  12  13.013   3.397  -5.339
  105   2HG   LYS  12          2HG       LYS  12  12.242   1.944  -4.738
  106   1HD   LYS  12          1HD       LYS  12  11.167   1.784  -7.133
  107   2HD   LYS  12          2HD       LYS  12  12.401   2.935  -7.605
  108   1HE   LYS  12          1HE       LYS  12  13.382   0.606  -6.007
  109   2HE   LYS  12          2HE       LYS  12  12.763   0.208  -7.597
  110   1HZ   LYS  12          1HZ       LYS  12  14.474   2.501  -7.538
  111   2HZ   LYS  12          2HZ       LYS  12  15.215   1.107  -7.124
  112   3HZ   LYS  12          3HZ       LYS  12  14.464   1.233  -8.569
  113    H    THR  13           H        THR  13  10.203   6.136  -5.500
  114    HA   THR  13           HA       THR  13   8.485   7.463  -3.579
  115    HB   THR  13           HB       THR  13   8.765   8.305  -6.463
  116    HG1  THR  13           HG1      THR  13  10.791   8.502  -4.349
  117   1HG2  THR  13          1HG2      THR  13   9.515  10.029  -4.125
  118   2HG2  THR  13          2HG2      THR  13   8.582  10.446  -5.583
  119   3HG2  THR  13          3HG2      THR  13   7.796   9.581  -4.240
  120    H    CYS  14           H        CYS  14   6.248   7.943  -3.929
  121    HA   CYS  14           HA       CYS  14   4.863   5.679  -4.903
  122   1HB   CYS  14          1HB       CYS  14   3.888   8.374  -3.941
  123   2HB   CYS  14          2HB       CYS  14   2.832   7.044  -4.369
  124    HA   PRO  15           HA       PRO  15   4.912   6.805  -9.175
  125   1HB   PRO  15          1HB       PRO  15   2.546   5.355  -9.841
  126   2HB   PRO  15          2HB       PRO  15   4.201   4.724  -9.839
  127   1HG   PRO  15          1HG       PRO  15   2.026   4.547  -7.653
  128   2HG   PRO  15          2HG       PRO  15   3.206   3.324  -8.178
  129   1HD   PRO  15          1HD       PRO  15   3.670   4.725  -5.884
  130   2HD   PRO  15          2HD       PRO  15   5.017   4.264  -6.961
  131    H    GLU  16           H        GLU  16   3.576   7.699 -11.010
  132    HA   GLU  16           HA       GLU  16   2.444  10.085 -10.207
  133   1HB   GLU  16          1HB       GLU  16   2.449   8.562 -12.833
  134   2HB   GLU  16          2HB       GLU  16   1.618  10.098 -12.687
  135   1HG   GLU  16          1HG       GLU  16   3.570  11.282 -12.696
  136   2HG   GLU  16          2HG       GLU  16   4.321  10.216 -11.524
  137    H    GLY  17           H        GLY  17   0.262  10.856 -10.157
  138   1HA   GLY  17          1HA       GLY  17  -2.028  10.663 -10.272
  139   2HA   GLY  17          2HA       GLY  17  -1.890   8.950 -10.617
  140    H    LYS  18           H        LYS  18   0.114   8.609  -8.317
  141    HA   LYS  18           HA       LYS  18  -1.927   8.342  -6.264
  142   1HB   LYS  18          1HB       LYS  18   0.835   7.164  -6.634
  143   2HB   LYS  18          2HB       LYS  18  -0.072   6.988  -5.145
  144   1HG   LYS  18          1HG       LYS  18  -0.739   5.063  -6.296
  145   2HG   LYS  18          2HG       LYS  18  -2.030   6.168  -6.726
  146   1HD   LYS  18          1HD       LYS  18  -0.218   6.747  -8.711
  147   2HD   LYS  18          2HD       LYS  18   0.168   5.062  -8.424
  148   1HE   LYS  18          1HE       LYS  18  -1.849   4.311  -9.256
  149   2HE   LYS  18          2HE       LYS  18  -2.752   5.648  -8.570
  150   1HZ   LYS  18          1HZ       LYS  18  -1.041   6.638 -10.528
  151   2HZ   LYS  18          2HZ       LYS  18  -1.856   5.374 -11.165
  152   3HZ   LYS  18          3HZ       LYS  18  -2.675   6.632 -10.519
  153    H    ASN  19           H        ASN  19  -1.212   8.828  -3.939
  154    HA   ASN  19           HA       ASN  19   0.664  11.022  -3.850
  155   1HB   ASN  19          1HB       ASN  19  -1.423  12.231  -4.129
  156   2HB   ASN  19          2HB       ASN  19  -2.271  11.170  -3.023
  157   1HD2  ASN  19          1HD2      ASN  19  -2.886  12.455  -1.433
  158   2HD2  ASN  19          2HD2      ASN  19  -1.861  13.454  -0.459
  159    H    LEU  20           H        LEU  20  -1.652   8.792  -2.192
  160    HA   LEU  20           HA       LEU  20   0.003   8.918   0.217
  161   1HB   LEU  20          1HB       LEU  20  -2.682   7.588  -0.054
  162   2HB   LEU  20          2HB       LEU  20  -1.849   8.080   1.407
  163    HG   LEU  20           HG       LEU  20  -2.123  10.479   0.084
  164   1HD1  LEU  20          1HD1      LEU  20  -3.523   9.931  -1.652
  165   2HD1  LEU  20          2HD1      LEU  20  -4.361   8.661  -0.729
  166   3HD1  LEU  20          3HD1      LEU  20  -4.704  10.376  -0.397
  167   1HD2  LEU  20          1HD2      LEU  20  -2.516  10.351   2.393
  168   2HD2  LEU  20          2HD2      LEU  20  -4.087  10.806   1.691
  169   3HD2  LEU  20          3HD2      LEU  20  -3.793   9.126   2.202
  170    H    CYS  21           H        CYS  21  -0.075   6.584   1.395
  171    HA   CYS  21           HA       CYS  21   1.048   4.792  -0.613
  172   1HB   CYS  21          1HB       CYS  21   1.490   5.145   2.335
  173   2HB   CYS  21          2HB       CYS  21   1.875   3.617   1.567
  174    H    TYR  22           H        TYR  22   0.303   2.591  -0.740
  175    HA   TYR  22           HA       TYR  22  -2.029   1.953   0.917
  176   1HB   TYR  22          1HB       TYR  22  -2.945   2.737  -1.204
  177   2HB   TYR  22          2HB       TYR  22  -1.626   2.034  -2.119
  178    HD1  TYR  22           HD1      TYR  22  -3.630   0.313   0.510
  179    HD2  TYR  22           HD2      TYR  22  -2.829   0.710  -3.673
  180    HE1  TYR  22           HE1      TYR  22  -5.049  -1.743   0.036
  181    HE2  TYR  22           HE2      TYR  22  -4.250  -1.347  -4.134
  182    HH   TYR  22           HH       TYR  22  -5.553  -2.853  -3.302
  183    H    LYS  23           H        LYS  23  -2.112  -0.169   1.597
  184    HA   LYS  23           HA       LYS  23  -0.242  -2.021   0.314
  185   1HB   LYS  23          1HB       LYS  23   0.310  -2.889   2.615
  186   2HB   LYS  23          2HB       LYS  23   0.977  -1.319   2.217
  187   1HG   LYS  23          1HG       LYS  23  -1.606  -0.823   3.343
  188   2HG   LYS  23          2HG       LYS  23  -0.853  -2.033   4.364
  189   1HD   LYS  23          1HD       LYS  23   1.228  -0.203   3.860
  190   2HD   LYS  23          2HD       LYS  23  -0.183   0.819   4.043
  191   1HE   LYS  23          1HE       LYS  23  -0.714  -0.499   6.194
  192   2HE   LYS  23          2HE       LYS  23   0.869  -1.234   6.038
  193   1HZ   LYS  23          1HZ       LYS  23   1.282   1.442   5.725
  194   2HZ   LYS  23          2HZ       LYS  23   0.207   1.341   6.952
  195   3HZ   LYS  23          3HZ       LYS  23   1.634   0.551   7.048
  196    H    MET  24           H        MET  24  -0.797  -4.343   0.816
  197    HA   MET  24           HA       MET  24  -3.603  -4.615   1.519
  198   1HB   MET  24          1HB       MET  24  -2.178  -5.727  -0.957
  199   2HB   MET  24          2HB       MET  24  -3.736  -6.326  -0.422
  200   1HG   MET  24          1HG       MET  24  -4.851  -4.498  -1.235
  201   2HG   MET  24          2HG       MET  24  -3.671  -3.375  -0.590
  202   1HE   MET  24          1HE       MET  24  -3.455  -6.449  -2.915
  203   2HE   MET  24          2HE       MET  24  -4.743  -5.525  -3.725
  204   3HE   MET  24          3HE       MET  24  -3.162  -5.733  -4.518
  205    H    PHE  25           H        PHE  25  -4.005  -6.341   2.878
  206    HA   PHE  25           HA       PHE  25  -1.872  -8.345   3.084
  207   1HB   PHE  25          1HB       PHE  25  -3.627  -7.200   5.332
  208   2HB   PHE  25          2HB       PHE  25  -2.241  -8.253   5.539
  209    HD1  PHE  25           HD1      PHE  25  -0.397  -6.835   3.563
  210    HD2  PHE  25           HD2      PHE  25  -2.910  -5.379   6.657
  211    HE1  PHE  25           HE1      PHE  25   1.088  -4.829   3.825
  212    HE2  PHE  25           HE2      PHE  25  -1.424  -3.373   6.920
  213    HZ   PHE  25           HZ       PHE  25   0.557  -3.121   5.501
  214    H    MET  26           H        MET  26  -2.543 -10.496   3.447
  215    HA   MET  26           HA       MET  26  -5.182 -11.025   2.591
  216   1HB   MET  26          1HB       MET  26  -3.017 -12.866   3.754
  217   2HB   MET  26          2HB       MET  26  -4.447 -13.421   2.907
  218   1HG   MET  26          1HG       MET  26  -3.642 -11.942   0.918
  219   2HG   MET  26          2HG       MET  26  -2.114 -11.826   1.768
  220   1HE   MET  26          1HE       MET  26  -3.998 -15.626  -0.006
  221   2HE   MET  26          2HE       MET  26  -4.804 -14.703   1.285
  222   3HE   MET  26          3HE       MET  26  -4.514 -13.948  -0.301
  223    H    MET  27           H        MET  27  -6.755 -12.431   3.782
  224    HA   MET  27           HA       MET  27  -7.245 -11.379   6.304
  225   1HB   MET  27          1HB       MET  27  -8.345 -13.617   4.583
  226   2HB   MET  27          2HB       MET  27  -8.845 -13.576   6.262
  227   1HG   MET  27          1HG       MET  27  -9.005 -11.058   4.571
  228   2HG   MET  27          2HG       MET  27 -10.267 -12.268   4.464
  229   1HE   MET  27          1HE       MET  27 -11.561  -9.299   6.297
  230   2HE   MET  27          2HE       MET  27  -9.887  -8.884   6.738
  231   3HE   MET  27          3HE       MET  27 -10.264  -9.420   5.083
  232    H    SER  28           H        SER  28  -5.604 -14.355   5.195
  233    HA   SER  28           HA       SER  28  -5.645 -15.649   7.659
  234   1HB   SER  28          1HB       SER  28  -5.161 -17.007   5.787
  235   2HB   SER  28          2HB       SER  28  -3.977 -15.884   5.147
  236    HG   SER  28           HG       SER  28  -3.109 -17.881   6.190
  237    H    ASP  29           H        ASP  29  -2.410 -15.162   6.340
  238    HA   ASP  29           HA       ASP  29  -1.513 -14.261   8.859
  239   1HB   ASP  29          1HB       ASP  29  -0.308 -15.680   6.975
  240   2HB   ASP  29          2HB       ASP  29   0.107 -14.118   6.297
  241    H    LEU  30           H        LEU  30  -2.653 -12.183   9.116
  242    HA   LEU  30           HA       LEU  30  -2.388 -10.162   7.126
  243   1HB   LEU  30          1HB       LEU  30  -3.364 -10.100   9.985
  244   2HB   LEU  30          2HB       LEU  30  -3.427  -8.735   8.889
  245    HG   LEU  30           HG       LEU  30  -4.677 -11.238   7.898
  246   1HD1  LEU  30          1HD1      LEU  30  -5.435 -11.441  10.142
  247   2HD1  LEU  30          2HD1      LEU  30  -5.788  -9.701  10.254
  248   3HD1  LEU  30          3HD1      LEU  30  -6.776 -10.743   9.202
  249   1HD2  LEU  30          1HD2      LEU  30  -5.807  -8.439   7.958
  250   2HD2  LEU  30          2HD2      LEU  30  -4.619  -8.967   6.741
  251   3HD2  LEU  30          3HD2      LEU  30  -6.198  -9.780   6.854
  252    H    THR  31           H        THR  31  -0.335 -11.454   9.574
  253    HA   THR  31           HA       THR  31   1.103  -8.959   9.964
  254    HB   THR  31           HB       THR  31   2.325 -10.271  11.628
  255    HG1  THR  31           HG1      THR  31   2.637 -12.353  10.940
  256   1HG2  THR  31          1HG2      THR  31   0.505 -11.349  12.952
  257   2HG2  THR  31          2HG2      THR  31  -0.028  -9.768  12.333
  258   3HG2  THR  31          3HG2      THR  31  -0.573 -11.264  11.538
  259    H    ILE  32           H        ILE  32   0.837 -10.855   7.367
  260    HA   ILE  32           HA       ILE  32   3.619 -10.364   6.649
  261    HB   ILE  32           HB       ILE  32   2.271 -13.008   6.786
  262   1HG1  ILE  32          1HG1      ILE  32   4.203 -12.048   8.257
  263   2HG1  ILE  32          2HG1      ILE  32   4.244 -13.718   7.728
  264   1HG2  ILE  32          1HG2      ILE  32   2.501 -13.240   4.538
  265   2HG2  ILE  32          2HG2      ILE  32   3.799 -12.028   4.425
  266   3HG2  ILE  32          3HG2      ILE  32   4.160 -13.666   5.023
  267   1HD1  ILE  32          1HD1      ILE  32   6.393 -12.242   7.428
  268   2HD1  ILE  32          2HD1      ILE  32   5.899 -13.309   6.092
  269   3HD1  ILE  32          3HD1      ILE  32   5.534 -11.568   6.023
  270    HA   PRO  33           HA       PRO  33   0.819  -8.374   3.722
  271   1HB   PRO  33          1HB       PRO  33   3.552  -7.330   2.861
  272   2HB   PRO  33          2HB       PRO  33   2.026  -6.449   3.048
  273   1HG   PRO  33          1HG       PRO  33   3.920  -6.258   4.997
  274   2HG   PRO  33          2HG       PRO  33   2.220  -6.463   5.475
  275   1HD   PRO  33          1HD       PRO  33   4.400  -8.621   5.375
  276   2HD   PRO  33          2HD       PRO  33   3.175  -8.317   6.638
  277    H    VAL  34           H        VAL  34   0.294  -8.398   1.486
  278    HA   VAL  34           HA       VAL  34   1.693 -10.521   0.015
  279    HB   VAL  34           HB       VAL  34  -0.545 -11.150   0.555
  280   1HG1  VAL  34          1HG1      VAL  34  -1.511  -8.984   1.068
  281   2HG1  VAL  34          2HG1      VAL  34  -1.401  -8.492  -0.639
  282   3HG1  VAL  34          3HG1      VAL  34  -2.507  -9.801  -0.158
  283   1HG2  VAL  34          1HG2      VAL  34   0.394 -10.837  -2.120
  284   2HG2  VAL  34          2HG2      VAL  34  -0.719 -12.066  -1.469
  285   3HG2  VAL  34          3HG2      VAL  34  -1.361 -10.538  -2.119
  286    H    LYS  35           H        LYS  35   0.128  -7.275  -0.182
  287    HA   LYS  35           HA       LYS  35   1.927  -6.694  -2.404
  288   1HB   LYS  35          1HB       LYS  35  -1.007  -5.967  -2.531
  289   2HB   LYS  35          2HB       LYS  35   0.204  -5.794  -3.786
  290   1HG   LYS  35          1HG       LYS  35  -0.465  -8.521  -2.614
  291   2HG   LYS  35          2HG       LYS  35  -1.418  -7.837  -3.916
  292   1HD   LYS  35          1HD       LYS  35   0.661  -7.599  -5.301
  293   2HD   LYS  35          2HD       LYS  35   1.601  -8.308  -4.002
  294   1HE   LYS  35          1HE       LYS  35   0.786 -10.451  -4.382
  295   2HE   LYS  35          2HE       LYS  35  -0.789  -9.882  -4.898
  296   1HZ   LYS  35          1HZ       LYS  35   1.407  -9.167  -6.610
  297   2HZ   LYS  35          2HZ       LYS  35   1.051 -10.760  -6.558
  298   3HZ   LYS  35          3HZ       LYS  35  -0.093  -9.680  -6.999
  299    H    ARG  36           H        ARG  36   2.596  -4.512  -2.499
  300    HA   ARG  36           HA       ARG  36   1.403  -2.723  -0.601
  301   1HB   ARG  36          1HB       ARG  36   4.227  -3.800  -0.378
  302   2HB   ARG  36          2HB       ARG  36   3.920  -2.147   0.112
  303   1HG   ARG  36          1HG       ARG  36   1.870  -3.282   1.432
  304   2HG   ARG  36          2HG       ARG  36   2.879  -4.710   1.317
  305   1HD   ARG  36          1HD       ARG  36   4.243  -2.183   2.203
  306   2HD   ARG  36          2HD       ARG  36   3.110  -2.895   3.336
  307    HE   ARG  36           HE       ARG  36   4.935  -4.872   2.201
  308   1HH1  ARG  36          1HH1      ARG  36   4.572  -2.430   4.709
  309   2HH1  ARG  36          2HH1      ARG  36   5.754  -3.143   5.754
  310   1HH2  ARG  36          1HH2      ARG  36   6.497  -5.814   3.580
  311   2HH2  ARG  36          2HH2      ARG  36   6.857  -5.080   5.107
  312    H    GLY  37           H        GLY  37   1.579  -0.549  -1.294
  313   1HA   GLY  37          1HA       GLY  37   3.598   0.380  -3.047
  314   2HA   GLY  37          2HA       GLY  37   2.160  -0.027  -3.962
  315    H    CYS  38           H        CYS  38   1.707   2.177  -4.506
  316    HA   CYS  38           HA       CYS  38   0.773   3.738  -2.207
  317   1HB   CYS  38          1HB       CYS  38   1.963   4.837  -4.762
  318   2HB   CYS  38          2HB       CYS  38   1.365   5.772  -3.406
  319    H    ILE  39           H        ILE  39  -1.026   5.331  -2.907
  320    HA   ILE  39           HA       ILE  39  -2.415   4.649  -5.324
  321    HB   ILE  39           HB       ILE  39  -2.952   2.981  -3.296
  322   1HG1  ILE  39          1HG1      ILE  39  -3.957   3.501  -5.807
  323   2HG1  ILE  39          2HG1      ILE  39  -4.393   2.148  -4.782
  324   1HG2  ILE  39          1HG2      ILE  39  -4.744   5.375  -2.883
  325   2HG2  ILE  39          2HG2      ILE  39  -5.207   3.733  -2.377
  326   3HG2  ILE  39          3HG2      ILE  39  -3.755   4.500  -1.690
  327   1HD1  ILE  39          1HD1      ILE  39  -6.391   3.155  -4.053
  328   2HD1  ILE  39          2HD1      ILE  39  -5.806   4.798  -4.407
  329   3HD1  ILE  39          3HD1      ILE  39  -6.286   3.718  -5.738
  330    H    ASP  40           H        ASP  40  -4.447   6.051  -5.526
  331    HA   ASP  40           HA       ASP  40  -3.720   8.634  -4.493
  332   1HB   ASP  40          1HB       ASP  40  -5.466   9.459  -6.077
  333   2HB   ASP  40          2HB       ASP  40  -4.268   8.459  -6.874
  334    H    VAL  41           H        VAL  41  -6.624   6.445  -4.740
  335    HA   VAL  41           HA       VAL  41  -7.769   7.879  -2.446
  336    HB   VAL  41           HB       VAL  41  -8.878   6.764  -4.953
  337   1HG1  VAL  41          1HG1      VAL  41 -10.430   6.610  -2.346
  338   2HG1  VAL  41          2HG1      VAL  41 -11.090   6.333  -3.976
  339   3HG1  VAL  41          3HG1      VAL  41  -9.863   5.227  -3.313
  340   1HG2  VAL  41          1HG2      VAL  41  -9.853   8.790  -5.099
  341   2HG2  VAL  41          2HG2      VAL  41 -10.384   8.768  -3.400
  342   3HG2  VAL  41          3HG2      VAL  41  -8.720   9.252  -3.806
  343    H    CYS  42           H        CYS  42  -8.446   6.700  -0.637
  344    HA   CYS  42           HA       CYS  42  -7.155   4.182  -0.336
  345   1HB   CYS  42          1HB       CYS  42  -7.547   6.069   1.407
  346   2HB   CYS  42          2HB       CYS  42  -9.127   5.338   1.616
  347    HA   PRO  43           HA       PRO  43 -10.835   2.247  -2.008
  348   1HB   PRO  43          1HB       PRO  43  -9.147  -0.220  -2.114
  349   2HB   PRO  43          2HB       PRO  43  -9.911   0.677  -3.437
  350   1HG   PRO  43          1HG       PRO  43  -7.182   0.765  -3.072
  351   2HG   PRO  43          2HG       PRO  43  -8.064   2.226  -3.574
  352   1HD   PRO  43          1HD       PRO  43  -7.265   1.468  -0.686
  353   2HD   PRO  43          2HD       PRO  43  -6.870   2.960  -1.583
  354    H    LYS  44           H        LYS  44 -12.310   0.394  -1.672
  355    HA   LYS  44           HA       LYS  44 -12.703  -0.013   1.127
  356   1HB   LYS  44          1HB       LYS  44 -14.207  -0.980  -1.320
  357   2HB   LYS  44          2HB       LYS  44 -14.718  -1.282   0.328
  358   1HG   LYS  44          1HG       LYS  44 -14.089   1.541   0.038
  359   2HG   LYS  44          2HG       LYS  44 -15.175   1.065  -1.251
  360   1HD   LYS  44          1HD       LYS  44 -16.926   0.613   0.192
  361   2HD   LYS  44          2HD       LYS  44 -15.875   0.002   1.453
  362   1HE   LYS  44          1HE       LYS  44 -16.415   1.992   2.480
  363   2HE   LYS  44          2HE       LYS  44 -15.100   2.610   1.502
  364   1HZ   LYS  44          1HZ       LYS  44 -17.641   2.513   0.177
  365   2HZ   LYS  44          2HZ       LYS  44 -17.569   3.556   1.432
  366   3HZ   LYS  44          3HZ       LYS  44 -16.517   3.698   0.192
  367    H    ASN  45           H        ASN  45 -12.548  -1.943   2.317
  368    HA   ASN  45           HA       ASN  45 -10.620  -3.746   1.231
  369   1HB   ASN  45          1HB       ASN  45 -12.067  -4.085   3.892
  370   2HB   ASN  45          2HB       ASN  45 -10.447  -4.607   3.474
  371   1HD2  ASN  45          1HD2      ASN  45 -12.158  -2.419   5.171
  372   2HD2  ASN  45          2HD2      ASN  45 -11.042  -1.097   5.268
  373    H    SER  46           H        SER  46 -11.043  -6.221   1.542
  374    HA   SER  46           HA       SER  46 -13.861  -6.757   1.007
  375   1HB   SER  46          1HB       SER  46 -13.100  -8.621  -0.470
  376   2HB   SER  46          2HB       SER  46 -12.570  -7.053  -1.045
  377    HG   SER  46           HG       SER  46 -10.475  -7.470  -0.034
  378    H    LEU  47           H        LEU  47 -14.231  -9.334   1.323
  379    HA   LEU  47           HA       LEU  47 -13.454  -9.823   4.050
  380   1HB   LEU  47          1HB       LEU  47 -15.247 -11.295   2.117
  381   2HB   LEU  47          2HB       LEU  47 -14.953 -11.810   3.766
  382    HG   LEU  47           HG       LEU  47 -16.074  -9.083   3.097
  383   1HD1  LEU  47          1HD1      LEU  47 -18.267  -9.863   3.224
  384   2HD1  LEU  47          2HD1      LEU  47 -17.445 -11.083   2.221
  385   3HD1  LEU  47          3HD1      LEU  47 -17.779 -11.420   3.936
  386   1HD2  LEU  47          1HD2      LEU  47 -16.215  -8.723   5.298
  387   2HD2  LEU  47          2HD2      LEU  47 -16.798 -10.371   5.630
  388   3HD2  LEU  47          3HD2      LEU  47 -15.054 -10.062   5.452
  389    H    LEU  48           H        LEU  48 -11.815 -10.118   1.227
  390    HA   LEU  48           HA       LEU  48 -10.697 -12.737   1.920
  391   1HB   LEU  48          1HB       LEU  48 -10.396 -11.141  -0.627
  392   2HB   LEU  48          2HB       LEU  48  -9.791 -12.758  -0.328
  393    HG   LEU  48           HG       LEU  48 -11.725 -12.998  -1.663
  394   1HD1  LEU  48          1HD1      LEU  48 -11.477 -14.292   0.694
  395   2HD1  LEU  48          2HD1      LEU  48 -13.097 -13.584   0.895
  396   3HD1  LEU  48          3HD1      LEU  48 -12.752 -14.634  -0.500
  397   1HD2  LEU  48          1HD2      LEU  48 -13.793 -11.928  -1.380
  398   2HD2  LEU  48          2HD2      LEU  48 -13.416 -11.437   0.289
  399   3HD2  LEU  48          3HD2      LEU  48 -12.581 -10.659  -1.079
  400    H    VAL  49           H        VAL  49  -9.760  -9.364   0.958
  401    HA   VAL  49           HA       VAL  49  -7.398  -9.716   2.662
  402    HB   VAL  49           HB       VAL  49  -5.970  -8.807   1.075
  403   1HG1  VAL  49          1HG1      VAL  49  -6.004 -10.330  -0.696
  404   2HG1  VAL  49          2HG1      VAL  49  -6.959 -11.151   0.562
  405   3HG1  VAL  49          3HG1      VAL  49  -7.782 -10.336  -0.790
  406   1HG2  VAL  49          1HG2      VAL  49  -6.909  -6.908   0.188
  407   2HG2  VAL  49          2HG2      VAL  49  -7.053  -8.000  -1.211
  408   3HG2  VAL  49          3HG2      VAL  49  -8.462  -7.702  -0.164
  409    H    LYS  50           H        LYS  50  -6.472  -7.556   3.357
  410    HA   LYS  50           HA       LYS  50  -8.653  -5.596   3.564
  411   1HB   LYS  50          1HB       LYS  50  -8.198  -6.858   5.674
  412   2HB   LYS  50          2HB       LYS  50  -6.562  -6.231   5.666
  413   1HG   LYS  50          1HG       LYS  50  -7.481  -3.888   5.672
  414   2HG   LYS  50          2HG       LYS  50  -9.106  -4.540   5.738
  415   1HD   LYS  50          1HD       LYS  50  -6.981  -5.208   7.822
  416   2HD   LYS  50          2HD       LYS  50  -8.073  -3.847   7.989
  417   1HE   LYS  50          1HE       LYS  50  -9.667  -5.227   8.818
  418   2HE   LYS  50          2HE       LYS  50  -9.698  -6.105   7.301
  419   1HZ   LYS  50          1HZ       LYS  50  -7.882  -7.450   8.104
  420   2HZ   LYS  50          2HZ       LYS  50  -7.829  -6.624   9.510
  421   3HZ   LYS  50          3HZ       LYS  50  -9.139  -7.527   9.143
  422    H    TYR  51           H        TYR  51  -8.162  -3.448   3.149
  423    HA   TYR  51           HA       TYR  51  -5.462  -3.023   2.084
  424   1HB   TYR  51          1HB       TYR  51  -8.147  -1.529   1.819
  425   2HB   TYR  51          2HB       TYR  51  -6.693  -1.103   0.938
  426    HD1  TYR  51           HD1      TYR  51  -5.933  -4.151   0.483
  427    HD2  TYR  51           HD2      TYR  51  -9.446  -1.812  -0.227
  428    HE1  TYR  51           HE1      TYR  51  -6.613  -5.727  -1.393
  429    HE2  TYR  51           HE2      TYR  51 -10.114  -3.396  -2.100
  430    HH   TYR  51           HH       TYR  51  -9.426  -6.119  -2.485
  431    H    VAL  52           H        VAL  52  -4.169  -1.309   2.787
  432    HA   VAL  52           HA       VAL  52  -5.296   0.346   4.925
  433    HB   VAL  52           HB       VAL  52  -2.498  -0.700   5.121
  434   1HG1  VAL  52          1HG1      VAL  52  -3.629  -0.582   7.641
  435   2HG1  VAL  52          2HG1      VAL  52  -2.634   0.683   6.883
  436   3HG1  VAL  52          3HG1      VAL  52  -4.409   0.773   6.790
  437   1HG2  VAL  52          1HG2      VAL  52  -3.451  -2.523   6.639
  438   2HG2  VAL  52          2HG2      VAL  52  -5.017  -2.211   5.852
  439   3HG2  VAL  52          3HG2      VAL  52  -3.629  -2.764   4.884
  440    H    CYS  53           H        CYS  53  -4.701   2.496   4.819
  441    HA   CYS  53           HA       CYS  53  -2.795   3.131   2.685
  442   1HB   CYS  53          1HB       CYS  53  -5.139   4.820   3.582
  443   2HB   CYS  53          2HB       CYS  53  -4.026   5.176   2.275
  444    H    CYS  54           H        CYS  54  -1.306   4.888   3.146
  445    HA   CYS  54           HA       CYS  54  -1.413   6.006   5.810
  446   1HB   CYS  54          1HB       CYS  54   1.065   5.444   6.098
  447   2HB   CYS  54          2HB       CYS  54  -0.122   4.201   6.441
  448    H    ASN  55           H        ASN  55  -0.362   8.066   5.872
  449    HA   ASN  55           HA       ASN  55   0.401   8.999   3.234
  450   1HB   ASN  55          1HB       ASN  55   0.259  11.298   4.599
  451   2HB   ASN  55          2HB       ASN  55  -1.203  10.514   4.034
  452   1HD2  ASN  55          1HD2      ASN  55   1.080  10.270   6.762
  453   2HD2  ASN  55          2HD2      ASN  55  -0.099  10.161   8.026
  454    H    THR  56           H        THR  56   1.892   7.552   5.741
  455    HA   THR  56           HA       THR  56   4.050   9.492   6.093
  456    HB   THR  56           HB       THR  56   4.756   7.625   7.778
  457    HG1  THR  56           HG1      THR  56   3.158   6.014   8.018
  458   1HG2  THR  56          1HG2      THR  56   3.709   9.082   9.201
  459   2HG2  THR  56          2HG2      THR  56   2.552   9.565   7.937
  460   3HG2  THR  56          3HG2      THR  56   2.225   8.132   8.942
  461    H    ASP  57           H        ASP  57   6.322   8.743   5.916
  462    HA   ASP  57           HA       ASP  57   6.591   7.445   3.400
  463   1HB   ASP  57          1HB       ASP  57   8.946   8.057   5.184
  464   2HB   ASP  57          2HB       ASP  57   8.814   8.216   3.444
  465    H    ARG  58           H        ARG  58   8.254   5.593   3.149
  466    HA   ARG  58           HA       ARG  58   8.533   3.451   3.546
  467   1HB   ARG  58          1HB       ARG  58   9.810   4.758   5.994
  468   2HB   ARG  58          2HB       ARG  58  10.058   3.069   5.599
  469   1HG   ARG  58          1HG       ARG  58  11.178   3.590   3.544
  470   2HG   ARG  58          2HG       ARG  58  10.577   5.235   3.530
  471   1HD   ARG  58          1HD       ARG  58  12.331   4.319   5.828
  472   2HD   ARG  58          2HD       ARG  58  13.072   4.739   4.297
  473    HE   ARG  58           HE       ARG  58  11.420   6.893   4.747
  474   1HH1  ARG  58          1HH1      ARG  58  13.822   5.273   6.744
  475   2HH1  ARG  58          2HH1      ARG  58  14.233   6.702   7.633
  476   1HH2  ARG  58          1HH2      ARG  58  11.962   8.778   5.919
  477   2HH2  ARG  58          2HH2      ARG  58  13.168   8.709   7.160
  478    H    CYS  59           H        CYS  59   5.888   4.210   4.373
  479    HA   CYS  59           HA       CYS  59   5.472   3.071   6.981
  480   1HB   CYS  59          1HB       CYS  59   3.146   3.645   6.658
  481   2HB   CYS  59          2HB       CYS  59   4.182   5.015   6.310
  482    H    ASN  60           H        ASN  60   4.640   2.393   3.510
  483    HA   ASN  60           HA       ASN  60   3.879  -0.283   4.327
  484   1HB   ASN  60          1HB       ASN  60   2.773  -0.451   2.157
  485   2HB   ASN  60          2HB       ASN  60   2.339   1.102   2.842
  486   1HD2  ASN  60          1HD2      ASN  60   4.651  -0.509   0.698
  487   2HD2  ASN  60          2HD2      ASN  60   4.917   0.814  -0.388
  488   1H    HOH  61          1H        HOH  61  -0.967 -12.246   4.564
  489   2H    HOH  61          2H        HOH  61  -0.123 -11.720   3.424
  Start of MODEL    9
    1   1H    LEU   1           H1       LEU   1   6.040  12.068  -1.978
    2    HA   LEU   1           HA       LEU   1   6.977  11.149   0.644
    3   1HB   LEU   1          1HB       LEU   1   4.333  10.898  -0.781
    4   2HB   LEU   1          2HB       LEU   1   4.742   9.940   0.628
    5    HG   LEU   1           HG       LEU   1   5.299  12.622   1.332
    6   1HD1  LEU   1          1HD1      LEU   1   2.452  12.583   0.429
    7   2HD1  LEU   1          2HD1      LEU   1   3.558  13.953   0.693
    8   3HD1  LEU   1          3HD1      LEU   1   3.721  12.947  -0.766
    9   1HD2  LEU   1          1HD2      LEU   1   2.945  12.045   2.591
   10   2HD2  LEU   1          2HD2      LEU   1   3.531  10.420   2.162
   11   3HD2  LEU   1          3HD2      LEU   1   4.554  11.509   3.130
   12    H    LYS   2           H        LYS   2   8.108   9.283   0.773
   13    HA   LYS   2           HA       LYS   2   8.018   7.551  -1.599
   14   1HB   LYS   2          1HB       LYS   2  10.283   8.233   0.286
   15   2HB   LYS   2          2HB       LYS   2  10.331   6.837  -0.772
   16   1HG   LYS   2          1HG       LYS   2  10.707   8.108  -2.633
   17   2HG   LYS   2          2HG       LYS   2   9.477   9.277  -2.195
   18   1HD   LYS   2          1HD       LYS   2  11.482   9.724  -0.284
   19   2HD   LYS   2          2HD       LYS   2  12.394   9.366  -1.738
   20   1HE   LYS   2          1HE       LYS   2  11.697  11.283  -2.821
   21   2HE   LYS   2          2HE       LYS   2  10.083  11.210  -2.142
   22   1HZ   LYS   2          1HZ       LYS   2  11.171  13.023  -1.172
   23   2HZ   LYS   2          2HZ       LYS   2  11.123  11.882  -0.005
   24   3HZ   LYS   2          3HZ       LYS   2  12.514  12.167  -0.813
   25    H    CYS   3           H        CYS   3   7.818   5.297  -1.297
   26    HA   CYS   3           HA       CYS   3   7.362   4.464   1.463
   27   1HB   CYS   3          1HB       CYS   3   5.427   4.334  -0.809
   28   2HB   CYS   3          2HB       CYS   3   5.473   2.991   0.317
   29    H    ASN   4           H        ASN   4   7.325   1.936   1.529
   30    HA   ASN   4           HA       ASN   4   9.595   1.078   0.058
   31   1HB   ASN   4          1HB       ASN   4   7.821  -0.774   1.689
   32   2HB   ASN   4          2HB       ASN   4   9.562  -0.829   1.496
   33   1HD2  ASN   4          1HD2      ASN   4  10.889   0.573   2.631
   34   2HD2  ASN   4          2HD2      ASN   4  10.365   1.447   4.032
   35    H    LYS   5           H        LYS   5   9.560  -0.995  -1.269
   36    HA   LYS   5           HA       LYS   5   7.074  -1.136  -2.788
   37   1HB   LYS   5          1HB       LYS   5   9.909  -2.014  -3.393
   38   2HB   LYS   5          2HB       LYS   5   8.543  -2.392  -4.423
   39   1HG   LYS   5          1HG       LYS   5   8.669   0.469  -3.649
   40   2HG   LYS   5          2HG       LYS   5  10.071  -0.065  -4.556
   41   1HD   LYS   5          1HD       LYS   5   8.661   0.491  -6.321
   42   2HD   LYS   5          2HD       LYS   5   8.237  -1.200  -6.135
   43   1HE   LYS   5          1HE       LYS   5   6.139  -0.067  -6.220
   44   2HE   LYS   5          2HE       LYS   5   6.374  -0.418  -4.519
   45   1HZ   LYS   5          1HZ       LYS   5   7.549   1.933  -4.699
   46   2HZ   LYS   5          2HZ       LYS   5   6.430   2.115  -5.874
   47   3HZ   LYS   5          3HZ       LYS   5   5.963   1.757  -4.350
   48    H    LEU   6           H        LEU   6   7.245  -3.710  -3.845
   49    HA   LEU   6           HA       LEU   6   5.914  -5.223  -2.053
   50   1HB   LEU   6          1HB       LEU   6   6.637  -5.505  -4.607
   51   2HB   LEU   6          2HB       LEU   6   7.772  -6.634  -3.896
   52    HG   LEU   6           HG       LEU   6   4.901  -6.865  -3.097
   53   1HD1  LEU   6          1HD1      LEU   6   5.119  -8.537  -5.315
   54   2HD1  LEU   6          2HD1      LEU   6   4.153  -7.049  -5.183
   55   3HD1  LEU   6          3HD1      LEU   6   5.799  -6.984  -5.857
   56   1HD2  LEU   6          1HD2      LEU   6   6.381  -8.357  -2.009
   57   2HD2  LEU   6          2HD2      LEU   6   5.521  -9.315  -3.239
   58   3HD2  LEU   6          3HD2      LEU   6   7.195  -8.785  -3.533
   59    H    VAL   7           H        VAL   7   9.496  -5.135  -2.555
   60    HA   VAL   7           HA       VAL   7   9.783  -6.812  -0.182
   61    HB   VAL   7           HB       VAL   7  12.044  -5.859  -1.899
   62   1HG1  VAL   7          1HG1      VAL   7  12.807  -8.244  -1.387
   63   2HG1  VAL   7          2HG1      VAL   7  12.738  -7.111  -0.014
   64   3HG1  VAL   7          3HG1      VAL   7  11.449  -8.318  -0.239
   65   1HG2  VAL   7          1HG2      VAL   7  11.671  -7.858  -3.375
   66   2HG2  VAL   7          2HG2      VAL   7  10.058  -8.029  -2.642
   67   3HG2  VAL   7          3HG2      VAL   7  10.465  -6.564  -3.566
   68    HA   PRO   8           HA       PRO   8  10.182  -2.943   1.972
   69   1HB   PRO   8          1HB       PRO   8  10.629  -4.836   4.294
   70   2HB   PRO   8          2HB       PRO   8   9.489  -3.489   4.146
   71   1HG   PRO   8          1HG       PRO   8   8.571  -6.048   3.933
   72   2HG   PRO   8          2HG       PRO   8   7.963  -4.821   2.797
   73   1HD   PRO   8          1HD       PRO   8  10.207  -6.871   2.279
   74   2HD   PRO   8          2HD       PRO   8   8.768  -6.522   1.283
   75    H    ILE   9           H        ILE   9  12.762  -4.690   0.976
   76    HA   ILE   9           HA       ILE   9  14.651  -3.551   2.882
   77    HB   ILE   9           HB       ILE   9  16.263  -4.994   1.937
   78   1HG1  ILE   9          1HG1      ILE   9  15.326  -6.563  -0.018
   79   2HG1  ILE   9          2HG1      ILE   9  14.371  -5.137  -0.370
   80   1HG2  ILE   9          1HG2      ILE   9  15.163  -7.227   2.162
   81   2HG2  ILE   9          2HG2      ILE   9  14.820  -6.098   3.494
   82   3HG2  ILE   9          3HG2      ILE   9  13.593  -6.391   2.238
   83   1HD1  ILE   9          1HD1      ILE   9  16.708  -5.341  -1.496
   84   2HD1  ILE   9          2HD1      ILE   9  16.290  -3.782  -0.744
   85   3HD1  ILE   9          3HD1      ILE   9  17.364  -4.920   0.105
   86    H    ALA  10           H        ALA  10  12.948  -2.578   0.175
   87    HA   ALA  10           HA       ALA  10  14.852  -0.468  -0.308
   88   1HB   ALA  10          1HB       ALA  10  15.787  -1.485  -2.094
   89   2HB   ALA  10          2HB       ALA  10  14.558  -2.772  -2.103
   90   3HB   ALA  10          3HB       ALA  10  14.230  -1.222  -2.916
   91    H    TYR  11           H        TYR  11  13.801   1.429  -0.880
   92    HA   TYR  11           HA       TYR  11  10.952   1.163  -1.552
   93   1HB   TYR  11          1HB       TYR  11  10.595   3.064   0.040
   94   2HB   TYR  11          2HB       TYR  11  11.381   1.746   0.886
   95    HD1  TYR  11           HD1      TYR  11  11.562   5.213   0.002
   96    HD2  TYR  11           HD2      TYR  11  13.948   1.855   1.158
   97    HE1  TYR  11           HE1      TYR  11  13.433   6.779   0.716
   98    HE2  TYR  11           HE2      TYR  11  15.811   3.433   1.867
   99    HH   TYR  11           HH       TYR  11  16.571   5.639   1.406
  100    H    LYS  12           H        LYS  12  10.047   3.116  -2.626
  101    HA   LYS  12           HA       LYS  12  12.107   4.799  -3.837
  102   1HB   LYS  12          1HB       LYS  12   9.942   3.377  -5.416
  103   2HB   LYS  12          2HB       LYS  12  11.119   4.507  -6.053
  104   1HG   LYS  12          1HG       LYS  12  12.934   2.907  -5.097
  105   2HG   LYS  12          2HG       LYS  12  11.641   1.744  -4.883
  106   1HD   LYS  12          1HD       LYS  12  11.589   1.244  -7.103
  107   2HD   LYS  12          2HD       LYS  12  11.536   2.935  -7.561
  108   1HE   LYS  12          1HE       LYS  12  13.942   3.142  -7.473
  109   2HE   LYS  12          2HE       LYS  12  14.119   1.619  -6.625
  110   1HZ   LYS  12          1HZ       LYS  12  14.217   0.612  -8.561
  111   2HZ   LYS  12          2HZ       LYS  12  12.741   1.160  -8.996
  112   3HZ   LYS  12          3HZ       LYS  12  14.075   2.035  -9.351
  113    H    THR  13           H        THR  13  10.193   6.127  -5.588
  114    HA   THR  13           HA       THR  13   8.652   7.528  -3.509
  115    HB   THR  13           HB       THR  13   9.890   9.264  -4.374
  116    HG1  THR  13           HG1      THR  13   8.864   9.973  -6.466
  117   1HG2  THR  13          1HG2      THR  13  10.210   7.712  -6.995
  118   2HG2  THR  13          2HG2      THR  13  11.093   9.182  -6.516
  119   3HG2  THR  13          3HG2      THR  13  11.384   7.650  -5.659
  120    H    CYS  14           H        CYS  14   6.476   7.993  -3.775
  121    HA   CYS  14           HA       CYS  14   5.072   6.111  -5.327
  122   1HB   CYS  14          1HB       CYS  14   4.108   8.576  -3.862
  123   2HB   CYS  14          2HB       CYS  14   3.062   7.367  -4.579
  124    HA   PRO  15           HA       PRO  15   5.714   8.383  -9.133
  125   1HB   PRO  15          1HB       PRO  15   3.819   6.790 -10.554
  126   2HB   PRO  15          2HB       PRO  15   5.556   6.477 -10.405
  127   1HG   PRO  15          1HG       PRO  15   3.202   5.342  -8.756
  128   2HG   PRO  15          2HG       PRO  15   4.666   4.524  -9.351
  129   1HD   PRO  15          1HD       PRO  15   4.550   5.277  -6.738
  130   2HD   PRO  15          2HD       PRO  15   6.081   5.395  -7.646
  131    H    GLU  16           H        GLU  16   4.280   9.267 -11.046
  132    HA   GLU  16           HA       GLU  16   2.722  11.271  -9.942
  133   1HB   GLU  16          1HB       GLU  16   2.952  10.259 -12.807
  134   2HB   GLU  16          2HB       GLU  16   2.092  11.722 -12.369
  135   1HG   GLU  16          1HG       GLU  16   4.807  11.591 -11.194
  136   2HG   GLU  16          2HG       GLU  16   4.823  11.541 -12.945
  137    H    GLY  17           H        GLY  17   0.488  11.560  -9.696
  138   1HA   GLY  17          1HA       GLY  17  -1.748  11.027 -10.150
  139   2HA   GLY  17          2HA       GLY  17  -1.276   9.420 -10.664
  140    H    LYS  18           H        LYS  18   0.627   9.136  -8.290
  141    HA   LYS  18           HA       LYS  18  -1.447   8.353  -6.399
  142   1HB   LYS  18          1HB       LYS  18   1.471   7.620  -6.219
  143   2HB   LYS  18          2HB       LYS  18   0.082   6.781  -5.559
  144   1HG   LYS  18          1HG       LYS  18   0.769   7.053  -8.523
  145   2HG   LYS  18          2HG       LYS  18   0.938   5.600  -7.558
  146   1HD   LYS  18          1HD       LYS  18  -1.632   5.898  -7.065
  147   2HD   LYS  18          2HD       LYS  18  -1.618   6.982  -8.443
  148   1HE   LYS  18          1HE       LYS  18  -0.453   5.055  -9.744
  149   2HE   LYS  18          2HE       LYS  18  -0.898   4.022  -8.401
  150   1HZ   LYS  18          1HZ       LYS  18  -3.024   5.655  -9.413
  151   2HZ   LYS  18          2HZ       LYS  18  -2.473   4.532 -10.463
  152   3HZ   LYS  18          3HZ       LYS  18  -3.030   4.077  -8.997
  153    H    ASN  19           H        ASN  19  -1.133   8.778  -4.069
  154    HA   ASN  19           HA       ASN  19   0.651  10.986  -3.537
  155   1HB   ASN  19          1HB       ASN  19  -1.439  12.145  -4.057
  156   2HB   ASN  19          2HB       ASN  19  -2.376  11.020  -3.094
  157   1HD2  ASN  19          1HD2      ASN  19  -3.205  12.228  -1.541
  158   2HD2  ASN  19          2HD2      ASN  19  -2.324  13.210  -0.418
  159    H    LEU  20           H        LEU  20  -1.869   8.648  -2.382
  160    HA   LEU  20           HA       LEU  20  -0.562   8.586   0.233
  161   1HB   LEU  20          1HB       LEU  20  -3.240   7.525  -0.679
  162   2HB   LEU  20          2HB       LEU  20  -2.598   7.391   0.946
  163    HG   LEU  20           HG       LEU  20  -2.773  10.133  -0.206
  164   1HD1  LEU  20          1HD1      LEU  20  -5.289   9.565   1.023
  165   2HD1  LEU  20          2HD1      LEU  20  -4.948  10.147  -0.625
  166   3HD1  LEU  20          3HD1      LEU  20  -5.022   8.399  -0.296
  167   1HD2  LEU  20          1HD2      LEU  20  -2.345   8.946   2.334
  168   2HD2  LEU  20          2HD2      LEU  20  -2.400  10.674   1.910
  169   3HD2  LEU  20          3HD2      LEU  20  -3.886   9.834   2.413
  170    H    CYS  21           H        CYS  21  -0.487   6.295   1.253
  171    HA   CYS  21           HA       CYS  21   0.523   4.495  -0.826
  172   1HB   CYS  21          1HB       CYS  21   1.475   5.138   1.930
  173   2HB   CYS  21          2HB       CYS  21   1.702   3.505   1.338
  174    H    TYR  22           H        TYR  22  -0.059   2.228  -0.634
  175    HA   TYR  22           HA       TYR  22  -2.137   1.663   1.360
  176   1HB   TYR  22          1HB       TYR  22  -3.558   0.861  -0.412
  177   2HB   TYR  22          2HB       TYR  22  -2.843   2.292  -1.128
  178    HD1  TYR  22           HD1      TYR  22  -3.139  -1.321  -1.306
  179    HD2  TYR  22           HD2      TYR  22  -0.942   2.049  -2.760
  180    HE1  TYR  22           HE1      TYR  22  -2.256  -2.721  -3.236
  181    HE2  TYR  22           HE2      TYR  22  -0.067   0.639  -4.685
  182    HH   TYR  22           HH       TYR  22   0.324  -1.990  -4.957
  183    H    LYS  23           H        LYS  23  -2.203  -0.490   2.108
  184    HA   LYS  23           HA       LYS  23  -0.267  -2.322   0.923
  185   1HB   LYS  23          1HB       LYS  23   0.432  -2.921   3.316
  186   2HB   LYS  23          2HB       LYS  23   1.101  -1.467   2.606
  187   1HG   LYS  23          1HG       LYS  23  -0.735  -0.131   3.743
  188   2HG   LYS  23          2HG       LYS  23  -1.264  -1.602   4.535
  189   1HD   LYS  23          1HD       LYS  23   1.623  -1.248   4.866
  190   2HD   LYS  23          2HD       LYS  23   0.767   0.181   5.409
  191   1HE   LYS  23          1HE       LYS  23  -0.827  -1.679   6.564
  192   2HE   LYS  23          2HE       LYS  23   0.641  -2.632   6.478
  193   1HZ   LYS  23          1HZ       LYS  23   1.783  -1.026   7.726
  194   2HZ   LYS  23          2HZ       LYS  23   0.584   0.076   7.603
  195   3HZ   LYS  23          3HZ       LYS  23   0.369  -1.265   8.508
  196    H    MET  24           H        MET  24  -1.379  -4.114   0.384
  197    HA   MET  24           HA       MET  24  -3.829  -4.626   1.830
  198   1HB   MET  24          1HB       MET  24  -2.591  -5.809  -0.716
  199   2HB   MET  24          2HB       MET  24  -4.129  -6.340  -0.066
  200   1HG   MET  24          1HG       MET  24  -5.196  -4.270  -0.529
  201   2HG   MET  24          2HG       MET  24  -3.683  -3.387  -0.592
  202   1HE   MET  24          1HE       MET  24  -5.857  -6.002  -1.900
  203   2HE   MET  24          2HE       MET  24  -5.852  -5.789  -3.667
  204   3HE   MET  24          3HE       MET  24  -4.669  -6.874  -2.898
  205    H    PHE  25           H        PHE  25  -4.246  -6.533   3.008
  206    HA   PHE  25           HA       PHE  25  -2.037  -8.441   3.167
  207   1HB   PHE  25          1HB       PHE  25  -3.574  -7.002   5.409
  208   2HB   PHE  25          2HB       PHE  25  -2.584  -8.415   5.714
  209    HD1  PHE  25           HD1      PHE  25  -0.180  -8.267   5.728
  210    HD2  PHE  25           HD2      PHE  25  -2.532  -4.870   4.763
  211    HE1  PHE  25           HE1      PHE  25   1.836  -6.795   5.996
  212    HE2  PHE  25           HE2      PHE  25  -0.517  -3.398   5.031
  213    HZ   PHE  25           HZ       PHE  25   1.643  -4.378   5.645
  214    H    MET  26           H        MET  26  -2.669 -10.593   3.451
  215    HA   MET  26           HA       MET  26  -5.382 -11.111   2.848
  216   1HB   MET  26          1HB       MET  26  -3.113 -12.999   3.698
  217   2HB   MET  26          2HB       MET  26  -4.609 -13.503   2.934
  218   1HG   MET  26          1HG       MET  26  -4.042 -12.446   0.854
  219   2HG   MET  26          2HG       MET  26  -2.790 -11.465   1.591
  220   1HE   MET  26          1HE       MET  26  -3.567 -14.740  -0.271
  221   2HE   MET  26          2HE       MET  26  -2.571 -15.941   0.586
  222   3HE   MET  26          3HE       MET  26  -3.942 -15.166   1.416
  223    H    MET  27           H        MET  27  -6.775 -12.654   4.131
  224    HA   MET  27           HA       MET  27  -7.034 -11.709   6.732
  225   1HB   MET  27          1HB       MET  27  -8.237 -13.924   5.048
  226   2HB   MET  27          2HB       MET  27  -8.566 -13.951   6.769
  227   1HG   MET  27          1HG       MET  27  -8.925 -11.313   5.366
  228   2HG   MET  27          2HG       MET  27 -10.101 -12.563   5.010
  229   1HE   MET  27          1HE       MET  27  -8.852 -10.181   8.262
  230   2HE   MET  27          2HE       MET  27  -9.391  -9.768   6.617
  231   3HE   MET  27          3HE       MET  27 -10.526  -9.646   7.981
  232    H    SER  28           H        SER  28  -5.485 -14.628   5.343
  233    HA   SER  28           HA       SER  28  -5.206 -15.984   7.755
  234   1HB   SER  28          1HB       SER  28  -4.956 -17.189   5.685
  235   2HB   SER  28          2HB       SER  28  -3.702 -16.104   5.115
  236    HG   SER  28           HG       SER  28  -2.372 -16.886   6.963
  237    H    ASP  29           H        ASP  29  -2.212 -15.208   5.987
  238    HA   ASP  29           HA       ASP  29  -0.950 -14.521   8.410
  239   1HB   ASP  29          1HB       ASP  29  -0.004 -15.604   6.191
  240   2HB   ASP  29          2HB       ASP  29   0.178 -13.948   5.651
  241    H    LEU  30           H        LEU  30  -2.401 -12.624   8.974
  242    HA   LEU  30           HA       LEU  30  -2.462 -10.356   7.277
  243   1HB   LEU  30          1HB       LEU  30  -3.223 -10.875  10.143
  244   2HB   LEU  30          2HB       LEU  30  -3.327  -9.275   9.434
  245    HG   LEU  30           HG       LEU  30  -4.682 -11.594   8.082
  246   1HD1  LEU  30          1HD1      LEU  30  -6.650 -10.349   9.622
  247   2HD1  LEU  30          2HD1      LEU  30  -5.984 -11.985   9.839
  248   3HD1  LEU  30          3HD1      LEU  30  -5.293 -10.616  10.742
  249   1HD2  LEU  30          1HD2      LEU  30  -5.480  -8.680   8.273
  250   2HD2  LEU  30          2HD2      LEU  30  -4.460  -9.353   6.979
  251   3HD2  LEU  30          3HD2      LEU  30  -6.133  -9.925   7.183
  252    H    THR  31           H        THR  31   0.023 -11.764   9.092
  253    HA   THR  31           HA       THR  31   1.235  -9.254   9.897
  254    HB   THR  31           HB       THR  31   1.403 -12.093  10.571
  255    HG1  THR  31           HG1      THR  31   2.059 -11.007  12.473
  256   1HG2  THR  31          1HG2      THR  31   3.828 -12.231  10.919
  257   2HG2  THR  31          2HG2      THR  31   3.543 -11.943   9.186
  258   3HG2  THR  31          3HG2      THR  31   4.059 -10.603  10.239
  259    H    ILE  32           H        ILE  32   1.324 -11.545   7.211
  260    HA   ILE  32           HA       ILE  32   3.626 -10.067   6.148
  261    HB   ILE  32           HB       ILE  32   2.725 -12.892   5.969
  262   1HG1  ILE  32          1HG1      ILE  32   5.540 -12.437   5.629
  263   2HG1  ILE  32          2HG1      ILE  32   4.968 -11.443   6.953
  264   1HG2  ILE  32          1HG2      ILE  32   2.574 -12.203   3.640
  265   2HG2  ILE  32          2HG2      ILE  32   4.207 -11.498   3.722
  266   3HG2  ILE  32          3HG2      ILE  32   3.987 -13.256   3.892
  267   1HD1  ILE  32          1HD1      ILE  32   4.612 -14.455   6.642
  268   2HD1  ILE  32          2HD1      ILE  32   5.576 -13.602   7.872
  269   3HD1  ILE  32          3HD1      ILE  32   3.800 -13.496   7.902
  270    HA   PRO  33           HA       PRO  33   0.604  -8.138   3.604
  271   1HB   PRO  33          1HB       PRO  33   2.439  -6.743   1.993
  272   2HB   PRO  33          2HB       PRO  33   1.881  -6.216   3.590
  273   1HG   PRO  33          1HG       PRO  33   4.487  -7.662   2.794
  274   2HG   PRO  33          2HG       PRO  33   4.224  -6.389   4.009
  275   1HD   PRO  33          1HD       PRO  33   4.437  -9.069   4.731
  276   2HD   PRO  33          2HD       PRO  33   3.517  -7.872   5.684
  277    H    VAL  34           H        VAL  34  -0.149  -7.825   1.361
  278    HA   VAL  34           HA       VAL  34   0.739 -10.049  -0.344
  279    HB   VAL  34           HB       VAL  34  -1.457 -10.451   0.532
  280   1HG1  VAL  34          1HG1      VAL  34  -1.868  -7.574  -0.106
  281   2HG1  VAL  34          2HG1      VAL  34  -3.256  -8.658  -0.370
  282   3HG1  VAL  34          3HG1      VAL  34  -2.500  -8.556   1.237
  283   1HG2  VAL  34          1HG2      VAL  34  -1.225 -11.221  -1.698
  284   2HG2  VAL  34          2HG2      VAL  34  -2.804 -10.400  -1.632
  285   3HG2  VAL  34          3HG2      VAL  34  -1.405  -9.581  -2.367
  286    H    LYS  35           H        LYS  35  -0.175  -6.608  -0.067
  287    HA   LYS  35           HA       LYS  35   1.167  -6.161  -2.608
  288   1HB   LYS  35          1HB       LYS  35  -1.530  -4.897  -2.120
  289   2HB   LYS  35          2HB       LYS  35  -0.595  -4.944  -3.601
  290   1HG   LYS  35          1HG       LYS  35  -1.681  -7.455  -2.248
  291   2HG   LYS  35          2HG       LYS  35  -2.566  -6.580  -3.482
  292   1HD   LYS  35          1HD       LYS  35   0.266  -7.241  -4.174
  293   2HD   LYS  35          2HD       LYS  35  -0.804  -8.619  -4.013
  294   1HE   LYS  35          1HE       LYS  35  -1.309  -8.156  -6.207
  295   2HE   LYS  35          2HE       LYS  35  -2.411  -6.990  -5.504
  296   1HZ   LYS  35          1HZ       LYS  35  -0.338  -5.487  -5.560
  297   2HZ   LYS  35          2HZ       LYS  35   0.201  -6.529  -6.695
  298   3HZ   LYS  35          3HZ       LYS  35  -1.198  -5.719  -6.928
  299    H    ARG  36           H        ARG  36   2.354  -4.265  -2.629
  300    HA   ARG  36           HA       ARG  36   1.816  -2.381  -0.518
  301   1HB   ARG  36          1HB       ARG  36   4.266  -4.104  -0.730
  302   2HB   ARG  36          2HB       ARG  36   4.553  -2.417  -0.353
  303   1HG   ARG  36          1HG       ARG  36   3.355  -2.521   1.682
  304   2HG   ARG  36          2HG       ARG  36   2.410  -3.908   1.177
  305   1HD   ARG  36          1HD       ARG  36   3.878  -5.111   2.462
  306   2HD   ARG  36          2HD       ARG  36   4.948  -4.979   1.081
  307    HE   ARG  36           HE       ARG  36   6.228  -3.347   2.222
  308   1HH1  ARG  36          1HH1      ARG  36   3.290  -4.087   4.012
  309   2HH1  ARG  36          2HH1      ARG  36   3.806  -3.267   5.449
  310   1HH2  ARG  36          1HH2      ARG  36   6.909  -2.266   4.116
  311   2HH2  ARG  36          2HH2      ARG  36   5.879  -2.224   5.508
  312    H    GLY  37           H        GLY  37   1.595  -0.474  -1.650
  313   1HA   GLY  37          1HA       GLY  37   3.730   0.468  -3.319
  314   2HA   GLY  37          2HA       GLY  37   2.308   0.014  -4.239
  315    H    CYS  38           H        CYS  38   1.955   2.249  -4.855
  316    HA   CYS  38           HA       CYS  38   0.970   3.876  -2.624
  317   1HB   CYS  38          1HB       CYS  38   2.034   4.907  -5.258
  318   2HB   CYS  38          2HB       CYS  38   1.560   5.851  -3.860
  319    H    ILE  39           H        ILE  39  -0.873   5.392  -3.339
  320    HA   ILE  39           HA       ILE  39  -2.293   4.601  -5.706
  321    HB   ILE  39           HB       ILE  39  -2.787   2.897  -3.825
  322   1HG1  ILE  39          1HG1      ILE  39  -5.422   3.495  -4.583
  323   2HG1  ILE  39          2HG1      ILE  39  -4.433   4.114  -5.890
  324   1HG2  ILE  39          1HG2      ILE  39  -3.158   4.359  -1.977
  325   2HG2  ILE  39          2HG2      ILE  39  -4.381   5.289  -2.876
  326   3HG2  ILE  39          3HG2      ILE  39  -4.718   3.609  -2.391
  327   1HD1  ILE  39          1HD1      ILE  39  -4.419   1.281  -4.764
  328   2HD1  ILE  39          2HD1      ILE  39  -4.920   1.797  -6.392
  329   3HD1  ILE  39          3HD1      ILE  39  -3.205   1.879  -5.920
  330    H    ASP  40           H        ASP  40  -4.187   6.031  -6.084
  331    HA   ASP  40           HA       ASP  40  -3.529   8.637  -5.157
  332   1HB   ASP  40          1HB       ASP  40  -4.213   8.380  -7.469
  333   2HB   ASP  40          2HB       ASP  40  -5.665   7.511  -7.013
  334    H    VAL  41           H        VAL  41  -6.216   6.231  -4.859
  335    HA   VAL  41           HA       VAL  41  -7.259   7.824  -2.622
  336    HB   VAL  41           HB       VAL  41  -9.107   6.093  -4.163
  337   1HG1  VAL  41          1HG1      VAL  41 -10.211   7.180  -2.460
  338   2HG1  VAL  41          2HG1      VAL  41  -9.201   8.640  -2.584
  339   3HG1  VAL  41          3HG1      VAL  41 -10.468   8.330  -3.795
  340   1HG2  VAL  41          1HG2      VAL  41  -7.942   8.657  -5.275
  341   2HG2  VAL  41          2HG2      VAL  41  -8.046   7.060  -6.054
  342   3HG2  VAL  41          3HG2      VAL  41  -9.523   8.015  -5.779
  343    H    CYS  42           H        CYS  42  -8.570   6.407  -1.062
  344    HA   CYS  42           HA       CYS  42  -6.921   4.200  -0.380
  345   1HB   CYS  42          1HB       CYS  42  -8.264   5.896   1.119
  346   2HB   CYS  42          2HB       CYS  42  -9.561   4.733   0.928
  347    HA   PRO  43           HA       PRO  43  -9.239   1.344  -2.824
  348   1HB   PRO  43          1HB       PRO  43  -7.742  -0.795  -1.340
  349   2HB   PRO  43          2HB       PRO  43  -7.719  -0.395  -3.066
  350   1HG   PRO  43          1HG       PRO  43  -5.571   0.228  -1.476
  351   2HG   PRO  43          2HG       PRO  43  -6.107   1.380  -2.722
  352   1HD   PRO  43          1HD       PRO  43  -6.868   1.429   0.274
  353   2HD   PRO  43          2HD       PRO  43  -6.110   2.725  -0.693
  354    H    LYS  44           H        LYS  44 -10.342  -0.963  -2.653
  355    HA   LYS  44           HA       LYS  44 -12.475  -0.614  -0.804
  356   1HB   LYS  44          1HB       LYS  44 -11.810  -2.687  -2.901
  357   2HB   LYS  44          2HB       LYS  44 -13.202  -2.846  -1.850
  358   1HG   LYS  44          1HG       LYS  44 -14.181  -0.790  -2.661
  359   2HG   LYS  44          2HG       LYS  44 -12.694  -0.305  -3.449
  360   1HD   LYS  44          1HD       LYS  44 -12.929  -1.922  -5.183
  361   2HD   LYS  44          2HD       LYS  44 -14.055  -2.893  -4.257
  362   1HE   LYS  44          1HE       LYS  44 -15.868  -1.430  -4.656
  363   2HE   LYS  44          2HE       LYS  44 -14.827  -0.054  -4.968
  364   1HZ   LYS  44          1HZ       LYS  44 -15.020  -0.552  -7.088
  365   2HZ   LYS  44          2HZ       LYS  44 -14.180  -1.934  -6.849
  366   3HZ   LYS  44          3HZ       LYS  44 -15.812  -1.948  -6.782
  367    H    ASN  45           H        ASN  45 -13.214  -2.959   0.247
  368    HA   ASN  45           HA       ASN  45 -10.936  -4.217   1.442
  369   1HB   ASN  45          1HB       ASN  45 -12.909  -2.496   3.004
  370   2HB   ASN  45          2HB       ASN  45 -12.089  -3.832   3.787
  371   1HD2  ASN  45          1HD2      ASN  45 -11.885  -0.629   2.645
  372   2HD2  ASN  45          2HD2      ASN  45 -10.231  -0.291   3.032
  373    H    SER  46           H        SER  46 -11.480  -6.399   1.835
  374    HA   SER  46           HA       SER  46 -14.335  -6.992   1.882
  375   1HB   SER  46          1HB       SER  46 -13.810  -9.104   0.639
  376   2HB   SER  46          2HB       SER  46 -13.484  -7.659  -0.297
  377    HG   SER  46           HG       SER  46 -11.182  -7.945   0.687
  378    H    LEU  47           H        LEU  47 -14.516  -9.530   2.642
  379    HA   LEU  47           HA       LEU  47 -13.231  -9.537   5.228
  380   1HB   LEU  47          1HB       LEU  47 -15.336 -11.301   3.972
  381   2HB   LEU  47          2HB       LEU  47 -14.717 -11.510   5.598
  382    HG   LEU  47           HG       LEU  47 -15.914  -8.879   4.760
  383   1HD1  LEU  47          1HD1      LEU  47 -17.561 -10.562   4.122
  384   2HD1  LEU  47          2HD1      LEU  47 -17.470 -11.287   5.745
  385   3HD1  LEU  47          3HD1      LEU  47 -18.109  -9.638   5.541
  386   1HD2  LEU  47          1HD2      LEU  47 -16.594  -9.029   7.267
  387   2HD2  LEU  47          2HD2      LEU  47 -15.334 -10.283   7.351
  388   3HD2  LEU  47          3HD2      LEU  47 -14.915  -8.633   6.831
  389    H    LEU  48           H        LEU  48 -12.059 -10.219   2.303
  390    HA   LEU  48           HA       LEU  48 -10.818 -12.739   3.153
  391   1HB   LEU  48          1HB       LEU  48 -11.037 -11.581   0.372
  392   2HB   LEU  48          2HB       LEU  48 -10.353 -13.135   0.808
  393    HG   LEU  48           HG       LEU  48 -13.250 -12.387   1.277
  394   1HD1  LEU  48          1HD1      LEU  48 -13.768 -13.760  -0.702
  395   2HD1  LEU  48          2HD1      LEU  48 -12.811 -12.316  -1.108
  396   3HD1  LEU  48          3HD1      LEU  48 -12.026 -13.913  -1.039
  397   1HD2  LEU  48          1HD2      LEU  48 -13.156 -15.101   1.113
  398   2HD2  LEU  48          2HD2      LEU  48 -11.590 -14.750   1.883
  399   3HD2  LEU  48          3HD2      LEU  48 -13.099 -14.173   2.630
  400    H    VAL  49           H        VAL  49 -10.195  -9.520   1.616
  401    HA   VAL  49           HA       VAL  49  -7.489  -9.700   2.740
  402    HB   VAL  49           HB       VAL  49  -7.017 -10.002   0.521
  403   1HG1  VAL  49          1HG1      VAL  49  -9.289  -9.921  -0.337
  404   2HG1  VAL  49          2HG1      VAL  49  -9.316  -8.148  -0.182
  405   3HG1  VAL  49          3HG1      VAL  49  -8.225  -8.922  -1.356
  406   1HG2  VAL  49          1HG2      VAL  49  -5.919  -7.935   1.409
  407   2HG2  VAL  49          2HG2      VAL  49  -6.094  -7.959  -0.362
  408   3HG2  VAL  49          3HG2      VAL  49  -7.199  -6.975   0.628
  409    H    LYS  50           H        LYS  50  -6.809  -7.909   3.879
  410    HA   LYS  50           HA       LYS  50  -8.791  -5.762   4.076
  411   1HB   LYS  50          1HB       LYS  50  -8.139  -7.149   6.112
  412   2HB   LYS  50          2HB       LYS  50  -6.562  -6.389   6.023
  413   1HG   LYS  50          1HG       LYS  50  -8.453  -4.266   5.785
  414   2HG   LYS  50          2HG       LYS  50  -9.063  -5.303   7.060
  415   1HD   LYS  50          1HD       LYS  50  -6.231  -5.081   7.465
  416   2HD   LYS  50          2HD       LYS  50  -6.820  -3.463   7.139
  417   1HE   LYS  50          1HE       LYS  50  -8.712  -4.019   8.867
  418   2HE   LYS  50          2HE       LYS  50  -7.696  -5.364   9.345
  419   1HZ   LYS  50          1HZ       LYS  50  -5.891  -3.656   9.573
  420   2HZ   LYS  50          2HZ       LYS  50  -7.052  -2.512   9.463
  421   3HZ   LYS  50          3HZ       LYS  50  -7.083  -3.592  10.687
  422    H    TYR  51           H        TYR  51  -8.163  -3.567   3.888
  423    HA   TYR  51           HA       TYR  51  -5.505  -3.225   2.669
  424   1HB   TYR  51          1HB       TYR  51  -8.163  -1.707   2.298
  425   2HB   TYR  51          2HB       TYR  51  -6.698  -1.392   1.391
  426    HD1  TYR  51           HD1      TYR  51  -6.518  -2.309  -0.735
  427    HD2  TYR  51           HD2      TYR  51  -9.003  -4.261   2.151
  428    HE1  TYR  51           HE1      TYR  51  -7.253  -3.989  -2.495
  429    HE2  TYR  51           HE2      TYR  51  -9.729  -5.934   0.380
  430    HH   TYR  51           HH       TYR  51  -9.805  -5.663  -2.429
  431    H    VAL  52           H        VAL  52  -4.231  -1.490   3.345
  432    HA   VAL  52           HA       VAL  52  -5.412   0.258   5.374
  433    HB   VAL  52           HB       VAL  52  -2.633  -0.787   5.730
  434   1HG1  VAL  52          1HG1      VAL  52  -4.781   0.442   7.439
  435   2HG1  VAL  52          2HG1      VAL  52  -3.513  -0.557   8.190
  436   3HG1  VAL  52          3HG1      VAL  52  -3.069   0.896   7.262
  437   1HG2  VAL  52          1HG2      VAL  52  -3.602  -2.586   7.226
  438   2HG2  VAL  52          2HG2      VAL  52  -5.173  -2.277   6.449
  439   3HG2  VAL  52          3HG2      VAL  52  -3.797  -2.854   5.478
  440    H    CYS  53           H        CYS  53  -5.116   2.349   4.814
  441    HA   CYS  53           HA       CYS  53  -3.094   2.884   2.791
  442   1HB   CYS  53          1HB       CYS  53  -5.352   4.640   3.776
  443   2HB   CYS  53          2HB       CYS  53  -4.262   5.003   2.452
  444    H    CYS  54           H        CYS  54  -1.655   4.790   3.103
  445    HA   CYS  54           HA       CYS  54  -1.515   5.845   5.780
  446   1HB   CYS  54          1HB       CYS  54   0.983   5.288   5.857
  447   2HB   CYS  54          2HB       CYS  54  -0.171   4.044   6.296
  448    H    ASN  55           H        ASN  55  -0.329   7.866   5.800
  449    HA   ASN  55           HA       ASN  55   0.279   8.788   3.103
  450   1HB   ASN  55          1HB       ASN  55   0.041  11.112   4.490
  451   2HB   ASN  55          2HB       ASN  55  -1.343  10.316   3.768
  452   1HD2  ASN  55          1HD2      ASN  55   0.671   9.876   6.679
  453   2HD2  ASN  55          2HD2      ASN  55  -0.624   9.773   7.827
  454    H    THR  56           H        THR  56   1.790   7.494   5.683
  455    HA   THR  56           HA       THR  56   3.859   9.536   5.987
  456    HB   THR  56           HB       THR  56   4.569   8.062   7.872
  457    HG1  THR  56           HG1      THR  56   3.908   5.968   7.620
  458   1HG2  THR  56          1HG2      THR  56   2.555   8.161   9.274
  459   2HG2  THR  56          2HG2      THR  56   2.602   9.633   8.274
  460   3HG2  THR  56          3HG2      THR  56   1.516   8.293   7.834
  461    H    ASP  57           H        ASP  57   6.170   8.825   5.923
  462    HA   ASP  57           HA       ASP  57   6.579   7.571   3.429
  463   1HB   ASP  57          1HB       ASP  57   8.806   8.043   5.417
  464   2HB   ASP  57          2HB       ASP  57   8.834   8.235   3.675
  465    H    ARG  58           H        ARG  58   8.100   5.641   3.162
  466    HA   ARG  58           HA       ARG  58   8.282   3.480   3.489
  467   1HB   ARG  58          1HB       ARG  58   9.494   4.568   6.078
  468   2HB   ARG  58          2HB       ARG  58   9.744   2.929   5.510
  469   1HG   ARG  58          1HG       ARG  58  10.914   3.675   3.539
  470   2HG   ARG  58          2HG       ARG  58  10.375   5.330   3.747
  471   1HD   ARG  58          1HD       ARG  58  11.668   5.288   6.011
  472   2HD   ARG  58          2HD       ARG  58  12.407   3.808   5.433
  473    HE   ARG  58           HE       ARG  58  12.738   5.594   3.320
  474   1HH1  ARG  58          1HH1      ARG  58  13.599   5.595   6.731
  475   2HH1  ARG  58          2HH1      ARG  58  15.000   6.591   6.509
  476   1HH2  ARG  58          1HH2      ARG  58  14.584   6.908   3.025
  477   2HH2  ARG  58          2HH2      ARG  58  15.563   7.343   4.387
  478    H    CYS  59           H        CYS  59   5.640   4.171   4.131
  479    HA   CYS  59           HA       CYS  59   5.033   3.098   6.729
  480   1HB   CYS  59          1HB       CYS  59   2.742   3.644   6.226
  481   2HB   CYS  59          2HB       CYS  59   3.784   5.010   5.877
  482    H    ASN  60           H        ASN  60   4.498   2.306   3.225
  483    HA   ASN  60           HA       ASN  60   3.781  -0.380   4.077
  484   1HB   ASN  60          1HB       ASN  60   2.750  -0.630   1.854
  485   2HB   ASN  60          2HB       ASN  60   2.165   0.854   2.581
  486   1HD2  ASN  60          1HD2      ASN  60   4.115  -0.590   0.114
  487   2HD2  ASN  60          2HD2      ASN  60   4.455   0.831  -0.818
  488   1H    HOH  61          1H        HOH  61  -1.044 -12.220   4.353
  489   2H    HOH  61          2H        HOH  61  -0.259 -11.812   3.125
  Start of MODEL   10
    1   1H    LEU   1           H1       LEU   1   6.272  11.771  -1.927
    2    HA   LEU   1           HA       LEU   1   7.030  11.069   0.794
    3   1HB   LEU   1          1HB       LEU   1   4.281  10.608  -0.369
    4   2HB   LEU   1          2HB       LEU   1   4.889   9.832   1.079
    5    HG   LEU   1           HG       LEU   1   4.960  12.817   0.980
    6   1HD1  LEU   1          1HD1      LEU   1   2.617  12.961   1.737
    7   2HD1  LEU   1          2HD1      LEU   1   2.760  12.367   0.064
    8   3HD1  LEU   1          3HD1      LEU   1   2.412  11.228   1.387
    9   1HD2  LEU   1          1HD2      LEU   1   4.969  10.664   2.994
   10   2HD2  LEU   1          2HD2      LEU   1   5.714  12.281   3.025
   11   3HD2  LEU   1          3HD2      LEU   1   3.988  12.088   3.414
   12    H    LYS   2           H        LYS   2   8.074   9.127   0.870
   13    HA   LYS   2           HA       LYS   2   7.903   7.501  -1.572
   14   1HB   LYS   2          1HB       LYS   2  10.284   8.095   0.203
   15   2HB   LYS   2          2HB       LYS   2  10.266   6.812  -0.990
   16   1HG   LYS   2          1HG       LYS   2  10.811   8.321  -2.589
   17   2HG   LYS   2          2HG       LYS   2   9.273   9.121  -2.335
   18   1HD   LYS   2          1HD       LYS   2  10.713  10.073  -0.177
   19   2HD   LYS   2          2HD       LYS   2  11.987   9.883  -1.366
   20   1HE   LYS   2          1HE       LYS   2  10.114  11.081  -2.943
   21   2HE   LYS   2          2HE       LYS   2   9.623  11.734  -1.392
   22   1HZ   LYS   2          1HZ       LYS   2  12.440  11.781  -2.124
   23   2HZ   LYS   2          2HZ       LYS   2  11.433  12.903  -2.750
   24   3HZ   LYS   2          3HZ       LYS   2  11.617  12.784  -1.132
   25    H    CYS   3           H        CYS   3   7.746   5.238  -1.332
   26    HA   CYS   3           HA       CYS   3   7.496   4.306   1.421
   27   1HB   CYS   3          1HB       CYS   3   5.406   4.208  -0.715
   28   2HB   CYS   3          2HB       CYS   3   5.540   2.856   0.392
   29    H    ASN   4           H        ASN   4   7.578   1.813   1.455
   30    HA   ASN   4           HA       ASN   4   9.719   1.022  -0.203
   31   1HB   ASN   4          1HB       ASN   4   8.042  -0.900   1.454
   32   2HB   ASN   4          2HB       ASN   4   9.764  -0.962   1.140
   33   1HD2  ASN   4          1HD2      ASN   4   7.396  -0.143   3.320
   34   2HD2  ASN   4          2HD2      ASN   4   8.294   0.860   4.411
   35    H    LYS   5           H        LYS   5   9.626  -1.015  -1.596
   36    HA   LYS   5           HA       LYS   5   7.076  -1.100  -3.007
   37   1HB   LYS   5          1HB       LYS   5   9.845  -2.061  -3.783
   38   2HB   LYS   5          2HB       LYS   5   8.414  -2.232  -4.779
   39   1HG   LYS   5          1HG       LYS   5   8.960   0.521  -3.724
   40   2HG   LYS   5          2HG       LYS   5  10.091  -0.081  -4.918
   41   1HD   LYS   5          1HD       LYS   5   8.351   1.056  -6.141
   42   2HD   LYS   5          2HD       LYS   5   8.105  -0.659  -6.407
   43   1HE   LYS   5          1HE       LYS   5   6.187  -0.744  -5.054
   44   2HE   LYS   5          2HE       LYS   5   6.690   0.614  -4.065
   45   1HZ   LYS   5          1HZ       LYS   5   4.965   0.716  -6.139
   46   2HZ   LYS   5          2HZ       LYS   5   5.675   2.003  -5.428
   47   3HZ   LYS   5          3HZ       LYS   5   6.328   1.350  -6.775
   48    H    LEU   6           H        LEU   6   7.182  -3.638  -4.152
   49    HA   LEU   6           HA       LEU   6   5.923  -5.202  -2.354
   50   1HB   LEU   6          1HB       LEU   6   6.530  -5.403  -4.946
   51   2HB   LEU   6          2HB       LEU   6   7.689  -6.561  -4.325
   52    HG   LEU   6           HG       LEU   6   5.854  -7.817  -3.239
   53   1HD1  LEU   6          1HD1      LEU   6   3.995  -6.665  -2.775
   54   2HD1  LEU   6          2HD1      LEU   6   4.311  -5.456  -4.044
   55   3HD1  LEU   6          3HD1      LEU   6   3.532  -7.002  -4.461
   56   1HD2  LEU   6          1HD2      LEU   6   6.203  -8.922  -5.159
   57   2HD2  LEU   6          2HD2      LEU   6   4.641  -8.222  -5.648
   58   3HD2  LEU   6          3HD2      LEU   6   6.161  -7.441  -6.145
   59    H    VAL   7           H        VAL   7   9.480  -5.149  -3.031
   60    HA   VAL   7           HA       VAL   7   9.858  -6.887  -0.716
   61    HB   VAL   7           HB       VAL   7  11.423  -6.149  -3.145
   62   1HG1  VAL   7          1HG1      VAL   7  13.423  -7.322  -1.978
   63   2HG1  VAL   7          2HG1      VAL   7  13.117  -5.603  -1.630
   64   3HG1  VAL   7          3HG1      VAL   7  12.615  -6.850  -0.464
   65   1HG2  VAL   7          1HG2      VAL   7  10.702  -8.693  -1.679
   66   2HG2  VAL   7          2HG2      VAL   7  10.255  -8.189  -3.327
   67   3HG2  VAL   7          3HG2      VAL   7  11.934  -8.657  -2.963
   68    HA   PRO   8           HA       PRO   8  10.416  -3.094   1.529
   69   1HB   PRO   8          1HB       PRO   8  10.991  -5.065   3.758
   70   2HB   PRO   8          2HB       PRO   8   9.856  -3.705   3.725
   71   1HG   PRO   8          1HG       PRO   8   8.903  -6.249   3.484
   72   2HG   PRO   8          2HG       PRO   8   8.238  -4.981   2.429
   73   1HD   PRO   8          1HD       PRO   8  10.424  -7.031   1.708
   74   2HD   PRO   8          2HD       PRO   8   8.933  -6.631   0.812
   75    H    ILE   9           H        ILE   9  12.926  -4.848   0.349
   76    HA   ILE   9           HA       ILE   9  14.931  -3.774   2.166
   77    HB   ILE   9           HB       ILE   9  14.716  -6.033   0.380
   78   1HG1  ILE   9          1HG1      ILE   9  16.992  -5.493   2.268
   79   2HG1  ILE   9          2HG1      ILE   9  15.381  -5.767   2.903
   80   1HG2  ILE   9          1HG2      ILE   9  16.018  -4.587  -1.145
   81   2HG2  ILE   9          2HG2      ILE   9  17.258  -4.405   0.118
   82   3HG2  ILE   9          3HG2      ILE   9  16.933  -6.007  -0.586
   83   1HD1  ILE   9          1HD1      ILE   9  16.530  -7.668   0.841
   84   2HD1  ILE   9          2HD1      ILE   9  16.972  -7.824   2.558
   85   3HD1  ILE   9          3HD1      ILE   9  15.269  -7.970   2.060
   86    H    ALA  10           H        ALA  10  13.079  -2.696  -0.405
   87    HA   ALA  10           HA       ALA  10  14.948  -0.562  -0.902
   88   1HB   ALA  10          1HB       ALA  10  13.963  -2.294  -3.203
   89   2HB   ALA  10          2HB       ALA  10  15.029  -0.872  -3.310
   90   3HB   ALA  10          3HB       ALA  10  15.608  -2.360  -2.524
   91    H    TYR  11           H        TYR  11  13.841   1.341  -1.223
   92    HA   TYR  11           HA       TYR  11  10.960   1.072  -1.761
   93   1HB   TYR  11          1HB       TYR  11  10.732   2.974  -0.149
   94   2HB   TYR  11          2HB       TYR  11  11.590   1.662   0.632
   95    HD1  TYR  11           HD1      TYR  11  13.956   1.860   1.197
   96    HD2  TYR  11           HD2      TYR  11  11.898   5.045  -0.784
   97    HE1  TYR  11           HE1      TYR  11  15.868   3.444   1.743
   98    HE2  TYR  11           HE2      TYR  11  13.818   6.618  -0.232
   99    HH   TYR  11           HH       TYR  11  16.023   6.627   0.354
  100    H    LYS  12           H        LYS  12   9.966   3.031  -2.751
  101    HA   LYS  12           HA       LYS  12  11.916   4.705  -4.141
  102   1HB   LYS  12          1HB       LYS  12   9.637   3.236  -5.502
  103   2HB   LYS  12          2HB       LYS  12  10.681   4.424  -6.256
  104   1HG   LYS  12          1HG       LYS  12  12.663   2.907  -5.509
  105   2HG   LYS  12          2HG       LYS  12  11.453   1.682  -5.182
  106   1HD   LYS  12          1HD       LYS  12  10.736   1.627  -7.493
  107   2HD   LYS  12          2HD       LYS  12  11.614   3.094  -7.877
  108   1HE   LYS  12          1HE       LYS  12  13.416   1.077  -6.743
  109   2HE   LYS  12          2HE       LYS  12  12.556   0.431  -8.128
  110   1HZ   LYS  12          1HZ       LYS  12  13.230   2.448  -9.334
  111   2HZ   LYS  12          2HZ       LYS  12  14.146   2.899  -8.059
  112   3HZ   LYS  12          3HZ       LYS  12  14.497   1.526  -8.873
  113    H    THR  13           H        THR  13   9.944   6.103  -5.699
  114    HA   THR  13           HA       THR  13   8.538   7.464  -3.503
  115    HB   THR  13           HB       THR  13   9.761   9.196  -4.399
  116    HG1  THR  13           HG1      THR  13   7.646   9.665  -5.250
  117   1HG2  THR  13          1HG2      THR  13   9.869   7.672  -7.055
  118   2HG2  THR  13          2HG2      THR  13  10.758   9.165  -6.668
  119   3HG2  THR  13          3HG2      THR  13  11.156   7.648  -5.826
  120    H    CYS  14           H        CYS  14   6.358   8.024  -3.669
  121    HA   CYS  14           HA       CYS  14   4.800   6.163  -5.048
  122   1HB   CYS  14          1HB       CYS  14   4.009   8.799  -3.792
  123   2HB   CYS  14          2HB       CYS  14   2.890   7.563  -4.332
  124    HA   PRO  15           HA       PRO  15   5.436   8.070  -9.055
  125   1HB   PRO  15          1HB       PRO  15   3.415   6.464 -10.274
  126   2HB   PRO  15          2HB       PRO  15   5.139   6.076 -10.155
  127   1HG   PRO  15          1HG       PRO  15   2.796   5.206  -8.338
  128   2HG   PRO  15          2HG       PRO  15   4.193   4.265  -8.910
  129   1HD   PRO  15          1HD       PRO  15   4.217   5.233  -6.369
  130   2HD   PRO  15          2HD       PRO  15   5.716   5.205  -7.339
  131    H    GLU  16           H        GLU  16   4.020   8.905 -10.977
  132    HA   GLU  16           HA       GLU  16   2.603  11.064 -10.016
  133   1HB   GLU  16          1HB       GLU  16   2.659   9.776 -12.778
  134   2HB   GLU  16          2HB       GLU  16   1.882  11.314 -12.454
  135   1HG   GLU  16          1HG       GLU  16   4.675  11.078 -11.426
  136   2HG   GLU  16          2HG       GLU  16   4.527  11.033 -13.170
  137    H    GLY  17           H        GLY  17   0.394  11.520  -9.744
  138   1HA   GLY  17          1HA       GLY  17  -1.877  11.105  -9.963
  139   2HA   GLY  17          2HA       GLY  17  -1.550   9.463 -10.479
  140    H    LYS  18           H        LYS  18   0.466   9.038  -8.243
  141    HA   LYS  18           HA       LYS  18  -1.520   8.391  -6.223
  142   1HB   LYS  18          1HB       LYS  18   1.380   7.548  -6.521
  143   2HB   LYS  18          2HB       LYS  18   0.277   6.973  -5.288
  144   1HG   LYS  18          1HG       LYS  18  -0.010   5.291  -6.866
  145   2HG   LYS  18          2HG       LYS  18  -1.275   6.386  -7.386
  146   1HD   LYS  18          1HD       LYS  18  -0.081   7.111  -9.266
  147   2HD   LYS  18          2HD       LYS  18   1.481   6.814  -8.528
  148   1HE   LYS  18          1HE       LYS  18   1.044   4.326  -8.700
  149   2HE   LYS  18          2HE       LYS  18  -0.458   4.675  -9.532
  150   1HZ   LYS  18          1HZ       LYS  18   0.729   4.781 -11.366
  151   2HZ   LYS  18          2HZ       LYS  18   1.470   6.130 -10.819
  152   3HZ   LYS  18          3HZ       LYS  18   2.147   4.666 -10.562
  153    H    ASN  19           H        ASN  19  -1.123   8.867  -3.929
  154    HA   ASN  19           HA       ASN  19   0.766  11.007  -3.496
  155   1HB   ASN  19          1HB       ASN  19  -1.280  12.249  -3.981
  156   2HB   ASN  19          2HB       ASN  19  -2.241  11.183  -2.976
  157   1HD2  ASN  19          1HD2      ASN  19  -2.804  11.999  -1.122
  158   2HD2  ASN  19          2HD2      ASN  19  -1.914  13.119  -0.145
  159    H    LEU  20           H        LEU  20  -1.804   8.788  -2.232
  160    HA   LEU  20           HA       LEU  20  -0.432   8.730   0.351
  161   1HB   LEU  20          1HB       LEU  20  -3.193   7.861  -0.504
  162   2HB   LEU  20          2HB       LEU  20  -2.521   7.557   1.086
  163    HG   LEU  20           HG       LEU  20  -2.672  10.364   0.007
  164   1HD1  LEU  20          1HD1      LEU  20  -4.889  10.349  -0.022
  165   2HD1  LEU  20          2HD1      LEU  20  -4.927   8.653   0.521
  166   3HD1  LEU  20          3HD1      LEU  20  -4.880   9.971   1.718
  167   1HD2  LEU  20          1HD2      LEU  20  -3.200  10.317   2.743
  168   2HD2  LEU  20          2HD2      LEU  20  -1.927   9.094   2.511
  169   3HD2  LEU  20          3HD2      LEU  20  -1.670  10.764   1.950
  170    H    CYS  21           H        CYS  21  -0.208   6.543   1.406
  171    HA   CYS  21           HA       CYS  21   0.618   4.645  -0.654
  172   1HB   CYS  21          1HB       CYS  21   1.600   5.282   2.094
  173   2HB   CYS  21          2HB       CYS  21   1.775   3.639   1.511
  174    H    TYR  22           H        TYR  22  -0.082   2.425  -0.486
  175    HA   TYR  22           HA       TYR  22  -2.199   1.971   1.503
  176   1HB   TYR  22          1HB       TYR  22  -3.527   1.023  -0.303
  177   2HB   TYR  22          2HB       TYR  22  -2.860   2.493  -0.985
  178    HD1  TYR  22           HD1      TYR  22  -2.567  -1.198  -0.928
  179    HD2  TYR  22           HD2      TYR  22  -1.293   2.426  -2.811
  180    HE1  TYR  22           HE1      TYR  22  -1.549  -2.537  -2.835
  181    HE2  TYR  22           HE2      TYR  22  -0.279   1.075  -4.712
  182    HH   TYR  22           HH       TYR  22  -0.276  -0.936  -5.684
  183    H    LYS  23           H        LYS  23  -2.308  -0.116   2.389
  184    HA   LYS  23           HA       LYS  23  -0.372  -2.049   1.370
  185   1HB   LYS  23          1HB       LYS  23   0.254  -2.542   3.782
  186   2HB   LYS  23          2HB       LYS  23   0.910  -1.076   3.084
  187   1HG   LYS  23          1HG       LYS  23  -1.408  -0.064   4.105
  188   2HG   LYS  23          2HG       LYS  23  -1.176  -1.398   5.217
  189   1HD   LYS  23          1HD       LYS  23   1.317   0.118   4.702
  190   2HD   LYS  23          2HD       LYS  23   0.050   1.108   5.398
  191   1HE   LYS  23          1HE       LYS  23  -0.257  -0.879   7.103
  192   2HE   LYS  23          2HE       LYS  23   1.323  -1.398   6.552
  193   1HZ   LYS  23          1HZ       LYS  23   0.611   0.907   8.111
  194   2HZ   LYS  23          2HZ       LYS  23   1.978   0.013   8.135
  195   3HZ   LYS  23          3HZ       LYS  23   1.773   1.162   6.992
  196    H    MET  24           H        MET  24  -1.351  -3.968   1.028
  197    HA   MET  24           HA       MET  24  -3.849  -4.387   2.474
  198   1HB   MET  24          1HB       MET  24  -2.880  -5.623  -0.164
  199   2HB   MET  24          2HB       MET  24  -4.474  -5.835   0.533
  200   1HG   MET  24          1HG       MET  24  -5.171  -3.675  -0.029
  201   2HG   MET  24          2HG       MET  24  -3.556  -3.004   0.084
  202   1HE   MET  24          1HE       MET  24  -4.929  -6.099  -1.380
  203   2HE   MET  24          2HE       MET  24  -5.885  -5.261  -2.627
  204   3HE   MET  24          3HE       MET  24  -4.396  -6.128  -3.078
  205    H    PHE  25           H        PHE  25  -4.328  -6.534   3.303
  206    HA   PHE  25           HA       PHE  25  -2.016  -8.326   3.378
  207   1HB   PHE  25          1HB       PHE  25  -3.861  -7.632   5.734
  208   2HB   PHE  25          2HB       PHE  25  -2.375  -8.559   5.816
  209    HD1  PHE  25           HD1      PHE  25  -0.488  -7.487   6.590
  210    HD2  PHE  25           HD2      PHE  25  -3.529  -5.167   4.749
  211    HE1  PHE  25           HE1      PHE  25   0.789  -5.392   7.118
  212    HE2  PHE  25           HE2      PHE  25  -2.251  -3.073   5.277
  213    HZ   PHE  25           HZ       PHE  25  -0.107  -3.210   6.455
  214    H    MET  26           H        MET  26  -2.558 -10.579   3.782
  215    HA   MET  26           HA       MET  26  -5.084 -11.221   2.655
  216   1HB   MET  26          1HB       MET  26  -2.893 -12.992   3.875
  217   2HB   MET  26          2HB       MET  26  -4.214 -13.577   2.883
  218   1HG   MET  26          1HG       MET  26  -3.355 -11.927   1.056
  219   2HG   MET  26          2HG       MET  26  -1.908 -11.775   2.033
  220   1HE   MET  26          1HE       MET  26  -3.575 -15.368  -0.148
  221   2HE   MET  26          2HE       MET  26  -3.883 -15.493   1.601
  222   3HE   MET  26          3HE       MET  26  -4.461 -14.074   0.695
  223    H    MET  27           H        MET  27  -6.523 -12.964   3.683
  224    HA   MET  27           HA       MET  27  -7.391 -12.031   6.144
  225   1HB   MET  27          1HB       MET  27  -7.957 -14.409   4.354
  226   2HB   MET  27          2HB       MET  27  -8.604 -14.457   5.982
  227   1HG   MET  27          1HG       MET  27  -9.045 -11.854   4.623
  228   2HG   MET  27          2HG       MET  27  -9.811 -13.202   3.804
  229   1HE   MET  27          1HE       MET  27 -11.169 -14.778   4.627
  230   2HE   MET  27          2HE       MET  27 -11.150 -15.200   6.356
  231   3HE   MET  27          3HE       MET  27 -12.551 -14.349   5.661
  232    H    SER  28           H        SER  28  -5.246 -14.744   5.207
  233    HA   SER  28           HA       SER  28  -5.277 -16.002   7.690
  234   1HB   SER  28          1HB       SER  28  -4.490 -17.232   5.788
  235   2HB   SER  28          2HB       SER  28  -3.320 -15.998   5.366
  236    HG   SER  28           HG       SER  28  -3.116 -18.099   7.202
  237    H    ASP  29           H        ASP  29  -2.069 -15.029   6.563
  238    HA   ASP  29           HA       ASP  29  -1.469 -14.018   9.125
  239   1HB   ASP  29          1HB       ASP  29   0.048 -15.206   7.310
  240   2HB   ASP  29          2HB       ASP  29   0.245 -13.593   6.657
  241    H    LEU  30           H        LEU  30  -3.024 -12.179   9.245
  242    HA   LEU  30           HA       LEU  30  -2.965 -10.119   7.305
  243   1HB   LEU  30          1HB       LEU  30  -4.078 -10.308  10.102
  244   2HB   LEU  30          2HB       LEU  30  -4.243  -8.879   9.102
  245    HG   LEU  30           HG       LEU  30  -5.138 -11.493   7.958
  246   1HD1  LEU  30          1HD1      LEU  30  -7.422 -10.490   9.182
  247   2HD1  LEU  30          2HD1      LEU  30  -6.511 -11.945   9.650
  248   3HD1  LEU  30          3HD1      LEU  30  -6.172 -10.389  10.444
  249   1HD2  LEU  30          1HD2      LEU  30  -6.556  -8.844   7.807
  250   2HD2  LEU  30          2HD2      LEU  30  -5.123  -9.175   6.804
  251   3HD2  LEU  30          3HD2      LEU  30  -6.567 -10.205   6.660
  252    H    THR  31           H        THR  31  -0.718 -11.113   9.648
  253    HA   THR  31           HA       THR  31   0.219  -8.436  10.264
  254    HB   THR  31           HB       THR  31   0.410 -11.135  11.365
  255    HG1  THR  31           HG1      THR  31   0.301  -9.704  13.055
  256   1HG2  THR  31          1HG2      THR  31   2.720 -11.135  10.395
  257   2HG2  THR  31          2HG2      THR  31   3.008  -9.527  11.104
  258   3HG2  THR  31          3HG2      THR  31   2.769 -10.938  12.163
  259    H    ILE  32           H        ILE  32   0.858 -11.060   7.989
  260    HA   ILE  32           HA       ILE  32   3.294  -9.671   7.152
  261    HB   ILE  32           HB       ILE  32   2.317 -12.474   7.025
  262   1HG1  ILE  32          1HG1      ILE  32   5.100 -11.323   7.360
  263   2HG1  ILE  32          2HG1      ILE  32   3.992 -11.600   8.690
  264   1HG2  ILE  32          1HG2      ILE  32   2.614 -12.502   4.780
  265   2HG2  ILE  32          2HG2      ILE  32   3.698 -11.090   4.787
  266   3HG2  ILE  32          3HG2      ILE  32   4.318 -12.690   5.258
  267   1HD1  ILE  32          1HD1      ILE  32   5.746 -13.486   7.484
  268   2HD1  ILE  32          2HD1      ILE  32   4.530 -13.797   8.746
  269   3HD1  ILE  32          3HD1      ILE  32   4.098 -13.983   7.029
  270    HA   PRO  33           HA       PRO  33   0.602  -7.680   4.228
  271   1HB   PRO  33          1HB       PRO  33   3.354  -6.863   3.190
  272   2HB   PRO  33          2HB       PRO  33   1.909  -5.866   3.431
  273   1HG   PRO  33          1HG       PRO  33   3.906  -5.766   5.275
  274   2HG   PRO  33          2HG       PRO  33   2.224  -5.850   5.848
  275   1HD   PRO  33          1HD       PRO  33   4.251  -8.150   5.679
  276   2HD   PRO  33          2HD       PRO  33   3.125  -7.737   7.001
  277    H    VAL  34           H        VAL  34   0.211  -7.457   1.869
  278    HA   VAL  34           HA       VAL  34   1.334  -9.714   0.367
  279    HB   VAL  34           HB       VAL  34  -1.281  -9.478   1.338
  280   1HG1  VAL  34          1HG1      VAL  34  -1.607  -7.827  -0.562
  281   2HG1  VAL  34          2HG1      VAL  34  -1.339  -9.188  -1.678
  282   3HG1  VAL  34          3HG1      VAL  34  -2.713  -9.221  -0.546
  283   1HG2  VAL  34          1HG2      VAL  34  -0.011 -11.245  -0.770
  284   2HG2  VAL  34          2HG2      VAL  34  -0.260 -11.595   0.957
  285   3HG2  VAL  34          3HG2      VAL  34  -1.656 -11.503  -0.143
  286    H    LYS  35           H        LYS  35  -0.160  -6.449   0.416
  287    HA   LYS  35           HA       LYS  35   1.219  -5.943  -2.120
  288   1HB   LYS  35          1HB       LYS  35  -1.559  -4.917  -1.487
  289   2HB   LYS  35          2HB       LYS  35  -0.664  -4.720  -2.981
  290   1HG   LYS  35          1HG       LYS  35  -0.709  -7.530  -2.442
  291   2HG   LYS  35          2HG       LYS  35  -2.334  -6.948  -2.140
  292   1HD   LYS  35          1HD       LYS  35  -2.688  -6.955  -4.379
  293   2HD   LYS  35          2HD       LYS  35  -1.551  -5.627  -4.515
  294   1HE   LYS  35          1HE       LYS  35   0.167  -6.985  -5.268
  295   2HE   LYS  35          2HE       LYS  35  -0.314  -8.339  -4.264
  296   1HZ   LYS  35          1HZ       LYS  35  -1.415  -9.174  -5.959
  297   2HZ   LYS  35          2HZ       LYS  35  -2.295  -7.816  -6.173
  298   3HZ   LYS  35          3HZ       LYS  35  -0.854  -7.983  -6.923
  299    H    ARG  36           H        ARG  36   2.366  -4.038  -2.182
  300    HA   ARG  36           HA       ARG  36   1.788  -2.097  -0.139
  301   1HB   ARG  36          1HB       ARG  36   4.702  -2.755  -0.471
  302   2HB   ARG  36          2HB       ARG  36   3.853  -2.178   0.949
  303   1HG   ARG  36          1HG       ARG  36   2.698  -4.507   1.007
  304   2HG   ARG  36          2HG       ARG  36   3.899  -5.012  -0.165
  305   1HD   ARG  36          1HD       ARG  36   5.259  -3.614   1.976
  306   2HD   ARG  36          2HD       ARG  36   4.190  -4.803   2.691
  307    HE   ARG  36           HE       ARG  36   6.637  -5.399   1.408
  308   1HH1  ARG  36          1HH1      ARG  36   3.297  -6.500   1.272
  309   2HH1  ARG  36          2HH1      ARG  36   3.712  -8.105   0.772
  310   1HH2  ARG  36          1HH2      ARG  36   7.185  -7.517   0.747
  311   2HH2  ARG  36          2HH2      ARG  36   5.939  -8.688   0.471
  312    H    GLY  37           H        GLY  37   1.496  -0.271  -1.388
  313   1HA   GLY  37          1HA       GLY  37   3.641   0.658  -3.066
  314   2HA   GLY  37          2HA       GLY  37   2.234   0.138  -3.974
  315    H    CYS  38           H        CYS  38   2.324   2.561  -4.559
  316    HA   CYS  38           HA       CYS  38   0.951   4.096  -2.475
  317   1HB   CYS  38          1HB       CYS  38   2.462   5.234  -4.828
  318   2HB   CYS  38          2HB       CYS  38   1.817   6.099  -3.448
  319    H    ILE  39           H        ILE  39  -0.850   5.485  -3.248
  320    HA   ILE  39           HA       ILE  39  -1.773   5.103  -5.936
  321    HB   ILE  39           HB       ILE  39  -2.464   3.022  -4.697
  322   1HG1  ILE  39          1HG1      ILE  39  -4.893   4.530  -5.623
  323   2HG1  ILE  39          2HG1      ILE  39  -3.594   4.203  -6.752
  324   1HG2  ILE  39          1HG2      ILE  39  -2.994   4.331  -2.564
  325   2HG2  ILE  39          2HG2      ILE  39  -4.527   4.769  -3.356
  326   3HG2  ILE  39          3HG2      ILE  39  -4.137   3.057  -3.055
  327   1HD1  ILE  39          1HD1      ILE  39  -3.946   1.750  -5.420
  328   2HD1  ILE  39          2HD1      ILE  39  -5.598   2.370  -5.651
  329   3HD1  ILE  39          3HD1      ILE  39  -4.524   2.156  -7.054
  330    H    ASP  40           H        ASP  40  -3.993   6.304  -6.171
  331    HA   ASP  40           HA       ASP  40  -3.567   8.829  -4.928
  332   1HB   ASP  40          1HB       ASP  40  -5.363   9.603  -6.406
  333   2HB   ASP  40          2HB       ASP  40  -4.250   8.604  -7.318
  334    H    VAL  41           H        VAL  41  -6.094   6.227  -5.030
  335    HA   VAL  41           HA       VAL  41  -7.210   7.364  -2.562
  336    HB   VAL  41           HB       VAL  41  -8.497   6.640  -5.125
  337   1HG1  VAL  41          1HG1      VAL  41 -10.643   6.057  -3.974
  338   2HG1  VAL  41          2HG1      VAL  41  -9.371   4.823  -3.804
  339   3HG1  VAL  41          3HG1      VAL  41  -9.735   5.919  -2.449
  340   1HG2  VAL  41          1HG2      VAL  41 -10.214   8.295  -3.989
  341   2HG2  VAL  41          2HG2      VAL  41  -8.834   8.651  -2.923
  342   3HG2  VAL  41          3HG2      VAL  41  -8.688   8.895  -4.680
  343    H    CYS  42           H        CYS  42  -7.727   5.878  -0.931
  344    HA   CYS  42           HA       CYS  42  -6.343   3.406  -1.128
  345   1HB   CYS  42          1HB       CYS  42  -6.890   5.037   0.924
  346   2HB   CYS  42          2HB       CYS  42  -8.234   3.927   1.111
  347    HA   PRO  43           HA       PRO  43  -9.830   1.211  -2.688
  348   1HB   PRO  43          1HB       PRO  43  -8.396  -1.327  -2.098
  349   2HB   PRO  43          2HB       PRO  43  -8.745  -0.575  -3.664
  350   1HG   PRO  43          1HG       PRO  43  -6.171  -0.652  -2.643
  351   2HG   PRO  43          2HG       PRO  43  -6.741   0.753  -3.574
  352   1HD   PRO  43          1HD       PRO  43  -6.741   0.473  -0.495
  353   2HD   PRO  43          2HD       PRO  43  -5.965   1.739  -1.483
  354    H    LYS  44           H        LYS  44 -11.424  -0.586  -2.354
  355    HA   LYS  44           HA       LYS  44 -12.410  -0.432   0.322
  356   1HB   LYS  44          1HB       LYS  44 -13.415  -1.834  -2.169
  357   2HB   LYS  44          2HB       LYS  44 -14.267  -1.835  -0.639
  358   1HG   LYS  44          1HG       LYS  44 -13.371   0.811  -1.803
  359   2HG   LYS  44          2HG       LYS  44 -14.780   0.024  -2.485
  360   1HD   LYS  44          1HD       LYS  44 -15.518  -0.210   0.070
  361   2HD   LYS  44          2HD       LYS  44 -14.380   1.101   0.313
  362   1HE   LYS  44          1HE       LYS  44 -15.803   2.629  -0.597
  363   2HE   LYS  44          2HE       LYS  44 -16.080   1.636  -2.014
  364   1HZ   LYS  44          1HZ       LYS  44 -17.714   0.415  -0.841
  365   2HZ   LYS  44          2HZ       LYS  44 -17.367   1.143   0.579
  366   3HZ   LYS  44          3HZ       LYS  44 -18.055   1.998  -0.630
  367    H    ASN  45           H        ASN  45 -12.640  -2.121   1.843
  368    HA   ASN  45           HA       ASN  45 -10.593  -4.094   1.574
  369   1HB   ASN  45          1HB       ASN  45 -12.628  -3.849   3.840
  370   2HB   ASN  45          2HB       ASN  45 -11.034  -4.572   3.919
  371   1HD2  ASN  45          1HD2      ASN  45 -12.901  -1.732   4.164
  372   2HD2  ASN  45          2HD2      ASN  45 -11.641  -0.588   4.484
  373    H    SER  46           H        SER  46 -11.003  -6.422   1.591
  374    HA   SER  46           HA       SER  46 -13.792  -7.087   1.047
  375   1HB   SER  46          1HB       SER  46 -12.882  -8.940  -0.410
  376   2HB   SER  46          2HB       SER  46 -12.555  -7.328  -1.013
  377    HG   SER  46           HG       SER  46 -10.775  -9.257  -0.541
  378    H    LEU  47           H        LEU  47 -13.991  -9.712   1.295
  379    HA   LEU  47           HA       LEU  47 -13.198 -10.190   4.031
  380   1HB   LEU  47          1HB       LEU  47 -14.971 -11.678   2.093
  381   2HB   LEU  47          2HB       LEU  47 -14.623 -12.238   3.716
  382    HG   LEU  47           HG       LEU  47 -15.851  -9.530   3.171
  383   1HD1  LEU  47          1HD1      LEU  47 -17.061 -12.142   2.852
  384   2HD1  LEU  47          2HD1      LEU  47 -17.863 -11.212   4.141
  385   3HD1  LEU  47          3HD1      LEU  47 -17.721 -10.525   2.506
  386   1HD2  LEU  47          1HD2      LEU  47 -16.030 -11.225   5.667
  387   2HD2  LEU  47          2HD2      LEU  47 -14.733 -10.036   5.393
  388   3HD2  LEU  47          3HD2      LEU  47 -16.431  -9.503   5.460
  389    H    LEU  48           H        LEU  48 -11.467 -10.283   1.322
  390    HA   LEU  48           HA       LEU  48 -10.297 -12.913   1.898
  391   1HB   LEU  48          1HB       LEU  48 -10.041 -11.225  -0.594
  392   2HB   LEU  48          2HB       LEU  48  -9.366 -12.823  -0.342
  393    HG   LEU  48           HG       LEU  48 -12.211 -12.900   0.132
  394   1HD1  LEU  48          1HD1      LEU  48 -11.349 -11.205  -2.106
  395   2HD1  LEU  48          2HD1      LEU  48 -12.457 -12.517  -2.570
  396   3HD1  LEU  48          3HD1      LEU  48 -12.935 -11.352  -1.312
  397   1HD2  LEU  48          1HD2      LEU  48 -11.984 -14.894  -0.849
  398   2HD2  LEU  48          2HD2      LEU  48 -11.200 -14.202  -2.289
  399   3HD2  LEU  48          3HD2      LEU  48 -10.235 -14.557  -0.836
  400    H    VAL  49           H        VAL  49  -9.443  -9.499   0.996
  401    HA   VAL  49           HA       VAL  49  -7.124  -9.791   2.766
  402    HB   VAL  49           HB       VAL  49  -5.679  -8.801   1.214
  403   1HG1  VAL  49          1HG1      VAL  49  -5.883 -11.090   0.667
  404   2HG1  VAL  49          2HG1      VAL  49  -7.463 -10.851  -0.117
  405   3HG1  VAL  49          3HG1      VAL  49  -5.984 -10.230  -0.889
  406   1HG2  VAL  49          1HG2      VAL  49  -7.214  -7.041   0.411
  407   2HG2  VAL  49          2HG2      VAL  49  -6.353  -7.840  -0.927
  408   3HG2  VAL  49          3HG2      VAL  49  -8.054  -8.245  -0.596
  409    H    LYS  50           H        LYS  50  -6.582  -7.916   3.953
  410    HA   LYS  50           HA       LYS  50  -8.717  -5.921   3.938
  411   1HB   LYS  50          1HB       LYS  50  -8.290  -7.126   6.043
  412   2HB   LYS  50          2HB       LYS  50  -6.629  -6.573   6.039
  413   1HG   LYS  50          1HG       LYS  50  -7.194  -4.490   6.794
  414   2HG   LYS  50          2HG       LYS  50  -8.543  -4.352   5.685
  415   1HD   LYS  50          1HD       LYS  50  -9.988  -4.787   7.373
  416   2HD   LYS  50          2HD       LYS  50  -9.257  -6.362   7.606
  417   1HE   LYS  50          1HE       LYS  50  -7.387  -4.685   8.804
  418   2HE   LYS  50          2HE       LYS  50  -8.890  -3.861   9.167
  419   1HZ   LYS  50          1HZ       LYS  50  -9.692  -5.706  10.273
  420   2HZ   LYS  50          2HZ       LYS  50  -8.623  -6.740   9.598
  421   3HZ   LYS  50          3HZ       LYS  50  -8.124  -5.671  10.727
  422    H    TYR  51           H        TYR  51  -8.345  -3.761   3.506
  423    HA   TYR  51           HA       TYR  51  -5.649  -3.173   2.509
  424   1HB   TYR  51          1HB       TYR  51  -8.453  -1.946   2.144
  425   2HB   TYR  51          2HB       TYR  51  -7.017  -1.277   1.395
  426    HD1  TYR  51           HD1      TYR  51  -6.689  -1.805  -0.833
  427    HD2  TYR  51           HD2      TYR  51  -8.688  -4.635   1.676
  428    HE1  TYR  51           HE1      TYR  51  -7.016  -3.351  -2.825
  429    HE2  TYR  51           HE2      TYR  51  -9.009  -6.172  -0.323
  430    HH   TYR  51           HH       TYR  51  -8.018  -6.588  -2.447
  431    H    VAL  52           H        VAL  52  -4.517  -1.318   3.186
  432    HA   VAL  52           HA       VAL  52  -5.789   0.231   5.320
  433    HB   VAL  52           HB       VAL  52  -3.273  -1.382   5.425
  434   1HG1  VAL  52          1HG1      VAL  52  -3.717   1.278   6.798
  435   2HG1  VAL  52          2HG1      VAL  52  -2.612   0.041   7.444
  436   3HG1  VAL  52          3HG1      VAL  52  -2.319   0.742   5.835
  437   1HG2  VAL  52          1HG2      VAL  52  -5.432  -2.116   6.486
  438   2HG2  VAL  52          2HG2      VAL  52  -4.060  -1.983   7.612
  439   3HG2  VAL  52          3HG2      VAL  52  -5.307  -0.713   7.575
  440    H    CYS  53           H        CYS  53  -4.901   2.395   5.559
  441    HA   CYS  53           HA       CYS  53  -3.508   3.223   3.119
  442   1HB   CYS  53          1HB       CYS  53  -5.191   5.015   4.864
  443   2HB   CYS  53          2HB       CYS  53  -4.599   5.320   3.243
  444    H    CYS  54           H        CYS  54  -1.987   5.129   3.460
  445    HA   CYS  54           HA       CYS  54  -1.183   5.741   6.105
  446   1HB   CYS  54          1HB       CYS  54   1.120   4.842   5.932
  447   2HB   CYS  54          2HB       CYS  54  -0.122   3.622   6.124
  448    H    ASN  55           H        ASN  55  -0.443   7.841   5.956
  449    HA   ASN  55           HA       ASN  55   0.221   8.759   3.293
  450   1HB   ASN  55          1HB       ASN  55   0.102  11.068   4.565
  451   2HB   ASN  55          2HB       ASN  55  -1.394  10.215   4.241
  452   1HD2  ASN  55          1HD2      ASN  55   1.219  10.368   6.654
  453   2HD2  ASN  55          2HD2      ASN  55   0.225  10.235   8.067
  454    H    THR  56           H        THR  56   1.822   7.359   5.788
  455    HA   THR  56           HA       THR  56   4.005   9.292   5.971
  456    HB   THR  56           HB       THR  56   4.778   7.684   7.760
  457    HG1  THR  56           HG1      THR  56   3.157   5.936   8.155
  458   1HG2  THR  56          1HG2      THR  56   1.845   8.552   7.863
  459   2HG2  THR  56          2HG2      THR  56   2.693   7.826   9.249
  460   3HG2  THR  56          3HG2      THR  56   3.238   9.388   8.590
  461    H    ASP  57           H        ASP  57   6.277   8.441   5.785
  462    HA   ASP  57           HA       ASP  57   6.440   7.151   3.257
  463   1HB   ASP  57          1HB       ASP  57   8.454   8.287   5.230
  464   2HB   ASP  57          2HB       ASP  57   8.996   7.382   3.831
  465    H    ARG  58           H        ARG  58   8.113   5.269   2.991
  466    HA   ARG  58           HA       ARG  58   8.367   3.122   3.351
  467   1HB   ARG  58          1HB       ARG  58   9.524   4.346   5.900
  468   2HB   ARG  58          2HB       ARG  58   9.767   2.662   5.478
  469   1HG   ARG  58          1HG       ARG  58  10.719   3.445   3.238
  470   2HG   ARG  58          2HG       ARG  58  10.633   5.089   3.841
  471   1HD   ARG  58          1HD       ARG  58  12.036   3.006   5.529
  472   2HD   ARG  58          2HD       ARG  58  12.865   3.637   4.120
  473    HE   ARG  58           HE       ARG  58  11.939   5.922   5.398
  474   1HH1  ARG  58          1HH1      ARG  58  13.898   3.173   6.393
  475   2HH1  ARG  58          2HH1      ARG  58  14.792   4.074   7.570
  476   1HH2  ARG  58          1HH2      ARG  58  13.119   7.110   6.952
  477   2HH2  ARG  58          2HH2      ARG  58  14.347   6.329   7.892
  478    H    CYS  59           H        CYS  59   5.690   3.899   4.051
  479    HA   CYS  59           HA       CYS  59   5.113   2.694   6.599
  480   1HB   CYS  59          1HB       CYS  59   2.826   3.323   6.180
  481   2HB   CYS  59          2HB       CYS  59   3.894   4.682   5.888
  482    H    ASN  60           H        ASN  60   4.475   2.122   3.069
  483    HA   ASN  60           HA       ASN  60   3.695  -0.586   3.780
  484   1HB   ASN  60          1HB       ASN  60   2.632  -0.682   1.563
  485   2HB   ASN  60          2HB       ASN  60   2.108   0.783   2.369
  486   1HD2  ASN  60          1HD2      ASN  60   4.326  -0.564  -0.006
  487   2HD2  ASN  60          2HD2      ASN  60   4.588   0.876  -0.932
  488   1H    HOH  61          1H        HOH  61  -1.115 -12.017   4.935
  489   2H    HOH  61          2H        HOH  61  -0.083 -11.618   3.903
  Start of MODEL   11
    1   1H    LEU   1           H1       LEU   1   5.711  12.270  -2.168
    2    HA   LEU   1           HA       LEU   1   6.313  10.970   0.338
    3   1HB   LEU   1          1HB       LEU   1   3.980  10.751  -1.568
    4   2HB   LEU   1          2HB       LEU   1   4.103   9.897  -0.043
    5    HG   LEU   1           HG       LEU   1   4.360  12.882  -0.033
    6   1HD1  LEU   1          1HD1      LEU   1   1.604  11.892   0.287
    7   2HD1  LEU   1          2HD1      LEU   1   2.221  13.361  -0.506
    8   3HD1  LEU   1          3HD1      LEU   1   2.245  11.805  -1.371
    9   1HD2  LEU   1          1HD2      LEU   1   3.277  10.814   1.892
   10   2HD2  LEU   1          2HD2      LEU   1   4.754  11.794   2.053
   11   3HD2  LEU   1          3HD2      LEU   1   3.156  12.572   2.145
   12    H    LYS   2           H        LYS   2   7.689   9.283   0.412
   13    HA   LYS   2           HA       LYS   2   7.595   7.421  -1.858
   14   1HB   LYS   2          1HB       LYS   2   9.972   8.580  -0.412
   15   2HB   LYS   2          2HB       LYS   2  10.079   7.028  -1.216
   16   1HG   LYS   2          1HG       LYS   2  10.227   8.016  -3.254
   17   2HG   LYS   2          2HG       LYS   2   8.750   8.920  -2.980
   18   1HD   LYS   2          1HD       LYS   2  10.282  10.671  -3.180
   19   2HD   LYS   2          2HD       LYS   2  10.289  10.444  -1.442
   20   1HE   LYS   2          1HE       LYS   2  12.204   8.614  -2.643
   21   2HE   LYS   2          2HE       LYS   2  12.504  10.232  -3.247
   22   1HZ   LYS   2          1HZ       LYS   2  13.549  10.493  -1.326
   23   2HZ   LYS   2          2HZ       LYS   2  12.077  10.646  -0.637
   24   3HZ   LYS   2          3HZ       LYS   2  12.844   9.204  -0.612
   25    H    CYS   3           H        CYS   3   7.704   5.194  -1.351
   26    HA   CYS   3           HA       CYS   3   7.688   4.588   1.503
   27   1HB   CYS   3          1HB       CYS   3   5.530   4.021  -0.483
   28   2HB   CYS   3          2HB       CYS   3   5.869   2.813   0.741
   29    H    ASN   4           H        ASN   4   7.795   1.999   1.684
   30    HA   ASN   4           HA       ASN   4  10.074   1.285   0.159
   31   1HB   ASN   4          1HB       ASN   4   8.507  -0.670   1.877
   32   2HB   ASN   4          2HB       ASN   4  10.242  -0.576   1.642
   33   1HD2  ASN   4          1HD2      ASN   4   8.014  -0.236   3.879
   34   2HD2  ASN   4          2HD2      ASN   4   8.646   1.039   4.868
   35    H    LYS   5           H        LYS   5  10.048  -1.165  -0.755
   36    HA   LYS   5           HA       LYS   5   7.731  -1.308  -2.517
   37   1HB   LYS   5          1HB       LYS   5  10.466  -2.611  -2.643
   38   2HB   LYS   5          2HB       LYS   5   9.182  -2.894  -3.802
   39   1HG   LYS   5          1HG       LYS   5  10.420  -0.172  -3.170
   40   2HG   LYS   5          2HG       LYS   5  10.772  -1.139  -4.589
   41   1HD   LYS   5          1HD       LYS   5   8.126   0.180  -3.854
   42   2HD   LYS   5          2HD       LYS   5   9.133   0.516  -5.249
   43   1HE   LYS   5          1HE       LYS   5   8.686  -2.182  -5.596
   44   2HE   LYS   5          2HE       LYS   5   7.196  -1.714  -4.801
   45   1HZ   LYS   5          1HZ       LYS   5   6.552  -0.923  -6.735
   46   2HZ   LYS   5          2HZ       LYS   5   7.713   0.224  -6.670
   47   3HZ   LYS   5          3HZ       LYS   5   8.007  -1.193  -7.427
   48    H    LEU   6           H        LEU   6   7.923  -4.103  -3.130
   49    HA   LEU   6           HA       LEU   6   6.138  -5.190  -1.431
   50   1HB   LEU   6          1HB       LEU   6   7.373  -5.988  -3.669
   51   2HB   LEU   6          2HB       LEU   6   8.210  -7.017  -2.524
   52    HG   LEU   6           HG       LEU   6   5.802  -7.639  -1.704
   53   1HD1  LEU   6          1HD1      LEU   6   4.957  -7.179  -4.519
   54   2HD1  LEU   6          2HD1      LEU   6   4.003  -7.209  -3.016
   55   3HD1  LEU   6          3HD1      LEU   6   4.968  -5.772  -3.428
   56   1HD2  LEU   6          1HD2      LEU   6   5.692  -9.328  -3.690
   57   2HD2  LEU   6          2HD2      LEU   6   7.261  -8.616  -4.137
   58   3HD2  LEU   6          3HD2      LEU   6   7.053  -9.384  -2.545
   59    H    VAL   7           H        VAL   7   9.678  -4.950  -1.004
   60    HA   VAL   7           HA       VAL   7   9.267  -5.854   1.749
   61    HB   VAL   7           HB       VAL   7  11.735  -6.628   0.237
   62   1HG1  VAL   7          1HG1      VAL   7  10.300  -7.525   2.729
   63   2HG1  VAL   7          2HG1      VAL   7  11.437  -8.615   1.898
   64   3HG1  VAL   7          3HG1      VAL   7  12.000  -7.042   2.512
   65   1HG2  VAL   7          1HG2      VAL   7   9.038  -7.978   0.088
   66   2HG2  VAL   7          2HG2      VAL   7  10.168  -7.575  -1.228
   67   3HG2  VAL   7          3HG2      VAL   7  10.551  -8.898  -0.100
   68    HA   PRO   8           HA       PRO   8  11.293  -2.135   2.696
   69   1HB   PRO   8          1HB       PRO   8  12.446  -3.555   5.105
   70   2HB   PRO   8          2HB       PRO   8  11.414  -2.118   5.033
   71   1HG   PRO   8          1HG       PRO   8  10.340  -4.507   5.804
   72   2HG   PRO   8          2HG       PRO   8   9.417  -3.463   4.696
   73   1HD   PRO   8          1HD       PRO   8  11.188  -5.869   3.921
   74   2HD   PRO   8          2HD       PRO   8   9.489  -5.554   3.477
   75    H    ILE   9           H        ILE   9  13.136  -4.468   1.326
   76    HA   ILE   9           HA       ILE   9  15.703  -3.333   2.101
   77    HB   ILE   9           HB       ILE   9  15.682  -5.684   2.083
   78   1HG1  ILE   9          1HG1      ILE   9  16.930  -5.386  -0.586
   79   2HG1  ILE   9          2HG1      ILE   9  17.470  -4.238   0.623
   80   1HG2  ILE   9          1HG2      ILE   9  14.010  -6.648   0.947
   81   2HG2  ILE   9          2HG2      ILE   9  13.957  -5.354  -0.275
   82   3HG2  ILE   9          3HG2      ILE   9  15.154  -6.664  -0.417
   83   1HD1  ILE   9          1HD1      ILE   9  17.248  -7.108   1.485
   84   2HD1  ILE   9          2HD1      ILE   9  18.579  -6.681   0.382
   85   3HD1  ILE   9          3HD1      ILE   9  18.435  -5.869   1.959
   86    H    ALA  10           H        ALA  10  13.180  -2.647  -0.014
   87    HA   ALA  10           HA       ALA  10  14.919  -0.967  -1.582
   88   1HB   ALA  10          1HB       ALA  10  14.026  -3.528  -2.568
   89   2HB   ALA  10          2HB       ALA  10  13.237  -2.233  -3.501
   90   3HB   ALA  10          3HB       ALA  10  15.013  -2.296  -3.390
   91    H    TYR  11           H        TYR  11  13.924   0.981  -1.757
   92    HA   TYR  11           HA       TYR  11  10.985   0.980  -1.642
   93   1HB   TYR  11          1HB       TYR  11  11.268   3.032  -0.228
   94   2HB   TYR  11          2HB       TYR  11  12.134   1.697   0.506
   95    HD1  TYR  11           HD1      TYR  11  14.624   1.587   0.362
   96    HD2  TYR  11           HD2      TYR  11  12.429   4.971  -1.064
   97    HE1  TYR  11           HE1      TYR  11  16.753   2.979   0.363
   98    HE2  TYR  11           HE2      TYR  11  14.564   6.350  -1.058
   99    HH   TYR  11           HH       TYR  11  17.101   5.734   0.588
  100    H    LYS  12           H        LYS  12   9.927   2.697  -2.804
  101    HA   LYS  12           HA       LYS  12  11.679   4.250  -4.551
  102   1HB   LYS  12          1HB       LYS  12   9.392   2.493  -5.481
  103   2HB   LYS  12          2HB       LYS  12  10.148   3.726  -6.469
  104   1HG   LYS  12          1HG       LYS  12  12.195   2.040  -5.247
  105   2HG   LYS  12          2HG       LYS  12  11.023   1.041  -6.082
  106   1HD   LYS  12          1HD       LYS  12  12.615   1.577  -7.765
  107   2HD   LYS  12          2HD       LYS  12  11.283   2.670  -8.086
  108   1HE   LYS  12          1HE       LYS  12  12.864   4.319  -8.034
  109   2HE   LYS  12          2HE       LYS  12  12.772   4.163  -6.291
  110   1HZ   LYS  12          1HZ       LYS  12  14.445   2.171  -7.129
  111   2HZ   LYS  12          2HZ       LYS  12  14.886   3.479  -8.001
  112   3HZ   LYS  12          3HZ       LYS  12  14.871   3.553  -6.370
  113    H    THR  13           H        THR  13   9.834   5.671  -5.979
  114    HA   THR  13           HA       THR  13   8.446   7.099  -3.830
  115    HB   THR  13           HB       THR  13   8.944   9.011  -5.053
  116    HG1  THR  13           HG1      THR  13   8.236   8.986  -7.161
  117   1HG2  THR  13          1HG2      THR  13  11.062   8.893  -6.152
  118   2HG2  THR  13          2HG2      THR  13  11.125   7.538  -5.001
  119   3HG2  THR  13          3HG2      THR  13  10.769   7.231  -6.718
  120    H    CYS  14           H        CYS  14   6.263   7.796  -4.041
  121    HA   CYS  14           HA       CYS  14   4.647   5.797  -5.227
  122   1HB   CYS  14          1HB       CYS  14   3.954   8.425  -3.901
  123   2HB   CYS  14          2HB       CYS  14   2.767   7.261  -4.453
  124    HA   PRO  15           HA       PRO  15   5.032   7.669  -9.282
  125   1HB   PRO  15          1HB       PRO  15   2.972   6.022 -10.373
  126   2HB   PRO  15          2HB       PRO  15   4.705   5.658 -10.342
  127   1HG   PRO  15          1HG       PRO  15   2.474   4.776  -8.395
  128   2HG   PRO  15          2HG       PRO  15   3.853   3.849  -9.030
  129   1HD   PRO  15          1HD       PRO  15   3.995   4.848  -6.504
  130   2HD   PRO  15          2HD       PRO  15   5.441   4.825  -7.550
  131    H    GLU  16           H        GLU  16   3.616   8.596 -11.080
  132    HA   GLU  16           HA       GLU  16   2.137  10.663 -10.025
  133   1HB   GLU  16          1HB       GLU  16   2.193   9.510 -12.846
  134   2HB   GLU  16          2HB       GLU  16   1.425  11.031 -12.436
  135   1HG   GLU  16          1HG       GLU  16   3.867  11.446 -11.282
  136   2HG   GLU  16          2HG       GLU  16   4.342  10.349 -12.564
  137    H    GLY  17           H        GLY  17  -0.099  11.068  -9.793
  138   1HA   GLY  17          1HA       GLY  17  -2.360  10.552 -10.151
  139   2HA   GLY  17          2HA       GLY  17  -1.937   8.889 -10.508
  140    H    LYS  18           H        LYS  18  -0.018   8.689  -8.190
  141    HA   LYS  18           HA       LYS  18  -2.069   8.302  -6.147
  142   1HB   LYS  18          1HB       LYS  18   0.741   7.173  -6.306
  143   2HB   LYS  18          2HB       LYS  18  -0.492   6.742  -5.139
  144   1HG   LYS  18          1HG       LYS  18  -1.612   5.396  -6.623
  145   2HG   LYS  18          2HG       LYS  18  -1.419   6.525  -7.948
  146   1HD   LYS  18          1HD       LYS  18   0.690   5.668  -8.562
  147   2HD   LYS  18          2HD       LYS  18   1.018   5.034  -6.962
  148   1HE   LYS  18          1HE       LYS  18   0.541   3.109  -8.300
  149   2HE   LYS  18          2HE       LYS  18  -0.910   3.369  -7.354
  150   1HZ   LYS  18          1HZ       LYS  18  -1.003   4.847  -9.746
  151   2HZ   LYS  18          2HZ       LYS  18  -0.738   3.268 -10.068
  152   3HZ   LYS  18          3HZ       LYS  18  -2.043   3.715  -9.195
  153    H    ASN  19           H        ASN  19  -1.366   8.733  -3.829
  154    HA   ASN  19           HA       ASN  19   0.581  10.859  -3.675
  155   1HB   ASN  19          1HB       ASN  19  -1.491  12.120  -3.956
  156   2HB   ASN  19          2HB       ASN  19  -2.347  11.087  -2.827
  157   1HD2  ASN  19          1HD2      ASN  19  -2.851  12.263  -1.140
  158   2HD2  ASN  19          2HD2      ASN  19  -1.794  13.285  -0.224
  159    H    LEU  20           H        LEU  20  -1.841   8.698  -2.069
  160    HA   LEU  20           HA       LEU  20  -0.234   8.733   0.368
  161   1HB   LEU  20          1HB       LEU  20  -2.881   7.359   0.009
  162   2HB   LEU  20          2HB       LEU  20  -2.111   7.898   1.488
  163    HG   LEU  20           HG       LEU  20  -2.565  10.157  -0.259
  164   1HD1  LEU  20          1HD1      LEU  20  -4.468   9.539  -1.260
  165   2HD1  LEU  20          2HD1      LEU  20  -4.709   8.153  -0.169
  166   3HD1  LEU  20          3HD1      LEU  20  -5.216   9.783   0.336
  167   1HD2  LEU  20          1HD2      LEU  20  -3.549  11.121   1.677
  168   2HD2  LEU  20          2HD2      LEU  20  -3.855   9.524   2.403
  169   3HD2  LEU  20          3HD2      LEU  20  -2.186  10.118   2.232
  170    H    CYS  21           H        CYS  21  -0.085   6.473   1.487
  171    HA   CYS  21           HA       CYS  21   0.883   4.649  -0.578
  172   1HB   CYS  21          1HB       CYS  21   1.674   5.167   2.265
  173   2HB   CYS  21          2HB       CYS  21   1.978   3.591   1.562
  174    H    TYR  22           H        TYR  22   0.244   2.399  -0.487
  175    HA   TYR  22           HA       TYR  22  -2.049   1.898   1.288
  176   1HB   TYR  22          1HB       TYR  22  -3.188   1.106  -0.623
  177   2HB   TYR  22          2HB       TYR  22  -2.120   2.235  -1.432
  178    HD1  TYR  22           HD1      TYR  22  -2.185  -1.341  -0.292
  179    HD2  TYR  22           HD2      TYR  22  -0.834   1.475  -3.217
  180    HE1  TYR  22           HE1      TYR  22  -1.223  -3.238  -1.684
  181    HE2  TYR  22           HE2      TYR  22   0.124  -0.433  -4.599
  182    HH   TYR  22           HH       TYR  22   0.959  -2.740  -4.145
  183    H    LYS  23           H        LYS  23  -2.306  -0.280   2.057
  184    HA   LYS  23           HA       LYS  23  -0.004  -2.019   1.558
  185   1HB   LYS  23          1HB       LYS  23  -0.439  -0.566   3.957
  186   2HB   LYS  23          2HB       LYS  23  -0.838  -2.235   4.307
  187   1HG   LYS  23          1HG       LYS  23   1.328  -3.019   3.639
  188   2HG   LYS  23          2HG       LYS  23   1.701  -1.532   2.790
  189   1HD   LYS  23          1HD       LYS  23   2.249  -0.383   4.737
  190   2HD   LYS  23          2HD       LYS  23   1.100  -1.269   5.719
  191   1HE   LYS  23          1HE       LYS  23   2.794  -3.314   5.088
  192   2HE   LYS  23          2HE       LYS  23   3.924  -1.978   4.994
  193   1HZ   LYS  23          1HZ       LYS  23   4.000  -2.465   7.186
  194   2HZ   LYS  23          2HZ       LYS  23   2.802  -1.356   7.234
  195   3HZ   LYS  23          3HZ       LYS  23   2.443  -2.948   7.288
  196    H    MET  24           H        MET  24  -0.763  -3.876   0.716
  197    HA   MET  24           HA       MET  24  -3.502  -4.578   1.366
  198   1HB   MET  24          1HB       MET  24  -1.537  -5.290  -0.852
  199   2HB   MET  24          2HB       MET  24  -2.932  -6.314  -0.580
  200   1HG   MET  24          1HG       MET  24  -4.472  -4.462  -0.982
  201   2HG   MET  24          2HG       MET  24  -3.163  -3.297  -0.986
  202   1HE   MET  24          1HE       MET  24  -4.182  -6.349  -4.258
  203   2HE   MET  24          2HE       MET  24  -3.512  -6.927  -2.713
  204   3HE   MET  24          3HE       MET  24  -5.060  -6.047  -2.739
  205    H    PHE  25           H        PHE  25  -3.995  -6.302   2.673
  206    HA   PHE  25           HA       PHE  25  -1.865  -8.261   3.127
  207   1HB   PHE  25          1HB       PHE  25  -3.807  -7.061   5.190
  208   2HB   PHE  25          2HB       PHE  25  -2.504  -8.176   5.545
  209    HD1  PHE  25           HD1      PHE  25  -0.390  -6.873   3.777
  210    HD2  PHE  25           HD2      PHE  25  -3.151  -5.259   6.567
  211    HE1  PHE  25           HE1      PHE  25   1.156  -4.938   4.188
  212    HE2  PHE  25           HE2      PHE  25  -1.604  -3.325   6.979
  213    HZ   PHE  25           HZ       PHE  25   0.530  -3.187   5.784
  214    H    MET  26           H        MET  26  -2.614 -10.402   3.724
  215    HA   MET  26           HA       MET  26  -5.184 -10.928   2.572
  216   1HB   MET  26          1HB       MET  26  -2.987 -12.717   3.751
  217   2HB   MET  26          2HB       MET  26  -4.440 -13.350   3.004
  218   1HG   MET  26          1HG       MET  26  -3.730 -11.810   0.955
  219   2HG   MET  26          2HG       MET  26  -2.147 -11.853   1.704
  220   1HE   MET  26          1HE       MET  26  -4.533 -15.430   0.096
  221   2HE   MET  26          2HE       MET  26  -4.875 -14.878   1.754
  222   3HE   MET  26          3HE       MET  26  -5.114 -13.771   0.381
  223    H    MET  27           H        MET  27  -6.773 -12.416   3.678
  224    HA   MET  27           HA       MET  27  -7.411 -11.379   6.179
  225   1HB   MET  27          1HB       MET  27  -8.385 -13.623   4.392
  226   2HB   MET  27          2HB       MET  27  -8.967 -13.603   6.045
  227   1HG   MET  27          1HG       MET  27  -9.101 -11.106   4.309
  228   2HG   MET  27          2HG       MET  27 -10.359 -12.324   4.239
  229   1HE   MET  27          1HE       MET  27 -11.151 -12.944   7.777
  230   2HE   MET  27          2HE       MET  27 -12.449 -12.191   6.820
  231   3HE   MET  27          3HE       MET  27 -11.340 -13.354   6.055
  232    H    SER  28           H        SER  28  -5.691 -14.338   5.127
  233    HA   SER  28           HA       SER  28  -5.804 -15.595   7.624
  234   1HB   SER  28          1HB       SER  28  -5.356 -16.872   5.597
  235   2HB   SER  28          2HB       SER  28  -3.927 -15.919   5.246
  236    HG   SER  28           HG       SER  28  -2.872 -16.813   7.077
  237    H    ASP  29           H        ASP  29  -2.569 -15.123   6.254
  238    HA   ASP  29           HA       ASP  29  -1.636 -14.236   8.767
  239   1HB   ASP  29          1HB       ASP  29  -0.459 -15.646   6.856
  240   2HB   ASP  29          2HB       ASP  29  -0.048 -14.080   6.186
  241    H    LEU  30           H        LEU  30  -2.836 -12.169   9.000
  242    HA   LEU  30           HA       LEU  30  -2.536 -10.139   7.023
  243   1HB   LEU  30          1HB       LEU  30  -3.438  -9.759   9.869
  244   2HB   LEU  30          2HB       LEU  30  -3.838  -8.797   8.460
  245    HG   LEU  30           HG       LEU  30  -4.743 -11.401   7.865
  246   1HD1  LEU  30          1HD1      LEU  30  -6.234 -11.927   9.736
  247   2HD1  LEU  30          2HD1      LEU  30  -4.523 -12.000  10.220
  248   3HD1  LEU  30          3HD1      LEU  30  -5.520 -10.600  10.683
  249   1HD2  LEU  30          1HD2      LEU  30  -5.788  -8.701   8.165
  250   2HD2  LEU  30          2HD2      LEU  30  -6.237  -9.986   7.019
  251   3HD2  LEU  30          3HD2      LEU  30  -6.976  -9.939   8.638
  252    H    THR  31           H        THR  31  -0.449 -11.480   9.346
  253    HA   THR  31           HA       THR  31   0.898  -8.981   9.953
  254    HB   THR  31           HB       THR  31   0.672 -11.675  11.059
  255    HG1  THR  31           HG1      THR  31   1.214 -10.358  12.859
  256   1HG2  THR  31          1HG2      THR  31   3.478 -10.515  10.654
  257   2HG2  THR  31          2HG2      THR  31   3.076 -11.738  11.885
  258   3HG2  THR  31          3HG2      THR  31   2.916 -12.129  10.156
  259    H    ILE  32           H        ILE  32   0.937 -11.435   7.504
  260    HA   ILE  32           HA       ILE  32   3.590 -10.481   6.680
  261    HB   ILE  32           HB       ILE  32   2.305 -13.159   6.647
  262   1HG1  ILE  32          1HG1      ILE  32   5.226 -12.407   6.843
  263   2HG1  ILE  32          2HG1      ILE  32   4.151 -12.348   8.225
  264   1HG2  ILE  32          1HG2      ILE  32   2.524 -13.160   4.365
  265   2HG2  ILE  32          2HG2      ILE  32   3.893 -12.022   4.379
  266   3HG2  ILE  32          3HG2      ILE  32   4.142 -13.721   4.849
  267   1HD1  ILE  32          1HD1      ILE  32   4.098 -14.620   8.437
  268   2HD1  ILE  32          2HD1      ILE  32   3.929 -14.868   6.684
  269   3HD1  ILE  32          3HD1      ILE  32   5.539 -14.595   7.392
  270    HA   PRO  33           HA       PRO  33   0.854  -8.310   3.856
  271   1HB   PRO  33          1HB       PRO  33   3.626  -7.432   2.929
  272   2HB   PRO  33          2HB       PRO  33   2.165  -6.457   3.158
  273   1HG   PRO  33          1HG       PRO  33   4.109  -6.411   5.067
  274   2HG   PRO  33          2HG       PRO  33   2.408  -6.514   5.581
  275   1HD   PRO  33          1HD       PRO  33   4.449  -8.798   5.425
  276   2HD   PRO  33          2HD       PRO  33   3.250  -8.443   6.699
  277    H    VAL  34           H        VAL  34   0.218  -8.284   1.661
  278    HA   VAL  34           HA       VAL  34   1.380 -10.488   0.115
  279    HB   VAL  34           HB       VAL  34  -1.078  -9.594  -0.975
  280   1HG1  VAL  34          1HG1      VAL  34  -1.825 -11.873  -0.369
  281   2HG1  VAL  34          2HG1      VAL  34  -0.212 -11.868  -1.121
  282   3HG1  VAL  34          3HG1      VAL  34  -0.372 -12.068   0.641
  283   1HG2  VAL  34          1HG2      VAL  34  -1.687  -8.510   1.069
  284   2HG2  VAL  34          2HG2      VAL  34  -2.576 -10.051   1.006
  285   3HG2  VAL  34          3HG2      VAL  34  -1.137  -9.896   2.042
  286    H    LYS  35           H        LYS  35   0.149  -7.091  -0.081
  287    HA   LYS  35           HA       LYS  35   2.084  -6.639  -2.204
  288   1HB   LYS  35          1HB       LYS  35  -0.779  -5.756  -2.579
  289   2HB   LYS  35          2HB       LYS  35   0.530  -5.731  -3.743
  290   1HG   LYS  35          1HG       LYS  35   0.599  -8.343  -3.364
  291   2HG   LYS  35          2HG       LYS  35  -1.001  -8.127  -2.682
  292   1HD   LYS  35          1HD       LYS  35  -1.736  -8.326  -4.835
  293   2HD   LYS  35          2HD       LYS  35  -1.233  -6.656  -5.005
  294   1HE   LYS  35          1HE       LYS  35   0.846  -8.812  -5.398
  295   2HE   LYS  35          2HE       LYS  35  -0.335  -8.563  -6.669
  296   1HZ   LYS  35          1HZ       LYS  35   1.590  -7.193  -6.992
  297   2HZ   LYS  35          2HZ       LYS  35   0.295  -6.240  -6.707
  298   3HZ   LYS  35          3HZ       LYS  35   1.403  -6.483  -5.533
  299    H    ARG  36           H        ARG  36   2.650  -4.370  -2.440
  300    HA   ARG  36           HA       ARG  36   1.483  -2.596  -0.520
  301   1HB   ARG  36          1HB       ARG  36   4.382  -3.527  -0.380
  302   2HB   ARG  36          2HB       ARG  36   3.908  -1.967   0.263
  303   1HG   ARG  36          1HG       ARG  36   2.169  -3.133   1.689
  304   2HG   ARG  36          2HG       ARG  36   2.762  -4.673   1.099
  305   1HD   ARG  36          1HD       ARG  36   4.968  -2.992   2.079
  306   2HD   ARG  36          2HD       ARG  36   3.752  -3.228   3.318
  307    HE   ARG  36           HE       ARG  36   4.239  -5.753   2.077
  308   1HH1  ARG  36          1HH1      ARG  36   5.882  -3.420   4.137
  309   2HH1  ARG  36          2HH1      ARG  36   6.887  -4.608   4.898
  310   1HH2  ARG  36          1HH2      ARG  36   5.565  -7.321   3.081
  311   2HH2  ARG  36          2HH2      ARG  36   6.705  -6.841   4.294
  312    H    GLY  37           H        GLY  37   1.387  -0.541  -1.422
  313   1HA   GLY  37          1HA       GLY  37   3.455   0.430  -3.167
  314   2HA   GLY  37          2HA       GLY  37   1.983   0.009  -4.019
  315    H    CYS  38           H        CYS  38   1.425   2.168  -4.571
  316    HA   CYS  38           HA       CYS  38   0.610   3.769  -2.256
  317   1HB   CYS  38          1HB       CYS  38   1.577   4.913  -4.877
  318   2HB   CYS  38          2HB       CYS  38   1.193   5.782  -3.405
  319    H    ILE  39           H        ILE  39  -1.233   5.337  -2.896
  320    HA   ILE  39           HA       ILE  39  -2.735   4.553  -5.225
  321    HB   ILE  39           HB       ILE  39  -3.213   2.933  -3.250
  322   1HG1  ILE  39          1HG1      ILE  39  -5.846   3.632  -4.052
  323   2HG1  ILE  39          2HG1      ILE  39  -4.794   4.008  -5.402
  324   1HG2  ILE  39          1HG2      ILE  39  -4.618   3.595  -1.549
  325   2HG2  ILE  39          2HG2      ILE  39  -3.582   5.030  -1.731
  326   3HG2  ILE  39          3HG2      ILE  39  -5.215   5.015  -2.441
  327   1HD1  ILE  39          1HD1      ILE  39  -3.729   1.667  -5.006
  328   2HD1  ILE  39          2HD1      ILE  39  -5.156   1.342  -3.994
  329   3HD1  ILE  39          3HD1      ILE  39  -5.357   1.721  -5.721
  330    H    ASP  40           H        ASP  40  -4.747   5.974  -5.425
  331    HA   ASP  40           HA       ASP  40  -3.946   8.601  -4.567
  332   1HB   ASP  40          1HB       ASP  40  -4.560   8.293  -6.923
  333   2HB   ASP  40          2HB       ASP  40  -6.101   7.587  -6.476
  334    H    VAL  41           H        VAL  41  -6.654   6.224  -4.344
  335    HA   VAL  41           HA       VAL  41  -7.774   7.847  -2.167
  336    HB   VAL  41           HB       VAL  41  -9.026   6.733  -4.605
  337   1HG1  VAL  41          1HG1      VAL  41 -10.073   5.232  -3.073
  338   2HG1  VAL  41          2HG1      VAL  41 -10.330   6.524  -1.876
  339   3HG1  VAL  41          3HG1      VAL  41 -11.245   6.530  -3.403
  340   1HG2  VAL  41          1HG2      VAL  41 -10.678   8.673  -3.591
  341   2HG2  VAL  41          2HG2      VAL  41  -9.092   9.176  -2.957
  342   3HG2  VAL  41          3HG2      VAL  41  -9.323   8.963  -4.708
  343    H    CYS  42           H        CYS  42  -8.498   6.695  -0.336
  344    HA   CYS  42           HA       CYS  42  -7.140   4.305   0.150
  345   1HB   CYS  42          1HB       CYS  42  -8.065   6.142   1.762
  346   2HB   CYS  42          2HB       CYS  42  -9.523   5.168   1.756
  347    HA   PRO  43           HA       PRO  43 -10.149   1.919  -2.171
  348   1HB   PRO  43          1HB       PRO  43  -8.224  -0.321  -1.546
  349   2HB   PRO  43          2HB       PRO  43  -8.841   0.229  -3.113
  350   1HG   PRO  43          1HG       PRO  43  -6.275   0.825  -2.387
  351   2HG   PRO  43          2HG       PRO  43  -7.260   2.074  -3.183
  352   1HD   PRO  43          1HD       PRO  43  -6.786   1.754  -0.149
  353   2HD   PRO  43          2HD       PRO  43  -6.539   3.202  -1.164
  354    H    LYS  44           H        LYS  44 -11.709   0.230  -1.970
  355    HA   LYS  44           HA       LYS  44 -12.576  -0.136   0.725
  356   1HB   LYS  44          1HB       LYS  44 -13.717  -1.338  -1.811
  357   2HB   LYS  44          2HB       LYS  44 -14.523  -1.157  -0.267
  358   1HG   LYS  44          1HG       LYS  44 -15.316   0.799  -1.149
  359   2HG   LYS  44          2HG       LYS  44 -13.746   1.443  -0.715
  360   1HD   LYS  44          1HD       LYS  44 -13.149   1.703  -2.894
  361   2HD   LYS  44          2HD       LYS  44 -13.596   0.054  -3.286
  362   1HE   LYS  44          1HE       LYS  44 -16.089   1.040  -3.089
  363   2HE   LYS  44          2HE       LYS  44 -15.277   2.559  -3.413
  364   1HZ   LYS  44          1HZ       LYS  44 -14.641   0.277  -5.091
  365   2HZ   LYS  44          2HZ       LYS  44 -16.062   1.044  -5.334
  366   3HZ   LYS  44          3HZ       LYS  44 -14.657   1.866  -5.467
  367    H    ASN  45           H        ASN  45 -12.445  -1.942   2.023
  368    HA   ASN  45           HA       ASN  45 -10.531  -3.878   1.164
  369   1HB   ASN  45          1HB       ASN  45 -12.135  -3.975   3.754
  370   2HB   ASN  45          2HB       ASN  45 -10.527  -4.609   3.465
  371   1HD2  ASN  45          1HD2      ASN  45 -12.420  -1.932   4.398
  372   2HD2  ASN  45          2HD2      ASN  45 -11.162  -0.767   4.649
  373    H    SER  46           H        SER  46 -11.009  -6.261   1.253
  374    HA   SER  46           HA       SER  46 -13.849  -6.761   0.814
  375   1HB   SER  46          1HB       SER  46 -13.080  -8.675  -0.649
  376   2HB   SER  46          2HB       SER  46 -12.670  -7.087  -1.267
  377    HG   SER  46           HG       SER  46 -10.922  -8.781  -1.284
  378    H    LEU  47           H        LEU  47 -14.147  -9.409   1.032
  379    HA   LEU  47           HA       LEU  47 -13.401  -9.911   3.776
  380   1HB   LEU  47          1HB       LEU  47 -15.208 -11.327   1.818
  381   2HB   LEU  47          2HB       LEU  47 -14.885 -11.918   3.435
  382    HG   LEU  47           HG       LEU  47 -16.102  -9.212   2.821
  383   1HD1  LEU  47          1HD1      LEU  47 -17.691 -11.451   4.001
  384   2HD1  LEU  47          2HD1      LEU  47 -18.215 -10.062   3.017
  385   3HD1  LEU  47          3HD1      LEU  47 -17.396 -11.442   2.244
  386   1HD2  LEU  47          1HD2      LEU  47 -16.814  -9.522   5.302
  387   2HD2  LEU  47          2HD2      LEU  47 -15.461 -10.678   5.365
  388   3HD2  LEU  47          3HD2      LEU  47 -15.161  -8.979   4.922
  389    H    LEU  48           H        LEU  48 -11.655 -10.072   1.073
  390    HA   LEU  48           HA       LEU  48 -10.534 -12.708   1.727
  391   1HB   LEU  48          1HB       LEU  48 -10.299 -11.188  -0.870
  392   2HB   LEU  48          2HB       LEU  48  -9.704 -12.801  -0.534
  393    HG   LEU  48           HG       LEU  48 -12.589 -12.512  -0.058
  394   1HD1  LEU  48          1HD1      LEU  48 -12.891 -12.674  -2.684
  395   2HD1  LEU  48          2HD1      LEU  48 -12.872 -11.109  -1.836
  396   3HD1  LEU  48          3HD1      LEU  48 -11.411 -11.686  -2.674
  397   1HD2  LEU  48          1HD2      LEU  48 -10.990 -14.603  -0.284
  398   2HD2  LEU  48          2HD2      LEU  48 -12.684 -14.664  -0.825
  399   3HD2  LEU  48          3HD2      LEU  48 -11.378 -14.422  -2.011
  400    H    VAL  49           H        VAL  49  -9.662  -9.373   0.577
  401    HA   VAL  49           HA       VAL  49  -7.289  -9.588   2.286
  402    HB   VAL  49           HB       VAL  49  -7.457  -9.270  -0.611
  403   1HG1  VAL  49          1HG1      VAL  49  -5.950  -7.208   1.017
  404   2HG1  VAL  49          2HG1      VAL  49  -5.537  -7.605  -0.668
  405   3HG1  VAL  49          3HG1      VAL  49  -7.141  -6.937  -0.277
  406   1HG2  VAL  49          1HG2      VAL  49  -6.122 -10.946   0.816
  407   2HG2  VAL  49          2HG2      VAL  49  -5.298 -10.199  -0.573
  408   3HG2  VAL  49          3HG2      VAL  49  -4.974  -9.611   1.076
  409    H    LYS  50           H        LYS  50  -6.648  -7.629   3.299
  410    HA   LYS  50           HA       LYS  50  -8.734  -5.572   3.170
  411   1HB   LYS  50          1HB       LYS  50  -8.397  -6.776   5.339
  412   2HB   LYS  50          2HB       LYS  50  -6.765  -6.140   5.404
  413   1HG   LYS  50          1HG       LYS  50  -7.467  -3.984   5.879
  414   2HG   LYS  50          2HG       LYS  50  -8.910  -4.116   4.895
  415   1HD   LYS  50          1HD       LYS  50  -9.425  -5.967   6.906
  416   2HD   LYS  50          2HD       LYS  50  -8.522  -4.741   7.774
  417   1HE   LYS  50          1HE       LYS  50 -10.288  -3.237   6.186
  418   2HE   LYS  50          2HE       LYS  50 -11.255  -4.618   6.664
  419   1HZ   LYS  50          1HZ       LYS  50  -9.786  -3.720   8.860
  420   2HZ   LYS  50          2HZ       LYS  50 -10.568  -2.446   8.203
  421   3HZ   LYS  50          3HZ       LYS  50 -11.408  -3.767   8.671
  422    H    TYR  51           H        TYR  51  -8.208  -3.432   2.740
  423    HA   TYR  51           HA       TYR  51  -5.432  -3.035   1.863
  424   1HB   TYR  51          1HB       TYR  51  -8.129  -1.679   1.234
  425   2HB   TYR  51          2HB       TYR  51  -6.609  -1.169   0.528
  426    HD1  TYR  51           HD1      TYR  51  -8.607  -4.329   0.917
  427    HD2  TYR  51           HD2      TYR  51  -6.120  -1.930  -1.606
  428    HE1  TYR  51           HE1      TYR  51  -8.925  -5.987  -0.985
  429    HE2  TYR  51           HE2      TYR  51  -6.445  -3.595  -3.499
  430    HH   TYR  51           HH       TYR  51  -8.038  -5.252  -4.181
  431    H    VAL  52           H        VAL  52  -4.161  -1.621   2.960
  432    HA   VAL  52           HA       VAL  52  -5.518   0.101   4.910
  433    HB   VAL  52           HB       VAL  52  -2.588  -0.516   4.934
  434   1HG1  VAL  52          1HG1      VAL  52  -3.080   1.026   6.589
  435   2HG1  VAL  52          2HG1      VAL  52  -4.690   0.335   6.908
  436   3HG1  VAL  52          3HG1      VAL  52  -3.229  -0.509   7.480
  437   1HG2  VAL  52          1HG2      VAL  52  -3.098  -2.727   4.927
  438   2HG2  VAL  52          2HG2      VAL  52  -3.515  -2.411   6.628
  439   3HG2  VAL  52          3HG2      VAL  52  -4.794  -2.451   5.391
  440    H    CYS  53           H        CYS  53  -4.100   2.192   5.360
  441    HA   CYS  53           HA       CYS  53  -2.957   3.179   2.883
  442   1HB   CYS  53          1HB       CYS  53  -5.187   4.647   4.307
  443   2HB   CYS  53          2HB       CYS  53  -4.282   5.223   2.921
  444    H    CYS  54           H        CYS  54  -1.446   4.928   3.285
  445    HA   CYS  54           HA       CYS  54  -1.181   5.871   5.988
  446   1HB   CYS  54          1HB       CYS  54   1.263   5.216   6.050
  447   2HB   CYS  54          2HB       CYS  54   0.087   3.955   6.366
  448    H    ASN  55           H        ASN  55  -0.323   7.968   5.940
  449    HA   ASN  55           HA       ASN  55   0.378   8.902   3.290
  450   1HB   ASN  55          1HB       ASN  55   0.229  11.196   4.705
  451   2HB   ASN  55          2HB       ASN  55  -1.212  10.414   4.089
  452   1HD2  ASN  55          1HD2      ASN  55   1.014   9.971   6.840
  453   2HD2  ASN  55          2HD2      ASN  55  -0.189   9.867   8.082
  454    H    THR  56           H        THR  56   1.979   7.484   5.728
  455    HA   THR  56           HA       THR  56   4.084   9.486   6.054
  456    HB   THR  56           HB       THR  56   4.894   7.711   7.731
  457    HG1  THR  56           HG1      THR  56   3.642   5.853   7.780
  458   1HG2  THR  56          1HG2      THR  56   2.952   9.611   8.112
  459   2HG2  THR  56          2HG2      THR  56   2.004   8.136   8.413
  460   3HG2  THR  56          3HG2      THR  56   3.455   8.474   9.387
  461    H    ASP  57           H        ASP  57   6.399   8.628   5.948
  462    HA   ASP  57           HA       ASP  57   6.642   7.459   3.348
  463   1HB   ASP  57          1HB       ASP  57   9.030   8.036   5.089
  464   2HB   ASP  57          2HB       ASP  57   8.835   8.287   3.365
  465    H    ARG  58           H        ARG  58   8.309   5.629   3.025
  466    HA   ARG  58           HA       ARG  58   8.660   3.494   3.367
  467   1HB   ARG  58          1HB       ARG  58   9.856   4.718   5.901
  468   2HB   ARG  58          2HB       ARG  58  10.169   3.067   5.408
  469   1HG   ARG  58          1HG       ARG  58  11.326   3.740   3.431
  470   2HG   ARG  58          2HG       ARG  58  10.638   5.351   3.464
  471   1HD   ARG  58          1HD       ARG  58  12.219   4.636   5.891
  472   2HD   ARG  58          2HD       ARG  58  13.153   4.710   4.410
  473    HE   ARG  58           HE       ARG  58  11.446   7.010   4.531
  474   1HH1  ARG  58          1HH1      ARG  58  14.299   5.669   6.095
  475   2HH1  ARG  58          2HH1      ARG  58  14.940   7.216   6.538
  476   1HH2  ARG  58          1HH2      ARG  58  12.292   9.051   5.115
  477   2HH2  ARG  58          2HH2      ARG  58  13.791   9.153   5.977
  478    H    CYS  59           H        CYS  59   5.986   4.205   4.195
  479    HA   CYS  59           HA       CYS  59   5.552   2.945   6.743
  480   1HB   CYS  59          1HB       CYS  59   3.234   3.518   6.435
  481   2HB   CYS  59          2HB       CYS  59   4.251   4.909   6.113
  482    H    ASN  60           H        ASN  60   4.810   2.399   3.231
  483    HA   ASN  60           HA       ASN  60   4.055  -0.316   3.924
  484   1HB   ASN  60          1HB       ASN  60   3.001  -0.406   1.718
  485   2HB   ASN  60          2HB       ASN  60   2.514   1.095   2.479
  486   1HD2  ASN  60          1HD2      ASN  60   4.909  -0.334   0.295
  487   2HD2  ASN  60          2HD2      ASN  60   5.159   1.054  -0.711
  488   1H    HOH  61          1H        HOH  61  -0.819 -12.258   4.416
  489   2H    HOH  61          2H        HOH  61  -0.164 -11.563   3.242
  Start of MODEL   12
    1   1H    LEU   1           H1       LEU   1   7.131  12.656  -1.017
    2    HA   LEU   1           HA       LEU   1   7.021  10.981   0.450
    3   1HB   LEU   1          1HB       LEU   1   4.481  11.054  -1.067
    4   2HB   LEU   1          2HB       LEU   1   4.728   9.643  -0.057
    5    HG   LEU   1           HG       LEU   1   5.025  12.456   1.010
    6   1HD1  LEU   1          1HD1      LEU   1   2.654  11.859   1.990
    7   2HD1  LEU   1          2HD1      LEU   1   2.827  12.606   0.383
    8   3HD1  LEU   1          3HD1      LEU   1   2.545  10.855   0.525
    9   1HD2  LEU   1          1HD2      LEU   1   4.998  11.523   3.135
   10   2HD2  LEU   1          2HD2      LEU   1   4.259  10.003   2.574
   11   3HD2  LEU   1          3HD2      LEU   1   5.963  10.355   2.199
   12    H    LYS   2           H        LYS   2   8.291   9.223   0.644
   13    HA   LYS   2           HA       LYS   2   8.300   7.359  -1.624
   14   1HB   LYS   2          1HB       LYS   2  10.509   7.796   0.400
   15   2HB   LYS   2          2HB       LYS   2  10.583   6.843  -1.067
   16   1HG   LYS   2          1HG       LYS   2  10.132   8.938  -2.408
   17   2HG   LYS   2          2HG       LYS   2  10.171   9.867  -0.922
   18   1HD   LYS   2          1HD       LYS   2  12.532   8.791  -0.547
   19   2HD   LYS   2          2HD       LYS   2  12.452   8.350  -2.241
   20   1HE   LYS   2          1HE       LYS   2  11.668  11.149  -1.880
   21   2HE   LYS   2          2HE       LYS   2  13.239  10.857  -1.158
   22   1HZ   LYS   2          1HZ       LYS   2  14.117  10.692  -3.157
   23   2HZ   LYS   2          2HZ       LYS   2  13.038   9.572  -3.652
   24   3HZ   LYS   2          3HZ       LYS   2  12.697  11.161  -3.810
   25    H    CYS   3           H        CYS   3   8.092   5.129  -1.237
   26    HA   CYS   3           HA       CYS   3   7.616   4.383   1.541
   27   1HB   CYS   3          1HB       CYS   3   5.680   4.185  -0.726
   28   2HB   CYS   3          2HB       CYS   3   5.721   2.885   0.448
   29    H    ASN   4           H        ASN   4   7.679   1.905   1.749
   30    HA   ASN   4           HA       ASN   4   9.919   0.986   0.314
   31   1HB   ASN   4          1HB       ASN   4   8.096  -0.843   1.912
   32   2HB   ASN   4          2HB       ASN   4   9.842  -0.890   1.784
   33   1HD2  ASN   4          1HD2      ASN   4  11.102   0.717   2.832
   34   2HD2  ASN   4          2HD2      ASN   4  10.524   1.545   4.240
   35    H    LYS   5           H        LYS   5   9.849  -1.273  -0.820
   36    HA   LYS   5           HA       LYS   5   7.515  -1.310  -2.564
   37   1HB   LYS   5          1HB       LYS   5  10.266  -2.558  -2.807
   38   2HB   LYS   5          2HB       LYS   5   8.972  -2.804  -3.962
   39   1HG   LYS   5          1HG       LYS   5   9.320   0.050  -3.361
   40   2HG   LYS   5          2HG       LYS   5  10.820  -0.663  -3.918
   41   1HD   LYS   5          1HD       LYS   5   9.676   0.069  -5.897
   42   2HD   LYS   5          2HD       LYS   5   9.508  -1.676  -5.872
   43   1HE   LYS   5          1HE       LYS   5   7.244  -1.519  -5.790
   44   2HE   LYS   5          2HE       LYS   5   7.316  -0.491  -4.372
   45   1HZ   LYS   5          1HZ       LYS   5   7.905   1.325  -6.005
   46   2HZ   LYS   5          2HZ       LYS   5   7.382   0.319  -7.179
   47   3HZ   LYS   5          3HZ       LYS   5   6.357   0.804  -6.005
   48    H    LEU   6           H        LEU   6   7.707  -4.047  -3.381
   49    HA   LEU   6           HA       LEU   6   5.952  -5.269  -1.748
   50   1HB   LEU   6          1HB       LEU   6   7.175  -5.895  -4.050
   51   2HB   LEU   6          2HB       LEU   6   8.025  -7.000  -2.987
   52    HG   LEU   6           HG       LEU   6   5.992  -7.915  -4.181
   53   1HD1  LEU   6          1HD1      LEU   6   6.888  -9.182  -2.396
   54   2HD1  LEU   6          2HD1      LEU   6   6.237  -8.065  -1.173
   55   3HD1  LEU   6          3HD1      LEU   6   5.132  -9.097  -2.113
   56   1HD2  LEU   6          1HD2      LEU   6   4.714  -5.676  -3.481
   57   2HD2  LEU   6          2HD2      LEU   6   3.871  -7.216  -3.774
   58   3HD2  LEU   6          3HD2      LEU   6   4.234  -6.702  -2.109
   59    H    VAL   7           H        VAL   7   9.470  -4.953  -1.296
   60    HA   VAL   7           HA       VAL   7   9.101  -6.125   1.361
   61    HB   VAL   7           HB       VAL   7  10.906  -7.003  -0.820
   62   1HG1  VAL   7          1HG1      VAL   7  11.846  -6.447   1.965
   63   2HG1  VAL   7          2HG1      VAL   7  12.401  -7.942   1.172
   64   3HG1  VAL   7          3HG1      VAL   7  12.726  -6.362   0.419
   65   1HG2  VAL   7          1HG2      VAL   7  10.696  -9.089   0.873
   66   2HG2  VAL   7          2HG2      VAL   7   9.232  -8.187   1.336
   67   3HG2  VAL   7          3HG2      VAL   7   9.465  -8.699  -0.353
   68    HA   PRO   8           HA       PRO   8  10.913  -2.369   2.587
   69   1HB   PRO   8          1HB       PRO   8  11.946  -3.895   4.988
   70   2HB   PRO   8          2HB       PRO   8  10.895  -2.470   4.928
   71   1HG   PRO   8          1HG       PRO   8   9.811  -4.903   5.507
   72   2HG   PRO   8          2HG       PRO   8   8.948  -3.825   4.386
   73   1HD   PRO   8          1HD       PRO   8  10.813  -6.164   3.627
   74   2HD   PRO   8          2HD       PRO   8   9.141  -5.859   3.085
   75    H    ILE   9           H        ILE   9  12.902  -4.603   1.239
   76    HA   ILE   9           HA       ILE   9  15.377  -3.406   2.210
   77    HB   ILE   9           HB       ILE   9  14.597  -5.986   1.325
   78   1HG1  ILE   9          1HG1      ILE   9  17.457  -5.396   1.866
   79   2HG1  ILE   9          2HG1      ILE   9  16.325  -4.916   3.115
   80   1HG2  ILE   9          1HG2      ILE   9  15.231  -5.104  -0.945
   81   2HG2  ILE   9          2HG2      ILE   9  16.889  -4.909  -0.329
   82   3HG2  ILE   9          3HG2      ILE   9  16.148  -6.526  -0.394
   83   1HD1  ILE   9          1HD1      ILE   9  15.868  -7.631   1.956
   84   2HD1  ILE   9          2HD1      ILE   9  17.355  -7.432   2.914
   85   3HD1  ILE   9          3HD1      ILE   9  15.772  -7.085   3.647
   86    H    ALA  10           H        ALA  10  12.976  -2.720  -0.010
   87    HA   ALA  10           HA       ALA  10  14.775  -1.015  -1.482
   88   1HB   ALA  10          1HB       ALA  10  14.931  -2.284  -3.326
   89   2HB   ALA  10          2HB       ALA  10  13.983  -3.566  -2.534
   90   3HB   ALA  10          3HB       ALA  10  13.156  -2.295  -3.467
   91    H    TYR  11           H        TYR  11  13.769   0.917  -1.849
   92    HA   TYR  11           HA       TYR  11  10.834   0.909  -1.844
   93   1HB   TYR  11          1HB       TYR  11  10.993   2.904  -0.336
   94   2HB   TYR  11          2HB       TYR  11  11.822   1.549   0.410
   95    HD1  TYR  11           HD1      TYR  11  14.234   1.554   0.703
   96    HD2  TYR  11           HD2      TYR  11  12.269   4.799  -1.274
   97    HE1  TYR  11           HE1      TYR  11  16.340   2.965   0.909
   98    HE2  TYR  11           HE2      TYR  11  14.381   6.198  -1.062
   99    HH   TYR  11           HH       TYR  11  16.792   5.518   1.008
  100    H    LYS  12           H        LYS  12   9.863   2.741  -2.957
  101    HA   LYS  12           HA       LYS  12  11.746   4.294  -4.565
  102   1HB   LYS  12          1HB       LYS  12   9.719   2.343  -5.551
  103   2HB   LYS  12          2HB       LYS  12   9.851   3.858  -6.419
  104   1HG   LYS  12          1HG       LYS  12  11.598   2.899  -7.521
  105   2HG   LYS  12          2HG       LYS  12  12.524   3.182  -6.060
  106   1HD   LYS  12          1HD       LYS  12  11.406   0.866  -5.296
  107   2HD   LYS  12          2HD       LYS  12  11.231   0.628  -7.023
  108   1HE   LYS  12          1HE       LYS  12  13.904   1.629  -6.489
  109   2HE   LYS  12          2HE       LYS  12  13.589   0.272  -5.426
  110   1HZ   LYS  12          1HZ       LYS  12  13.013   0.160  -8.298
  111   2HZ   LYS  12          2HZ       LYS  12  14.465  -0.264  -7.682
  112   3HZ   LYS  12          3HZ       LYS  12  13.122  -1.087  -7.249
  113    H    THR  13           H        THR  13   9.948   5.795  -6.031
  114    HA   THR  13           HA       THR  13   8.589   7.238  -3.872
  115    HB   THR  13           HB       THR  13  10.012   7.910  -6.414
  116    HG1  THR  13           HG1      THR  13  10.940   8.927  -4.679
  117   1HG2  THR  13          1HG2      THR  13   7.650   8.697  -6.912
  118   2HG2  THR  13          2HG2      THR  13   7.678   9.602  -5.379
  119   3HG2  THR  13          3HG2      THR  13   8.799  10.038  -6.691
  120    H    CYS  14           H        CYS  14   6.421   7.883  -3.991
  121    HA   CYS  14           HA       CYS  14   4.793   6.005  -5.365
  122   1HB   CYS  14          1HB       CYS  14   4.121   8.444  -3.709
  123   2HB   CYS  14          2HB       CYS  14   2.920   7.366  -4.392
  124    HA   PRO  15           HA       PRO  15   5.059   8.325  -9.179
  125   1HB   PRO  15          1HB       PRO  15   2.921   6.868 -10.379
  126   2HB   PRO  15          2HB       PRO  15   4.642   6.457 -10.449
  127   1HG   PRO  15          1HG       PRO  15   2.446   5.415  -8.542
  128   2HG   PRO  15          2HG       PRO  15   3.778   4.532  -9.323
  129   1HD   PRO  15          1HD       PRO  15   4.021   5.235  -6.705
  130   2HD   PRO  15          2HD       PRO  15   5.436   5.287  -7.792
  131    H    GLU  16           H        GLU  16   3.700   9.579 -10.750
  132    HA   GLU  16           HA       GLU  16   2.230  11.466  -9.379
  133   1HB   GLU  16          1HB       GLU  16   2.407  10.815 -12.349
  134   2HB   GLU  16          2HB       GLU  16   1.561  12.222 -11.736
  135   1HG   GLU  16          1HG       GLU  16   4.451  11.664 -10.964
  136   2HG   GLU  16          2HG       GLU  16   4.056  12.506 -12.449
  137    H    GLY  17           H        GLY  17  -0.003  11.856  -9.122
  138   1HA   GLY  17          1HA       GLY  17  -2.261  11.453  -9.631
  139   2HA   GLY  17          2HA       GLY  17  -1.848   9.868 -10.256
  140    H    LYS  18           H        LYS  18   0.022   9.310  -7.923
  141    HA   LYS  18           HA       LYS  18  -2.018   8.996  -5.836
  142   1HB   LYS  18          1HB       LYS  18  -0.935   6.760  -5.364
  143   2HB   LYS  18          2HB       LYS  18  -1.895   6.858  -6.827
  144   1HG   LYS  18          1HG       LYS  18   0.304   7.390  -8.077
  145   2HG   LYS  18          2HG       LYS  18   1.145   6.943  -6.605
  146   1HD   LYS  18          1HD       LYS  18   1.040   4.781  -7.278
  147   2HD   LYS  18          2HD       LYS  18  -0.692   4.835  -7.019
  148   1HE   LYS  18          1HE       LYS  18  -0.137   6.127  -9.543
  149   2HE   LYS  18          2HE       LYS  18   0.729   4.604  -9.518
  150   1HZ   LYS  18          1HZ       LYS  18  -2.104   5.081  -9.481
  151   2HZ   LYS  18          2HZ       LYS  18  -1.263   3.847 -10.140
  152   3HZ   LYS  18          3HZ       LYS  18  -1.592   3.849  -8.540
  153    H    ASN  19           H        ASN  19  -1.441  10.061  -4.028
  154    HA   ASN  19           HA       ASN  19   1.419  10.471  -3.654
  155   1HB   ASN  19          1HB       ASN  19   0.185  12.586  -3.851
  156   2HB   ASN  19          2HB       ASN  19  -1.013  12.058  -2.685
  157   1HD2  ASN  19          1HD2      ASN  19  -0.717  12.417  -0.594
  158   2HD2  ASN  19          2HD2      ASN  19   0.709  13.067   0.142
  159    H    LEU  20           H        LEU  20  -1.307   8.696  -2.632
  160    HA   LEU  20           HA       LEU  20  -0.412   8.552   0.147
  161   1HB   LEU  20          1HB       LEU  20  -2.956   7.826  -1.277
  162   2HB   LEU  20          2HB       LEU  20  -2.585   7.163   0.302
  163    HG   LEU  20           HG       LEU  20  -2.566  10.141  -0.190
  164   1HD1  LEU  20          1HD1      LEU  20  -4.960   8.453   0.589
  165   2HD1  LEU  20          2HD1      LEU  20  -4.888  10.231   0.602
  166   3HD1  LEU  20          3HD1      LEU  20  -4.743   9.345  -0.935
  167   1HD2  LEU  20          1HD2      LEU  20  -2.448   8.338   2.175
  168   2HD2  LEU  20          2HD2      LEU  20  -1.640   9.895   1.868
  169   3HD2  LEU  20          3HD2      LEU  20  -3.355   9.861   2.344
  170    H    CYS  21           H        CYS  21  -0.242   6.358   1.146
  171    HA   CYS  21           HA       CYS  21   0.837   4.498  -0.842
  172   1HB   CYS  21          1HB       CYS  21   1.706   5.241   1.917
  173   2HB   CYS  21          2HB       CYS  21   1.969   3.593   1.381
  174    H    TYR  22           H        TYR  22   0.232   2.252  -0.636
  175    HA   TYR  22           HA       TYR  22  -1.833   1.695   1.369
  176   1HB   TYR  22          1HB       TYR  22  -3.303   0.954  -0.378
  177   2HB   TYR  22          2HB       TYR  22  -2.545   2.344  -1.128
  178    HD1  TYR  22           HD1      TYR  22  -2.801  -1.312  -1.122
  179    HD2  TYR  22           HD2      TYR  22  -0.854   2.058  -2.896
  180    HE1  TYR  22           HE1      TYR  22  -2.000  -2.776  -3.039
  181    HE2  TYR  22           HE2      TYR  22  -0.058   0.583  -4.808
  182    HH   TYR  22           HH       TYR  22  -0.108  -2.744  -4.657
  183    H    LYS  23           H        LYS  23  -2.074  -0.580   1.888
  184    HA   LYS  23           HA       LYS  23  -0.090  -2.357   0.738
  185   1HB   LYS  23          1HB       LYS  23   0.609  -3.039   3.093
  186   2HB   LYS  23          2HB       LYS  23   1.259  -1.537   2.469
  187   1HG   LYS  23          1HG       LYS  23  -0.946  -0.513   3.631
  188   2HG   LYS  23          2HG       LYS  23  -0.826  -1.964   4.605
  189   1HD   LYS  23          1HD       LYS  23   1.775  -0.585   4.250
  190   2HD   LYS  23          2HD       LYS  23   0.574   0.408   5.051
  191   1HE   LYS  23          1HE       LYS  23   0.265  -2.101   6.282
  192   2HE   LYS  23          2HE       LYS  23   1.998  -1.973   6.053
  193   1HZ   LYS  23          1HZ       LYS  23   1.514  -0.948   8.071
  194   2HZ   LYS  23          2HZ       LYS  23   1.774   0.295   7.043
  195   3HZ   LYS  23          3HZ       LYS  23   0.250  -0.102   7.476
  196    H    MET  24           H        MET  24  -1.061  -4.259   0.288
  197    HA   MET  24           HA       MET  24  -3.614  -4.720   1.576
  198   1HB   MET  24          1HB       MET  24  -2.230  -5.977  -0.858
  199   2HB   MET  24          2HB       MET  24  -3.810  -6.478  -0.288
  200   1HG   MET  24          1HG       MET  24  -4.698  -4.182  -0.650
  201   2HG   MET  24          2HG       MET  24  -3.112  -3.629  -1.151
  202   1HE   MET  24          1HE       MET  24  -5.269  -3.325  -3.996
  203   2HE   MET  24          2HE       MET  24  -4.033  -2.655  -2.904
  204   3HE   MET  24          3HE       MET  24  -3.549  -3.403  -4.446
  205    H    PHE  25           H        PHE  25  -4.086  -6.584   2.795
  206    HA   PHE  25           HA       PHE  25  -1.867  -8.461   3.147
  207   1HB   PHE  25          1HB       PHE  25  -3.551  -6.896   5.173
  208   2HB   PHE  25          2HB       PHE  25  -2.777  -8.395   5.646
  209    HD1  PHE  25           HD1      PHE  25  -2.104  -4.984   4.374
  210    HD2  PHE  25           HD2      PHE  25  -0.486  -8.450   6.212
  211    HE1  PHE  25           HE1      PHE  25   0.016  -3.733   4.866
  212    HE2  PHE  25           HE2      PHE  25   1.633  -7.199   6.704
  213    HZ   PHE  25           HZ       PHE  25   1.859  -4.856   6.025
  214    H    MET  26           H        MET  26  -2.493 -10.621   3.693
  215    HA   MET  26           HA       MET  26  -5.065 -11.275   2.704
  216   1HB   MET  26          1HB       MET  26  -2.839 -12.928   4.020
  217   2HB   MET  26          2HB       MET  26  -4.267 -13.641   3.298
  218   1HG   MET  26          1HG       MET  26  -3.578 -12.253   1.153
  219   2HG   MET  26          2HG       MET  26  -2.008 -12.148   1.925
  220   1HE   MET  26          1HE       MET  26  -1.570 -14.926   3.435
  221   2HE   MET  26          2HE       MET  26  -0.697 -15.698   2.089
  222   3HE   MET  26          3HE       MET  26  -0.470 -13.964   2.419
  223    H    MET  27           H        MET  27  -6.677 -12.628   3.882
  224    HA   MET  27           HA       MET  27  -7.309 -11.472   6.324
  225   1HB   MET  27          1HB       MET  27  -8.288 -13.813   4.664
  226   2HB   MET  27          2HB       MET  27  -8.880 -13.685   6.308
  227   1HG   MET  27          1HG       MET  27  -8.960 -11.129   4.773
  228   2HG   MET  27          2HG       MET  27  -9.998 -12.388   4.135
  229   1HE   MET  27          1HE       MET  27  -9.166  -9.902   6.603
  230   2HE   MET  27          2HE       MET  27 -10.465  -9.887   7.818
  231   3HE   MET  27          3HE       MET  27  -9.100 -11.016   7.990
  232    H    SER  28           H        SER  28  -5.678 -14.549   5.442
  233    HA   SER  28           HA       SER  28  -5.769 -15.609   8.030
  234   1HB   SER  28          1HB       SER  28  -5.410 -17.163   6.278
  235   2HB   SER  28          2HB       SER  28  -4.157 -16.189   5.535
  236    HG   SER  28           HG       SER  28  -3.296 -18.053   6.674
  237    H    ASP  29           H        ASP  29  -2.612 -15.130   6.397
  238    HA   ASP  29           HA       ASP  29  -1.469 -14.306   8.837
  239   1HB   ASP  29          1HB       ASP  29  -0.436 -15.586   6.767
  240   2HB   ASP  29          2HB       ASP  29  -0.161 -13.983   6.117
  241    H    LEU  30           H        LEU  30  -2.915 -12.331   9.139
  242    HA   LEU  30           HA       LEU  30  -2.698 -10.189   7.277
  243   1HB   LEU  30          1HB       LEU  30  -3.673 -10.072  10.126
  244   2HB   LEU  30          2HB       LEU  30  -4.050  -8.972   8.815
  245    HG   LEU  30           HG       LEU  30  -4.834 -11.614   8.022
  246   1HD1  LEU  30          1HD1      LEU  30  -6.731 -11.597   9.919
  247   2HD1  LEU  30          2HD1      LEU  30  -5.219 -12.526  10.057
  248   3HD1  LEU  30          3HD1      LEU  30  -5.371 -10.947  10.866
  249   1HD2  LEU  30          1HD2      LEU  30  -5.869  -9.756   7.028
  250   2HD2  LEU  30          2HD2      LEU  30  -7.123 -10.485   8.058
  251   3HD2  LEU  30          3HD2      LEU  30  -6.266  -9.022   8.600
  252    H    THR  31           H        THR  31  -0.611 -11.511   9.644
  253    HA   THR  31           HA       THR  31   0.611  -8.971  10.332
  254    HB   THR  31           HB       THR  31   0.373 -10.727  12.051
  255    HG1  THR  31           HG1      THR  31   2.349  -9.406  11.973
  256   1HG2  THR  31          1HG2      THR  31   0.414 -12.807  10.792
  257   2HG2  THR  31          2HG2      THR  31   1.974 -12.387  10.042
  258   3HG2  THR  31          3HG2      THR  31   1.898 -12.786  11.776
  259    H    ILE  32           H        ILE  32   0.532 -10.608   7.532
  260    HA   ILE  32           HA       ILE  32   3.246  -9.753   6.902
  261    HB   ILE  32           HB       ILE  32   2.209 -12.522   6.810
  262   1HG1  ILE  32          1HG1      ILE  32   5.083 -12.137   6.694
  263   2HG1  ILE  32          2HG1      ILE  32   4.377 -11.147   7.956
  264   1HG2  ILE  32          1HG2      ILE  32   2.296 -12.059   4.435
  265   2HG2  ILE  32          2HG2      ILE  32   3.935 -11.383   4.596
  266   3HG2  ILE  32          3HG2      ILE  32   3.654 -13.114   4.898
  267   1HD1  ILE  32          1HD1      ILE  32   3.043 -13.298   8.625
  268   2HD1  ILE  32          2HD1      ILE  32   4.239 -14.160   7.626
  269   3HD1  ILE  32          3HD1      ILE  32   4.773 -13.217   9.037
  270    HA   PRO  33           HA       PRO  33   0.818  -7.808   3.812
  271   1HB   PRO  33          1HB       PRO  33   2.974  -6.799   2.317
  272   2HB   PRO  33          2HB       PRO  33   2.314  -6.052   3.781
  273   1HG   PRO  33          1HG       PRO  33   4.795  -7.853   3.438
  274   2HG   PRO  33          2HG       PRO  33   4.557  -6.441   4.494
  275   1HD   PRO  33          1HD       PRO  33   4.359  -9.043   5.469
  276   2HD   PRO  33          2HD       PRO  33   3.501  -7.658   6.198
  277    H    VAL  34           H        VAL  34   0.316  -7.673   1.499
  278    HA   VAL  34           HA       VAL  34   1.212 -10.075   0.061
  279    HB   VAL  34           HB       VAL  34  -1.352  -9.430   0.983
  280   1HG1  VAL  34          1HG1      VAL  34  -1.505  -7.824  -0.925
  281   2HG1  VAL  34          2HG1      VAL  34  -1.266  -9.189  -2.043
  282   3HG1  VAL  34          3HG1      VAL  34  -2.705  -9.136  -0.996
  283   1HG2  VAL  34          1HG2      VAL  34  -1.971 -11.513   0.046
  284   2HG2  VAL  34          2HG2      VAL  34  -0.744 -11.393  -1.239
  285   3HG2  VAL  34          3HG2      VAL  34  -0.243 -11.668   0.447
  286    H    LYS  35           H        LYS  35   0.128  -6.645  -0.080
  287    HA   LYS  35           HA       LYS  35   1.709  -6.393  -2.524
  288   1HB   LYS  35          1HB       LYS  35  -1.060  -5.199  -2.247
  289   2HB   LYS  35          2HB       LYS  35  -0.009  -5.138  -3.647
  290   1HG   LYS  35          1HG       LYS  35  -0.202  -7.894  -3.044
  291   2HG   LYS  35          2HG       LYS  35  -1.821  -7.281  -2.776
  292   1HD   LYS  35          1HD       LYS  35  -2.143  -7.346  -5.020
  293   2HD   LYS  35          2HD       LYS  35  -1.004  -6.022  -5.167
  294   1HE   LYS  35          1HE       LYS  35   0.225  -8.731  -4.848
  295   2HE   LYS  35          2HE       LYS  35  -0.655  -8.481  -6.343
  296   1HZ   LYS  35          1HZ       LYS  35   0.817  -6.955  -7.028
  297   2HZ   LYS  35          2HZ       LYS  35   1.113  -6.351  -5.540
  298   3HZ   LYS  35          3HZ       LYS  35   1.832  -7.738  -6.016
  299    H    ARG  36           H        ARG  36   2.542  -4.227  -2.872
  300    HA   ARG  36           HA       ARG  36   2.083  -2.383  -0.721
  301   1HB   ARG  36          1HB       ARG  36   4.674  -3.850  -1.183
  302   2HB   ARG  36          2HB       ARG  36   4.793  -2.150  -0.776
  303   1HG   ARG  36          1HG       ARG  36   3.190  -2.662   1.199
  304   2HG   ARG  36          2HG       ARG  36   3.474  -4.358   0.858
  305   1HD   ARG  36          1HD       ARG  36   5.978  -3.908   1.080
  306   2HD   ARG  36          2HD       ARG  36   5.590  -2.279   1.596
  307    HE   ARG  36           HE       ARG  36   4.191  -4.368   3.116
  308   1HH1  ARG  36          1HH1      ARG  36   7.089  -2.384   2.898
  309   2HH1  ARG  36          2HH1      ARG  36   7.478  -2.542   4.579
  310   1HH2  ARG  36          1HH2      ARG  36   4.704  -4.577   5.334
  311   2HH2  ARG  36          2HH2      ARG  36   6.112  -3.797   5.973
  312    H    GLY  37           H        GLY  37   1.589  -0.524  -1.846
  313   1HA   GLY  37          1HA       GLY  37   3.457   0.494  -3.802
  314   2HA   GLY  37          2HA       GLY  37   1.912   0.008  -4.471
  315    H    CYS  38           H        CYS  38   1.551   2.296  -5.022
  316    HA   CYS  38           HA       CYS  38   0.669   3.796  -2.664
  317   1HB   CYS  38          1HB       CYS  38   1.753   5.086  -5.166
  318   2HB   CYS  38          2HB       CYS  38   1.380   5.842  -3.630
  319    H    ILE  39           H        ILE  39  -1.206   5.264  -3.150
  320    HA   ILE  39           HA       ILE  39  -2.568   4.754  -5.652
  321    HB   ILE  39           HB       ILE  39  -3.152   2.914  -3.987
  322   1HG1  ILE  39          1HG1      ILE  39  -5.721   4.161  -4.676
  323   2HG1  ILE  39          2HG1      ILE  39  -4.578   4.154  -6.005
  324   1HG2  ILE  39          1HG2      ILE  39  -4.633   3.352  -2.210
  325   2HG2  ILE  39          2HG2      ILE  39  -3.336   4.562  -2.056
  326   3HG2  ILE  39          3HG2      ILE  39  -4.911   5.029  -2.740
  327   1HD1  ILE  39          1HD1      ILE  39  -4.210   1.708  -5.690
  328   2HD1  ILE  39          2HD1      ILE  39  -5.372   1.717  -4.343
  329   3HD1  ILE  39          3HD1      ILE  39  -5.923   2.078  -5.996
  330    H    ASP  40           H        ASP  40  -4.845   6.042  -5.451
  331    HA   ASP  40           HA       ASP  40  -3.999   8.648  -4.509
  332   1HB   ASP  40          1HB       ASP  40  -6.210   9.258  -5.863
  333   2HB   ASP  40          2HB       ASP  40  -4.707   8.941  -6.705
  334    H    VAL  41           H        VAL  41  -6.742   6.275  -4.473
  335    HA   VAL  41           HA       VAL  41  -7.786   7.677  -2.109
  336    HB   VAL  41           HB       VAL  41  -9.080   6.656  -4.566
  337   1HG1  VAL  41          1HG1      VAL  41 -11.232   6.238  -3.367
  338   2HG1  VAL  41          2HG1      VAL  41  -9.972   5.030  -3.020
  339   3HG1  VAL  41          3HG1      VAL  41 -10.340   6.299  -1.828
  340   1HG2  VAL  41          1HG2      VAL  41  -9.982   8.738  -2.552
  341   2HG2  VAL  41          2HG2      VAL  41  -8.882   9.075  -3.911
  342   3HG2  VAL  41          3HG2      VAL  41 -10.546   8.527  -4.228
  343    H    CYS  42           H        CYS  42  -8.685   6.305  -0.422
  344    HA   CYS  42           HA       CYS  42  -7.139   3.946  -0.109
  345   1HB   CYS  42          1HB       CYS  42  -7.962   5.655   1.669
  346   2HB   CYS  42          2HB       CYS  42  -9.443   4.718   1.659
  347    HA   PRO  43           HA       PRO  43 -10.198   1.629  -2.410
  348   1HB   PRO  43          1HB       PRO  43  -8.300  -0.648  -1.818
  349   2HB   PRO  43          2HB       PRO  43  -8.924  -0.077  -3.375
  350   1HG   PRO  43          1HG       PRO  43  -6.346   0.483  -2.670
  351   2HG   PRO  43          2HG       PRO  43  -7.326   1.754  -3.440
  352   1HD   PRO  43          1HD       PRO  43  -6.817   1.392  -0.416
  353   2HD   PRO  43          2HD       PRO  43  -6.573   2.850  -1.415
  354    H    LYS  44           H        LYS  44 -11.801  -0.009  -2.229
  355    HA   LYS  44           HA       LYS  44 -12.716  -0.380   0.431
  356   1HB   LYS  44          1HB       LYS  44 -13.769  -1.708  -2.076
  357   2HB   LYS  44          2HB       LYS  44 -14.628  -1.403  -0.580
  358   1HG   LYS  44          1HG       LYS  44 -15.283   0.606  -1.395
  359   2HG   LYS  44          2HG       LYS  44 -13.611   1.129  -1.398
  360   1HD   LYS  44          1HD       LYS  44 -13.881   1.326  -3.658
  361   2HD   LYS  44          2HD       LYS  44 -13.659  -0.412  -3.684
  362   1HE   LYS  44          1HE       LYS  44 -16.188  -0.656  -3.383
  363   2HE   LYS  44          2HE       LYS  44 -16.323   1.080  -3.580
  364   1HZ   LYS  44          1HZ       LYS  44 -16.630   0.059  -5.667
  365   2HZ   LYS  44          2HZ       LYS  44 -15.172   0.793  -5.727
  366   3HZ   LYS  44          3HZ       LYS  44 -15.264  -0.828  -5.545
  367    H    ASN  45           H        ASN  45 -12.474  -2.083   1.814
  368    HA   ASN  45           HA       ASN  45 -10.590  -4.070   0.994
  369   1HB   ASN  45          1HB       ASN  45 -12.071  -4.085   3.650
  370   2HB   ASN  45          2HB       ASN  45 -10.436  -4.616   3.317
  371   1HD2  ASN  45          1HD2      ASN  45 -12.404  -2.126   4.414
  372   2HD2  ASN  45          2HD2      ASN  45 -11.252  -0.835   4.494
  373    H    SER  46           H        SER  46 -11.093  -6.466   1.486
  374    HA   SER  46           HA       SER  46 -13.943  -6.971   1.118
  375   1HB   SER  46          1HB       SER  46 -13.311  -8.929  -0.296
  376   2HB   SER  46          2HB       SER  46 -12.790  -7.407  -0.992
  377    HG   SER  46           HG       SER  46 -10.703  -8.027   0.399
  378    H    LEU  47           H        LEU  47 -14.255  -9.581   1.542
  379    HA   LEU  47           HA       LEU  47 -13.323  -9.916   4.258
  380   1HB   LEU  47          1HB       LEU  47 -15.301 -11.424   2.548
  381   2HB   LEU  47          2HB       LEU  47 -14.885 -11.878   4.188
  382    HG   LEU  47           HG       LEU  47 -15.938  -9.123   3.551
  383   1HD1  LEU  47          1HD1      LEU  47 -18.052  -9.795   3.301
  384   2HD1  LEU  47          2HD1      LEU  47 -17.369 -11.402   2.957
  385   3HD1  LEU  47          3HD1      LEU  47 -17.921 -11.003   4.601
  386   1HD2  LEU  47          1HD2      LEU  47 -15.635 -10.796   6.036
  387   2HD2  LEU  47          2HD2      LEU  47 -15.074  -9.138   5.711
  388   3HD2  LEU  47          3HD2      LEU  47 -16.807  -9.457   5.959
  389    H    LEU  48           H        LEU  48 -11.685 -10.225   1.568
  390    HA   LEU  48           HA       LEU  48 -10.647 -12.890   2.244
  391   1HB   LEU  48          1HB       LEU  48 -10.467 -11.478  -0.419
  392   2HB   LEU  48          2HB       LEU  48  -9.936 -13.106  -0.044
  393    HG   LEU  48           HG       LEU  48 -12.808 -12.526   0.456
  394   1HD1  LEU  48          1HD1      LEU  48 -13.442 -11.964  -1.599
  395   2HD1  LEU  48          2HD1      LEU  48 -11.729 -11.624  -1.946
  396   3HD1  LEU  48          3HD1      LEU  48 -12.418 -13.217  -2.340
  397   1HD2  LEU  48          1HD2      LEU  48 -11.340 -14.841  -0.838
  398   2HD2  LEU  48          2HD2      LEU  48 -11.870 -14.743   0.858
  399   3HD2  LEU  48          3HD2      LEU  48 -13.075 -14.786  -0.451
  400    H    VAL  49           H        VAL  49  -9.735  -9.617   0.960
  401    HA   VAL  49           HA       VAL  49  -7.281  -9.866   2.545
  402    HB   VAL  49           HB       VAL  49  -7.595  -9.604  -0.345
  403   1HG1  VAL  49          1HG1      VAL  49  -7.205  -7.218   0.198
  404   2HG1  VAL  49          2HG1      VAL  49  -5.706  -7.674   1.044
  405   3HG1  VAL  49          3HG1      VAL  49  -5.855  -7.941  -0.709
  406   1HG2  VAL  49          1HG2      VAL  49  -5.492 -10.626  -0.404
  407   2HG2  VAL  49          2HG2      VAL  49  -5.020  -9.973   1.184
  408   3HG2  VAL  49          3HG2      VAL  49  -6.226 -11.278   1.080
  409    H    LYS  50           H        LYS  50  -6.602  -7.954   3.567
  410    HA   LYS  50           HA       LYS  50  -8.609  -5.823   3.469
  411   1HB   LYS  50          1HB       LYS  50  -8.174  -7.013   5.638
  412   2HB   LYS  50          2HB       LYS  50  -6.538  -6.385   5.610
  413   1HG   LYS  50          1HG       LYS  50  -7.579  -4.034   5.381
  414   2HG   LYS  50          2HG       LYS  50  -9.127  -4.777   5.728
  415   1HD   LYS  50          1HD       LYS  50  -8.058  -5.743   7.862
  416   2HD   LYS  50          2HD       LYS  50  -6.671  -4.722   7.537
  417   1HE   LYS  50          1HE       LYS  50  -8.142  -2.700   7.579
  418   2HE   LYS  50          2HE       LYS  50  -9.537  -3.716   7.885
  419   1HZ   LYS  50          1HZ       LYS  50  -7.764  -4.463   9.776
  420   2HZ   LYS  50          2HZ       LYS  50  -7.534  -2.848   9.687
  421   3HZ   LYS  50          3HZ       LYS  50  -9.021  -3.446  10.001
  422    H    TYR  51           H        TYR  51  -8.062  -3.720   2.934
  423    HA   TYR  51           HA       TYR  51  -5.306  -3.395   1.966
  424   1HB   TYR  51          1HB       TYR  51  -7.957  -1.951   1.339
  425   2HB   TYR  51          2HB       TYR  51  -6.442  -1.654   0.509
  426    HD1  TYR  51           HD1      TYR  51  -8.704  -4.548   1.306
  427    HD2  TYR  51           HD2      TYR  51  -6.135  -2.668  -1.553
  428    HE1  TYR  51           HE1      TYR  51  -9.281  -6.341  -0.403
  429    HE2  TYR  51           HE2      TYR  51  -6.721  -4.467  -3.252
  430    HH   TYR  51           HH       TYR  51  -9.301  -6.670  -2.726
  431    H    VAL  52           H        VAL  52  -4.000  -1.982   3.017
  432    HA   VAL  52           HA       VAL  52  -5.313  -0.127   4.873
  433    HB   VAL  52           HB       VAL  52  -2.402  -0.815   4.955
  434   1HG1  VAL  52          1HG1      VAL  52  -2.937   0.827   6.522
  435   2HG1  VAL  52          2HG1      VAL  52  -4.515   0.097   6.903
  436   3HG1  VAL  52          3HG1      VAL  52  -3.016  -0.672   7.478
  437   1HG2  VAL  52          1HG2      VAL  52  -3.378  -2.628   6.707
  438   2HG2  VAL  52          2HG2      VAL  52  -4.652  -2.686   5.466
  439   3HG2  VAL  52          3HG2      VAL  52  -2.960  -3.015   5.021
  440    H    CYS  53           H        CYS  53  -4.212   2.035   5.123
  441    HA   CYS  53           HA       CYS  53  -2.873   2.833   2.654
  442   1HB   CYS  53          1HB       CYS  53  -5.140   4.373   3.936
  443   2HB   CYS  53          2HB       CYS  53  -4.196   4.882   2.551
  444    H    CYS  54           H        CYS  54  -1.714   5.001   2.995
  445    HA   CYS  54           HA       CYS  54  -1.373   5.871   5.683
  446   1HB   CYS  54          1HB       CYS  54   1.146   5.438   5.619
  447   2HB   CYS  54          2HB       CYS  54   0.082   4.120   6.066
  448    H    ASN  55           H        ASN  55   0.117   7.815   5.707
  449    HA   ASN  55           HA       ASN  55   0.406   8.882   3.009
  450   1HB   ASN  55          1HB       ASN  55  -0.264  11.075   3.814
  451   2HB   ASN  55          2HB       ASN  55  -1.470   9.944   4.396
  452   1HD2  ASN  55          1HD2      ASN  55  -1.067   8.990   6.571
  453   2HD2  ASN  55          2HD2      ASN  55  -0.451  10.019   7.820
  454    H    THR  56           H        THR  56   1.982   7.678   5.668
  455    HA   THR  56           HA       THR  56   4.049   9.741   5.797
  456    HB   THR  56           HB       THR  56   4.674   8.655   7.842
  457    HG1  THR  56           HG1      THR  56   4.583   6.443   7.798
  458   1HG2  THR  56          1HG2      THR  56   1.922   7.635   8.144
  459   2HG2  THR  56          2HG2      THR  56   2.737   8.942   9.036
  460   3HG2  THR  56          3HG2      THR  56   1.949   9.285   7.478
  461    H    ASP  57           H        ASP  57   6.370   8.987   5.785
  462    HA   ASP  57           HA       ASP  57   6.746   7.610   3.347
  463   1HB   ASP  57          1HB       ASP  57   8.998   8.161   5.283
  464   2HB   ASP  57          2HB       ASP  57   9.003   8.274   3.535
  465    H    ARG  58           H        ARG  58   8.350   5.695   3.205
  466    HA   ARG  58           HA       ARG  58   8.533   3.549   3.628
  467   1HB   ARG  58          1HB       ARG  58   9.665   4.802   6.177
  468   2HB   ARG  58          2HB       ARG  58   9.902   3.114   5.767
  469   1HG   ARG  58          1HG       ARG  58  11.157   3.655   3.786
  470   2HG   ARG  58          2HG       ARG  58  10.632   5.327   3.811
  471   1HD   ARG  58          1HD       ARG  58  12.834   5.447   4.681
  472   2HD   ARG  58          2HD       ARG  58  11.838   5.485   6.123
  473    HE   ARG  58           HE       ARG  58  12.616   2.774   5.302
  474   1HH1  ARG  58          1HH1      ARG  58  13.516   5.600   7.198
  475   2HH1  ARG  58          2HH1      ARG  58  14.563   4.714   8.256
  476   1HH2  ARG  58          1HH2      ARG  58  13.997   1.606   6.699
  477   2HH2  ARG  58          2HH2      ARG  58  14.838   2.427   7.971
  478    H    CYS  59           H        CYS  59   5.864   4.283   4.176
  479    HA   CYS  59           HA       CYS  59   5.184   3.289   6.786
  480   1HB   CYS  59          1HB       CYS  59   2.904   3.806   6.190
  481   2HB   CYS  59          2HB       CYS  59   3.954   5.165   5.842
  482    H    ASN  60           H        ASN  60   4.726   2.381   3.296
  483    HA   ASN  60           HA       ASN  60   4.017  -0.282   4.224
  484   1HB   ASN  60          1HB       ASN  60   2.971  -0.608   2.036
  485   2HB   ASN  60          2HB       ASN  60   2.421   0.934   2.662
  486   1HD2  ASN  60          1HD2      ASN  60   4.651  -0.663   0.467
  487   2HD2  ASN  60          2HD2      ASN  60   4.925   0.668  -0.607
  488   1H    HOH  61          1H        HOH  61  -0.676 -12.434   4.661
  489   2H    HOH  61          2H        HOH  61  -0.005 -11.683   3.532
  Start of MODEL   13
    1   1H    LEU   1           H1       LEU   1   8.114  11.768  -1.310
    2    HA   LEU   1           HA       LEU   1   5.998  10.736   0.376
    3   1HB   LEU   1          1HB       LEU   1   4.331  10.761  -1.369
    4   2HB   LEU   1          2HB       LEU   1   4.830  12.387  -0.947
    5    HG   LEU   1           HG       LEU   1   6.377  11.327  -3.186
    6   1HD1  LEU   1          1HD1      LEU   1   4.817  10.755  -4.711
    7   2HD1  LEU   1          2HD1      LEU   1   3.881  10.307  -3.265
    8   3HD1  LEU   1          3HD1      LEU   1   3.599  11.876  -4.055
    9   1HD2  LEU   1          1HD2      LEU   1   6.412  13.663  -2.624
   10   2HD2  LEU   1          2HD2      LEU   1   5.639  13.471  -4.216
   11   3HD2  LEU   1          3HD2      LEU   1   4.642  13.776  -2.773
   12    H    LYS   2           H        LYS   2   8.052   9.302   0.464
   13    HA   LYS   2           HA       LYS   2   7.893   7.411  -1.780
   14   1HB   LYS   2          1HB       LYS   2  10.269   8.410  -0.215
   15   2HB   LYS   2          2HB       LYS   2  10.309   6.852  -1.015
   16   1HG   LYS   2          1HG       LYS   2  10.292   7.776  -3.141
   17   2HG   LYS   2          2HG       LYS   2   9.278   9.125  -2.668
   18   1HD   LYS   2          1HD       LYS   2  11.327   9.999  -1.335
   19   2HD   LYS   2          2HD       LYS   2  12.269   8.796  -2.192
   20   1HE   LYS   2          1HE       LYS   2  11.876   9.813  -4.316
   21   2HE   LYS   2          2HE       LYS   2  10.493  10.718  -3.733
   22   1HZ   LYS   2          1HZ       LYS   2  12.477  12.071  -3.955
   23   2HZ   LYS   2          2HZ       LYS   2  11.960  12.044  -2.407
   24   3HZ   LYS   2          3HZ       LYS   2  13.261  11.161  -2.848
   25    H    CYS   3           H        CYS   3   7.810   5.187  -1.271
   26    HA   CYS   3           HA       CYS   3   7.631   4.584   1.578
   27   1HB   CYS   3          1HB       CYS   3   5.510   4.193  -0.489
   28   2HB   CYS   3          2HB       CYS   3   5.708   2.959   0.739
   29    H    ASN   4           H        ASN   4   7.587   2.020   1.791
   30    HA   ASN   4           HA       ASN   4   9.831   1.122   0.321
   31   1HB   ASN   4          1HB       ASN   4   8.061  -0.666   2.033
   32   2HB   ASN   4          2HB       ASN   4   9.795  -0.766   1.800
   33   1HD2  ASN   4          1HD2      ASN   4   8.138  -0.577   4.229
   34   2HD2  ASN   4          2HD2      ASN   4   8.725   0.777   5.134
   35    H    LYS   5           H        LYS   5   9.723  -1.208  -0.718
   36    HA   LYS   5           HA       LYS   5   7.354  -1.269  -2.418
   37   1HB   LYS   5          1HB       LYS   5  10.031  -2.664  -2.713
   38   2HB   LYS   5          2HB       LYS   5   8.723  -2.697  -3.878
   39   1HG   LYS   5          1HG       LYS   5   9.330   0.062  -3.123
   40   2HG   LYS   5          2HG       LYS   5  10.785  -0.751  -3.663
   41   1HD   LYS   5          1HD       LYS   5   9.551   0.334  -5.550
   42   2HD   LYS   5          2HD       LYS   5   9.719  -1.395  -5.776
   43   1HE   LYS   5          1HE       LYS   5   7.461  -1.345  -6.161
   44   2HE   LYS   5          2HE       LYS   5   7.331  -1.316  -4.413
   45   1HZ   LYS   5          1HZ       LYS   5   7.207   1.042  -4.470
   46   2HZ   LYS   5          2HZ       LYS   5   7.509   1.101  -6.073
   47   3HZ   LYS   5          3HZ       LYS   5   6.108   0.464  -5.531
   48    H    LEU   6           H        LEU   6   7.710  -4.097  -3.130
   49    HA   LEU   6           HA       LEU   6   5.901  -5.276  -1.517
   50   1HB   LEU   6          1HB       LEU   6   7.249  -5.993  -3.715
   51   2HB   LEU   6          2HB       LEU   6   8.089  -6.999  -2.551
   52    HG   LEU   6           HG       LEU   6   5.145  -7.111  -2.354
   53   1HD1  LEU   6          1HD1      LEU   6   6.372  -8.517  -4.716
   54   2HD1  LEU   6          2HD1      LEU   6   4.658  -8.217  -4.341
   55   3HD1  LEU   6          3HD1      LEU   6   5.702  -6.874  -4.865
   56   1HD2  LEU   6          1HD2      LEU   6   7.289  -8.610  -1.468
   57   2HD2  LEU   6          2HD2      LEU   6   5.578  -9.100  -1.444
   58   3HD2  LEU   6          3HD2      LEU   6   6.625  -9.591  -2.797
   59    H    VAL   7           H        VAL   7   9.427  -4.958  -0.972
   60    HA   VAL   7           HA       VAL   7   8.941  -5.861   1.769
   61    HB   VAL   7           HB       VAL   7  11.462  -6.613   0.336
   62   1HG1  VAL   7          1HG1      VAL   7   9.944  -7.573   2.764
   63   2HG1  VAL   7          2HG1      VAL   7  11.192  -8.578   1.989
   64   3HG1  VAL   7          3HG1      VAL   7  11.619  -6.981   2.646
   65   1HG2  VAL   7          1HG2      VAL   7   8.795  -8.024   0.136
   66   2HG2  VAL   7          2HG2      VAL   7   9.914  -7.561  -1.169
   67   3HG2  VAL   7          3HG2      VAL   7  10.341  -8.886  -0.060
   68    HA   PRO   8           HA       PRO   8  10.889  -2.110   2.753
   69   1HB   PRO   8          1HB       PRO   8  11.943  -3.495   5.226
   70   2HB   PRO   8          2HB       PRO   8  10.907  -2.064   5.093
   71   1HG   PRO   8          1HG       PRO   8   9.812  -4.448   5.843
   72   2HG   PRO   8          2HG       PRO   8   8.935  -3.425   4.681
   73   1HD   PRO   8          1HD       PRO   8  10.754  -5.829   4.020
   74   2HD   PRO   8          2HD       PRO   8   9.074  -5.531   3.495
   75    H    ILE   9           H        ILE   9  12.809  -4.454   1.503
   76    HA   ILE   9           HA       ILE   9  15.327  -3.259   2.360
   77    HB   ILE   9           HB       ILE   9  14.452  -5.860   1.462
   78   1HG1  ILE   9          1HG1      ILE   9  16.870  -6.335   2.365
   79   2HG1  ILE   9          2HG1      ILE   9  16.804  -4.670   2.905
   80   1HG2  ILE   9          1HG2      ILE   9  16.295  -6.436   0.007
   81   2HG2  ILE   9          2HG2      ILE   9  15.363  -5.099  -0.707
   82   3HG2  ILE   9          3HG2      ILE   9  16.922  -4.773   0.085
   83   1HD1  ILE   9          1HD1      ILE   9  15.975  -6.490   4.556
   84   2HD1  ILE   9          2HD1      ILE   9  14.927  -5.070   4.323
   85   3HD1  ILE   9          3HD1      ILE   9  14.539  -6.606   3.510
   86    H    ALA  10           H        ALA  10  12.897  -2.644   0.148
   87    HA   ALA  10           HA       ALA  10  14.701  -1.055  -1.444
   88   1HB   ALA  10          1HB       ALA  10  14.830  -2.487  -3.171
   89   2HB   ALA  10          2HB       ALA  10  13.745  -3.636  -2.351
   90   3HB   ALA  10          3HB       ALA  10  13.067  -2.343  -3.368
   91    H    TYR  11           H        TYR  11  13.752   0.913  -1.512
   92    HA   TYR  11           HA       TYR  11  10.814   0.966  -1.641
   93   1HB   TYR  11          1HB       TYR  11  11.009   2.948  -0.116
   94   2HB   TYR  11          2HB       TYR  11  11.789   1.565   0.627
   95    HD1  TYR  11           HD1      TYR  11  12.315   4.851  -0.923
   96    HD2  TYR  11           HD2      TYR  11  14.233   1.460   0.847
   97    HE1  TYR  11           HE1      TYR  11  14.464   6.186  -0.674
   98    HE2  TYR  11           HE2      TYR  11  16.375   2.807   1.090
   99    HH   TYR  11           HH       TYR  11  16.824   5.446   1.315
  100    H    LYS  12           H        LYS  12   9.889   2.777  -2.790
  101    HA   LYS  12           HA       LYS  12  11.813   4.351  -4.325
  102   1HB   LYS  12          1HB       LYS  12   9.576   2.674  -5.493
  103   2HB   LYS  12          2HB       LYS  12  10.379   3.963  -6.368
  104   1HG   LYS  12          1HG       LYS  12  12.425   2.314  -5.181
  105   2HG   LYS  12          2HG       LYS  12  11.272   1.246  -5.956
  106   1HD   LYS  12          1HD       LYS  12  11.951   1.864  -8.039
  107   2HD   LYS  12          2HD       LYS  12  11.830   3.569  -7.654
  108   1HE   LYS  12          1HE       LYS  12  14.072   3.758  -7.226
  109   2HE   LYS  12          2HE       LYS  12  14.119   2.266  -6.307
  110   1HZ   LYS  12          1HZ       LYS  12  15.041   1.344  -8.061
  111   2HZ   LYS  12          2HZ       LYS  12  13.669   1.560  -8.922
  112   3HZ   LYS  12          3HZ       LYS  12  14.849   2.688  -8.969
  113    H    THR  13           H        THR  13   9.922   5.742  -5.896
  114    HA   THR  13           HA       THR  13   8.496   7.183  -3.768
  115    HB   THR  13           HB       THR  13   9.744   8.865  -4.723
  116    HG1  THR  13           HG1      THR  13   8.296   9.820  -6.128
  117   1HG2  THR  13          1HG2      THR  13  11.145   7.277  -6.076
  118   2HG2  THR  13          2HG2      THR  13   9.855   7.211  -7.301
  119   3HG2  THR  13          3HG2      THR  13  10.726   8.735  -7.008
  120    H    CYS  14           H        CYS  14   6.319   7.656  -3.895
  121    HA   CYS  14           HA       CYS  14   4.774   5.800  -5.299
  122   1HB   CYS  14          1HB       CYS  14   3.886   8.409  -4.053
  123   2HB   CYS  14          2HB       CYS  14   2.856   7.062  -4.490
  124    HA   PRO  15           HA       PRO  15   5.344   7.825  -9.258
  125   1HB   PRO  15          1HB       PRO  15   3.384   6.185 -10.524
  126   2HB   PRO  15          2HB       PRO  15   5.118   5.844 -10.401
  127   1HG   PRO  15          1HG       PRO  15   2.788   4.864  -8.622
  128   2HG   PRO  15          2HG       PRO  15   4.214   3.978  -9.207
  129   1HD   PRO  15          1HD       PRO  15   4.190   4.892  -6.643
  130   2HD   PRO  15          2HD       PRO  15   5.698   4.912  -7.599
  131    H    GLU  16           H        GLU  16   3.970   8.745 -11.119
  132    HA   GLU  16           HA       GLU  16   2.427  10.776 -10.084
  133   1HB   GLU  16          1HB       GLU  16   2.621   9.662 -12.914
  134   2HB   GLU  16          2HB       GLU  16   1.774  11.146 -12.524
  135   1HG   GLU  16          1HG       GLU  16   4.529  10.978 -11.403
  136   2HG   GLU  16          2HG       GLU  16   4.463  10.987 -13.154
  137    H    GLY  17           H        GLY  17   0.196  11.116  -9.844
  138   1HA   GLY  17          1HA       GLY  17  -2.051  10.575 -10.330
  139   2HA   GLY  17          2HA       GLY  17  -1.586   8.917 -10.657
  140    H    LYS  18           H        LYS  18   0.236   8.716  -8.288
  141    HA   LYS  18           HA       LYS  18  -1.871   8.310  -6.316
  142   1HB   LYS  18          1HB       LYS  18   0.973   7.262  -6.417
  143   2HB   LYS  18          2HB       LYS  18  -0.230   6.843  -5.214
  144   1HG   LYS  18          1HG       LYS  18  -1.558   5.637  -6.759
  145   2HG   LYS  18          2HG       LYS  18  -0.895   6.479  -8.146
  146   1HD   LYS  18          1HD       LYS  18   1.395   5.341  -7.288
  147   2HD   LYS  18          2HD       LYS  18   0.281   4.195  -6.568
  148   1HE   LYS  18          1HE       LYS  18  -0.753   4.517  -9.151
  149   2HE   LYS  18          2HE       LYS  18   0.978   4.601  -9.416
  150   1HZ   LYS  18          1HZ       LYS  18  -0.601   2.373  -8.702
  151   2HZ   LYS  18          2HZ       LYS  18   0.928   2.413  -9.273
  152   3HZ   LYS  18          3HZ       LYS  18   0.652   2.553  -7.669
  153    H    ASN  19           H        ASN  19  -1.262   8.769  -3.969
  154    HA   ASN  19           HA       ASN  19   0.597  10.965  -3.755
  155   1HB   ASN  19          1HB       ASN  19  -1.448  12.205  -4.097
  156   2HB   ASN  19          2HB       ASN  19  -2.380  11.099  -3.108
  157   1HD2  ASN  19          1HD2      ASN  19  -1.119  14.076  -3.194
  158   2HD2  ASN  19          2HD2      ASN  19  -0.862  14.409  -1.514
  159    H    LEU  20           H        LEU  20  -1.797   8.712  -2.244
  160    HA   LEU  20           HA       LEU  20  -0.260   8.798   0.243
  161   1HB   LEU  20          1HB       LEU  20  -2.967   7.566  -0.270
  162   2HB   LEU  20          2HB       LEU  20  -2.187   7.802   1.280
  163    HG   LEU  20           HG       LEU  20  -2.742  10.197  -0.438
  164   1HD1  LEU  20          1HD1      LEU  20  -4.919   9.739   1.398
  165   2HD1  LEU  20          2HD1      LEU  20  -4.954  10.050  -0.354
  166   3HD1  LEU  20          3HD1      LEU  20  -4.779   8.385   0.252
  167   1HD2  LEU  20          1HD2      LEU  20  -3.016   9.955   2.552
  168   2HD2  LEU  20          2HD2      LEU  20  -1.428  10.172   1.780
  169   3HD2  LEU  20          3HD2      LEU  20  -2.700  11.398   1.559
  170    H    CYS  21           H        CYS  21  -0.099   6.563   1.380
  171    HA   CYS  21           HA       CYS  21   0.859   4.705  -0.658
  172   1HB   CYS  21          1HB       CYS  21   1.673   5.292   2.162
  173   2HB   CYS  21          2HB       CYS  21   1.948   3.685   1.518
  174    H    TYR  22           H        TYR  22   0.196   2.471  -0.554
  175    HA   TYR  22           HA       TYR  22  -1.963   1.917   1.357
  176   1HB   TYR  22          1HB       TYR  22  -3.344   1.244  -0.468
  177   2HB   TYR  22          2HB       TYR  22  -2.459   2.559  -1.217
  178    HD1  TYR  22           HD1      TYR  22  -3.291  -0.909  -1.408
  179    HD2  TYR  22           HD2      TYR  22  -0.308   1.943  -2.537
  180    HE1  TYR  22           HE1      TYR  22  -2.448  -2.493  -3.210
  181    HE2  TYR  22           HE2      TYR  22   0.524   0.349  -4.336
  182    HH   TYR  22           HH       TYR  22  -1.084  -1.937  -5.600
  183    H    LYS  23           H        LYS  23  -2.226  -0.332   1.914
  184    HA   LYS  23           HA       LYS  23  -0.198  -2.138   0.879
  185   1HB   LYS  23          1HB       LYS  23   0.302  -2.814   3.306
  186   2HB   LYS  23          2HB       LYS  23   1.059  -1.364   2.680
  187   1HG   LYS  23          1HG       LYS  23  -1.524  -0.643   3.775
  188   2HG   LYS  23          2HG       LYS  23  -0.677  -1.616   4.960
  189   1HD   LYS  23          1HD       LYS  23   1.377   0.004   4.206
  190   2HD   LYS  23          2HD       LYS  23   0.042   1.080   3.849
  191   1HE   LYS  23          1HE       LYS  23   0.474   1.601   6.099
  192   2HE   LYS  23          2HE       LYS  23  -0.824   0.433   6.255
  193   1HZ   LYS  23          1HZ       LYS  23   1.984   0.125   6.855
  194   2HZ   LYS  23          2HZ       LYS  23   0.680  -0.473   7.636
  195   3HZ   LYS  23          3HZ       LYS  23   1.215  -1.192   6.272
  196    H    MET  24           H        MET  24  -1.034  -4.148   0.546
  197    HA   MET  24           HA       MET  24  -3.652  -4.605   1.750
  198   1HB   MET  24          1HB       MET  24  -2.493  -5.906  -0.769
  199   2HB   MET  24          2HB       MET  24  -4.166  -5.944  -0.247
  200   1HG   MET  24          1HG       MET  24  -3.859  -3.251  -0.377
  201   2HG   MET  24          2HG       MET  24  -2.628  -3.701  -1.540
  202   1HE   MET  24          1HE       MET  24  -4.156  -5.175  -4.412
  203   2HE   MET  24          2HE       MET  24  -3.882  -3.422  -4.274
  204   3HE   MET  24          3HE       MET  24  -2.766  -4.562  -3.485
  205    H    PHE  25           H        PHE  25  -4.093  -6.612   2.757
  206    HA   PHE  25           HA       PHE  25  -1.903  -8.541   2.785
  207   1HB   PHE  25          1HB       PHE  25  -3.456  -7.633   5.267
  208   2HB   PHE  25          2HB       PHE  25  -1.982  -8.581   5.237
  209    HD1  PHE  25           HD1      PHE  25  -0.003  -7.506   5.726
  210    HD2  PHE  25           HD2      PHE  25  -3.211  -5.228   4.137
  211    HE1  PHE  25           HE1      PHE  25   1.350  -5.410   6.000
  212    HE2  PHE  25           HE2      PHE  25  -1.859  -3.131   4.411
  213    HZ   PHE  25           HZ       PHE  25   0.406  -3.247   5.339
  214    H    MET  26           H        MET  26  -2.570 -10.717   3.398
  215    HA   MET  26           HA       MET  26  -5.214 -11.236   2.520
  216   1HB   MET  26          1HB       MET  26  -3.050 -13.053   3.721
  217   2HB   MET  26          2HB       MET  26  -4.506 -13.637   2.939
  218   1HG   MET  26          1HG       MET  26  -3.833 -12.739   0.791
  219   2HG   MET  26          2HG       MET  26  -2.547 -11.790   1.509
  220   1HE   MET  26          1HE       MET  26  -1.326 -14.597  -0.855
  221   2HE   MET  26          2HE       MET  26  -2.816 -15.450  -0.385
  222   3HE   MET  26          3HE       MET  26  -2.871 -13.717  -0.783
  223    H    MET  27           H        MET  27  -6.769 -12.657   3.762
  224    HA   MET  27           HA       MET  27  -7.289 -11.499   6.233
  225   1HB   MET  27          1HB       MET  27  -8.345 -13.832   4.611
  226   2HB   MET  27          2HB       MET  27  -8.855 -13.718   6.284
  227   1HG   MET  27          1HG       MET  27  -9.015 -11.155   4.764
  228   2HG   MET  27          2HG       MET  27 -10.092 -12.413   4.189
  229   1HE   MET  27          1HE       MET  27  -9.883  -9.526   6.072
  230   2HE   MET  27          2HE       MET  27 -10.736  -9.708   7.622
  231   3HE   MET  27          3HE       MET  27  -9.060 -10.284   7.456
  232    H    SER  28           H        SER  28  -5.625 -14.517   5.263
  233    HA   SER  28           HA       SER  28  -5.621 -15.617   7.844
  234   1HB   SER  28          1HB       SER  28  -5.325 -17.098   5.978
  235   2HB   SER  28          2HB       SER  28  -4.007 -16.145   5.325
  236    HG   SER  28           HG       SER  28  -2.627 -17.235   6.538
  237    H    ASP  29           H        ASP  29  -2.474 -15.311   6.240
  238    HA   ASP  29           HA       ASP  29  -1.346 -14.311   8.617
  239   1HB   ASP  29          1HB       ASP  29  -0.323 -15.811   6.701
  240   2HB   ASP  29          2HB       ASP  29   0.018 -14.289   5.904
  241    H    LEU  30           H        LEU  30  -2.377 -12.204   8.940
  242    HA   LEU  30           HA       LEU  30  -2.309 -10.259   6.850
  243   1HB   LEU  30          1HB       LEU  30  -3.027 -10.111   9.779
  244   2HB   LEU  30          2HB       LEU  30  -3.150  -8.759   8.670
  245    HG   LEU  30           HG       LEU  30  -4.539 -11.256   7.848
  246   1HD1  LEU  30          1HD1      LEU  30  -6.464 -10.852   9.292
  247   2HD1  LEU  30          2HD1      LEU  30  -5.010 -11.222  10.251
  248   3HD1  LEU  30          3HD1      LEU  30  -5.586  -9.543  10.118
  249   1HD2  LEU  30          1HD2      LEU  30  -5.556  -8.411   7.888
  250   2HD2  LEU  30          2HD2      LEU  30  -4.512  -9.047   6.594
  251   3HD2  LEU  30          3HD2      LEU  30  -6.108  -9.778   6.889
  252    H    THR  31           H        THR  31  -0.015 -11.528   9.054
  253    HA   THR  31           HA       THR  31   1.456  -9.037   9.313
  254    HB   THR  31           HB       THR  31   1.263 -11.621  10.662
  255    HG1  THR  31           HG1      THR  31   2.721  -9.101  11.049
  256   1HG2  THR  31          1HG2      THR  31   4.080 -10.561  10.090
  257   2HG2  THR  31          2HG2      THR  31   3.659 -11.888  11.199
  258   3HG2  THR  31          3HG2      THR  31   3.436 -12.089   9.444
  259    H    ILE  32           H        ILE  32   1.003 -11.320   6.887
  260    HA   ILE  32           HA       ILE  32   3.698 -10.763   5.857
  261    HB   ILE  32           HB       ILE  32   2.088 -13.259   5.937
  262   1HG1  ILE  32          1HG1      ILE  32   5.075 -12.732   5.970
  263   2HG1  ILE  32          2HG1      ILE  32   4.064 -12.851   7.398
  264   1HG2  ILE  32          1HG2      ILE  32   2.104 -13.135   3.613
  265   2HG2  ILE  32          2HG2      ILE  32   3.706 -12.360   3.562
  266   3HG2  ILE  32          3HG2      ILE  32   3.564 -14.083   3.984
  267   1HD1  ILE  32          1HD1      ILE  32   4.245 -15.104   7.352
  268   2HD1  ILE  32          2HD1      ILE  32   3.500 -15.139   5.736
  269   3HD1  ILE  32          3HD1      ILE  32   5.265 -14.984   5.899
  270    HA   PRO  33           HA       PRO  33   0.864  -8.297   3.342
  271   1HB   PRO  33          1HB       PRO  33   3.596  -7.394   2.343
  272   2HB   PRO  33          2HB       PRO  33   2.174  -6.418   2.751
  273   1HG   PRO  33          1HG       PRO  33   4.247  -6.575   4.520
  274   2HG   PRO  33          2HG       PRO  33   2.580  -6.669   5.135
  275   1HD   PRO  33          1HD       PRO  33   4.524  -8.996   4.657
  276   2HD   PRO  33          2HD       PRO  33   3.438  -8.701   6.043
  277    H    VAL  34           H        VAL  34   0.209  -8.055   1.143
  278    HA   VAL  34           HA       VAL  34   1.358 -10.107  -0.621
  279    HB   VAL  34           HB       VAL  34  -1.248  -9.466  -1.460
  280   1HG1  VAL  34          1HG1      VAL  34   0.264 -11.683  -1.231
  281   2HG1  VAL  34          2HG1      VAL  34  -0.820 -11.926   0.159
  282   3HG1  VAL  34          3HG1      VAL  34  -1.499 -11.727  -1.474
  283   1HG2  VAL  34          1HG2      VAL  34  -1.102  -9.891   1.543
  284   2HG2  VAL  34          2HG2      VAL  34  -1.771  -8.483   0.684
  285   3HG2  VAL  34          3HG2      VAL  34  -2.581 -10.065   0.568
  286    H    LYS  35           H        LYS  35  -0.017  -6.805  -0.284
  287    HA   LYS  35           HA       LYS  35   1.426  -6.106  -2.728
  288   1HB   LYS  35          1HB       LYS  35  -1.372  -5.095  -2.197
  289   2HB   LYS  35          2HB       LYS  35  -0.409  -4.911  -3.649
  290   1HG   LYS  35          1HG       LYS  35  -1.140  -7.675  -2.619
  291   2HG   LYS  35          2HG       LYS  35  -2.273  -6.760  -3.594
  292   1HD   LYS  35          1HD       LYS  35  -0.218  -6.456  -5.238
  293   2HD   LYS  35          2HD       LYS  35   0.460  -7.821  -4.371
  294   1HE   LYS  35          1HE       LYS  35  -0.726  -9.121  -5.824
  295   2HE   LYS  35          2HE       LYS  35  -2.126  -8.707  -4.853
  296   1HZ   LYS  35          1HZ       LYS  35  -2.918  -7.699  -6.624
  297   2HZ   LYS  35          2HZ       LYS  35  -1.708  -6.604  -6.571
  298   3HZ   LYS  35          3HZ       LYS  35  -1.550  -7.954  -7.478
  299    H    ARG  36           H        ARG  36   2.512  -4.161  -2.604
  300    HA   ARG  36           HA       ARG  36   1.790  -2.382  -0.471
  301   1HB   ARG  36          1HB       ARG  36   4.250  -4.080  -0.479
  302   2HB   ARG  36          2HB       ARG  36   4.539  -2.386  -0.135
  303   1HG   ARG  36          1HG       ARG  36   3.076  -2.405   1.773
  304   2HG   ARG  36          2HG       ARG  36   2.342  -3.925   1.302
  305   1HD   ARG  36          1HD       ARG  36   4.296  -5.189   1.891
  306   2HD   ARG  36          2HD       ARG  36   5.316  -3.765   1.921
  307    HE   ARG  36           HE       ARG  36   3.111  -3.658   3.853
  308   1HH1  ARG  36          1HH1      ARG  36   6.425  -4.706   3.303
  309   2HH1  ARG  36          2HH1      ARG  36   6.832  -4.727   4.987
  310   1HH2  ARG  36          1HH2      ARG  36   3.648  -3.688   6.074
  311   2HH2  ARG  36          2HH2      ARG  36   5.242  -4.145   6.573
  312    H    GLY  37           H        GLY  37   1.661  -0.421  -1.514
  313   1HA   GLY  37          1HA       GLY  37   3.890   0.561  -3.040
  314   2HA   GLY  37          2HA       GLY  37   2.501   0.171  -4.035
  315    H    CYS  38           H        CYS  38   1.674   2.174  -4.585
  316    HA   CYS  38           HA       CYS  38   0.842   3.826  -2.319
  317   1HB   CYS  38          1HB       CYS  38   1.862   4.967  -4.921
  318   2HB   CYS  38          2HB       CYS  38   1.417   5.840  -3.468
  319    H    ILE  39           H        ILE  39  -1.027   5.325  -3.009
  320    HA   ILE  39           HA       ILE  39  -2.433   4.494  -5.385
  321    HB   ILE  39           HB       ILE  39  -2.936   2.873  -3.425
  322   1HG1  ILE  39          1HG1      ILE  39  -5.550   3.672  -4.360
  323   2HG1  ILE  39          2HG1      ILE  39  -4.388   3.797  -5.665
  324   1HG2  ILE  39          1HG2      ILE  39  -4.677   5.228  -2.646
  325   2HG2  ILE  39          2HG2      ILE  39  -4.769   3.585  -1.968
  326   3HG2  ILE  39          3HG2      ILE  39  -3.311   4.572  -1.711
  327   1HD1  ILE  39          1HD1      ILE  39  -5.343   1.527  -5.595
  328   2HD1  ILE  39          2HD1      ILE  39  -3.610   1.466  -5.193
  329   3HD1  ILE  39          3HD1      ILE  39  -4.827   1.343  -3.900
  330    H    ASP  40           H        ASP  40  -4.570   5.825  -5.536
  331    HA   ASP  40           HA       ASP  40  -3.828   8.495  -4.722
  332   1HB   ASP  40          1HB       ASP  40  -5.991   8.922  -6.260
  333   2HB   ASP  40          2HB       ASP  40  -4.405   8.653  -6.954
  334    H    VAL  41           H        VAL  41  -6.471   6.040  -4.553
  335    HA   VAL  41           HA       VAL  41  -7.686   7.638  -2.409
  336    HB   VAL  41           HB       VAL  41  -9.402   5.853  -4.041
  337   1HG1  VAL  41          1HG1      VAL  41  -9.958   8.695  -3.195
  338   2HG1  VAL  41          2HG1      VAL  41 -11.099   7.357  -3.464
  339   3HG1  VAL  41          3HG1      VAL  41 -10.047   7.354  -2.028
  340   1HG2  VAL  41          1HG2      VAL  41  -8.164   8.393  -5.113
  341   2HG2  VAL  41          2HG2      VAL  41  -8.316   6.801  -5.898
  342   3HG2  VAL  41          3HG2      VAL  41  -9.757   7.819  -5.665
  343    H    CYS  42           H        CYS  42  -8.652   6.397  -0.676
  344    HA   CYS  42           HA       CYS  42  -7.178   4.022  -0.166
  345   1HB   CYS  42          1HB       CYS  42  -8.152   5.920   1.433
  346   2HB   CYS  42          2HB       CYS  42  -9.504   4.810   1.526
  347    HA   PRO  43           HA       PRO  43 -10.230   1.638  -2.401
  348   1HB   PRO  43          1HB       PRO  43  -8.428  -0.648  -1.587
  349   2HB   PRO  43          2HB       PRO  43  -8.978  -0.167  -3.202
  350   1HG   PRO  43          1HG       PRO  43  -6.409   0.363  -2.439
  351   2HG   PRO  43          2HG       PRO  43  -7.320   1.606  -3.329
  352   1HD   PRO  43          1HD       PRO  43  -6.930   1.440  -0.273
  353   2HD   PRO  43          2HD       PRO  43  -6.605   2.817  -1.359
  354    H    LYS  44           H        LYS  44 -11.746  -0.175  -2.194
  355    HA   LYS  44           HA       LYS  44 -12.859  -0.232   0.433
  356   1HB   LYS  44          1HB       LYS  44 -13.708  -1.732  -2.062
  357   2HB   LYS  44          2HB       LYS  44 -14.661  -1.490  -0.612
  358   1HG   LYS  44          1HG       LYS  44 -13.539   0.945  -2.004
  359   2HG   LYS  44          2HG       LYS  44 -14.911   0.134  -2.732
  360   1HD   LYS  44          1HD       LYS  44 -16.262   1.243  -1.290
  361   2HD   LYS  44          2HD       LYS  44 -15.571   0.298   0.015
  362   1HE   LYS  44          1HE       LYS  44 -13.671   2.026   0.123
  363   2HE   LYS  44          2HE       LYS  44 -14.592   3.006  -0.999
  364   1HZ   LYS  44          1HZ       LYS  44 -16.400   3.018   0.573
  365   2HZ   LYS  44          2HZ       LYS  44 -15.564   2.079   1.615
  366   3HZ   LYS  44          3HZ       LYS  44 -15.043   3.590   1.279
  367    H    ASN  45           H        ASN  45 -12.843  -1.874   1.946
  368    HA   ASN  45           HA       ASN  45 -10.800  -3.828   1.531
  369   1HB   ASN  45          1HB       ASN  45 -12.651  -3.227   3.895
  370   2HB   ASN  45          2HB       ASN  45 -11.411  -4.464   3.940
  371   1HD2  ASN  45          1HD2      ASN  45 -12.016  -1.023   3.461
  372   2HD2  ASN  45          2HD2      ASN  45 -10.470  -0.438   3.978
  373    H    SER  46           H        SER  46 -11.209  -6.184   1.738
  374    HA   SER  46           HA       SER  46 -14.009  -6.849   1.253
  375   1HB   SER  46          1HB       SER  46 -13.139  -8.775  -0.121
  376   2HB   SER  46          2HB       SER  46 -12.776  -7.200  -0.800
  377    HG   SER  46           HG       SER  46 -10.939  -8.699  -0.804
  378    H    LEU  47           H        LEU  47 -14.351  -9.371   1.722
  379    HA   LEU  47           HA       LEU  47 -13.406  -9.755   4.426
  380   1HB   LEU  47          1HB       LEU  47 -15.426 -11.200   2.711
  381   2HB   LEU  47          2HB       LEU  47 -15.005 -11.690   4.341
  382    HG   LEU  47           HG       LEU  47 -16.024  -8.912   3.739
  383   1HD1  LEU  47          1HD1      LEU  47 -18.102 -10.494   4.859
  384   2HD1  LEU  47          2HD1      LEU  47 -18.057  -9.664   3.285
  385   3HD1  LEU  47          3HD1      LEU  47 -17.486 -11.345   3.422
  386   1HD2  LEU  47          1HD2      LEU  47 -16.318  -8.661   6.005
  387   2HD2  LEU  47          2HD2      LEU  47 -16.444 -10.412   6.299
  388   3HD2  LEU  47          3HD2      LEU  47 -14.858  -9.679   5.959
  389    H    LEU  48           H        LEU  48 -11.828 -10.095   1.681
  390    HA   LEU  48           HA       LEU  48 -10.807 -12.765   2.360
  391   1HB   LEU  48          1HB       LEU  48 -10.682 -11.388  -0.323
  392   2HB   LEU  48          2HB       LEU  48 -10.161 -13.019   0.057
  393    HG   LEU  48           HG       LEU  48 -12.770 -13.159   0.819
  394   1HD1  LEU  48          1HD1      LEU  48 -13.251 -10.871   0.095
  395   2HD1  LEU  48          2HD1      LEU  48 -12.718 -11.274  -1.555
  396   3HD1  LEU  48          3HD1      LEU  48 -14.157 -12.064  -0.866
  397   1HD2  LEU  48          1HD2      LEU  48 -11.139 -14.058  -1.393
  398   2HD2  LEU  48          2HD2      LEU  48 -12.470 -14.884  -0.546
  399   3HD2  LEU  48          3HD2      LEU  48 -12.821 -13.795  -1.910
  400    H    VAL  49           H        VAL  49  -9.979  -9.431   1.228
  401    HA   VAL  49           HA       VAL  49  -7.402  -9.790   2.580
  402    HB   VAL  49           HB       VAL  49  -6.223  -8.811   0.816
  403   1HG1  VAL  49          1HG1      VAL  49  -6.256 -10.570  -0.584
  404   2HG1  VAL  49          2HG1      VAL  49  -7.567 -11.186   0.450
  405   3HG1  VAL  49          3HG1      VAL  49  -7.954 -10.296  -1.042
  406   1HG2  VAL  49          1HG2      VAL  49  -8.869  -7.741   0.026
  407   2HG2  VAL  49          2HG2      VAL  49  -7.250  -7.012  -0.093
  408   3HG2  VAL  49          3HG2      VAL  49  -7.790  -8.186  -1.317
  409    H    LYS  50           H        LYS  50  -6.484  -7.783   3.423
  410    HA   LYS  50           HA       LYS  50  -8.573  -5.756   3.812
  411   1HB   LYS  50          1HB       LYS  50  -7.881  -7.138   5.819
  412   2HB   LYS  50          2HB       LYS  50  -6.295  -6.403   5.700
  413   1HG   LYS  50          1HG       LYS  50  -8.536  -4.449   5.601
  414   2HG   LYS  50          2HG       LYS  50  -8.442  -5.343   7.106
  415   1HD   LYS  50          1HD       LYS  50  -5.755  -4.617   6.452
  416   2HD   LYS  50          2HD       LYS  50  -6.728  -3.190   6.154
  417   1HE   LYS  50          1HE       LYS  50  -7.596  -3.190   8.418
  418   2HE   LYS  50          2HE       LYS  50  -6.981  -4.800   8.731
  419   1HZ   LYS  50          1HZ       LYS  50  -5.385  -3.504   9.656
  420   2HZ   LYS  50          2HZ       LYS  50  -4.739  -3.677   8.165
  421   3HZ   LYS  50          3HZ       LYS  50  -5.519  -2.298   8.562
  422    H    TYR  51           H        TYR  51  -8.007  -3.552   3.618
  423    HA   TYR  51           HA       TYR  51  -5.368  -3.126   2.388
  424   1HB   TYR  51          1HB       TYR  51  -8.034  -1.631   2.015
  425   2HB   TYR  51          2HB       TYR  51  -6.589  -1.393   1.052
  426    HD1  TYR  51           HD1      TYR  51  -6.509  -2.398  -1.038
  427    HD2  TYR  51           HD2      TYR  51  -8.922  -4.178   2.015
  428    HE1  TYR  51           HE1      TYR  51  -7.336  -4.139  -2.696
  429    HE2  TYR  51           HE2      TYR  51  -9.740  -5.913   0.347
  430    HH   TYR  51           HH       TYR  51  -9.731  -6.571  -1.712
  431    H    VAL  52           H        VAL  52  -4.144  -1.366   3.079
  432    HA   VAL  52           HA       VAL  52  -5.390   0.360   5.088
  433    HB   VAL  52           HB       VAL  52  -2.588  -0.623   5.462
  434   1HG1  VAL  52          1HG1      VAL  52  -4.442   1.042   6.878
  435   2HG1  VAL  52          2HG1      VAL  52  -4.079  -0.385   7.878
  436   3HG1  VAL  52          3HG1      VAL  52  -2.755   0.647   7.285
  437   1HG2  VAL  52          1HG2      VAL  52  -3.968  -2.659   5.154
  438   2HG2  VAL  52          2HG2      VAL  52  -3.348  -2.499   6.815
  439   3HG2  VAL  52          3HG2      VAL  52  -5.046  -2.106   6.457
  440    H    CYS  53           H        CYS  53  -4.703   2.512   5.020
  441    HA   CYS  53           HA       CYS  53  -2.866   3.086   2.811
  442   1HB   CYS  53          1HB       CYS  53  -5.084   4.839   3.888
  443   2HB   CYS  53          2HB       CYS  53  -4.010   5.223   2.556
  444    H    CYS  54           H        CYS  54  -1.525   5.122   3.178
  445    HA   CYS  54           HA       CYS  54  -1.318   6.065   5.861
  446   1HB   CYS  54          1HB       CYS  54   1.151   5.421   5.999
  447   2HB   CYS  54          2HB       CYS  54  -0.050   4.209   6.393
  448    H    ASN  55           H        ASN  55  -0.514   8.172   5.767
  449    HA   ASN  55           HA       ASN  55   0.281   9.041   3.130
  450   1HB   ASN  55          1HB       ASN  55  -0.569  11.126   3.722
  451   2HB   ASN  55          2HB       ASN  55  -1.479  10.159   4.866
  452   1HD2  ASN  55          1HD2      ASN  55  -0.089   9.588   6.902
  453   2HD2  ASN  55          2HD2      ASN  55   0.673  10.933   7.683
  454    H    THR  56           H        THR  56   1.810   7.684   5.679
  455    HA   THR  56           HA       THR  56   3.959   9.650   5.928
  456    HB   THR  56           HB       THR  56   4.694   7.984   7.729
  457    HG1  THR  56           HG1      THR  56   3.475   6.116   7.803
  458   1HG2  THR  56          1HG2      THR  56   1.743   8.700   8.046
  459   2HG2  THR  56          2HG2      THR  56   2.978   8.561   9.320
  460   3HG2  THR  56          3HG2      THR  56   3.023   9.929   8.183
  461    H    ASP  57           H        ASP  57   6.232   8.913   5.753
  462    HA   ASP  57           HA       ASP  57   6.486   7.519   3.290
  463   1HB   ASP  57          1HB       ASP  57   8.854   8.197   5.031
  464   2HB   ASP  57          2HB       ASP  57   8.707   8.297   3.288
  465    H    ARG  58           H        ARG  58   8.201   5.684   3.108
  466    HA   ARG  58           HA       ARG  58   8.518   3.564   3.570
  467   1HB   ARG  58          1HB       ARG  58   9.649   4.848   6.107
  468   2HB   ARG  58          2HB       ARG  58  10.040   3.226   5.570
  469   1HG   ARG  58          1HG       ARG  58  11.047   4.081   3.504
  470   2HG   ARG  58          2HG       ARG  58  10.495   5.708   3.852
  471   1HD   ARG  58          1HD       ARG  58  12.181   4.389   5.963
  472   2HD   ARG  58          2HD       ARG  58  12.997   4.835   4.477
  473    HE   ARG  58           HE       ARG  58  11.502   7.097   5.144
  474   1HH1  ARG  58          1HH1      ARG  58  13.966   5.164   6.751
  475   2HH1  ARG  58          2HH1      ARG  58  14.581   6.490   7.681
  476   1HH2  ARG  58          1HH2      ARG  58  12.314   8.846   6.370
  477   2HH2  ARG  58          2HH2      ARG  58  13.636   8.598   7.463
  478    H    CYS  59           H        CYS  59   5.833   4.326   4.309
  479    HA   CYS  59           HA       CYS  59   5.348   3.223   6.919
  480   1HB   CYS  59          1HB       CYS  59   3.034   3.769   6.523
  481   2HB   CYS  59          2HB       CYS  59   4.059   5.140   6.150
  482    H    ASN  60           H        ASN  60   4.675   2.457   3.434
  483    HA   ASN  60           HA       ASN  60   3.954  -0.224   4.290
  484   1HB   ASN  60          1HB       ASN  60   2.809  -0.450   2.162
  485   2HB   ASN  60          2HB       ASN  60   2.377   1.128   2.789
  486   1HD2  ASN  60          1HD2      ASN  60   4.551  -0.595   0.612
  487   2HD2  ASN  60          2HD2      ASN  60   4.841   0.698  -0.504
  488   1H    HOH  61          1H        HOH  61  -1.019 -12.295   4.167
  489   2H    HOH  61          2H        HOH  61  -0.255 -11.929   2.913
  Start of MODEL   14
    1   1H    LEU   1           H1       LEU   1   7.682  12.223   0.247
    2    HA   LEU   1           HA       LEU   1   6.000  10.809   0.496
    3   1HB   LEU   1          1HB       LEU   1   4.286  10.601  -1.361
    4   2HB   LEU   1          2HB       LEU   1   4.468  12.161  -0.583
    5    HG   LEU   1           HG       LEU   1   5.998  11.638  -3.105
    6   1HD1  LEU   1          1HD1      LEU   1   3.800  12.731  -4.171
    7   2HD1  LEU   1          2HD1      LEU   1   4.068  10.973  -4.090
    8   3HD1  LEU   1          3HD1      LEU   1   3.037  11.774  -2.879
    9   1HD2  LEU   1          1HD2      LEU   1   5.920  13.771  -1.481
   10   2HD2  LEU   1          2HD2      LEU   1   6.187  13.889  -3.236
   11   3HD2  LEU   1          3HD2      LEU   1   4.566  14.182  -2.562
   12    H    LYS   2           H        LYS   2   7.938   9.342   0.548
   13    HA   LYS   2           HA       LYS   2   7.772   7.462  -1.705
   14   1HB   LYS   2          1HB       LYS   2  10.206   8.321  -0.118
   15   2HB   LYS   2          2HB       LYS   2  10.180   6.933  -1.186
   16   1HG   LYS   2          1HG       LYS   2  10.132   8.226  -3.101
   17   2HG   LYS   2          2HG       LYS   2   9.113   9.455  -2.378
   18   1HD   LYS   2          1HD       LYS   2  11.078  10.291  -1.055
   19   2HD   LYS   2          2HD       LYS   2  12.093   9.077  -1.810
   20   1HE   LYS   2          1HE       LYS   2  11.151  10.157  -4.074
   21   2HE   LYS   2          2HE       LYS   2  10.842  11.538  -3.042
   22   1HZ   LYS   2          1HZ       LYS   2  13.067  11.772  -2.589
   23   2HZ   LYS   2          2HZ       LYS   2  13.452  10.236  -2.988
   24   3HZ   LYS   2          3HZ       LYS   2  13.100  11.319  -4.158
   25    H    CYS   3           H        CYS   3   7.745   5.235  -1.188
   26    HA   CYS   3           HA       CYS   3   7.616   4.646   1.668
   27   1HB   CYS   3          1HB       CYS   3   5.492   4.169  -0.382
   28   2HB   CYS   3          2HB       CYS   3   5.725   2.972   0.876
   29    H    ASN   4           H        ASN   4   7.498   2.020   1.803
   30    HA   ASN   4           HA       ASN   4   9.806   1.183   0.368
   31   1HB   ASN   4          1HB       ASN   4   8.073  -0.661   2.053
   32   2HB   ASN   4          2HB       ASN   4   9.813  -0.691   1.852
   33   1HD2  ASN   4          1HD2      ASN   4  11.118   0.792   2.926
   34   2HD2  ASN   4          2HD2      ASN   4  10.585   1.684   4.312
   35    H    LYS   5           H        LYS   5   9.713  -1.179  -0.642
   36    HA   LYS   5           HA       LYS   5   7.383  -1.237  -2.392
   37   1HB   LYS   5          1HB       LYS   5  10.113  -2.544  -2.563
   38   2HB   LYS   5          2HB       LYS   5   8.817  -2.846  -3.702
   39   1HG   LYS   5          1HG       LYS   5   9.903  -0.060  -3.079
   40   2HG   LYS   5          2HG       LYS   5  10.458  -1.040  -4.422
   41   1HD   LYS   5          1HD       LYS   5   7.622   0.000  -3.978
   42   2HD   LYS   5          2HD       LYS   5   8.743   0.519  -5.221
   43   1HE   LYS   5          1HE       LYS   5   8.635  -2.258  -5.595
   44   2HE   LYS   5          2HE       LYS   5   6.988  -1.858  -5.155
   45   1HZ   LYS   5          1HZ       LYS   5   7.217  -0.027  -6.852
   46   2HZ   LYS   5          2HZ       LYS   5   8.555  -0.797  -7.383
   47   3HZ   LYS   5          3HZ       LYS   5   7.107  -1.551  -7.429
   48    H    LEU   6           H        LEU   6   7.558  -4.031  -3.077
   49    HA   LEU   6           HA       LEU   6   5.743  -5.139  -1.430
   50   1HB   LEU   6          1HB       LEU   6   7.015  -5.907  -3.657
   51   2HB   LEU   6          2HB       LEU   6   7.825  -6.959  -2.514
   52    HG   LEU   6           HG       LEU   6   4.813  -6.809  -2.704
   53   1HD1  LEU   6          1HD1      LEU   6   5.074  -7.600  -4.800
   54   2HD1  LEU   6          2HD1      LEU   6   6.745  -8.140  -4.511
   55   3HD1  LEU   6          3HD1      LEU   6   5.379  -9.135  -3.953
   56   1HD2  LEU   6          1HD2      LEU   6   6.171  -9.300  -1.892
   57   2HD2  LEU   6          2HD2      LEU   6   6.375  -7.926  -0.779
   58   3HD2  LEU   6          3HD2      LEU   6   4.742  -8.486  -1.212
   59    H    VAL   7           H        VAL   7   9.279  -4.938  -0.936
   60    HA   VAL   7           HA       VAL   7   8.810  -5.876   1.797
   61    HB   VAL   7           HB       VAL   7  11.296  -6.654   0.317
   62   1HG1  VAL   7          1HG1      VAL   7  11.578  -7.172   2.541
   63   2HG1  VAL   7          2HG1      VAL   7   9.846  -7.483   2.805
   64   3HG1  VAL   7          3HG1      VAL   7  10.846  -8.685   1.955
   65   1HG2  VAL   7          1HG2      VAL   7   9.797  -7.596  -1.195
   66   2HG2  VAL   7          2HG2      VAL   7  10.055  -8.919  -0.031
   67   3HG2  VAL   7          3HG2      VAL   7   8.578  -7.929   0.060
   68    HA   PRO   8           HA       PRO   8  10.837  -2.170   2.802
   69   1HB   PRO   8          1HB       PRO   8  11.850  -3.599   5.267
   70   2HB   PRO   8          2HB       PRO   8  10.852  -2.142   5.141
   71   1HG   PRO   8          1HG       PRO   8   9.694  -4.502   5.873
   72   2HG   PRO   8          2HG       PRO   8   8.846  -3.450   4.715
   73   1HD   PRO   8          1HD       PRO   8  10.607  -5.894   4.042
   74   2HD   PRO   8          2HD       PRO   8   8.936  -5.553   3.518
   75    H    ILE   9           H        ILE   9  12.696  -4.545   1.528
   76    HA   ILE   9           HA       ILE   9  15.248  -3.464   2.420
   77    HB   ILE   9           HB       ILE   9  15.236  -5.794   2.394
   78   1HG1  ILE   9          1HG1      ILE   9  16.852  -6.401   0.621
   79   2HG1  ILE   9          2HG1      ILE   9  16.514  -4.893  -0.204
   80   1HG2  ILE   9          1HG2      ILE   9  14.627  -7.030   0.196
   81   2HG2  ILE   9          2HG2      ILE   9  13.324  -6.459   1.266
   82   3HG2  ILE   9          3HG2      ILE   9  13.739  -5.539  -0.200
   83   1HD1  ILE   9          1HD1      ILE   9  17.772  -5.262   2.544
   84   2HD1  ILE   9          2HD1      ILE   9  18.494  -4.508   1.103
   85   3HD1  ILE   9          3HD1      ILE   9  17.174  -3.686   1.969
   86    H    ALA  10           H        ALA  10  12.837  -2.747   0.170
   87    HA   ALA  10           HA       ALA  10  14.679  -1.077  -1.294
   88   1HB   ALA  10          1HB       ALA  10  13.764  -1.954  -3.501
   89   2HB   ALA  10          2HB       ALA  10  14.871  -3.053  -2.643
   90   3HB   ALA  10          3HB       ALA  10  13.115  -3.339  -2.590
   91    H    TYR  11           H        TYR  11  13.718   0.885  -1.470
   92    HA   TYR  11           HA       TYR  11  10.777   0.919  -1.541
   93   1HB   TYR  11          1HB       TYR  11  10.998   2.947  -0.082
   94   2HB   TYR  11          2HB       TYR  11  11.801   1.590   0.684
   95    HD1  TYR  11           HD1      TYR  11  12.277   4.828  -0.978
   96    HD2  TYR  11           HD2      TYR  11  14.248   1.502   0.855
   97    HE1  TYR  11           HE1      TYR  11  14.425   6.180  -0.818
   98    HE2  TYR  11           HE2      TYR  11  16.389   2.865   1.009
   99    HH   TYR  11           HH       TYR  11  17.117   5.073   1.029
  100    H    LYS  12           H        LYS  12   9.815   2.690  -2.720
  101    HA   LYS  12           HA       LYS  12  11.693   4.225  -4.349
  102   1HB   LYS  12          1HB       LYS  12   9.456   2.475  -5.394
  103   2HB   LYS  12          2HB       LYS  12  10.167   3.774  -6.332
  104   1HG   LYS  12          1HG       LYS  12  12.223   2.053  -5.105
  105   2HG   LYS  12          2HG       LYS  12  11.136   1.140  -6.133
  106   1HD   LYS  12          1HD       LYS  12  12.480   1.849  -7.841
  107   2HD   LYS  12          2HD       LYS  12  11.582   3.349  -7.717
  108   1HE   LYS  12          1HE       LYS  12  13.579   4.363  -7.308
  109   2HE   LYS  12          2HE       LYS  12  13.512   3.638  -5.716
  110   1HZ   LYS  12          1HZ       LYS  12  14.517   2.025  -7.909
  111   2HZ   LYS  12          2HZ       LYS  12  15.489   3.187  -7.298
  112   3HZ   LYS  12          3HZ       LYS  12  14.931   1.998  -6.329
  113    H    THR  13           H        THR  13   9.985   5.734  -5.834
  114    HA   THR  13           HA       THR  13   8.549   7.182  -3.738
  115    HB   THR  13           HB       THR  13   9.118   9.073  -4.964
  116    HG1  THR  13           HG1      THR  13   8.827   9.020  -7.253
  117   1HG2  THR  13          1HG2      THR  13  11.277   8.910  -5.888
  118   2HG2  THR  13          2HG2      THR  13  11.234   7.416  -4.920
  119   3HG2  THR  13          3HG2      THR  13  10.928   7.351  -6.673
  120    H    CYS  14           H        CYS  14   6.378   7.803  -3.893
  121    HA   CYS  14           HA       CYS  14   4.743   5.874  -5.102
  122   1HB   CYS  14          1HB       CYS  14   4.096   8.561  -3.877
  123   2HB   CYS  14          2HB       CYS  14   2.884   7.420  -4.424
  124    HA   PRO  15           HA       PRO  15   5.246   7.583  -9.214
  125   1HB   PRO  15          1HB       PRO  15   3.166   5.949 -10.284
  126   2HB   PRO  15          2HB       PRO  15   4.888   5.542 -10.205
  127   1HG   PRO  15          1HG       PRO  15   2.595   4.792  -8.272
  128   2HG   PRO  15          2HG       PRO  15   3.962   3.806  -8.843
  129   1HD   PRO  15          1HD       PRO  15   4.079   4.898  -6.354
  130   2HD   PRO  15          2HD       PRO  15   5.545   4.792  -7.366
  131    H    GLU  16           H        GLU  16   3.878   8.467 -11.076
  132    HA   GLU  16           HA       GLU  16   2.366  10.571 -10.066
  133   1HB   GLU  16          1HB       GLU  16   2.561   9.512 -12.920
  134   2HB   GLU  16          2HB       GLU  16   1.917  11.080 -12.473
  135   1HG   GLU  16          1HG       GLU  16   4.751  10.163 -11.796
  136   2HG   GLU  16          2HG       GLU  16   4.351  11.103 -13.221
  137    H    GLY  17           H        GLY  17   0.179  10.822  -9.698
  138   1HA   GLY  17          1HA       GLY  17  -2.074  10.365 -10.346
  139   2HA   GLY  17          2HA       GLY  17  -1.615   8.719 -10.737
  140    H    LYS  18           H        LYS  18   0.198   8.654  -8.233
  141    HA   LYS  18           HA       LYS  18  -1.933   8.525  -6.222
  142   1HB   LYS  18          1HB       LYS  18  -0.820   6.413  -5.392
  143   2HB   LYS  18          2HB       LYS  18  -1.707   6.272  -6.897
  144   1HG   LYS  18          1HG       LYS  18   0.590   6.761  -8.063
  145   2HG   LYS  18          2HG       LYS  18   1.305   6.401  -6.504
  146   1HD   LYS  18          1HD       LYS  18   1.183   4.193  -6.996
  147   2HD   LYS  18          2HD       LYS  18  -0.566   4.310  -6.963
  148   1HE   LYS  18          1HE       LYS  18  -0.720   4.645  -9.317
  149   2HE   LYS  18          2HE       LYS  18   0.953   5.150  -9.453
  150   1HZ   LYS  18          1HZ       LYS  18   1.536   2.849  -8.761
  151   2HZ   LYS  18          2HZ       LYS  18  -0.036   2.439  -8.933
  152   3HZ   LYS  18          3HZ       LYS  18   0.818   2.960 -10.225
  153    H    ASN  19           H        ASN  19  -1.428   9.497  -4.312
  154    HA   ASN  19           HA       ASN  19   1.371  10.267  -4.031
  155   1HB   ASN  19          1HB       ASN  19  -0.045  12.247  -4.337
  156   2HB   ASN  19          2HB       ASN  19  -1.200  11.673  -3.148
  157   1HD2  ASN  19          1HD2      ASN  19   1.151  13.831  -3.646
  158   2HD2  ASN  19          2HD2      ASN  19   1.772  14.070  -2.047
  159    H    LEU  20           H        LEU  20  -1.566   8.846  -2.621
  160    HA   LEU  20           HA       LEU  20  -0.450   8.737   0.038
  161   1HB   LEU  20          1HB       LEU  20  -3.040   7.942  -1.246
  162   2HB   LEU  20          2HB       LEU  20  -2.613   7.310   0.332
  163    HG   LEU  20           HG       LEU  20  -2.603  10.276  -0.225
  164   1HD1  LEU  20          1HD1      LEU  20  -4.870  10.484   0.431
  165   2HD1  LEU  20          2HD1      LEU  20  -4.822   9.233  -0.834
  166   3HD1  LEU  20          3HD1      LEU  20  -4.977   8.763   0.876
  167   1HD2  LEU  20          1HD2      LEU  20  -3.272   9.048   2.413
  168   2HD2  LEU  20          2HD2      LEU  20  -1.575   9.027   1.873
  169   3HD2  LEU  20          3HD2      LEU  20  -2.440  10.575   2.032
  170    H    CYS  21           H        CYS  21  -0.191   6.640   1.194
  171    HA   CYS  21           HA       CYS  21   0.934   4.688  -0.665
  172   1HB   CYS  21          1HB       CYS  21   1.595   5.503   2.134
  173   2HB   CYS  21          2HB       CYS  21   1.930   3.856   1.641
  174    H    TYR  22           H        TYR  22   0.338   2.443  -0.437
  175    HA   TYR  22           HA       TYR  22  -1.856   1.918   1.434
  176   1HB   TYR  22          1HB       TYR  22  -3.218   1.193  -0.378
  177   2HB   TYR  22          2HB       TYR  22  -2.324   2.471  -1.177
  178    HD1  TYR  22           HD1      TYR  22  -2.842  -1.140  -0.926
  179    HD2  TYR  22           HD2      TYR  22  -0.484   1.933  -2.743
  180    HE1  TYR  22           HE1      TYR  22  -1.989  -2.804  -2.648
  181    HE2  TYR  22           HE2      TYR  22   0.361   0.258  -4.460
  182    HH   TYR  22           HH       TYR  22   0.561  -1.934  -4.886
  183    H    LYS  23           H        LYS  23  -2.044  -0.290   2.106
  184    HA   LYS  23           HA       LYS  23  -0.045  -2.130   1.089
  185   1HB   LYS  23          1HB       LYS  23   0.596  -2.657   3.523
  186   2HB   LYS  23          2HB       LYS  23   1.311  -1.250   2.761
  187   1HG   LYS  23          1HG       LYS  23  -0.465   0.195   3.816
  188   2HG   LYS  23          2HG       LYS  23  -1.117  -1.221   4.616
  189   1HD   LYS  23          1HD       LYS  23   1.716  -1.165   5.140
  190   2HD   LYS  23          2HD       LYS  23   1.096   0.448   5.439
  191   1HE   LYS  23          1HE       LYS  23  -0.327  -0.259   7.166
  192   2HE   LYS  23          2HE       LYS  23  -0.487  -1.881   6.521
  193   1HZ   LYS  23          1HZ       LYS  23   0.908  -2.117   8.313
  194   2HZ   LYS  23          2HZ       LYS  23   1.972  -2.063   7.075
  195   3HZ   LYS  23          3HZ       LYS  23   1.748  -0.747   8.018
  196    H    MET  24           H        MET  24  -1.215  -3.884   0.543
  197    HA   MET  24           HA       MET  24  -3.616  -4.385   2.094
  198   1HB   MET  24          1HB       MET  24  -2.712  -5.782  -0.474
  199   2HB   MET  24          2HB       MET  24  -4.342  -5.687   0.160
  200   1HG   MET  24          1HG       MET  24  -4.411  -3.248  -0.263
  201   2HG   MET  24          2HG       MET  24  -2.738  -3.261  -0.782
  202   1HE   MET  24          1HE       MET  24  -3.683  -2.380  -3.769
  203   2HE   MET  24          2HE       MET  24  -5.434  -2.615  -3.554
  204   3HE   MET  24          3HE       MET  24  -4.462  -1.915  -2.238
  205    H    PHE  25           H        PHE  25  -4.075  -6.478   3.005
  206    HA   PHE  25           HA       PHE  25  -1.835  -8.351   2.991
  207   1HB   PHE  25          1HB       PHE  25  -3.431  -7.465   5.464
  208   2HB   PHE  25          2HB       PHE  25  -2.010  -8.491   5.464
  209    HD1  PHE  25           HD1      PHE  25   0.166  -7.561   5.521
  210    HD2  PHE  25           HD2      PHE  25  -3.181  -5.035   4.870
  211    HE1  PHE  25           HE1      PHE  25   1.622  -5.545   5.858
  212    HE2  PHE  25           HE2      PHE  25  -1.724  -3.018   5.207
  213    HZ   PHE  25           HZ       PHE  25   0.660  -3.297   5.697
  214    H    MET  26           H        MET  26  -2.437 -10.554   3.344
  215    HA   MET  26           HA       MET  26  -5.096 -11.088   2.547
  216   1HB   MET  26          1HB       MET  26  -2.776 -12.870   3.472
  217   2HB   MET  26          2HB       MET  26  -4.279 -13.512   2.840
  218   1HG   MET  26          1HG       MET  26  -3.905 -12.531   0.662
  219   2HG   MET  26          2HG       MET  26  -2.620 -11.501   1.261
  220   1HE   MET  26          1HE       MET  26  -2.739 -15.649   2.173
  221   2HE   MET  26          2HE       MET  26  -3.959 -14.924   1.098
  222   3HE   MET  26          3HE       MET  26  -2.659 -15.933   0.418
  223    H    MET  27           H        MET  27  -6.636 -12.510   3.719
  224    HA   MET  27           HA       MET  27  -6.991 -11.625   6.331
  225   1HB   MET  27          1HB       MET  27  -8.229 -13.707   4.508
  226   2HB   MET  27          2HB       MET  27  -8.658 -13.763   6.205
  227   1HG   MET  27          1HG       MET  27  -8.798 -11.122   4.719
  228   2HG   MET  27          2HG       MET  27 -10.093 -12.288   4.530
  229   1HE   MET  27          1HE       MET  27 -12.333 -11.805   6.957
  230   2HE   MET  27          2HE       MET  27 -11.577 -12.961   5.833
  231   3HE   MET  27          3HE       MET  27 -11.401 -13.183   7.590
  232    H    SER  28           H        SER  28  -5.599 -14.628   4.937
  233    HA   SER  28           HA       SER  28  -5.450 -15.914   7.449
  234   1HB   SER  28          1HB       SER  28  -5.583 -17.251   5.424
  235   2HB   SER  28          2HB       SER  28  -4.167 -16.476   4.746
  236    HG   SER  28           HG       SER  28  -2.964 -17.385   6.649
  237    H    ASP  29           H        ASP  29  -2.681 -15.252   5.202
  238    HA   ASP  29           HA       ASP  29  -0.924 -15.022   7.382
  239   1HB   ASP  29          1HB       ASP  29  -0.521 -15.715   4.859
  240   2HB   ASP  29          2HB       ASP  29  -0.333 -13.993   4.589
  241    H    LEU  30           H        LEU  30  -2.373 -13.206   8.408
  242    HA   LEU  30           HA       LEU  30  -2.327 -10.651   7.151
  243   1HB   LEU  30          1HB       LEU  30  -3.142 -11.665   9.865
  244   2HB   LEU  30          2HB       LEU  30  -3.143  -9.957   9.479
  245    HG   LEU  30           HG       LEU  30  -4.638 -11.917   7.749
  246   1HD1  LEU  30          1HD1      LEU  30  -5.349 -12.320  10.073
  247   2HD1  LEU  30          2HD1      LEU  30  -5.740 -10.592  10.242
  248   3HD1  LEU  30          3HD1      LEU  30  -6.639 -11.599   9.082
  249   1HD2  LEU  30          1HD2      LEU  30  -5.954 -10.015   7.122
  250   2HD2  LEU  30          2HD2      LEU  30  -5.179  -9.002   8.365
  251   3HD2  LEU  30          3HD2      LEU  30  -4.235  -9.580   6.971
  252    H    THR  31           H        THR  31  -0.013 -12.545   8.828
  253    HA   THR  31           HA       THR  31   1.378 -10.258   9.951
  254    HB   THR  31           HB       THR  31   1.334 -12.306  11.268
  255    HG1  THR  31           HG1      THR  31   3.433 -11.563  11.459
  256   1HG2  THR  31          1HG2      THR  31   2.900 -14.164   9.877
  257   2HG2  THR  31          2HG2      THR  31   1.141 -14.289  10.122
  258   3HG2  THR  31          3HG2      THR  31   1.783 -13.570   8.625
  259    H    ILE  32           H        ILE  32   0.902 -11.152   6.876
  260    HA   ILE  32           HA       ILE  32   3.475 -10.081   6.105
  261    HB   ILE  32           HB       ILE  32   2.709 -12.902   5.748
  262   1HG1  ILE  32          1HG1      ILE  32   5.338 -12.826   5.328
  263   2HG1  ILE  32          2HG1      ILE  32   5.184 -11.259   6.098
  264   1HG2  ILE  32          1HG2      ILE  32   2.326 -12.206   3.478
  265   2HG2  ILE  32          2HG2      ILE  32   3.855 -11.296   3.450
  266   3HG2  ILE  32          3HG2      ILE  32   3.879 -13.072   3.561
  267   1HD1  ILE  32          1HD1      ILE  32   3.590 -13.045   7.648
  268   2HD1  ILE  32          2HD1      ILE  32   5.119 -13.892   7.313
  269   3HD1  ILE  32          3HD1      ILE  32   5.140 -12.300   8.107
  270    HA   PRO  33           HA       PRO  33   0.631  -8.153   3.410
  271   1HB   PRO  33          1HB       PRO  33   2.942  -6.911   2.010
  272   2HB   PRO  33          2HB       PRO  33   1.740  -6.159   3.074
  273   1HG   PRO  33          1HG       PRO  33   4.364  -6.507   3.886
  274   2HG   PRO  33          2HG       PRO  33   3.022  -6.683   5.042
  275   1HD   PRO  33          1HD       PRO  33   4.403  -8.967   3.479
  276   2HD   PRO  33          2HD       PRO  33   4.227  -8.795   5.247
  277    H    VAL  34           H        VAL  34  -0.117  -7.773   1.202
  278    HA   VAL  34           HA       VAL  34   0.886  -9.839  -0.633
  279    HB   VAL  34           HB       VAL  34  -1.746  -9.066  -1.317
  280   1HG1  VAL  34          1HG1      VAL  34  -2.248 -11.407  -0.954
  281   2HG1  VAL  34          2HG1      VAL  34  -0.629 -11.264  -1.680
  282   3HG1  VAL  34          3HG1      VAL  34  -0.798 -11.601   0.061
  283   1HG2  VAL  34          1HG2      VAL  34  -2.002  -8.180   0.960
  284   2HG2  VAL  34          2HG2      VAL  34  -3.011  -9.626   0.710
  285   3HG2  VAL  34          3HG2      VAL  34  -1.493  -9.749   1.632
  286    H    LYS  35           H        LYS  35  -0.244  -6.477  -0.159
  287    HA   LYS  35           HA       LYS  35   1.052  -5.822  -2.691
  288   1HB   LYS  35          1HB       LYS  35  -1.653  -4.681  -1.965
  289   2HB   LYS  35          2HB       LYS  35  -0.770  -4.499  -3.468
  290   1HG   LYS  35          1HG       LYS  35  -1.609  -7.244  -2.453
  291   2HG   LYS  35          2HG       LYS  35  -2.706  -6.248  -3.391
  292   1HD   LYS  35          1HD       LYS  35   0.043  -6.528  -4.531
  293   2HD   LYS  35          2HD       LYS  35  -0.899  -8.005  -4.491
  294   1HE   LYS  35          1HE       LYS  35  -2.363  -7.272  -6.103
  295   2HE   LYS  35          2HE       LYS  35  -2.441  -5.652  -5.441
  296   1HZ   LYS  35          1HZ       LYS  35  -0.270  -5.232  -6.412
  297   2HZ   LYS  35          2HZ       LYS  35  -0.238  -6.731  -7.059
  298   3HZ   LYS  35          3HZ       LYS  35  -1.358  -5.652  -7.557
  299    H    ARG  36           H        ARG  36   2.366  -4.056  -2.530
  300    HA   ARG  36           HA       ARG  36   1.844  -2.234  -0.358
  301   1HB   ARG  36          1HB       ARG  36   4.393  -3.858  -0.718
  302   2HB   ARG  36          2HB       ARG  36   4.441  -2.304   0.093
  303   1HG   ARG  36          1HG       ARG  36   2.223  -3.888   1.133
  304   2HG   ARG  36          2HG       ARG  36   3.703  -4.823   1.210
  305   1HD   ARG  36          1HD       ARG  36   4.184  -2.056   2.058
  306   2HD   ARG  36          2HD       ARG  36   2.892  -2.775   2.996
  307    HE   ARG  36           HE       ARG  36   5.271  -4.485   2.671
  308   1HH1  ARG  36          1HH1      ARG  36   3.629  -2.099   4.668
  309   2HH1  ARG  36          2HH1      ARG  36   4.497  -2.516   6.107
  310   1HH2  ARG  36          1HH2      ARG  36   6.417  -5.038   4.569
  311   2HH2  ARG  36          2HH2      ARG  36   6.095  -4.199   6.051
  312    H    GLY  37           H        GLY  37   1.546  -0.392  -1.609
  313   1HA   GLY  37          1HA       GLY  37   3.812   0.590  -3.123
  314   2HA   GLY  37          2HA       GLY  37   2.401   0.199  -4.088
  315    H    CYS  38           H        CYS  38   1.511   2.164  -4.636
  316    HA   CYS  38           HA       CYS  38   0.690   3.832  -2.389
  317   1HB   CYS  38          1HB       CYS  38   1.895   4.973  -4.914
  318   2HB   CYS  38          2HB       CYS  38   1.326   5.863  -3.516
  319    H    ILE  39           H        ILE  39  -1.100   5.406  -3.166
  320    HA   ILE  39           HA       ILE  39  -2.404   4.665  -5.617
  321    HB   ILE  39           HB       ILE  39  -3.020   2.951  -3.784
  322   1HG1  ILE  39          1HG1      ILE  39  -5.571   3.928  -4.798
  323   2HG1  ILE  39          2HG1      ILE  39  -4.331   3.967  -6.035
  324   1HG2  ILE  39          1HG2      ILE  39  -3.425   4.659  -2.024
  325   2HG2  ILE  39          2HG2      ILE  39  -4.844   5.219  -2.942
  326   3HG2  ILE  39          3HG2      ILE  39  -4.802   3.563  -2.289
  327   1HD1  ILE  39          1HD1      ILE  39  -3.835   1.616  -5.752
  328   2HD1  ILE  39          2HD1      ILE  39  -4.815   1.529  -4.269
  329   3HD1  ILE  39          3HD1      ILE  39  -5.606   1.765  -5.846
  330    H    ASP  40           H        ASP  40  -4.581   5.993  -5.746
  331    HA   ASP  40           HA       ASP  40  -3.858   8.623  -4.769
  332   1HB   ASP  40          1HB       ASP  40  -4.468   7.918  -7.271
  333   2HB   ASP  40          2HB       ASP  40  -6.119   8.072  -6.706
  334    H    VAL  41           H        VAL  41  -6.336   6.054  -4.713
  335    HA   VAL  41           HA       VAL  41  -7.857   7.656  -2.777
  336    HB   VAL  41           HB       VAL  41  -9.259   5.594  -4.380
  337   1HG1  VAL  41          1HG1      VAL  41 -10.388   8.300  -4.103
  338   2HG1  VAL  41          2HG1      VAL  41 -11.096   6.713  -3.717
  339   3HG1  VAL  41          3HG1      VAL  41 -10.005   7.508  -2.556
  340   1HG2  VAL  41          1HG2      VAL  41  -8.474   8.279  -5.566
  341   2HG2  VAL  41          2HG2      VAL  41  -7.911   6.681  -6.114
  342   3HG2  VAL  41          3HG2      VAL  41  -9.628   7.123  -6.273
  343    H    CYS  42           H        CYS  42  -8.697   6.509  -0.965
  344    HA   CYS  42           HA       CYS  42  -7.100   4.264  -0.260
  345   1HB   CYS  42          1HB       CYS  42  -8.038   6.192   1.222
  346   2HB   CYS  42          2HB       CYS  42  -9.483   5.204   1.307
  347    HA   PRO  43           HA       PRO  43 -10.019   1.559  -2.298
  348   1HB   PRO  43          1HB       PRO  43  -8.111  -0.563  -1.306
  349   2HB   PRO  43          2HB       PRO  43  -8.675  -0.236  -2.954
  350   1HG   PRO  43          1HG       PRO  43  -6.139   0.477  -2.228
  351   2HG   PRO  43          2HG       PRO  43  -7.103   1.599  -3.217
  352   1HD   PRO  43          1HD       PRO  43  -6.727   1.692  -0.155
  353   2HD   PRO  43          2HD       PRO  43  -6.461   2.996  -1.346
  354    H    LYS  44           H        LYS  44 -11.604  -0.067  -1.938
  355    HA   LYS  44           HA       LYS  44 -12.560  -0.102   0.751
  356   1HB   LYS  44          1HB       LYS  44 -13.566  -1.395  -1.800
  357   2HB   LYS  44          2HB       LYS  44 -14.408  -1.460  -0.265
  358   1HG   LYS  44          1HG       LYS  44 -13.622   1.291  -0.865
  359   2HG   LYS  44          2HG       LYS  44 -14.526   0.616  -2.206
  360   1HD   LYS  44          1HD       LYS  44 -16.213  -0.222  -0.380
  361   2HD   LYS  44          2HD       LYS  44 -15.403   0.903   0.692
  362   1HE   LYS  44          1HE       LYS  44 -16.585   2.627  -0.184
  363   2HE   LYS  44          2HE       LYS  44 -15.932   2.296  -1.776
  364   1HZ   LYS  44          1HZ       LYS  44 -18.481   1.641  -0.718
  365   2HZ   LYS  44          2HZ       LYS  44 -17.999   1.744  -2.274
  366   3HZ   LYS  44          3HZ       LYS  44 -17.769   0.360  -1.438
  367    H    ASN  45           H        ASN  45 -12.621  -1.809   2.221
  368    HA   ASN  45           HA       ASN  45 -10.613  -3.784   1.739
  369   1HB   ASN  45          1HB       ASN  45 -12.396  -3.079   4.115
  370   2HB   ASN  45          2HB       ASN  45 -11.372  -4.500   4.145
  371   1HD2  ASN  45          1HD2      ASN  45 -11.106  -2.432   5.946
  372   2HD2  ASN  45          2HD2      ASN  45  -9.598  -1.613   5.713
  373    H    SER  46           H        SER  46 -11.071  -6.148   1.954
  374    HA   SER  46           HA       SER  46 -13.884  -6.757   1.480
  375   1HB   SER  46          1HB       SER  46 -13.135  -8.582  -0.046
  376   2HB   SER  46          2HB       SER  46 -12.666  -6.996  -0.626
  377    HG   SER  46           HG       SER  46 -10.569  -7.565   0.710
  378    H    LEU  47           H        LEU  47 -14.278  -9.260   1.884
  379    HA   LEU  47           HA       LEU  47 -13.280  -9.777   4.527
  380   1HB   LEU  47          1HB       LEU  47 -15.265 -11.161   2.728
  381   2HB   LEU  47          2HB       LEU  47 -14.810 -11.782   4.302
  382    HG   LEU  47           HG       LEU  47 -15.933  -9.001   3.934
  383   1HD1  LEU  47          1HD1      LEU  47 -17.983  -9.773   3.593
  384   2HD1  LEU  47          2HD1      LEU  47 -17.311 -11.414   3.435
  385   3HD1  LEU  47          3HD1      LEU  47 -17.866 -10.828   5.022
  386   1HD2  LEU  47          1HD2      LEU  47 -14.754 -10.265   6.119
  387   2HD2  LEU  47          2HD2      LEU  47 -15.746  -8.787   6.138
  388   3HD2  LEU  47          3HD2      LEU  47 -16.503 -10.371   6.431
  389    H    LEU  48           H        LEU  48 -11.858 -10.076   1.596
  390    HA   LEU  48           HA       LEU  48 -10.738 -12.720   2.176
  391   1HB   LEU  48          1HB       LEU  48 -10.573 -11.083  -0.356
  392   2HB   LEU  48          2HB       LEU  48  -9.979 -12.716  -0.126
  393    HG   LEU  48           HG       LEU  48 -12.869 -12.281   0.422
  394   1HD1  LEU  48          1HD1      LEU  48 -13.350 -11.292  -1.508
  395   2HD1  LEU  48          2HD1      LEU  48 -11.664 -11.418  -2.064
  396   3HD1  LEU  48          3HD1      LEU  48 -12.793 -12.767  -2.333
  397   1HD2  LEU  48          1HD2      LEU  48 -12.181 -14.440  -1.373
  398   2HD2  LEU  48          2HD2      LEU  48 -11.145 -14.463   0.073
  399   3HD2  LEU  48          3HD2      LEU  48 -12.916 -14.493   0.247
  400    H    VAL  49           H        VAL  49  -9.823  -9.332   1.262
  401    HA   VAL  49           HA       VAL  49  -7.351  -9.769   2.775
  402    HB   VAL  49           HB       VAL  49  -6.039  -8.753   1.121
  403   1HG1  VAL  49          1HG1      VAL  49  -7.998 -10.545  -0.353
  404   2HG1  VAL  49          2HG1      VAL  49  -6.327 -10.175  -0.842
  405   3HG1  VAL  49          3HG1      VAL  49  -6.634 -11.102   0.646
  406   1HG2  VAL  49          1HG2      VAL  49  -7.151  -6.902   0.306
  407   2HG2  VAL  49          2HG2      VAL  49  -7.259  -7.998  -1.092
  408   3HG2  VAL  49          3HG2      VAL  49  -8.655  -7.804  -0.004
  409    H    LYS  50           H        LYS  50  -6.323  -7.592   3.385
  410    HA   LYS  50           HA       LYS  50  -8.448  -5.607   3.790
  411   1HB   LYS  50          1HB       LYS  50  -8.043  -6.907   5.853
  412   2HB   LYS  50          2HB       LYS  50  -6.349  -6.462   5.807
  413   1HG   LYS  50          1HG       LYS  50  -6.752  -4.346   6.591
  414   2HG   LYS  50          2HG       LYS  50  -8.159  -4.129   5.569
  415   1HD   LYS  50          1HD       LYS  50  -9.105  -4.151   7.728
  416   2HD   LYS  50          2HD       LYS  50  -9.350  -5.803   7.196
  417   1HE   LYS  50          1HE       LYS  50  -7.174  -6.432   8.366
  418   2HE   LYS  50          2HE       LYS  50  -7.100  -4.801   9.002
  419   1HZ   LYS  50          1HZ       LYS  50  -8.153  -6.342  10.520
  420   2HZ   LYS  50          2HZ       LYS  50  -9.196  -5.166  10.080
  421   3HZ   LYS  50          3HZ       LYS  50  -9.334  -6.660   9.438
  422    H    TYR  51           H        TYR  51  -7.870  -3.449   3.495
  423    HA   TYR  51           HA       TYR  51  -5.131  -3.071   2.486
  424   1HB   TYR  51          1HB       TYR  51  -7.754  -1.540   1.962
  425   2HB   TYR  51          2HB       TYR  51  -6.247  -1.288   1.103
  426    HD1  TYR  51           HD1      TYR  51  -6.007  -2.272  -0.986
  427    HD2  TYR  51           HD2      TYR  51  -8.655  -4.072   1.852
  428    HE1  TYR  51           HE1      TYR  51  -6.718  -3.984  -2.725
  429    HE2  TYR  51           HE2      TYR  51  -9.357  -5.778   0.103
  430    HH   TYR  51           HH       TYR  51  -7.714  -6.528  -2.442
  431    H    VAL  52           H        VAL  52  -3.925  -1.296   3.204
  432    HA   VAL  52           HA       VAL  52  -5.236   0.426   5.175
  433    HB   VAL  52           HB       VAL  52  -2.874  -1.366   5.532
  434   1HG1  VAL  52          1HG1      VAL  52  -1.736   0.654   5.914
  435   2HG1  VAL  52          2HG1      VAL  52  -3.147   1.411   6.691
  436   3HG1  VAL  52          3HG1      VAL  52  -2.249   0.127   7.535
  437   1HG2  VAL  52          1HG2      VAL  52  -5.392  -1.432   6.518
  438   2HG2  VAL  52          2HG2      VAL  52  -3.982  -2.105   7.369
  439   3HG2  VAL  52          3HG2      VAL  52  -4.587  -0.486   7.793
  440    H    CYS  53           H        CYS  53  -4.969   2.522   4.619
  441    HA   CYS  53           HA       CYS  53  -2.925   3.107   2.646
  442   1HB   CYS  53          1HB       CYS  53  -5.070   4.956   3.694
  443   2HB   CYS  53          2HB       CYS  53  -4.085   5.163   2.260
  444    H    CYS  54           H        CYS  54  -1.704   5.274   3.003
  445    HA   CYS  54           HA       CYS  54  -1.475   6.193   5.677
  446   1HB   CYS  54          1HB       CYS  54   1.012   5.601   5.807
  447   2HB   CYS  54          2HB       CYS  54  -0.167   4.373   6.225
  448    H    ASN  55           H        ASN  55  -0.577   8.286   5.622
  449    HA   ASN  55           HA       ASN  55   0.153   9.168   2.961
  450   1HB   ASN  55          1HB       ASN  55  -0.071  11.500   4.170
  451   2HB   ASN  55          2HB       ASN  55  -1.535  10.602   3.816
  452   1HD2  ASN  55          1HD2      ASN  55   0.984  10.898   6.314
  453   2HD2  ASN  55          2HD2      ASN  55  -0.056  10.768   7.694
  454    H    THR  56           H        THR  56   1.681   7.861   5.553
  455    HA   THR  56           HA       THR  56   3.812   9.848   5.774
  456    HB   THR  56           HB       THR  56   4.542   8.309   7.637
  457    HG1  THR  56           HG1      THR  56   3.541   6.320   7.667
  458   1HG2  THR  56          1HG2      THR  56   3.078   9.542   8.892
  459   2HG2  THR  56          2HG2      THR  56   1.962   9.707   7.515
  460   3HG2  THR  56          3HG2      THR  56   1.865   8.280   8.573
  461    H    ASP  57           H        ASP  57   6.117   8.924   5.807
  462    HA   ASP  57           HA       ASP  57   6.397   7.573   3.297
  463   1HB   ASP  57          1HB       ASP  57   8.757   8.237   5.045
  464   2HB   ASP  57          2HB       ASP  57   8.601   8.368   3.304
  465    H    ARG  58           H        ARG  58   8.142   5.743   3.186
  466    HA   ARG  58           HA       ARG  58   8.455   3.630   3.678
  467   1HB   ARG  58          1HB       ARG  58   9.518   5.053   6.164
  468   2HB   ARG  58          2HB       ARG  58   9.815   3.350   5.868
  469   1HG   ARG  58          1HG       ARG  58  11.257   3.757   4.090
  470   2HG   ARG  58          2HG       ARG  58  10.415   5.211   3.592
  471   1HD   ARG  58          1HD       ARG  58  12.176   6.316   4.552
  472   2HD   ARG  58          2HD       ARG  58  11.356   5.994   6.066
  473    HE   ARG  58           HE       ARG  58  12.811   3.684   5.680
  474   1HH1  ARG  58          1HH1      ARG  58  13.668   7.097   5.649
  475   2HH1  ARG  58          2HH1      ARG  58  15.291   6.825   6.189
  476   1HH2  ARG  58          1HH2      ARG  58  14.951   3.325   6.392
  477   2HH2  ARG  58          2HH2      ARG  58  16.026   4.666   6.614
  478    H    CYS  59           H        CYS  59   5.738   4.358   4.280
  479    HA   CYS  59           HA       CYS  59   5.144   3.290   6.882
  480   1HB   CYS  59          1HB       CYS  59   2.843   3.801   6.368
  481   2HB   CYS  59          2HB       CYS  59   3.870   5.179   6.028
  482    H    ASN  60           H        ASN  60   4.619   2.471   3.382
  483    HA   ASN  60           HA       ASN  60   3.902  -0.209   4.243
  484   1HB   ASN  60          1HB       ASN  60   2.963  -0.481   1.966
  485   2HB   ASN  60          2HB       ASN  60   2.313   0.970   2.702
  486   1HD2  ASN  60          1HD2      ASN  60   4.496  -0.352   0.332
  487   2HD2  ASN  60          2HD2      ASN  60   4.778   1.090  -0.584
  488   1H    HOH  61          1H        HOH  61  -0.951 -12.223   3.775
  489   2H    HOH  61          2H        HOH  61  -0.079 -11.431   2.825
  Start of MODEL   15
    1   1H    LEU   1           H1       LEU   1   7.615  12.590  -1.010
    2    HA   LEU   1           HA       LEU   1   6.686  11.216   0.510
    3   1HB   LEU   1          1HB       LEU   1   4.363  11.865  -1.071
    4   2HB   LEU   1          2HB       LEU   1   4.344  10.166  -0.638
    5    HG   LEU   1           HG       LEU   1   4.849  11.030   1.779
    6   1HD1  LEU   1          1HD1      LEU   1   3.550  13.505   0.613
    7   2HD1  LEU   1          2HD1      LEU   1   4.016  13.223   2.307
    8   3HD1  LEU   1          3HD1      LEU   1   5.270  13.372   1.052
    9   1HD2  LEU   1          1HD2      LEU   1   2.789   9.878   0.985
   10   2HD2  LEU   1          2HD2      LEU   1   2.500  11.072   2.274
   11   3HD2  LEU   1          3HD2      LEU   1   2.100  11.470   0.585
   12    H    LYS   2           H        LYS   2   7.988   9.469   0.583
   13    HA   LYS   2           HA       LYS   2   7.867   7.652  -1.724
   14   1HB   LYS   2          1HB       LYS   2  10.184   8.377   0.087
   15   2HB   LYS   2          2HB       LYS   2  10.209   7.006  -1.003
   16   1HG   LYS   2          1HG       LYS   2  10.764   8.369  -2.723
   17   2HG   LYS   2          2HG       LYS   2   9.264   9.250  -2.521
   18   1HD   LYS   2          1HD       LYS   2  10.250  10.934  -1.239
   19   2HD   LYS   2          2HD       LYS   2  11.473   9.868  -0.577
   20   1HE   LYS   2          1HE       LYS   2  12.882  10.085  -2.437
   21   2HE   LYS   2          2HE       LYS   2  11.559  10.405  -3.542
   22   1HZ   LYS   2          1HZ       LYS   2  12.862  12.370  -3.058
   23   2HZ   LYS   2          2HZ       LYS   2  11.317  12.568  -2.570
   24   3HZ   LYS   2          3HZ       LYS   2  12.488  12.273  -1.471
   25    H    CYS   3           H        CYS   3   7.680   5.417  -1.331
   26    HA   CYS   3           HA       CYS   3   7.342   4.679   1.471
   27   1HB   CYS   3          1HB       CYS   3   5.431   3.554  -0.529
   28   2HB   CYS   3          2HB       CYS   3   5.269   3.720   1.208
   29    H    ASN   4           H        ASN   4   7.390   2.187   1.671
   30    HA   ASN   4           HA       ASN   4   9.562   1.274   0.102
   31   1HB   ASN   4          1HB       ASN   4   7.918  -0.543   1.892
   32   2HB   ASN   4          2HB       ASN   4   9.651  -0.544   1.634
   33   1HD2  ASN   4          1HD2      ASN   4   8.247  -0.533   4.123
   34   2HD2  ASN   4          2HD2      ASN   4   8.688   0.896   4.997
   35    H    LYS   5           H        LYS   5   9.474  -0.859  -1.126
   36    HA   LYS   5           HA       LYS   5   6.907  -1.090  -2.494
   37   1HB   LYS   5          1HB       LYS   5   9.685  -2.053  -3.239
   38   2HB   LYS   5          2HB       LYS   5   8.244  -2.332  -4.195
   39   1HG   LYS   5          1HG       LYS   5   9.208   0.447  -3.377
   40   2HG   LYS   5          2HG       LYS   5   9.626  -0.309  -4.902
   41   1HD   LYS   5          1HD       LYS   5   6.783   0.279  -3.943
   42   2HD   LYS   5          2HD       LYS   5   7.665   1.217  -5.132
   43   1HE   LYS   5          1HE       LYS   5   7.791  -1.532  -5.970
   44   2HE   LYS   5          2HE       LYS   5   6.125  -1.203  -5.530
   45   1HZ   LYS   5          1HZ       LYS   5   7.740   0.041  -7.595
   46   2HZ   LYS   5          2HZ       LYS   5   6.188  -0.465  -7.656
   47   3HZ   LYS   5          3HZ       LYS   5   6.562   0.934  -6.900
   48    H    LEU   6           H        LEU   6   7.121  -3.726  -3.454
   49    HA   LEU   6           HA       LEU   6   5.875  -5.176  -1.553
   50   1HB   LEU   6          1HB       LEU   6   6.512  -5.575  -4.103
   51   2HB   LEU   6          2HB       LEU   6   7.729  -6.614  -3.389
   52    HG   LEU   6           HG       LEU   6   5.731  -7.650  -2.066
   53   1HD1  LEU   6          1HD1      LEU   6   4.245  -6.415  -4.400
   54   2HD1  LEU   6          2HD1      LEU   6   3.586  -7.570  -3.217
   55   3HD1  LEU   6          3HD1      LEU   6   4.082  -5.943  -2.691
   56   1HD2  LEU   6          1HD2      LEU   6   5.304  -8.604  -4.746
   57   2HD2  LEU   6          2HD2      LEU   6   7.033  -8.270  -4.487
   58   3HD2  LEU   6          3HD2      LEU   6   6.166  -9.372  -3.391
   59    H    VAL   7           H        VAL   7   9.442  -5.078  -2.179
   60    HA   VAL   7           HA       VAL   7   9.826  -6.594   0.285
   61    HB   VAL   7           HB       VAL   7  12.017  -5.719  -1.560
   62   1HG1  VAL   7          1HG1      VAL   7  12.959  -6.861   0.198
   63   2HG1  VAL   7          2HG1      VAL   7  11.533  -7.901   0.436
   64   3HG1  VAL   7          3HG1      VAL   7  12.647  -8.213  -0.917
   65   1HG2  VAL   7          1HG2      VAL   7  10.376  -6.550  -3.117
   66   2HG2  VAL   7          2HG2      VAL   7  11.633  -7.793  -2.909
   67   3HG2  VAL   7          3HG2      VAL   7  10.059  -7.974  -2.099
   68    HA   PRO   8           HA       PRO   8  10.236  -2.598   2.190
   69   1HB   PRO   8          1HB       PRO   8  10.788  -4.345   4.604
   70   2HB   PRO   8          2HB       PRO   8   9.625  -3.022   4.415
   71   1HG   PRO   8          1HG       PRO   8   8.733  -5.598   4.385
   72   2HG   PRO   8          2HG       PRO   8   8.074  -4.450   3.197
   73   1HD   PRO   8          1HD       PRO   8  10.330  -6.501   2.734
   74   2HD   PRO   8          2HD       PRO   8   8.855  -6.232   1.765
   75    H    ILE   9           H        ILE   9  12.808  -4.364   1.212
   76    HA   ILE   9           HA       ILE   9  14.742  -3.099   2.986
   77    HB   ILE   9           HB       ILE   9  14.601  -5.554   1.584
   78   1HG1  ILE   9          1HG1      ILE   9  17.123  -4.759   2.937
   79   2HG1  ILE   9          2HG1      ILE   9  15.662  -4.621   3.894
   80   1HG2  ILE   9          1HG2      ILE   9  15.640  -4.231  -0.295
   81   2HG2  ILE   9          2HG2      ILE   9  17.054  -3.990   0.758
   82   3HG2  ILE   9          3HG2      ILE   9  16.577  -5.634   0.272
   83   1HD1  ILE   9          1HD1      ILE   9  17.055  -6.936   3.671
   84   2HD1  ILE   9          2HD1      ILE   9  15.296  -6.900   3.933
   85   3HD1  ILE   9          3HD1      ILE   9  15.947  -7.137   2.293
   86    H    ALA  10           H        ALA  10  12.936  -2.298   0.284
   87    HA   ALA  10           HA       ALA  10  14.780  -0.177  -0.361
   88   1HB   ALA  10          1HB       ALA  10  15.360  -0.816  -2.475
   89   2HB   ALA  10          2HB       ALA  10  15.097  -2.450  -1.817
   90   3HB   ALA  10          3HB       ALA  10  13.815  -1.653  -2.761
   91    H    TYR  11           H        TYR  11  13.658   1.670  -0.914
   92    HA   TYR  11           HA       TYR  11  10.797   1.309  -1.494
   93   1HB   TYR  11          1HB       TYR  11  10.471   3.304  -0.016
   94   2HB   TYR  11          2HB       TYR  11  11.319   2.057   0.878
   95    HD1  TYR  11           HD1      TYR  11  11.544   5.400  -0.579
   96    HD2  TYR  11           HD2      TYR  11  13.740   2.290   1.372
   97    HE1  TYR  11           HE1      TYR  11  13.412   7.041  -0.050
   98    HE2  TYR  11           HE2      TYR  11  15.602   3.941   1.894
   99    HH   TYR  11           HH       TYR  11  16.456   6.039   0.967
  100    H    LYS  12           H        LYS  12   9.809   3.111  -2.703
  101    HA   LYS  12           HA       LYS  12  11.763   4.805  -4.065
  102   1HB   LYS  12          1HB       LYS  12   9.816   2.907  -5.386
  103   2HB   LYS  12          2HB       LYS  12  10.461   4.307  -6.218
  104   1HG   LYS  12          1HG       LYS  12  12.673   2.976  -4.938
  105   2HG   LYS  12          2HG       LYS  12  11.728   1.749  -5.758
  106   1HD   LYS  12          1HD       LYS  12  11.740   3.616  -7.726
  107   2HD   LYS  12          2HD       LYS  12  13.223   4.087  -6.917
  108   1HE   LYS  12          1HE       LYS  12  14.053   1.720  -7.091
  109   2HE   LYS  12          2HE       LYS  12  12.581   1.276  -7.933
  110   1HZ   LYS  12          1HZ       LYS  12  13.218   2.390  -9.774
  111   2HZ   LYS  12          2HZ       LYS  12  14.088   3.517  -8.975
  112   3HZ   LYS  12          3HZ       LYS  12  14.706   2.024  -9.207
  113    H    THR  13           H        THR  13  10.238   6.321  -5.653
  114    HA   THR  13           HA       THR  13   8.527   7.664  -3.738
  115    HB   THR  13           HB       THR  13   9.042   8.559  -6.590
  116    HG1  THR  13           HG1      THR  13  11.176   8.252  -6.054
  117   1HG2  THR  13          1HG2      THR  13   8.104   9.760  -4.138
  118   2HG2  THR  13          2HG2      THR  13   9.703  10.453  -4.506
  119   3HG2  THR  13          3HG2      THR  13   8.389  10.558  -5.703
  120    H    CYS  14           H        CYS  14   6.328   8.020  -3.903
  121    HA   CYS  14           HA       CYS  14   4.891   5.978  -5.167
  122   1HB   CYS  14          1HB       CYS  14   3.990   8.589  -3.937
  123   2HB   CYS  14          2HB       CYS  14   2.892   7.352  -4.518
  124    HA   PRO  15           HA       PRO  15   5.306   7.734  -9.264
  125   1HB   PRO  15          1HB       PRO  15   3.336   5.980 -10.358
  126   2HB   PRO  15          2HB       PRO  15   5.081   5.680 -10.269
  127   1HG   PRO  15          1HG       PRO  15   2.829   4.777  -8.355
  128   2HG   PRO  15          2HG       PRO  15   4.260   3.884  -8.919
  129   1HD   PRO  15          1HD       PRO  15   4.289   4.970  -6.425
  130   2HD   PRO  15          2HD       PRO  15   5.767   4.966  -7.428
  131    H    GLU  16           H        GLU  16   3.805   8.413 -11.182
  132    HA   GLU  16           HA       GLU  16   2.303  10.540 -10.275
  133   1HB   GLU  16          1HB       GLU  16   2.394   9.144 -12.981
  134   2HB   GLU  16          2HB       GLU  16   1.508  10.633 -12.710
  135   1HG   GLU  16          1HG       GLU  16   4.381  10.541 -11.802
  136   2HG   GLU  16          2HG       GLU  16   4.082  10.622 -13.527
  137    H    GLY  17           H        GLY  17   0.061  10.915 -10.041
  138   1HA   GLY  17          1HA       GLY  17  -2.186  10.357 -10.215
  139   2HA   GLY  17          2HA       GLY  17  -1.766   8.699 -10.598
  140    H    LYS  18           H        LYS  18   0.254   8.496  -8.373
  141    HA   LYS  18           HA       LYS  18  -1.696   8.074  -6.244
  142   1HB   LYS  18          1HB       LYS  18   1.108   6.981  -6.628
  143   2HB   LYS  18          2HB       LYS  18   0.046   6.596  -5.288
  144   1HG   LYS  18          1HG       LYS  18  -0.628   4.858  -6.619
  145   2HG   LYS  18          2HG       LYS  18  -1.641   6.067  -7.383
  146   1HD   LYS  18          1HD       LYS  18   0.775   6.447  -8.703
  147   2HD   LYS  18          2HD       LYS  18   0.796   4.718  -8.418
  148   1HE   LYS  18          1HE       LYS  18  -1.844   5.667  -9.346
  149   2HE   LYS  18          2HE       LYS  18  -0.567   6.031 -10.490
  150   1HZ   LYS  18          1HZ       LYS  18  -0.836   3.369  -9.301
  151   2HZ   LYS  18          2HZ       LYS  18  -1.646   3.790 -10.655
  152   3HZ   LYS  18          3HZ       LYS  18  -0.012   3.795 -10.645
  153    H    ASN  19           H        ASN  19  -0.978   8.559  -3.967
  154    HA   ASN  19           HA       ASN  19   0.976  10.682  -3.860
  155   1HB   ASN  19          1HB       ASN  19  -1.094  11.945  -4.133
  156   2HB   ASN  19          2HB       ASN  19  -1.943  10.927  -2.987
  157   1HD2  ASN  19          1HD2      ASN  19  -2.527  12.658  -1.713
  158   2HD2  ASN  19          2HD2      ASN  19  -1.424  13.498  -0.676
  159    H    LEU  20           H        LEU  20  -1.433   8.543  -2.205
  160    HA   LEU  20           HA       LEU  20   0.225   8.585   0.202
  161   1HB   LEU  20          1HB       LEU  20  -2.457   7.265  -0.042
  162   2HB   LEU  20          2HB       LEU  20  -1.641   7.861   1.390
  163    HG   LEU  20           HG       LEU  20  -1.934  10.185   0.008
  164   1HD1  LEU  20          1HD1      LEU  20  -4.605   8.947  -0.490
  165   2HD1  LEU  20          2HD1      LEU  20  -3.799  10.313  -1.298
  166   3HD1  LEU  20          3HD1      LEU  20  -3.299   8.644  -1.662
  167   1HD2  LEU  20          1HD2      LEU  20  -3.799  10.673   1.510
  168   2HD2  LEU  20          2HD2      LEU  20  -3.977   8.938   1.869
  169   3HD2  LEU  20          3HD2      LEU  20  -2.499   9.801   2.357
  170    H    CYS  21           H        CYS  21   0.241   6.300   1.355
  171    HA   CYS  21           HA       CYS  21   1.182   4.450  -0.698
  172   1HB   CYS  21          1HB       CYS  21   1.751   4.105   2.221
  173   2HB   CYS  21          2HB       CYS  21   2.674   3.566   0.833
  174    H    TYR  22           H        TYR  22   0.480   2.207  -0.603
  175    HA   TYR  22           HA       TYR  22  -1.796   1.726   1.187
  176   1HB   TYR  22          1HB       TYR  22  -3.125   1.252  -0.697
  177   2HB   TYR  22          2HB       TYR  22  -1.994   2.321  -1.503
  178    HD1  TYR  22           HD1      TYR  22  -0.363   1.471  -3.080
  179    HD2  TYR  22           HD2      TYR  22  -2.927  -1.209  -0.947
  180    HE1  TYR  22           HE1      TYR  22   0.288  -0.416  -4.654
  181    HE2  TYR  22           HE2      TYR  22  -2.267  -3.087  -2.527
  182    HH   TYR  22           HH       TYR  22  -1.411  -3.400  -4.688
  183    H    LYS  23           H        LYS  23  -2.057  -0.439   1.883
  184    HA   LYS  23           HA       LYS  23  -0.134  -2.374   0.880
  185   1HB   LYS  23          1HB       LYS  23   0.384  -2.959   3.339
  186   2HB   LYS  23          2HB       LYS  23   1.210  -1.599   2.606
  187   1HG   LYS  23          1HG       LYS  23  -0.424  -0.027   3.626
  188   2HG   LYS  23          2HG       LYS  23  -1.316  -1.371   4.311
  189   1HD   LYS  23          1HD       LYS  23   0.073  -1.449   6.101
  190   2HD   LYS  23          2HD       LYS  23   1.468  -1.652   5.059
  191   1HE   LYS  23          1HE       LYS  23   2.022   0.594   5.118
  192   2HE   LYS  23          2HE       LYS  23   0.351   1.118   5.147
  193   1HZ   LYS  23          1HZ       LYS  23   0.469   1.281   7.324
  194   2HZ   LYS  23          2HZ       LYS  23   0.939  -0.273   7.500
  195   3HZ   LYS  23          3HZ       LYS  23   2.056   0.898   7.282
  196    H    MET  24           H        MET  24  -1.138  -4.289   0.543
  197    HA   MET  24           HA       MET  24  -3.683  -4.631   1.930
  198   1HB   MET  24          1HB       MET  24  -2.667  -5.670  -0.773
  199   2HB   MET  24          2HB       MET  24  -4.190  -6.174  -0.067
  200   1HG   MET  24          1HG       MET  24  -4.968  -3.792  -0.045
  201   2HG   MET  24          2HG       MET  24  -3.445  -3.286  -0.746
  202   1HE   MET  24          1HE       MET  24  -5.701  -2.516  -3.339
  203   2HE   MET  24          2HE       MET  24  -4.276  -2.143  -2.338
  204   3HE   MET  24          3HE       MET  24  -4.067  -2.877  -3.946
  205    H    PHE  25           H        PHE  25  -4.127  -6.592   2.998
  206    HA   PHE  25           HA       PHE  25  -1.990  -8.593   2.900
  207   1HB   PHE  25          1HB       PHE  25  -3.546  -7.741   5.401
  208   2HB   PHE  25          2HB       PHE  25  -2.077  -8.696   5.351
  209    HD1  PHE  25           HD1      PHE  25  -3.287  -5.305   4.348
  210    HD2  PHE  25           HD2      PHE  25  -0.089  -7.648   5.864
  211    HE1  PHE  25           HE1      PHE  25  -1.923  -3.226   4.684
  212    HE2  PHE  25           HE2      PHE  25   1.276  -5.567   6.199
  213    HZ   PHE  25           HZ       PHE  25   0.343  -3.381   5.604
  214    H    MET  26           H        MET  26  -2.670 -10.778   3.357
  215    HA   MET  26           HA       MET  26  -5.338 -11.230   2.518
  216   1HB   MET  26          1HB       MET  26  -3.101 -13.080   3.514
  217   2HB   MET  26          2HB       MET  26  -4.617 -13.674   2.867
  218   1HG   MET  26          1HG       MET  26  -4.066 -12.198   0.766
  219   2HG   MET  26          2HG       MET  26  -2.439 -12.126   1.412
  220   1HE   MET  26          1HE       MET  26  -4.790 -15.716  -0.060
  221   2HE   MET  26          2HE       MET  26  -5.352 -14.079   0.358
  222   3HE   MET  26          3HE       MET  26  -4.462 -14.355  -1.159
  223    H    MET  27           H        MET  27  -6.876 -12.706   3.713
  224    HA   MET  27           HA       MET  27  -7.333 -11.692   6.256
  225   1HB   MET  27          1HB       MET  27  -8.437 -13.922   4.528
  226   2HB   MET  27          2HB       MET  27  -8.906 -13.907   6.217
  227   1HG   MET  27          1HG       MET  27  -9.094 -11.285   4.761
  228   2HG   MET  27          2HG       MET  27 -10.249 -12.518   4.292
  229   1HE   MET  27          1HE       MET  27 -10.804 -14.167   7.052
  230   2HE   MET  27          2HE       MET  27 -12.285 -13.249   7.411
  231   3HE   MET  27          3HE       MET  27 -11.871 -13.647   5.726
  232    H    SER  28           H        SER  28  -5.729 -14.674   5.081
  233    HA   SER  28           HA       SER  28  -5.672 -15.928   7.579
  234   1HB   SER  28          1HB       SER  28  -5.383 -17.259   5.592
  235   2HB   SER  28          2HB       SER  28  -4.050 -16.270   5.031
  236    HG   SER  28           HG       SER  28  -2.676 -17.396   6.236
  237    H    ASP  29           H        ASP  29  -2.544 -15.474   5.970
  238    HA   ASP  29           HA       ASP  29  -1.408 -14.629   8.408
  239   1HB   ASP  29          1HB       ASP  29  -0.391 -16.001   6.385
  240   2HB   ASP  29          2HB       ASP  29  -0.044 -14.425   5.704
  241    H    LEU  30           H        LEU  30  -2.556 -12.563   8.799
  242    HA   LEU  30           HA       LEU  30  -2.411 -10.491   6.840
  243   1HB   LEU  30          1HB       LEU  30  -3.118 -10.192   9.751
  244   2HB   LEU  30          2HB       LEU  30  -3.598  -9.178   8.405
  245    HG   LEU  30           HG       LEU  30  -4.555 -11.767   7.797
  246   1HD1  LEU  30          1HD1      LEU  30  -4.795 -11.089  10.711
  247   2HD1  LEU  30          2HD1      LEU  30  -6.104 -11.965   9.884
  248   3HD1  LEU  30          3HD1      LEU  30  -4.463 -12.651   9.929
  249   1HD2  LEU  30          1HD2      LEU  30  -6.016 -10.262   7.025
  250   2HD2  LEU  30          2HD2      LEU  30  -6.753 -10.354   8.642
  251   3HD2  LEU  30          3HD2      LEU  30  -5.587  -9.063   8.267
  252    H    THR  31           H        THR  31  -0.213 -11.859   9.081
  253    HA   THR  31           HA       THR  31   1.200  -9.369   9.565
  254    HB   THR  31           HB       THR  31   2.581 -10.799  11.013
  255    HG1  THR  31           HG1      THR  31   2.703 -12.939  10.431
  256   1HG2  THR  31          1HG2      THR  31   0.847 -10.835  12.504
  257   2HG2  THR  31          2HG2      THR  31  -0.342 -10.843  11.179
  258   3HG2  THR  31          3HG2      THR  31   0.337 -12.376  11.775
  259    H    ILE  32           H        ILE  32   0.870 -11.376   6.937
  260    HA   ILE  32           HA       ILE  32   3.576 -10.669   6.057
  261    HB   ILE  32           HB       ILE  32   2.233 -13.319   6.068
  262   1HG1  ILE  32          1HG1      ILE  32   5.179 -13.001   5.940
  263   2HG1  ILE  32          2HG1      ILE  32   4.404 -12.293   7.342
  264   1HG2  ILE  32          1HG2      ILE  32   2.332 -13.411   3.809
  265   2HG2  ILE  32          2HG2      ILE  32   3.583 -12.150   3.694
  266   3HG2  ILE  32          3HG2      ILE  32   4.034 -13.812   4.144
  267   1HD1  ILE  32          1HD1      ILE  32   5.128 -14.779   7.508
  268   2HD1  ILE  32          2HD1      ILE  32   3.479 -14.376   8.044
  269   3HD1  ILE  32          3HD1      ILE  32   3.739 -15.122   6.449
  270    HA   PRO  33           HA       PRO  33   0.746  -8.417   3.407
  271   1HB   PRO  33          1HB       PRO  33   3.467  -7.569   2.323
  272   2HB   PRO  33          2HB       PRO  33   2.046  -6.574   2.682
  273   1HG   PRO  33          1HG       PRO  33   4.123  -6.613   4.446
  274   2HG   PRO  33          2HG       PRO  33   2.462  -6.699   5.079
  275   1HD   PRO  33          1HD       PRO  33   4.433  -9.023   4.696
  276   2HD   PRO  33          2HD       PRO  33   3.371  -8.666   6.086
  277    H    VAL  34           H        VAL  34  -0.004  -8.339   1.247
  278    HA   VAL  34           HA       VAL  34   1.097 -10.485  -0.430
  279    HB   VAL  34           HB       VAL  34  -1.496  -9.773  -1.278
  280   1HG1  VAL  34          1HG1      VAL  34  -2.011 -12.060  -0.828
  281   2HG1  VAL  34          2HG1      VAL  34  -0.304 -12.003  -1.329
  282   3HG1  VAL  34          3HG1      VAL  34  -0.720 -12.181   0.393
  283   1HG2  VAL  34          1HG2      VAL  34  -1.297 -10.049   1.737
  284   2HG2  VAL  34          2HG2      VAL  34  -1.987  -8.697   0.809
  285   3HG2  VAL  34          3HG2      VAL  34  -2.801 -10.279   0.813
  286    H    LYS  35           H        LYS  35  -0.155  -7.119  -0.285
  287    HA   LYS  35           HA       LYS  35   1.316  -6.613  -2.757
  288   1HB   LYS  35          1HB       LYS  35  -1.458  -5.494  -2.327
  289   2HB   LYS  35          2HB       LYS  35  -0.478  -5.439  -3.777
  290   1HG   LYS  35          1HG       LYS  35  -1.323  -8.095  -2.559
  291   2HG   LYS  35          2HG       LYS  35  -2.388  -7.220  -3.642
  292   1HD   LYS  35          1HD       LYS  35  -0.662  -7.249  -5.421
  293   2HD   LYS  35          2HD       LYS  35   0.476  -8.027  -4.338
  294   1HE   LYS  35          1HE       LYS  35  -0.950 -10.029  -4.188
  295   2HE   LYS  35          2HE       LYS  35  -2.216  -9.246  -5.113
  296   1HZ   LYS  35          1HZ       LYS  35  -0.781 -10.715  -6.423
  297   2HZ   LYS  35          2HZ       LYS  35  -0.798  -9.186  -6.996
  298   3HZ   LYS  35          3HZ       LYS  35   0.490  -9.726  -6.150
  299    H    ARG  36           H        ARG  36   2.379  -4.632  -2.794
  300    HA   ARG  36           HA       ARG  36   1.734  -2.787  -0.681
  301   1HB   ARG  36          1HB       ARG  36   4.621  -3.692  -1.101
  302   2HB   ARG  36          2HB       ARG  36   4.010  -2.661   0.177
  303   1HG   ARG  36          1HG       ARG  36   2.480  -4.729   0.782
  304   2HG   ARG  36          2HG       ARG  36   3.617  -5.647  -0.184
  305   1HD   ARG  36          1HD       ARG  36   4.655  -5.823   1.892
  306   2HD   ARG  36          2HD       ARG  36   5.437  -4.366   1.309
  307    HE   ARG  36           HE       ARG  36   3.105  -3.467   2.576
  308   1HH1  ARG  36          1HH1      ARG  36   5.934  -5.336   3.520
  309   2HH1  ARG  36          2HH1      ARG  36   5.884  -4.816   5.172
  310   1HH2  ARG  36          1HH2      ARG  36   3.039  -2.782   4.756
  311   2HH2  ARG  36          2HH2      ARG  36   4.227  -3.354   5.880
  312    H    GLY  37           H        GLY  37   1.774  -0.712  -1.519
  313   1HA   GLY  37          1HA       GLY  37   3.762   0.230  -3.288
  314   2HA   GLY  37          2HA       GLY  37   2.333  -0.208  -4.204
  315    H    CYS  38           H        CYS  38   2.126   2.116  -4.727
  316    HA   CYS  38           HA       CYS  38   1.118   3.657  -2.451
  317   1HB   CYS  38          1HB       CYS  38   2.264   4.627  -5.077
  318   2HB   CYS  38          2HB       CYS  38   1.582   5.657  -3.834
  319    H    ILE  39           H        ILE  39  -0.720   5.228  -3.129
  320    HA   ILE  39           HA       ILE  39  -2.221   4.429  -5.445
  321    HB   ILE  39           HB       ILE  39  -2.702   2.755  -3.554
  322   1HG1  ILE  39          1HG1      ILE  39  -5.332   3.748  -4.297
  323   2HG1  ILE  39          2HG1      ILE  39  -4.230   3.804  -5.659
  324   1HG2  ILE  39          1HG2      ILE  39  -2.996   4.842  -1.947
  325   2HG2  ILE  39          2HG2      ILE  39  -4.674   4.750  -2.534
  326   3HG2  ILE  39          3HG2      ILE  39  -3.934   3.345  -1.728
  327   1HD1  ILE  39          1HD1      ILE  39  -4.896   1.605  -5.868
  328   2HD1  ILE  39          2HD1      ILE  39  -3.567   1.351  -4.711
  329   3HD1  ILE  39          3HD1      ILE  39  -5.248   1.437  -4.131
  330    H    ASP  40           H        ASP  40  -4.302   5.806  -5.569
  331    HA   ASP  40           HA       ASP  40  -3.537   8.434  -4.629
  332   1HB   ASP  40          1HB       ASP  40  -4.130   7.846  -7.093
  333   2HB   ASP  40          2HB       ASP  40  -5.793   7.732  -6.553
  334    H    VAL  41           H        VAL  41  -6.232   6.026  -4.706
  335    HA   VAL  41           HA       VAL  41  -7.541   7.569  -2.573
  336    HB   VAL  41           HB       VAL  41  -8.569   6.412  -5.094
  337   1HG1  VAL  41          1HG1      VAL  41  -9.625   4.865  -3.578
  338   2HG1  VAL  41          2HG1      VAL  41 -10.102   6.187  -2.486
  339   3HG1  VAL  41          3HG1      VAL  41 -10.839   6.058  -4.100
  340   1HG2  VAL  41          1HG2      VAL  41  -9.709   8.381  -5.246
  341   2HG2  VAL  41          2HG2      VAL  41 -10.036   8.458  -3.498
  342   3HG2  VAL  41          3HG2      VAL  41  -8.432   8.911  -4.124
  343    H    CYS  42           H        CYS  42  -8.317   6.387  -0.789
  344    HA   CYS  42           HA       CYS  42  -6.965   3.923  -0.376
  345   1HB   CYS  42          1HB       CYS  42  -7.603   5.839   1.300
  346   2HB   CYS  42          2HB       CYS  42  -9.109   4.954   1.446
  347    HA   PRO  43           HA       PRO  43 -10.344   1.763  -2.361
  348   1HB   PRO  43          1HB       PRO  43  -8.622  -0.647  -1.790
  349   2HB   PRO  43          2HB       PRO  43  -9.264  -0.062  -3.334
  350   1HG   PRO  43          1HG       PRO  43  -6.611   0.268  -2.750
  351   2HG   PRO  43          2HG       PRO  43  -7.500   1.594  -3.537
  352   1HD   PRO  43          1HD       PRO  43  -6.908   1.307  -0.521
  353   2HD   PRO  43          2HD       PRO  43  -6.561   2.692  -1.592
  354    H    LYS  44           H        LYS  44 -11.906  -0.012  -2.049
  355    HA   LYS  44           HA       LYS  44 -12.789  -0.054   0.663
  356   1HB   LYS  44          1HB       LYS  44 -13.897  -1.499  -1.761
  357   2HB   LYS  44          2HB       LYS  44 -14.716  -1.247  -0.233
  358   1HG   LYS  44          1HG       LYS  44 -13.652   1.242  -1.475
  359   2HG   LYS  44          2HG       LYS  44 -14.897   0.445  -2.416
  360   1HD   LYS  44          1HD       LYS  44 -16.410   0.431  -0.440
  361   2HD   LYS  44          2HD       LYS  44 -15.161   1.172   0.541
  362   1HE   LYS  44          1HE       LYS  44 -15.273   3.241  -0.655
  363   2HE   LYS  44          2HE       LYS  44 -16.097   2.514  -2.021
  364   1HZ   LYS  44          1HZ       LYS  44 -17.920   2.032  -0.348
  365   2HZ   LYS  44          2HZ       LYS  44 -17.186   3.124   0.620
  366   3HZ   LYS  44          3HZ       LYS  44 -17.747   3.579  -0.845
  367    H    ASN  45           H        ASN  45 -12.673  -1.691   2.170
  368    HA   ASN  45           HA       ASN  45 -10.763  -3.725   1.559
  369   1HB   ASN  45          1HB       ASN  45 -12.371  -3.455   4.139
  370   2HB   ASN  45          2HB       ASN  45 -10.792  -4.186   3.940
  371   1HD2  ASN  45          1HD2      ASN  45 -12.597  -1.293   4.374
  372   2HD2  ASN  45          2HD2      ASN  45 -11.285  -0.173   4.525
  373    H    SER  46           H        SER  46 -11.242  -6.064   1.818
  374    HA   SER  46           HA       SER  46 -14.100  -6.615   1.616
  375   1HB   SER  46          1HB       SER  46 -13.444  -8.576   0.166
  376   2HB   SER  46          2HB       SER  46 -13.114  -7.012  -0.553
  377    HG   SER  46           HG       SER  46 -11.167  -7.900  -0.852
  378    H    LEU  47           H        LEU  47 -14.409  -9.194   2.041
  379    HA   LEU  47           HA       LEU  47 -13.296  -9.593   4.678
  380   1HB   LEU  47          1HB       LEU  47 -15.406 -11.038   3.075
  381   2HB   LEU  47          2HB       LEU  47 -14.880 -11.546   4.667
  382    HG   LEU  47           HG       LEU  47 -16.022  -8.800   4.110
  383   1HD1  LEU  47          1HD1      LEU  47 -18.170  -9.557   4.822
  384   2HD1  LEU  47          2HD1      LEU  47 -17.622 -10.640   3.521
  385   3HD1  LEU  47          3HD1      LEU  47 -17.539 -11.174   5.216
  386   1HD2  LEU  47          1HD2      LEU  47 -14.870 -10.102   6.439
  387   2HD2  LEU  47          2HD2      LEU  47 -15.297  -8.395   6.173
  388   3HD2  LEU  47          3HD2      LEU  47 -16.532  -9.542   6.745
  389    H    LEU  48           H        LEU  48 -11.898  -9.900   1.828
  390    HA   LEU  48           HA       LEU  48 -10.837 -12.581   2.392
  391   1HB   LEU  48          1HB       LEU  48 -10.850 -11.085  -0.231
  392   2HB   LEU  48          2HB       LEU  48 -10.242 -12.705   0.046
  393    HG   LEU  48           HG       LEU  48 -12.925 -12.719   0.945
  394   1HD1  LEU  48          1HD1      LEU  48 -14.212 -11.535  -0.453
  395   2HD1  LEU  48          2HD1      LEU  48 -12.739 -10.585  -0.759
  396   3HD1  LEU  48          3HD1      LEU  48 -13.195 -11.902  -1.866
  397   1HD2  LEU  48          1HD2      LEU  48 -13.048 -14.044  -1.398
  398   2HD2  LEU  48          2HD2      LEU  48 -11.284 -13.989  -1.172
  399   3HD2  LEU  48          3HD2      LEU  48 -12.320 -14.715   0.080
  400    H    VAL  49           H        VAL  49  -9.988  -9.248   1.241
  401    HA   VAL  49           HA       VAL  49  -7.408  -9.623   2.583
  402    HB   VAL  49           HB       VAL  49  -7.969  -9.147  -0.239
  403   1HG1  VAL  49          1HG1      VAL  49  -6.275  -7.163   1.286
  404   2HG1  VAL  49          2HG1      VAL  49  -5.966  -7.535  -0.428
  405   3HG1  VAL  49          3HG1      VAL  49  -7.536  -6.858   0.066
  406   1HG2  VAL  49          1HG2      VAL  49  -5.351  -9.703   1.190
  407   2HG2  VAL  49          2HG2      VAL  49  -6.535 -10.955   0.747
  408   3HG2  VAL  49          3HG2      VAL  49  -5.737  -9.997  -0.523
  409    H    LYS  50           H        LYS  50  -6.554  -7.731   3.578
  410    HA   LYS  50           HA       LYS  50  -8.571  -5.621   3.865
  411   1HB   LYS  50          1HB       LYS  50  -7.917  -6.983   5.889
  412   2HB   LYS  50          2HB       LYS  50  -6.307  -6.306   5.758
  413   1HG   LYS  50          1HG       LYS  50  -7.060  -4.089   6.215
  414   2HG   LYS  50          2HG       LYS  50  -8.723  -4.469   5.814
  415   1HD   LYS  50          1HD       LYS  50  -8.482  -6.197   7.849
  416   2HD   LYS  50          2HD       LYS  50  -7.178  -5.126   8.326
  417   1HE   LYS  50          1HE       LYS  50  -9.296  -3.381   7.637
  418   2HE   LYS  50          2HE       LYS  50 -10.082  -4.700   8.482
  419   1HZ   LYS  50          1HZ       LYS  50  -8.724  -4.360  10.337
  420   2HZ   LYS  50          2HZ       LYS  50  -7.687  -3.381   9.540
  421   3HZ   LYS  50          3HZ       LYS  50  -9.197  -2.863   9.885
  422    H    TYR  51           H        TYR  51  -7.929  -3.408   3.750
  423    HA   TYR  51           HA       TYR  51  -5.311  -3.045   2.452
  424   1HB   TYR  51          1HB       TYR  51  -7.963  -1.502   2.158
  425   2HB   TYR  51          2HB       TYR  51  -6.524  -1.227   1.196
  426    HD1  TYR  51           HD1      TYR  51  -8.857  -4.042   2.066
  427    HD2  TYR  51           HD2      TYR  51  -6.448  -2.159  -0.928
  428    HE1  TYR  51           HE1      TYR  51  -9.685  -5.713   0.338
  429    HE2  TYR  51           HE2      TYR  51  -7.284  -3.837  -2.646
  430    HH   TYR  51           HH       TYR  51  -8.400  -5.677  -2.964
  431    H    VAL  52           H        VAL  52  -3.996  -1.390   3.192
  432    HA   VAL  52           HA       VAL  52  -5.155   0.390   5.205
  433    HB   VAL  52           HB       VAL  52  -2.907  -1.544   5.492
  434   1HG1  VAL  52          1HG1      VAL  52  -2.965   1.175   6.845
  435   2HG1  VAL  52          2HG1      VAL  52  -1.911  -0.182   7.314
  436   3HG1  VAL  52          3HG1      VAL  52  -1.732   0.572   5.711
  437   1HG2  VAL  52          1HG2      VAL  52  -3.836  -1.937   7.631
  438   2HG2  VAL  52          2HG2      VAL  52  -4.748  -0.409   7.608
  439   3HG2  VAL  52          3HG2      VAL  52  -5.231  -1.750   6.541
  440    H    CYS  53           H        CYS  53  -4.813   2.467   4.619
  441    HA   CYS  53           HA       CYS  53  -2.619   2.942   2.748
  442   1HB   CYS  53          1HB       CYS  53  -4.934   4.796   3.298
  443   2HB   CYS  53          2HB       CYS  53  -3.793   4.853   1.968
  444    H    CYS  54           H        CYS  54  -1.283   4.898   3.127
  445    HA   CYS  54           HA       CYS  54  -1.559   6.138   5.716
  446   1HB   CYS  54          1HB       CYS  54   0.938   5.698   6.145
  447   2HB   CYS  54          2HB       CYS  54  -0.231   4.456   6.548
  448    H    ASN  55           H        ASN  55  -0.408   8.192   5.771
  449    HA   ASN  55           HA       ASN  55   0.405   9.013   3.101
  450   1HB   ASN  55          1HB       ASN  55   0.146  11.369   4.476
  451   2HB   ASN  55          2HB       ASN  55  -1.184  10.614   3.620
  452   1HD2  ASN  55          1HD2      ASN  55   0.468   9.648   6.611
  453   2HD2  ASN  55          2HD2      ASN  55  -0.906   9.727   7.664
  454    H    THR  56           H        THR  56   1.866   7.679   5.610
  455    HA   THR  56           HA       THR  56   3.876   9.740   6.118
  456    HB   THR  56           HB       THR  56   4.627   7.763   7.723
  457    HG1  THR  56           HG1      THR  56   2.971   6.204   7.913
  458   1HG2  THR  56          1HG2      THR  56   2.591   8.269   9.273
  459   2HG2  THR  56          2HG2      THR  56   3.606   9.654   8.806
  460   3HG2  THR  56          3HG2      THR  56   2.050   9.376   7.988
  461    H    ASP  57           H        ASP  57   6.193   9.171   5.996
  462    HA   ASP  57           HA       ASP  57   6.672   8.033   3.454
  463   1HB   ASP  57          1HB       ASP  57   8.872   8.592   5.447
  464   2HB   ASP  57          2HB       ASP  57   8.875   8.843   3.713
  465    H    ARG  58           H        ARG  58   8.009   6.100   3.041
  466    HA   ARG  58           HA       ARG  58   8.246   3.938   3.360
  467   1HB   ARG  58          1HB       ARG  58   9.909   5.154   5.614
  468   2HB   ARG  58          2HB       ARG  58  10.014   3.455   5.196
  469   1HG   ARG  58          1HG       ARG  58  11.386   3.920   3.451
  470   2HG   ARG  58          2HG       ARG  58  10.197   5.003   2.754
  471   1HD   ARG  58          1HD       ARG  58  12.273   6.247   3.195
  472   2HD   ARG  58          2HD       ARG  58  11.005   6.849   4.245
  473    HE   ARG  58           HE       ARG  58  12.238   4.828   5.732
  474   1HH1  ARG  58          1HH1      ARG  58  13.297   7.803   4.180
  475   2HH1  ARG  58          2HH1      ARG  58  14.581   8.085   5.308
  476   1HH2  ARG  58          1HH2      ARG  58  13.931   5.199   7.220
  477   2HH2  ARG  58          2HH2      ARG  58  14.945   6.594   7.049
  478    H    CYS  59           H        CYS  59   5.748   4.568   4.411
  479    HA   CYS  59           HA       CYS  59   5.580   3.645   7.116
  480   1HB   CYS  59          1HB       CYS  59   3.162   3.928   6.824
  481   2HB   CYS  59          2HB       CYS  59   4.073   5.368   6.417
  482    H    ASN  60           H        ASN  60   4.559   2.522   3.811
  483    HA   ASN  60           HA       ASN  60   4.003  -0.074   4.936
  484   1HB   ASN  60          1HB       ASN  60   2.869  -0.545   2.876
  485   2HB   ASN  60          2HB       ASN  60   2.512   1.142   3.188
  486   1HD2  ASN  60          1HD2      ASN  60   4.339  -1.132   1.285
  487   2HD2  ASN  60          2HD2      ASN  60   4.836  -0.060   0.018
  488   1H    HOH  61          1H        HOH  61  -0.970 -12.661   4.018
  489   2H    HOH  61          2H        HOH  61  -0.252 -11.993   2.865
  Start of MODEL   16
    1   1H    LEU   1           H1       LEU   1   5.455  12.360  -1.131
    2    HA   LEU   1           HA       LEU   1   7.175  11.225   0.753
    3   1HB   LEU   1          1HB       LEU   1   4.335  10.488   0.031
    4   2HB   LEU   1          2HB       LEU   1   5.179   9.997   1.486
    5    HG   LEU   1           HG       LEU   1   4.835  12.917   0.837
    6   1HD1  LEU   1          1HD1      LEU   1   2.822  12.402   2.630
    7   2HD1  LEU   1          2HD1      LEU   1   2.615  12.654   0.880
    8   3HD1  LEU   1          3HD1      LEU   1   2.722  11.002   1.535
    9   1HD2  LEU   1          1HD2      LEU   1   5.128  11.404   3.448
   10   2HD2  LEU   1          2HD2      LEU   1   6.401  12.329   2.615
   11   3HD2  LEU   1          3HD2      LEU   1   4.974  13.169   3.270
   12    H    LYS   2           H        LYS   2   8.203   9.256   0.915
   13    HA   LYS   2           HA       LYS   2   7.905   7.516  -1.434
   14   1HB   LYS   2          1HB       LYS   2  10.335   8.267   0.197
   15   2HB   LYS   2          2HB       LYS   2  10.300   6.816  -0.784
   16   1HG   LYS   2          1HG       LYS   2  10.234   7.995  -2.796
   17   2HG   LYS   2          2HG       LYS   2   9.379   9.357  -2.099
   18   1HD   LYS   2          1HD       LYS   2  12.001   9.075  -0.841
   19   2HD   LYS   2          2HD       LYS   2  12.177   9.139  -2.583
   20   1HE   LYS   2          1HE       LYS   2  10.286  11.139  -2.099
   21   2HE   LYS   2          2HE       LYS   2  11.331  11.265  -0.699
   22   1HZ   LYS   2          1HZ       LYS   2  12.874  10.923  -3.011
   23   2HZ   LYS   2          2HZ       LYS   2  11.845  12.171  -3.230
   24   3HZ   LYS   2          3HZ       LYS   2  12.870  12.173  -1.960
   25    H    CYS   3           H        CYS   3   7.728   5.269  -1.100
   26    HA   CYS   3           HA       CYS   3   7.556   4.452   1.697
   27   1HB   CYS   3          1HB       CYS   3   5.409   4.293  -0.374
   28   2HB   CYS   3          2HB       CYS   3   5.570   2.966   0.760
   29    H    ASN   4           H        ASN   4   7.599   1.949   1.818
   30    HA   ASN   4           HA       ASN   4   9.722   1.078   0.193
   31   1HB   ASN   4          1HB       ASN   4   7.990  -0.790   1.855
   32   2HB   ASN   4          2HB       ASN   4   9.719  -0.874   1.577
   33   1HD2  ASN   4          1HD2      ASN   4  11.116   0.598   2.608
   34   2HD2  ASN   4          2HD2      ASN   4  10.679   1.405   4.077
   35    H    LYS   5           H        LYS   5   9.626  -0.907  -1.229
   36    HA   LYS   5           HA       LYS   5   7.054  -1.033  -2.601
   37   1HB   LYS   5          1HB       LYS   5   9.854  -1.841  -3.434
   38   2HB   LYS   5          2HB       LYS   5   8.422  -2.142  -4.398
   39   1HG   LYS   5          1HG       LYS   5   8.593   0.655  -3.446
   40   2HG   LYS   5          2HG       LYS   5   9.960   0.194  -4.441
   41   1HD   LYS   5          1HD       LYS   5   8.324   1.011  -5.981
   42   2HD   LYS   5          2HD       LYS   5   8.263  -0.733  -6.142
   43   1HE   LYS   5          1HE       LYS   5   5.975  -0.016  -6.002
   44   2HE   LYS   5          2HE       LYS   5   6.341  -0.728  -4.443
   45   1HZ   LYS   5          1HZ       LYS   5   5.542   1.208  -3.719
   46   2HZ   LYS   5          2HZ       LYS   5   7.036   1.789  -4.030
   47   3HZ   LYS   5          3HZ       LYS   5   5.831   2.015  -5.108
   48    H    LEU   6           H        LEU   6   7.271  -3.563  -3.800
   49    HA   LEU   6           HA       LEU   6   6.062  -5.195  -2.029
   50   1HB   LEU   6          1HB       LEU   6   6.713  -5.346  -4.619
   51   2HB   LEU   6          2HB       LEU   6   7.898  -6.472  -3.987
   52    HG   LEU   6           HG       LEU   6   5.935  -7.668  -4.717
   53   1HD1  LEU   6          1HD1      LEU   6   6.909  -7.732  -1.990
   54   2HD1  LEU   6          2HD1      LEU   6   5.221  -8.291  -2.086
   55   3HD1  LEU   6          3HD1      LEU   6   6.475  -9.070  -3.081
   56   1HD2  LEU   6          1HD2      LEU   6   4.503  -5.558  -3.206
   57   2HD2  LEU   6          2HD2      LEU   6   4.055  -6.419  -4.698
   58   3HD2  LEU   6          3HD2      LEU   6   3.821  -7.199  -3.115
   59    H    VAL   7           H        VAL   7   9.620  -4.988  -2.667
   60    HA   VAL   7           HA       VAL   7  10.043  -6.727  -0.361
   61    HB   VAL   7           HB       VAL   7  11.629  -5.892  -2.753
   62   1HG1  VAL   7          1HG1      VAL   7  13.601  -7.112  -1.550
   63   2HG1  VAL   7          2HG1      VAL   7  13.299  -5.390  -1.217
   64   3HG1  VAL   7          3HG1      VAL   7  12.755  -6.629  -0.061
   65   1HG2  VAL   7          1HG2      VAL   7  10.422  -7.948  -2.957
   66   2HG2  VAL   7          2HG2      VAL   7  12.140  -8.363  -2.746
   67   3HG2  VAL   7          3HG2      VAL   7  11.010  -8.524  -1.380
   68    HA   PRO   8           HA       PRO   8  10.442  -2.921   1.897
   69   1HB   PRO   8          1HB       PRO   8  11.037  -4.875   4.137
   70   2HB   PRO   8          2HB       PRO   8   9.859  -3.553   4.081
   71   1HG   PRO   8          1HG       PRO   8   8.993  -6.126   3.824
   72   2HG   PRO   8          2HG       PRO   8   8.308  -4.880   2.755
   73   1HD   PRO   8          1HD       PRO   8  10.574  -6.856   2.078
   74   2HD   PRO   8          2HD       PRO   8   9.087  -6.509   1.154
   75    H    ILE   9           H        ILE   9  13.013  -4.529   0.712
   76    HA   ILE   9           HA       ILE   9  14.961  -3.437   2.585
   77    HB   ILE   9           HB       ILE   9  14.826  -5.736   0.939
   78   1HG1  ILE   9          1HG1      ILE   9  17.328  -5.745   2.074
   79   2HG1  ILE   9          2HG1      ILE   9  16.477  -4.614   3.107
   80   1HG2  ILE   9          1HG2      ILE   9  16.812  -5.654  -0.378
   81   2HG2  ILE   9          2HG2      ILE   9  15.816  -4.246  -0.818
   82   3HG2  ILE   9          3HG2      ILE   9  17.231  -4.038   0.241
   83   1HD1  ILE   9          1HD1      ILE   9  14.579  -6.606   2.820
   84   2HD1  ILE   9          2HD1      ILE   9  16.096  -7.537   2.791
   85   3HD1  ILE   9          3HD1      ILE   9  15.724  -6.486   4.178
   86    H    ALA  10           H        ALA  10  13.118  -2.413  -0.031
   87    HA   ALA  10           HA       ALA  10  14.899  -0.188  -0.451
   88   1HB   ALA  10          1HB       ALA  10  15.875  -1.143  -2.261
   89   2HB   ALA  10          2HB       ALA  10  14.631  -2.411  -2.380
   90   3HB   ALA  10          3HB       ALA  10  14.331  -0.801  -3.077
   91    H    TYR  11           H        TYR  11  13.743   1.672  -0.980
   92    HA   TYR  11           HA       TYR  11  10.875   1.261  -1.490
   93   1HB   TYR  11          1HB       TYR  11  10.558   3.223   0.031
   94   2HB   TYR  11          2HB       TYR  11  11.469   1.987   0.876
   95    HD1  TYR  11           HD1      TYR  11  11.864   5.161  -1.048
   96    HD2  TYR  11           HD2      TYR  11  13.594   2.465   1.788
   97    HE1  TYR  11           HE1      TYR  11  13.709   6.842  -0.565
   98    HE2  TYR  11           HE2      TYR  11  15.434   4.155   2.261
   99    HH   TYR  11           HH       TYR  11  15.225   7.319   1.447
  100    H    LYS  12           H        LYS  12   9.812   3.200  -2.513
  101    HA   LYS  12           HA       LYS  12  11.715   4.824  -4.023
  102   1HB   LYS  12          1HB       LYS  12   9.477   3.157  -5.202
  103   2HB   LYS  12          2HB       LYS  12  10.263   4.467  -6.060
  104   1HG   LYS  12          1HG       LYS  12  12.490   3.156  -5.292
  105   2HG   LYS  12          2HG       LYS  12  11.386   1.796  -5.228
  106   1HD   LYS  12          1HD       LYS  12  11.886   1.605  -7.460
  107   2HD   LYS  12          2HD       LYS  12  10.660   2.842  -7.645
  108   1HE   LYS  12          1HE       LYS  12  13.141   4.161  -6.979
  109   2HE   LYS  12          2HE       LYS  12  13.474   3.012  -8.260
  110   1HZ   LYS  12          1HZ       LYS  12  11.617   3.966  -9.485
  111   2HZ   LYS  12          2HZ       LYS  12  11.380   5.071  -8.306
  112   3HZ   LYS  12          3HZ       LYS  12  12.766   5.083  -9.169
  113    H    THR  13           H        THR  13   9.853   6.272  -5.536
  114    HA   THR  13           HA       THR  13   8.366   7.607  -3.376
  115    HB   THR  13           HB       THR  13   9.667   9.338  -4.160
  116    HG1  THR  13           HG1      THR  13   8.066  10.311  -5.335
  117   1HG2  THR  13          1HG2      THR  13   9.890   7.864  -6.840
  118   2HG2  THR  13          2HG2      THR  13  10.767   9.346  -6.389
  119   3HG2  THR  13          3HG2      THR  13  11.115   7.816  -5.549
  120    H    CYS  14           H        CYS  14   6.200   8.089  -3.565
  121    HA   CYS  14           HA       CYS  14   4.777   6.392  -5.342
  122   1HB   CYS  14          1HB       CYS  14   3.822   8.538  -3.436
  123   2HB   CYS  14          2HB       CYS  14   2.770   7.456  -4.328
  124    HA   PRO  15           HA       PRO  15   5.243   9.292  -8.719
  125   1HB   PRO  15          1HB       PRO  15   3.293   7.948 -10.314
  126   2HB   PRO  15          2HB       PRO  15   5.036   7.634 -10.295
  127   1HG   PRO  15          1HG       PRO  15   2.761   6.204  -8.768
  128   2HG   PRO  15          2HG       PRO  15   4.200   5.518  -9.558
  129   1HD   PRO  15          1HD       PRO  15   4.200   5.804  -6.853
  130   2HD   PRO  15          2HD       PRO  15   5.687   6.101  -7.793
  131    H    GLU  16           H        GLU  16   3.880  10.641 -10.268
  132    HA   GLU  16           HA       GLU  16   2.229  12.267  -8.748
  133   1HB   GLU  16          1HB       GLU  16   2.710  12.050 -11.744
  134   2HB   GLU  16          2HB       GLU  16   1.667  13.280 -11.059
  135   1HG   GLU  16          1HG       GLU  16   4.284  13.068  -9.680
  136   2HG   GLU  16          2HG       GLU  16   4.430  13.493 -11.374
  137    H    GLY  17           H        GLY  17  -0.050  12.562  -8.693
  138   1HA   GLY  17          1HA       GLY  17  -2.237  12.109  -9.247
  139   2HA   GLY  17          2HA       GLY  17  -1.726  10.788 -10.280
  140    H    LYS  18           H        LYS  18   0.139   9.791  -8.015
  141    HA   LYS  18           HA       LYS  18  -1.819   8.940  -6.050
  142   1HB   LYS  18          1HB       LYS  18  -1.022   6.524  -6.423
  143   2HB   LYS  18          2HB       LYS  18  -2.213   7.184  -7.525
  144   1HG   LYS  18          1HG       LYS  18  -0.103   7.904  -8.960
  145   2HG   LYS  18          2HG       LYS  18   0.742   6.702  -8.005
  146   1HD   LYS  18          1HD       LYS  18  -1.384   5.189  -8.672
  147   2HD   LYS  18          2HD       LYS  18  -1.479   6.318 -10.009
  148   1HE   LYS  18          1HE       LYS  18   0.611   5.671 -10.892
  149   2HE   LYS  18          2HE       LYS  18   1.207   5.097  -9.347
  150   1HZ   LYS  18          1HZ       LYS  18   0.342   3.110  -9.719
  151   2HZ   LYS  18          2HZ       LYS  18  -1.097   3.688 -10.231
  152   3HZ   LYS  18          3HZ       LYS  18   0.150   3.561 -11.277
  153    H    ASN  19           H        ASN  19  -0.585  10.268  -4.616
  154    HA   ASN  19           HA       ASN  19   2.166   9.422  -4.280
  155   1HB   ASN  19          1HB       ASN  19   1.820  11.854  -4.429
  156   2HB   ASN  19          2HB       ASN  19   0.578  11.802  -3.195
  157   1HD2  ASN  19          1HD2      ASN  19   1.731  13.323  -1.986
  158   2HD2  ASN  19          2HD2      ASN  19   3.116  12.900  -1.036
  159    H    LEU  20           H        LEU  20  -0.761   8.352  -3.312
  160    HA   LEU  20           HA       LEU  20  -0.278   8.293  -0.454
  161   1HB   LEU  20          1HB       LEU  20  -2.548   7.630  -2.275
  162   2HB   LEU  20          2HB       LEU  20  -2.480   6.855  -0.704
  163    HG   LEU  20           HG       LEU  20  -2.495   9.848  -1.184
  164   1HD1  LEU  20          1HD1      LEU  20  -4.635   7.888  -1.016
  165   2HD1  LEU  20          2HD1      LEU  20  -4.777   9.140   0.242
  166   3HD1  LEU  20          3HD1      LEU  20  -4.687   9.608  -1.473
  167   1HD2  LEU  20          1HD2      LEU  20  -1.906  10.146   0.933
  168   2HD2  LEU  20          2HD2      LEU  20  -3.189   9.048   1.494
  169   3HD2  LEU  20          3HD2      LEU  20  -1.591   8.398   1.055
  170    H    CYS  21           H        CYS  21  -0.123   6.281   0.754
  171    HA   CYS  21           HA       CYS  21   1.164   4.224  -0.876
  172   1HB   CYS  21          1HB       CYS  21   1.449   4.913   2.053
  173   2HB   CYS  21          2HB       CYS  21   2.131   3.472   1.325
  174    H    TYR  22           H        TYR  22   0.450   2.033  -0.674
  175    HA   TYR  22           HA       TYR  22  -1.878   1.612   1.057
  176   1HB   TYR  22          1HB       TYR  22  -3.130   0.864  -0.830
  177   2HB   TYR  22          2HB       TYR  22  -2.171   2.125  -1.579
  178    HD1  TYR  22           HD1      TYR  22  -2.125  -1.557  -0.896
  179    HD2  TYR  22           HD2      TYR  22  -0.857   1.630  -3.452
  180    HE1  TYR  22           HE1      TYR  22  -1.182  -3.247  -2.546
  181    HE2  TYR  22           HE2      TYR  22   0.082  -0.069  -5.094
  182    HH   TYR  22           HH       TYR  22   0.727  -3.144  -4.330
  183    H    LYS  23           H        LYS  23  -2.282  -0.672   1.564
  184    HA   LYS  23           HA       LYS  23  -0.288  -2.576   0.765
  185   1HB   LYS  23          1HB       LYS  23   0.282  -3.058   3.224
  186   2HB   LYS  23          2HB       LYS  23   1.077  -1.708   2.438
  187   1HG   LYS  23          1HG       LYS  23  -0.523  -0.119   3.450
  188   2HG   LYS  23          2HG       LYS  23  -1.441  -1.438   4.147
  189   1HD   LYS  23          1HD       LYS  23  -0.057  -1.541   5.941
  190   2HD   LYS  23          2HD       LYS  23   1.349  -1.721   4.911
  191   1HE   LYS  23          1HE       LYS  23   1.915   0.497   5.073
  192   2HE   LYS  23          2HE       LYS  23   0.256   1.037   4.917
  193   1HZ   LYS  23          1HZ       LYS  23   1.727   0.344   7.300
  194   2HZ   LYS  23          2HZ       LYS  23   0.603   1.507   7.070
  195   3HZ   LYS  23          3HZ       LYS  23   0.140  -0.044   7.291
  196    H    MET  24           H        MET  24  -1.267  -4.528   0.573
  197    HA   MET  24           HA       MET  24  -3.799  -4.797   2.001
  198   1HB   MET  24          1HB       MET  24  -2.825  -5.861  -0.702
  199   2HB   MET  24          2HB       MET  24  -4.273  -6.483   0.066
  200   1HG   MET  24          1HG       MET  24  -5.471  -4.730  -0.737
  201   2HG   MET  24          2HG       MET  24  -4.446  -3.609   0.138
  202   1HE   MET  24          1HE       MET  24  -5.142  -5.697  -2.710
  203   2HE   MET  24          2HE       MET  24  -5.319  -4.321  -3.825
  204   3HE   MET  24          3HE       MET  24  -3.904  -5.392  -3.952
  205    H    PHE  25           H        PHE  25  -4.257  -6.758   3.097
  206    HA   PHE  25           HA       PHE  25  -2.107  -8.743   3.065
  207   1HB   PHE  25          1HB       PHE  25  -3.622  -7.790   5.555
  208   2HB   PHE  25          2HB       PHE  25  -2.161  -8.757   5.521
  209    HD1  PHE  25           HD1      PHE  25  -0.166  -7.701   5.984
  210    HD2  PHE  25           HD2      PHE  25  -3.355  -5.402   4.385
  211    HE1  PHE  25           HE1      PHE  25   1.217  -5.619   6.217
  212    HE2  PHE  25           HE2      PHE  25  -1.972  -3.321   4.618
  213    HZ   PHE  25           HZ       PHE  25   0.297  -3.455   5.531
  214    H    MET  26           H        MET  26  -2.794 -10.898   3.834
  215    HA   MET  26           HA       MET  26  -5.444 -11.419   2.943
  216   1HB   MET  26          1HB       MET  26  -3.231 -13.183   4.131
  217   2HB   MET  26          2HB       MET  26  -4.737 -13.826   3.507
  218   1HG   MET  26          1HG       MET  26  -4.163 -12.575   1.294
  219   2HG   MET  26          2HG       MET  26  -2.554 -12.368   1.959
  220   1HE   MET  26          1HE       MET  26  -5.090 -15.756   1.947
  221   2HE   MET  26          2HE       MET  26  -5.273 -14.450   0.752
  222   3HE   MET  26          3HE       MET  26  -4.556 -16.005   0.267
  223    H    MET  27           H        MET  27  -6.972 -12.850   4.243
  224    HA   MET  27           HA       MET  27  -7.500 -11.603   6.672
  225   1HB   MET  27          1HB       MET  27  -8.537 -14.007   5.143
  226   2HB   MET  27          2HB       MET  27  -9.049 -13.826   6.810
  227   1HG   MET  27          1HG       MET  27  -9.227 -11.332   5.179
  228   2HG   MET  27          2HG       MET  27 -10.295 -12.622   4.662
  229   1HE   MET  27          1HE       MET  27 -10.297  -9.646   7.506
  230   2HE   MET  27          2HE       MET  27 -10.541  -9.796   5.748
  231   3HE   MET  27          3HE       MET  27 -11.944  -9.778   6.844
  232    H    SER  28           H        SER  28  -5.855 -14.671   5.804
  233    HA   SER  28           HA       SER  28  -5.803 -15.635   8.443
  234   1HB   SER  28          1HB       SER  28  -5.562 -17.278   6.759
  235   2HB   SER  28          2HB       SER  28  -4.384 -16.338   5.866
  236    HG   SER  28           HG       SER  28  -3.064 -17.760   6.858
  237    H    ASP  29           H        ASP  29  -2.707 -15.448   6.718
  238    HA   ASP  29           HA       ASP  29  -1.470 -14.383   9.005
  239   1HB   ASP  29          1HB       ASP  29  -0.550 -15.923   7.056
  240   2HB   ASP  29          2HB       ASP  29  -0.220 -14.408   6.240
  241    H    LEU  30           H        LEU  30  -2.659 -12.295   9.233
  242    HA   LEU  30           HA       LEU  30  -2.561 -10.391   7.117
  243   1HB   LEU  30          1HB       LEU  30  -3.163  -9.843  10.015
  244   2HB   LEU  30          2HB       LEU  30  -3.695  -8.949   8.605
  245    HG   LEU  30           HG       LEU  30  -4.680 -11.560   8.235
  246   1HD1  LEU  30          1HD1      LEU  30  -5.468 -12.399  10.173
  247   2HD1  LEU  30          2HD1      LEU  30  -4.115 -11.481  10.874
  248   3HD1  LEU  30          3HD1      LEU  30  -5.756 -10.792  10.883
  249   1HD2  LEU  30          1HD2      LEU  30  -6.030  -9.915   7.415
  250   2HD2  LEU  30          2HD2      LEU  30  -6.885 -10.267   8.936
  251   3HD2  LEU  30          3HD2      LEU  30  -5.802  -8.859   8.829
  252    H    THR  31           H        THR  31  -0.300 -11.558   9.426
  253    HA   THR  31           HA       THR  31   1.138  -9.042   9.612
  254    HB   THR  31           HB       THR  31   0.942 -10.536  11.587
  255    HG1  THR  31           HG1      THR  31   2.947  -9.526  11.628
  256   1HG2  THR  31          1HG2      THR  31   2.176 -12.704  11.588
  257   2HG2  THR  31          2HG2      THR  31   0.843 -12.748  10.410
  258   3HG2  THR  31          3HG2      THR  31   2.517 -12.512   9.851
  259    H    ILE  32           H        ILE  32   0.677 -11.093   7.128
  260    HA   ILE  32           HA       ILE  32   3.424 -10.671   6.199
  261    HB   ILE  32           HB       ILE  32   1.847 -13.186   6.312
  262   1HG1  ILE  32          1HG1      ILE  32   3.854 -12.604   7.761
  263   2HG1  ILE  32          2HG1      ILE  32   3.889 -14.154   6.945
  264   1HG2  ILE  32          1HG2      ILE  32   1.905 -13.172   4.001
  265   2HG2  ILE  32          2HG2      ILE  32   3.454 -12.298   3.935
  266   3HG2  ILE  32          3HG2      ILE  32   3.420 -14.014   4.410
  267   1HD1  ILE  32          1HD1      ILE  32   5.051 -11.905   5.374
  268   2HD1  ILE  32          2HD1      ILE  32   5.937 -12.334   6.858
  269   3HD1  ILE  32          3HD1      ILE  32   5.653 -13.564   5.603
  270    HA   PRO  33           HA       PRO  33   0.711  -8.214   3.570
  271   1HB   PRO  33          1HB       PRO  33   3.495  -7.673   2.435
  272   2HB   PRO  33          2HB       PRO  33   2.168  -6.535   2.724
  273   1HG   PRO  33          1HG       PRO  33   4.226  -6.676   4.510
  274   2HG   PRO  33          2HG       PRO  33   2.561  -6.558   5.125
  275   1HD   PRO  33          1HD       PRO  33   4.311  -9.063   4.952
  276   2HD   PRO  33          2HD       PRO  33   3.200  -8.549   6.250
  277    H    VAL  34           H        VAL  34   0.017  -8.050   1.361
  278    HA   VAL  34           HA       VAL  34   0.885 -10.336  -0.270
  279    HB   VAL  34           HB       VAL  34  -1.632  -9.784   0.832
  280   1HG1  VAL  34          1HG1      VAL  34  -1.927  -8.096  -0.981
  281   2HG1  VAL  34          2HG1      VAL  34  -1.717  -9.397  -2.178
  282   3HG1  VAL  34          3HG1      VAL  34  -3.100  -9.434  -1.058
  283   1HG2  VAL  34          1HG2      VAL  34  -2.283 -11.711  -0.803
  284   2HG2  VAL  34          2HG2      VAL  34  -0.551 -11.717  -1.209
  285   3HG2  VAL  34          3HG2      VAL  34  -1.073 -12.012   0.467
  286    H    LYS  35           H        LYS  35  -0.275  -6.929  -0.164
  287    HA   LYS  35           HA       LYS  35   1.161  -6.511  -2.674
  288   1HB   LYS  35          1HB       LYS  35  -1.613  -5.400  -2.178
  289   2HB   LYS  35          2HB       LYS  35  -0.644  -5.237  -3.629
  290   1HG   LYS  35          1HG       LYS  35  -0.740  -8.024  -3.175
  291   2HG   LYS  35          2HG       LYS  35  -2.355  -7.471  -2.778
  292   1HD   LYS  35          1HD       LYS  35  -2.142  -6.096  -5.045
  293   2HD   LYS  35          2HD       LYS  35  -0.875  -7.250  -5.412
  294   1HE   LYS  35          1HE       LYS  35  -2.414  -9.132  -5.184
  295   2HE   LYS  35          2HE       LYS  35  -3.672  -8.101  -4.533
  296   1HZ   LYS  35          1HZ       LYS  35  -2.877  -8.480  -7.247
  297   2HZ   LYS  35          2HZ       LYS  35  -4.313  -7.992  -6.641
  298   3HZ   LYS  35          3HZ       LYS  35  -3.107  -6.911  -6.852
  299    H    ARG  36           H        ARG  36   2.403  -4.676  -2.671
  300    HA   ARG  36           HA       ARG  36   1.796  -2.710  -0.645
  301   1HB   ARG  36          1HB       ARG  36   4.607  -3.855  -1.027
  302   2HB   ARG  36          2HB       ARG  36   4.139  -2.632   0.138
  303   1HG   ARG  36          1HG       ARG  36   2.544  -5.149   0.277
  304   2HG   ARG  36          2HG       ARG  36   4.241  -5.342   0.668
  305   1HD   ARG  36          1HD       ARG  36   2.801  -3.004   1.910
  306   2HD   ARG  36          2HD       ARG  36   2.413  -4.600   2.521
  307    HE   ARG  36           HE       ARG  36   5.273  -4.310   2.330
  308   1HH1  ARG  36          1HH1      ARG  36   2.527  -3.257   4.262
  309   2HH1  ARG  36          2HH1      ARG  36   3.465  -3.017   5.698
  310   1HH2  ARG  36          1HH2      ARG  36   6.512  -3.994   4.225
  311   2HH2  ARG  36          2HH2      ARG  36   5.748  -3.439   5.677
  312    H    GLY  37           H        GLY  37   1.816  -0.706  -1.622
  313   1HA   GLY  37          1HA       GLY  37   3.882   0.172  -3.331
  314   2HA   GLY  37          2HA       GLY  37   2.508  -0.327  -4.299
  315    H    CYS  38           H        CYS  38   2.417   2.018  -4.911
  316    HA   CYS  38           HA       CYS  38   1.218   3.626  -2.781
  317   1HB   CYS  38          1HB       CYS  38   2.371   4.633  -5.385
  318   2HB   CYS  38          2HB       CYS  38   1.873   5.580  -3.997
  319    H    ILE  39           H        ILE  39  -0.704   4.937  -3.412
  320    HA   ILE  39           HA       ILE  39  -1.996   4.139  -5.883
  321    HB   ILE  39           HB       ILE  39  -2.564   2.493  -4.012
  322   1HG1  ILE  39          1HG1      ILE  39  -5.064   3.738  -5.075
  323   2HG1  ILE  39          2HG1      ILE  39  -3.865   3.196  -6.234
  324   1HG2  ILE  39          1HG2      ILE  39  -4.070   4.930  -3.037
  325   2HG2  ILE  39          2HG2      ILE  39  -4.453   3.261  -2.550
  326   3HG2  ILE  39          3HG2      ILE  39  -2.863   3.961  -2.157
  327   1HD1  ILE  39          1HD1      ILE  39  -4.282   0.993  -5.819
  328   2HD1  ILE  39          2HD1      ILE  39  -4.336   1.245  -4.057
  329   3HD1  ILE  39          3HD1      ILE  39  -5.777   1.577  -5.048
  330    H    ASP  40           H        ASP  40  -4.263   5.403  -5.933
  331    HA   ASP  40           HA       ASP  40  -3.516   8.108  -5.217
  332   1HB   ASP  40          1HB       ASP  40  -5.484   8.670  -6.783
  333   2HB   ASP  40          2HB       ASP  40  -4.071   7.949  -7.529
  334    H    VAL  41           H        VAL  41  -6.380   5.850  -5.289
  335    HA   VAL  41           HA       VAL  41  -7.525   7.403  -3.073
  336    HB   VAL  41           HB       VAL  41  -8.639   6.118  -5.495
  337   1HG1  VAL  41          1HG1      VAL  41 -10.908   5.969  -4.259
  338   2HG1  VAL  41          2HG1      VAL  41  -9.741   4.641  -4.049
  339   3HG1  VAL  41          3HG1      VAL  41  -9.929   5.872  -2.776
  340   1HG2  VAL  41          1HG2      VAL  41  -9.710   8.097  -5.736
  341   2HG2  VAL  41          2HG2      VAL  41 -10.120   8.209  -4.007
  342   3HG2  VAL  41          3HG2      VAL  41  -8.495   8.671  -4.568
  343    H    CYS  42           H        CYS  42  -8.420   6.243  -1.272
  344    HA   CYS  42           HA       CYS  42  -6.937   3.894  -0.683
  345   1HB   CYS  42          1HB       CYS  42  -7.739   5.805   0.888
  346   2HB   CYS  42          2HB       CYS  42  -9.242   4.907   0.957
  347    HA   PRO  43           HA       PRO  43 -10.048   1.323  -2.534
  348   1HB   PRO  43          1HB       PRO  43  -8.335  -0.975  -1.684
  349   2HB   PRO  43          2HB       PRO  43  -8.745  -0.422  -3.317
  350   1HG   PRO  43          1HG       PRO  43  -6.209  -0.056  -2.303
  351   2HG   PRO  43          2HG       PRO  43  -6.959   1.203  -3.312
  352   1HD   PRO  43          1HD       PRO  43  -6.937   1.100  -0.222
  353   2HD   PRO  43          2HD       PRO  43  -6.340   2.406  -1.283
  354    H    LYS  44           H        LYS  44 -11.658  -0.308  -2.170
  355    HA   LYS  44           HA       LYS  44 -12.610  -0.288   0.518
  356   1HB   LYS  44          1HB       LYS  44 -13.695  -1.792  -1.879
  357   2HB   LYS  44          2HB       LYS  44 -14.544  -1.422  -0.393
  358   1HG   LYS  44          1HG       LYS  44 -13.337   0.840  -2.004
  359   2HG   LYS  44          2HG       LYS  44 -14.846   0.126  -2.535
  360   1HD   LYS  44          1HD       LYS  44 -15.813   0.545  -0.238
  361   2HD   LYS  44          2HD       LYS  44 -14.318   1.335   0.222
  362   1HE   LYS  44          1HE       LYS  44 -15.028   3.276  -0.710
  363   2HE   LYS  44          2HE       LYS  44 -15.166   2.498  -2.274
  364   1HZ   LYS  44          1HZ       LYS  44 -17.231   3.466  -1.067
  365   2HZ   LYS  44          2HZ       LYS  44 -17.358   2.103  -1.959
  366   3HZ   LYS  44          3HZ       LYS  44 -17.262   2.008  -0.332
  367    H    ASN  45           H        ASN  45 -12.565  -1.900   2.056
  368    HA   ASN  45           HA       ASN  45 -10.670  -3.972   1.540
  369   1HB   ASN  45          1HB       ASN  45 -12.356  -3.685   4.063
  370   2HB   ASN  45          2HB       ASN  45 -10.749  -4.370   3.916
  371   1HD2  ASN  45          1HD2      ASN  45 -12.645  -1.545   4.325
  372   2HD2  ASN  45          2HD2      ASN  45 -11.374  -0.379   4.487
  373    H    SER  46           H        SER  46 -11.215  -6.313   2.001
  374    HA   SER  46           HA       SER  46 -14.063  -6.821   1.629
  375   1HB   SER  46          1HB       SER  46 -13.400  -8.824   0.262
  376   2HB   SER  46          2HB       SER  46 -12.959  -7.298  -0.477
  377    HG   SER  46           HG       SER  46 -11.124  -8.548  -0.655
  378    H    LEU  47           H        LEU  47 -14.433  -9.380   2.128
  379    HA   LEU  47           HA       LEU  47 -13.467  -9.699   4.828
  380   1HB   LEU  47          1HB       LEU  47 -15.483 -11.191   3.151
  381   2HB   LEU  47          2HB       LEU  47 -15.049 -11.657   4.784
  382    HG   LEU  47           HG       LEU  47 -16.103  -8.899   4.139
  383   1HD1  LEU  47          1HD1      LEU  47 -18.326  -9.785   4.949
  384   2HD1  LEU  47          2HD1      LEU  47 -17.817 -10.322   3.330
  385   3HD1  LEU  47          3HD1      LEU  47 -17.665 -11.423   4.720
  386   1HD2  LEU  47          1HD2      LEU  47 -16.387 -10.380   6.742
  387   2HD2  LEU  47          2HD2      LEU  47 -14.884  -9.515   6.341
  388   3HD2  LEU  47          3HD2      LEU  47 -16.426  -8.629   6.421
  389    H    LEU  48           H        LEU  48 -11.973 -10.155   2.006
  390    HA   LEU  48           HA       LEU  48 -10.940 -12.804   2.734
  391   1HB   LEU  48          1HB       LEU  48 -10.762 -11.359   0.088
  392   2HB   LEU  48          2HB       LEU  48 -10.191 -12.979   0.435
  393    HG   LEU  48           HG       LEU  48 -13.100 -12.250   0.763
  394   1HD1  LEU  48          1HD1      LEU  48 -11.965 -13.408  -1.783
  395   2HD1  LEU  48          2HD1      LEU  48 -13.597 -12.764  -1.475
  396   3HD1  LEU  48          3HD1      LEU  48 -12.204 -11.658  -1.553
  397   1HD2  LEU  48          1HD2      LEU  48 -12.029 -14.930  -0.057
  398   2HD2  LEU  48          2HD2      LEU  48 -11.946 -14.423   1.647
  399   3HD2  LEU  48          3HD2      LEU  48 -13.521 -14.515   0.822
  400    H    VAL  49           H        VAL  49  -9.982  -9.501   1.585
  401    HA   VAL  49           HA       VAL  49  -7.501  -9.878   3.101
  402    HB   VAL  49           HB       VAL  49  -6.191  -9.000   1.376
  403   1HG1  VAL  49          1HG1      VAL  49  -6.209 -10.772  -0.025
  404   2HG1  VAL  49          2HG1      VAL  49  -7.513 -11.360   1.034
  405   3HG1  VAL  49          3HG1      VAL  49  -7.911 -10.525  -0.487
  406   1HG2  VAL  49          1HG2      VAL  49  -8.790  -8.164   0.067
  407   2HG2  VAL  49          2HG2      VAL  49  -7.440  -7.138   0.609
  408   3HG2  VAL  49          3HG2      VAL  49  -7.240  -8.198  -0.806
  409    H    LYS  50           H        LYS  50  -6.526  -7.812   3.822
  410    HA   LYS  50           HA       LYS  50  -8.609  -5.758   4.092
  411   1HB   LYS  50          1HB       LYS  50  -8.103  -6.916   6.198
  412   2HB   LYS  50          2HB       LYS  50  -6.405  -6.520   6.030
  413   1HG   LYS  50          1HG       LYS  50  -6.782  -4.530   7.041
  414   2HG   LYS  50          2HG       LYS  50  -7.813  -4.058   5.704
  415   1HD   LYS  50          1HD       LYS  50  -9.669  -4.238   6.994
  416   2HD   LYS  50          2HD       LYS  50  -9.279  -5.897   7.404
  417   1HE   LYS  50          1HE       LYS  50  -7.759  -5.111   9.216
  418   2HE   LYS  50          2HE       LYS  50  -8.088  -3.444   8.788
  419   1HZ   LYS  50          1HZ       LYS  50  -9.960  -5.405   9.894
  420   2HZ   LYS  50          2HZ       LYS  50  -9.523  -3.961  10.521
  421   3HZ   LYS  50          3HZ       LYS  50 -10.480  -4.021   9.198
  422    H    TYR  51           H        TYR  51  -8.081  -3.612   3.653
  423    HA   TYR  51           HA       TYR  51  -5.429  -3.264   2.431
  424   1HB   TYR  51          1HB       TYR  51  -8.145  -1.840   2.105
  425   2HB   TYR  51          2HB       TYR  51  -6.706  -1.415   1.200
  426    HD1  TYR  51           HD1      TYR  51  -6.517  -2.251  -0.954
  427    HD2  TYR  51           HD2      TYR  51  -8.780  -4.466   1.924
  428    HE1  TYR  51           HE1      TYR  51  -7.151  -3.943  -2.742
  429    HE2  TYR  51           HE2      TYR  51  -9.406  -6.149   0.126
  430    HH   TYR  51           HH       TYR  51  -8.268  -6.910  -2.101
  431    H    VAL  52           H        VAL  52  -4.118  -1.555   3.065
  432    HA   VAL  52           HA       VAL  52  -5.248   0.291   5.032
  433    HB   VAL  52           HB       VAL  52  -3.002  -1.635   5.369
  434   1HG1  VAL  52          1HG1      VAL  52  -1.578   0.117   5.715
  435   2HG1  VAL  52          2HG1      VAL  52  -2.887   1.248   6.129
  436   3HG1  VAL  52          3HG1      VAL  52  -2.326   0.059   7.328
  437   1HG2  VAL  52          1HG2      VAL  52  -4.357  -0.575   7.739
  438   2HG2  VAL  52          2HG2      VAL  52  -5.486  -1.256   6.543
  439   3HG2  VAL  52          3HG2      VAL  52  -4.161  -2.256   7.186
  440    H    CYS  53           H        CYS  53  -4.885   2.354   4.404
  441    HA   CYS  53           HA       CYS  53  -2.775   2.751   2.424
  442   1HB   CYS  53          1HB       CYS  53  -4.998   4.676   3.097
  443   2HB   CYS  53          2HB       CYS  53  -3.936   4.696   1.703
  444    H    CYS  54           H        CYS  54  -1.578   4.925   2.656
  445    HA   CYS  54           HA       CYS  54  -1.603   6.154   5.214
  446   1HB   CYS  54          1HB       CYS  54   0.858   5.604   5.646
  447   2HB   CYS  54          2HB       CYS  54  -0.356   4.419   6.088
  448    H    ASN  55           H        ASN  55  -0.380   8.154   5.128
  449    HA   ASN  55           HA       ASN  55   0.510   8.753   2.420
  450   1HB   ASN  55          1HB       ASN  55   0.213  11.221   3.488
  451   2HB   ASN  55          2HB       ASN  55  -1.139  10.361   2.779
  452   1HD2  ASN  55          1HD2      ASN  55   0.668  10.272   5.854
  453   2HD2  ASN  55          2HD2      ASN  55  -0.700  10.333   6.914
  454    H    THR  56           H        THR  56   1.784   7.681   5.191
  455    HA   THR  56           HA       THR  56   3.836   9.731   5.539
  456    HB   THR  56           HB       THR  56   4.440   8.093   7.467
  457    HG1  THR  56           HG1      THR  56   2.955   6.385   7.685
  458   1HG2  THR  56          1HG2      THR  56   2.113   9.874   7.203
  459   2HG2  THR  56          2HG2      THR  56   1.770   8.522   8.310
  460   3HG2  THR  56          3HG2      THR  56   3.154   9.597   8.620
  461    H    ASP  57           H        ASP  57   6.140   9.055   5.662
  462    HA   ASP  57           HA       ASP  57   6.726   7.622   3.297
  463   1HB   ASP  57          1HB       ASP  57   8.385   8.914   5.492
  464   2HB   ASP  57          2HB       ASP  57   9.158   7.977   4.228
  465    H    ARG  58           H        ARG  58   8.195   5.674   3.245
  466    HA   ARG  58           HA       ARG  58   8.366   3.551   3.777
  467   1HB   ARG  58          1HB       ARG  58   9.613   4.947   6.191
  468   2HB   ARG  58          2HB       ARG  58   9.786   3.226   5.918
  469   1HG   ARG  58          1HG       ARG  58  11.167   3.507   4.060
  470   2HG   ARG  58          2HG       ARG  58  10.428   5.027   3.600
  471   1HD   ARG  58          1HD       ARG  58  12.236   4.667   6.039
  472   2HD   ARG  58          2HD       ARG  58  12.783   5.277   4.490
  473    HE   ARG  58           HE       ARG  58  10.481   6.760   5.482
  474   1HH1  ARG  58          1HH1      ARG  58  13.976   6.448   5.738
  475   2HH1  ARG  58          2HH1      ARG  58  14.211   8.080   6.265
  476   1HH2  ARG  58          1HH2      ARG  58  10.791   8.914   6.178
  477   2HH2  ARG  58          2HH2      ARG  58  12.387   9.493   6.517
  478    H    CYS  59           H        CYS  59   5.726   4.287   4.340
  479    HA   CYS  59           HA       CYS  59   5.117   3.486   7.035
  480   1HB   CYS  59          1HB       CYS  59   2.823   3.968   6.472
  481   2HB   CYS  59          2HB       CYS  59   3.861   5.295   5.992
  482    H    ASN  60           H        ASN  60   4.585   2.338   3.630
  483    HA   ASN  60           HA       ASN  60   3.862  -0.244   4.749
  484   1HB   ASN  60          1HB       ASN  60   2.762  -0.707   2.646
  485   2HB   ASN  60          2HB       ASN  60   2.333   0.944   3.049
  486   1HD2  ASN  60          1HD2      ASN  60   4.555  -1.067   1.186
  487   2HD2  ASN  60          2HD2      ASN  60   4.889   0.065  -0.081
  488   1H    HOH  61          1H        HOH  61  -1.072 -12.845   4.562
  489   2H    HOH  61          2H        HOH  61  -0.386 -12.160   3.401
  Start of MODEL   17
    1   1H    LEU   1           H1       LEU   1   6.742  12.315  -1.871
    2    HA   LEU   1           HA       LEU   1   6.793  10.846   0.625
    3   1HB   LEU   1          1HB       LEU   1   4.756  11.444  -1.482
    4   2HB   LEU   1          2HB       LEU   1   4.516  10.068  -0.425
    5    HG   LEU   1           HG       LEU   1   3.328  12.033   0.388
    6   1HD1  LEU   1          1HD1      LEU   1   4.800  10.312   1.889
    7   2HD1  LEU   1          2HD1      LEU   1   5.429  11.879   2.455
    8   3HD1  LEU   1          3HD1      LEU   1   3.685  11.533   2.549
    9   1HD2  LEU   1          1HD2      LEU   1   4.477  14.029   1.167
   10   2HD2  LEU   1          2HD2      LEU   1   6.043  13.355   0.657
   11   3HD2  LEU   1          3HD2      LEU   1   4.807  13.755  -0.561
   12    H    LYS   2           H        LYS   2   8.018   9.034   0.683
   13    HA   LYS   2           HA       LYS   2   7.779   7.245  -1.631
   14   1HB   LYS   2          1HB       LYS   2  10.290   7.840  -0.037
   15   2HB   LYS   2          2HB       LYS   2  10.143   6.596  -1.262
   16   1HG   LYS   2          1HG       LYS   2  10.417   8.102  -2.942
   17   2HG   LYS   2          2HG       LYS   2   9.153   9.136  -2.307
   18   1HD   LYS   2          1HD       LYS   2  10.993   9.802  -0.503
   19   2HD   LYS   2          2HD       LYS   2  12.119   9.177  -1.693
   20   1HE   LYS   2          1HE       LYS   2  10.172  10.883  -3.026
   21   2HE   LYS   2          2HE       LYS   2  10.852  11.746  -1.660
   22   1HZ   LYS   2          1HZ       LYS   2  12.960  11.557  -2.519
   23   2HZ   LYS   2          2HZ       LYS   2  12.603  10.290  -3.486
   24   3HZ   LYS   2          3HZ       LYS   2  12.075  11.786  -3.872
   25    H    CYS   3           H        CYS   3   7.608   5.020  -1.159
   26    HA   CYS   3           HA       CYS   3   7.529   4.365   1.683
   27   1HB   CYS   3          1HB       CYS   3   5.296   4.133  -0.285
   28   2HB   CYS   3          2HB       CYS   3   5.488   2.855   0.900
   29    H    ASN   4           H        ASN   4   7.547   1.872   1.941
   30    HA   ASN   4           HA       ASN   4   9.618   0.880   0.345
   31   1HB   ASN   4          1HB       ASN   4   7.787  -0.843   2.068
   32   2HB   ASN   4          2HB       ASN   4   9.495  -1.075   1.751
   33   1HD2  ASN   4          1HD2      ASN   4   7.706  -0.606   4.194
   34   2HD2  ASN   4          2HD2      ASN   4   8.534   0.596   5.126
   35    H    LYS   5           H        LYS   5   9.513  -0.996  -1.144
   36    HA   LYS   5           HA       LYS   5   6.913  -1.175  -2.453
   37   1HB   LYS   5          1HB       LYS   5   9.669  -2.022  -3.399
   38   2HB   LYS   5          2HB       LYS   5   8.193  -2.112  -4.340
   39   1HG   LYS   5          1HG       LYS   5   8.784   0.555  -3.111
   40   2HG   LYS   5          2HG       LYS   5   9.887   0.041  -4.372
   41   1HD   LYS   5          1HD       LYS   5   8.339   0.872  -5.825
   42   2HD   LYS   5          2HD       LYS   5   7.446  -0.601  -5.507
   43   1HE   LYS   5          1HE       LYS   5   5.829   0.493  -4.314
   44   2HE   LYS   5          2HE       LYS   5   7.000   1.446  -3.425
   45   1HZ   LYS   5          1HZ       LYS   5   7.145   2.426  -5.933
   46   2HZ   LYS   5          2HZ       LYS   5   5.549   2.129  -5.760
   47   3HZ   LYS   5          3HZ       LYS   5   6.318   3.101  -4.697
   48    H    LEU   6           H        LEU   6   7.331  -3.715  -3.719
   49    HA   LEU   6           HA       LEU   6   6.113  -5.414  -2.020
   50   1HB   LEU   6          1HB       LEU   6   6.888  -5.526  -4.566
   51   2HB   LEU   6          2HB       LEU   6   8.125  -6.565  -3.888
   52    HG   LEU   6           HG       LEU   6   6.287  -7.898  -4.700
   53   1HD1  LEU   6          1HD1      LEU   6   6.237  -7.873  -1.670
   54   2HD1  LEU   6          2HD1      LEU   6   5.805  -9.229  -2.739
   55   3HD1  LEU   6          3HD1      LEU   6   7.487  -8.650  -2.674
   56   1HD2  LEU   6          1HD2      LEU   6   4.161  -7.369  -2.919
   57   2HD2  LEU   6          2HD2      LEU   6   4.673  -5.799  -3.582
   58   3HD2  LEU   6          3HD2      LEU   6   4.211  -7.121  -4.681
   59    H    VAL   7           H        VAL   7   9.688  -5.041  -2.471
   60    HA   VAL   7           HA       VAL   7  10.068  -6.748  -0.135
   61    HB   VAL   7           HB       VAL   7  12.353  -5.633  -1.661
   62   1HG1  VAL   7          1HG1      VAL   7  11.891  -7.710   0.192
   63   2HG1  VAL   7          2HG1      VAL   7  12.279  -8.505  -1.353
   64   3HG1  VAL   7          3HG1      VAL   7  13.409  -7.320  -0.653
   65   1HG2  VAL   7          1HG2      VAL   7  11.963  -7.613  -3.329
   66   2HG2  VAL   7          2HG2      VAL   7  10.254  -7.409  -2.877
   67   3HG2  VAL   7          3HG2      VAL   7  11.152  -6.052  -3.599
   68    HA   PRO   8           HA       PRO   8  10.184  -2.911   2.107
   69   1HB   PRO   8          1HB       PRO   8  10.710  -4.820   4.399
   70   2HB   PRO   8          2HB       PRO   8   9.486  -3.547   4.254
   71   1HG   PRO   8          1HG       PRO   8   8.741  -6.156   3.974
   72   2HG   PRO   8          2HG       PRO   8   8.076  -4.947   2.851
   73   1HD   PRO   8          1HD       PRO   8  10.460  -6.834   2.338
   74   2HD   PRO   8          2HD       PRO   8   9.018  -6.563   1.322
   75    H    ILE   9           H        ILE   9  12.887  -4.488   1.137
   76    HA   ILE   9           HA       ILE   9  14.661  -3.241   3.088
   77    HB   ILE   9           HB       ILE   9  15.192  -5.494   2.666
   78   1HG1  ILE   9          1HG1      ILE   9  17.226  -4.364   0.832
   79   2HG1  ILE   9          2HG1      ILE   9  17.002  -3.486   2.332
   80   1HG2  ILE   9          1HG2      ILE   9  14.359  -4.871  -0.063
   81   2HG2  ILE   9          2HG2      ILE   9  15.861  -5.822   0.003
   82   3HG2  ILE   9          3HG2      ILE   9  14.390  -6.424   0.805
   83   1HD1  ILE   9          1HD1      ILE   9  18.056  -5.100   3.524
   84   2HD1  ILE   9          2HD1      ILE   9  17.022  -6.370   2.828
   85   3HD1  ILE   9          3HD1      ILE   9  18.495  -5.852   1.972
   86    H    ALA  10           H        ALA  10  12.962  -2.367   0.355
   87    HA   ALA  10           HA       ALA  10  14.741  -0.151  -0.098
   88   1HB   ALA  10          1HB       ALA  10  14.592  -2.470  -1.925
   89   2HB   ALA  10          2HB       ALA  10  14.313  -0.900  -2.715
   90   3HB   ALA  10          3HB       ALA  10  15.817  -1.184  -1.807
   91    H    TYR  11           H        TYR  11  13.590   1.665  -0.751
   92    HA   TYR  11           HA       TYR  11  10.738   1.190  -1.314
   93   1HB   TYR  11          1HB       TYR  11  10.404   3.302  -0.018
   94   2HB   TYR  11          2HB       TYR  11  11.317   2.173   0.963
   95    HD1  TYR  11           HD1      TYR  11  13.454   2.743   1.803
   96    HD2  TYR  11           HD2      TYR  11  11.685   5.135  -1.271
   97    HE1  TYR  11           HE1      TYR  11  15.282   4.486   2.098
   98    HE2  TYR  11           HE2      TYR  11  13.519   6.871  -0.966
   99    HH   TYR  11           HH       TYR  11  16.289   6.358   0.303
  100    H    LYS  12           H        LYS  12   9.683   2.995  -2.559
  101    HA   LYS  12           HA       LYS  12  11.596   4.459  -4.214
  102   1HB   LYS  12          1HB       LYS  12   9.389   2.655  -5.238
  103   2HB   LYS  12          2HB       LYS  12  10.188   3.865  -6.222
  104   1HG   LYS  12          1HG       LYS  12  12.293   2.438  -4.949
  105   2HG   LYS  12          2HG       LYS  12  11.136   1.212  -5.430
  106   1HD   LYS  12          1HD       LYS  12  11.367   1.677  -7.713
  107   2HD   LYS  12          2HD       LYS  12  11.795   3.355  -7.443
  108   1HE   LYS  12          1HE       LYS  12  14.016   2.587  -6.491
  109   2HE   LYS  12          2HE       LYS  12  13.584   0.938  -6.899
  110   1HZ   LYS  12          1HZ       LYS  12  13.222   1.893  -9.217
  111   2HZ   LYS  12          2HZ       LYS  12  14.111   3.165  -8.708
  112   3HZ   LYS  12          3HZ       LYS  12  14.758   1.666  -8.712
  113    H    THR  13           H        THR  13  10.090   5.980  -5.759
  114    HA   THR  13           HA       THR  13   8.566   7.528  -3.839
  115    HB   THR  13           HB       THR  13   9.984   7.920  -6.436
  116    HG1  THR  13           HG1      THR  13   9.147   9.671  -4.239
  117   1HG2  THR  13          1HG2      THR  13   8.706  10.058  -6.855
  118   2HG2  THR  13          2HG2      THR  13   7.723   8.609  -7.180
  119   3HG2  THR  13          3HG2      THR  13   7.488   9.524  -5.671
  120    H    CYS  14           H        CYS  14   6.398   8.259  -4.156
  121    HA   CYS  14           HA       CYS  14   4.754   6.166  -5.139
  122   1HB   CYS  14          1HB       CYS  14   4.100   8.910  -4.052
  123   2HB   CYS  14          2HB       CYS  14   2.894   7.722  -4.503
  124    HA   PRO  15           HA       PRO  15   5.162   7.654  -9.346
  125   1HB   PRO  15          1HB       PRO  15   3.069   5.954 -10.283
  126   2HB   PRO  15          2HB       PRO  15   4.795   5.562 -10.219
  127   1HG   PRO  15          1HG       PRO  15   2.551   4.903  -8.200
  128   2HG   PRO  15          2HG       PRO  15   3.912   3.896  -8.747
  129   1HD   PRO  15          1HD       PRO  15   4.077   5.118  -6.322
  130   2HD   PRO  15          2HD       PRO  15   5.521   4.975  -7.362
  131    H    GLU  16           H        GLU  16   3.707   8.381 -11.240
  132    HA   GLU  16           HA       GLU  16   2.283  10.584 -10.370
  133   1HB   GLU  16          1HB       GLU  16   2.337   9.175 -13.072
  134   2HB   GLU  16          2HB       GLU  16   1.566  10.727 -12.810
  135   1HG   GLU  16          1HG       GLU  16   4.481  10.234 -12.072
  136   2HG   GLU  16          2HG       GLU  16   4.008  10.756 -13.677
  137    H    GLY  17           H        GLY  17   0.071  11.021 -10.102
  138   1HA   GLY  17          1HA       GLY  17  -2.197  10.560 -10.328
  139   2HA   GLY  17          2HA       GLY  17  -1.839   8.891 -10.727
  140    H    LYS  18           H        LYS  18   0.156   8.612  -8.472
  141    HA   LYS  18           HA       LYS  18  -1.837   8.327  -6.345
  142   1HB   LYS  18          1HB       LYS  18   0.815   6.898  -6.697
  143   2HB   LYS  18          2HB       LYS  18  -0.381   6.581  -5.457
  144   1HG   LYS  18          1HG       LYS  18  -1.848   5.532  -6.929
  145   2HG   LYS  18          2HG       LYS  18  -1.354   6.511  -8.297
  146   1HD   LYS  18          1HD       LYS  18   0.800   4.762  -7.225
  147   2HD   LYS  18          2HD       LYS  18  -0.577   3.884  -7.860
  148   1HE   LYS  18          1HE       LYS  18  -0.389   5.406  -9.956
  149   2HE   LYS  18          2HE       LYS  18   1.166   5.910  -9.325
  150   1HZ   LYS  18          1HZ       LYS  18   1.926   4.112 -10.332
  151   2HZ   LYS  18          2HZ       LYS  18   1.241   3.220  -9.148
  152   3HZ   LYS  18          3HZ       LYS  18   0.446   3.460 -10.554
  153    H    ASN  19           H        ASN  19  -1.161   8.809  -4.112
  154    HA   ASN  19           HA       ASN  19   1.147  10.535  -3.949
  155   1HB   ASN  19          1HB       ASN  19  -0.564  12.195  -4.326
  156   2HB   ASN  19          2HB       ASN  19  -1.725  11.347  -3.323
  157   1HD2  ASN  19          1HD2      ASN  19  -2.121  12.333  -1.508
  158   2HD2  ASN  19          2HD2      ASN  19  -1.004  13.205  -0.512
  159    H    LEU  20           H        LEU  20  -1.680   8.899  -2.394
  160    HA   LEU  20           HA       LEU  20  -0.365   8.886   0.178
  161   1HB   LEU  20          1HB       LEU  20  -3.049   8.093  -0.878
  162   2HB   LEU  20          2HB       LEU  20  -2.504   7.446   0.656
  163    HG   LEU  20           HG       LEU  20  -2.475  10.415   0.139
  164   1HD1  LEU  20          1HD1      LEU  20  -4.799   8.878  -0.015
  165   2HD1  LEU  20          2HD1      LEU  20  -4.801   9.544   1.636
  166   3HD1  LEU  20          3HD1      LEU  20  -4.684  10.637   0.235
  167   1HD2  LEU  20          1HD2      LEU  20  -2.545  10.608   2.525
  168   2HD2  LEU  20          2HD2      LEU  20  -2.822   8.859   2.714
  169   3HD2  LEU  20          3HD2      LEU  20  -1.260   9.451   2.098
  170    H    CYS  21           H        CYS  21  -0.245   6.720   1.389
  171    HA   CYS  21           HA       CYS  21   0.917   4.792  -0.474
  172   1HB   CYS  21          1HB       CYS  21   1.515   5.551   2.358
  173   2HB   CYS  21          2HB       CYS  21   1.854   3.913   1.836
  174    H    TYR  22           H        TYR  22   0.237   2.583  -0.373
  175    HA   TYR  22           HA       TYR  22  -1.938   2.002   1.501
  176   1HB   TYR  22          1HB       TYR  22  -3.340   1.359  -0.332
  177   2HB   TYR  22          2HB       TYR  22  -2.508   2.744  -1.013
  178    HD1  TYR  22           HD1      TYR  22  -0.187   2.136  -2.222
  179    HD2  TYR  22           HD2      TYR  22  -3.423  -0.591  -1.589
  180    HE1  TYR  22           HE1      TYR  22   0.654   0.683  -4.131
  181    HE2  TYR  22           HE2      TYR  22  -2.570  -2.035  -3.500
  182    HH   TYR  22           HH       TYR  22   0.182  -2.174  -4.562
  183    H    LYS  23           H        LYS  23  -2.336  -0.351   1.760
  184    HA   LYS  23           HA       LYS  23  -0.261  -2.079   0.721
  185   1HB   LYS  23          1HB       LYS  23   0.180  -2.910   3.114
  186   2HB   LYS  23          2HB       LYS  23   0.965  -1.434   2.591
  187   1HG   LYS  23          1HG       LYS  23  -1.651  -0.788   3.688
  188   2HG   LYS  23          2HG       LYS  23  -0.779  -1.788   4.832
  189   1HD   LYS  23          1HD       LYS  23   1.109   0.109   3.802
  190   2HD   LYS  23          2HD       LYS  23  -0.351   1.007   4.171
  191   1HE   LYS  23          1HE       LYS  23  -0.368  -0.149   6.462
  192   2HE   LYS  23          2HE       LYS  23   1.212  -0.797   6.074
  193   1HZ   LYS  23          1HZ       LYS  23   0.496   2.045   6.246
  194   2HZ   LYS  23          2HZ       LYS  23   1.470   1.216   7.260
  195   3HZ   LYS  23          3HZ       LYS  23   1.946   1.504   5.725
  196    H    MET  24           H        MET  24  -0.925  -4.244   0.600
  197    HA   MET  24           HA       MET  24  -3.654  -4.670   1.547
  198   1HB   MET  24          1HB       MET  24  -2.388  -6.015  -0.892
  199   2HB   MET  24          2HB       MET  24  -4.092  -5.935  -0.487
  200   1HG   MET  24          1HG       MET  24  -3.678  -3.290  -0.645
  201   2HG   MET  24          2HG       MET  24  -2.311  -3.775  -1.628
  202   1HE   MET  24          1HE       MET  24  -3.476  -3.632  -4.734
  203   2HE   MET  24          2HE       MET  24  -2.205  -4.147  -3.598
  204   3HE   MET  24          3HE       MET  24  -3.182  -5.364  -4.453
  205    H    PHE  25           H        PHE  25  -4.009  -6.482   2.802
  206    HA   PHE  25           HA       PHE  25  -1.894  -8.507   2.802
  207   1HB   PHE  25          1HB       PHE  25  -3.418  -7.493   5.262
  208   2HB   PHE  25          2HB       PHE  25  -1.967  -8.475   5.257
  209    HD1  PHE  25           HD1      PHE  25  -0.277  -6.981   3.333
  210    HD2  PHE  25           HD2      PHE  25  -2.808  -5.579   6.436
  211    HE1  PHE  25           HE1      PHE  25   1.125  -4.909   3.540
  212    HE2  PHE  25           HE2      PHE  25  -1.407  -3.508   6.644
  213    HZ   PHE  25           HZ       PHE  25   0.542  -3.197   5.193
  214    H    MET  26           H        MET  26  -2.620 -10.631   3.673
  215    HA   MET  26           HA       MET  26  -5.293 -11.117   2.779
  216   1HB   MET  26          1HB       MET  26  -3.051 -12.906   3.866
  217   2HB   MET  26          2HB       MET  26  -4.592 -13.542   3.327
  218   1HG   MET  26          1HG       MET  26  -4.053 -12.152   1.110
  219   2HG   MET  26          2HG       MET  26  -2.402 -12.244   1.688
  220   1HE   MET  26          1HE       MET  26  -1.416 -15.848   1.570
  221   2HE   MET  26          2HE       MET  26  -1.077 -14.172   2.064
  222   3HE   MET  26          3HE       MET  26  -2.122 -15.204   3.070
  223    H    MET  27           H        MET  27  -6.897 -12.358   4.075
  224    HA   MET  27           HA       MET  27  -7.220 -11.206   6.584
  225   1HB   MET  27          1HB       MET  27  -8.536 -13.404   4.965
  226   2HB   MET  27          2HB       MET  27  -8.967 -13.287   6.659
  227   1HG   MET  27          1HG       MET  27  -9.079 -10.896   4.764
  228   2HG   MET  27          2HG       MET  27 -10.449 -11.954   5.037
  229   1HE   MET  27          1HE       MET  27 -11.453  -8.842   7.135
  230   2HE   MET  27          2HE       MET  27 -10.612  -8.875   5.566
  231   3HE   MET  27          3HE       MET  27 -11.944 -10.012   5.886
  232    H    SER  28           H        SER  28  -5.787 -14.286   5.492
  233    HA   SER  28           HA       SER  28  -5.798 -15.448   8.060
  234   1HB   SER  28          1HB       SER  28  -5.711 -16.928   6.176
  235   2HB   SER  28          2HB       SER  28  -4.363 -16.069   5.456
  236    HG   SER  28           HG       SER  28  -3.856 -18.151   6.589
  237    H    ASP  29           H        ASP  29  -2.715 -15.366   6.305
  238    HA   ASP  29           HA       ASP  29  -1.383 -14.542   8.637
  239   1HB   ASP  29          1HB       ASP  29  -0.602 -16.011   6.568
  240   2HB   ASP  29          2HB       ASP  29  -0.154 -14.469   5.866
  241    H    LEU  30           H        LEU  30  -2.523 -12.400   8.947
  242    HA   LEU  30           HA       LEU  30  -2.245 -10.379   6.972
  243   1HB   LEU  30          1HB       LEU  30  -2.847  -9.952   9.888
  244   2HB   LEU  30          2HB       LEU  30  -3.321  -8.967   8.518
  245    HG   LEU  30           HG       LEU  30  -4.441 -11.504   8.025
  246   1HD1  LEU  30          1HD1      LEU  30  -3.908 -11.477  10.714
  247   2HD1  LEU  30          2HD1      LEU  30  -5.575 -10.854  10.654
  248   3HD1  LEU  30          3HD1      LEU  30  -5.186 -12.429   9.922
  249   1HD2  LEU  30          1HD2      LEU  30  -6.564 -10.081   8.841
  250   2HD2  LEU  30          2HD2      LEU  30  -5.383  -8.762   8.663
  251   3HD2  LEU  30          3HD2      LEU  30  -5.753  -9.818   7.279
  252    H    THR  31           H        THR  31  -0.119 -11.806   9.282
  253    HA   THR  31           HA       THR  31   1.484  -9.405   9.590
  254    HB   THR  31           HB       THR  31   1.148 -10.932  11.512
  255    HG1  THR  31           HG1      THR  31   3.305 -10.594  11.912
  256   1HG2  THR  31          1HG2      THR  31   0.860 -13.102  10.351
  257   2HG2  THR  31          2HG2      THR  31   2.505 -12.983   9.683
  258   3HG2  THR  31          3HG2      THR  31   2.269 -13.194  11.435
  259    H    ILE  32           H        ILE  32   0.933 -11.095   6.956
  260    HA   ILE  32           HA       ILE  32   3.708 -10.854   6.105
  261    HB   ILE  32           HB       ILE  32   2.190 -13.353   6.342
  262   1HG1  ILE  32          1HG1      ILE  32   5.061 -13.394   5.690
  263   2HG1  ILE  32          2HG1      ILE  32   4.668 -12.417   7.091
  264   1HG2  ILE  32          1HG2      ILE  32   1.867 -13.431   4.067
  265   2HG2  ILE  32          2HG2      ILE  32   3.336 -12.491   3.711
  266   3HG2  ILE  32          3HG2      ILE  32   3.470 -14.193   4.213
  267   1HD1  ILE  32          1HD1      ILE  32   3.970 -15.350   6.640
  268   2HD1  ILE  32          2HD1      ILE  32   5.051 -14.670   7.880
  269   3HD1  ILE  32          3HD1      ILE  32   3.296 -14.382   7.974
  270    HA   PRO  33           HA       PRO  33   0.905  -8.517   3.437
  271   1HB   PRO  33          1HB       PRO  33   3.609  -7.383   2.633
  272   2HB   PRO  33          2HB       PRO  33   2.100  -6.531   3.006
  273   1HG   PRO  33          1HG       PRO  33   4.097  -6.597   4.865
  274   2HG   PRO  33          2HG       PRO  33   2.418  -6.846   5.398
  275   1HD   PRO  33          1HD       PRO  33   4.545  -9.007   4.886
  276   2HD   PRO  33          2HD       PRO  33   3.443  -8.828   6.278
  277    H    VAL  34           H        VAL  34   0.597  -8.069   1.113
  278    HA   VAL  34           HA       VAL  34   1.960 -10.060  -0.564
  279    HB   VAL  34           HB       VAL  34  -0.096 -10.561  -1.649
  280   1HG1  VAL  34          1HG1      VAL  34  -0.602 -12.039  -0.058
  281   2HG1  VAL  34          2HG1      VAL  34   0.374 -11.093   1.091
  282   3HG1  VAL  34          3HG1      VAL  34  -1.369 -10.772   0.929
  283   1HG2  VAL  34          1HG2      VAL  34  -2.218  -9.526  -1.149
  284   2HG2  VAL  34          2HG2      VAL  34  -1.488  -8.552   0.150
  285   3HG2  VAL  34          3HG2      VAL  34  -1.043  -8.250  -1.547
  286    H    LYS  35           H        LYS  35   0.220  -6.915  -0.307
  287    HA   LYS  35           HA       LYS  35   1.798  -6.030  -2.612
  288   1HB   LYS  35          1HB       LYS  35  -1.097  -5.259  -2.184
  289   2HB   LYS  35          2HB       LYS  35  -0.078  -4.879  -3.557
  290   1HG   LYS  35          1HG       LYS  35  -0.027  -7.743  -3.191
  291   2HG   LYS  35          2HG       LYS  35  -1.702  -7.227  -3.130
  292   1HD   LYS  35          1HD       LYS  35  -1.581  -6.199  -5.305
  293   2HD   LYS  35          2HD       LYS  35   0.172  -6.248  -5.321
  294   1HE   LYS  35          1HE       LYS  35  -0.667  -8.034  -6.764
  295   2HE   LYS  35          2HE       LYS  35   0.082  -8.763  -5.357
  296   1HZ   LYS  35          1HZ       LYS  35  -2.009  -9.174  -4.424
  297   2HZ   LYS  35          2HZ       LYS  35  -2.797  -8.222  -5.492
  298   3HZ   LYS  35          3HZ       LYS  35  -2.143  -9.636  -5.985
  299    H    ARG  36           H        ARG  36   2.693  -3.981  -2.415
  300    HA   ARG  36           HA       ARG  36   1.760  -2.299  -0.310
  301   1HB   ARG  36          1HB       ARG  36   4.258  -3.918  -0.072
  302   2HB   ARG  36          2HB       ARG  36   4.463  -2.217   0.300
  303   1HG   ARG  36          1HG       ARG  36   2.729  -2.297   2.010
  304   2HG   ARG  36          2HG       ARG  36   2.232  -3.904   1.518
  305   1HD   ARG  36          1HD       ARG  36   4.547  -4.750   2.153
  306   2HD   ARG  36          2HD       ARG  36   4.919  -3.152   2.768
  307    HE   ARG  36           HE       ARG  36   3.015  -5.093   3.951
  308   1HH1  ARG  36          1HH1      ARG  36   4.379  -1.849   4.010
  309   2HH1  ARG  36          2HH1      ARG  36   3.855  -1.520   5.628
  310   1HH2  ARG  36          1HH2      ARG  36   2.324  -4.660   6.086
  311   2HH2  ARG  36          2HH2      ARG  36   2.679  -3.130   6.817
  312    H    GLY  37           H        GLY  37   1.655  -0.346  -1.374
  313   1HA   GLY  37          1HA       GLY  37   4.001   0.719  -2.663
  314   2HA   GLY  37          2HA       GLY  37   2.719   0.306  -3.783
  315    H    CYS  38           H        CYS  38   2.098   2.406  -4.381
  316    HA   CYS  38           HA       CYS  38   1.060   4.033  -2.174
  317   1HB   CYS  38          1HB       CYS  38   2.132   5.006  -4.830
  318   2HB   CYS  38          2HB       CYS  38   1.491   6.006  -3.543
  319    H    ILE  39           H        ILE  39  -0.817   5.516  -2.999
  320    HA   ILE  39           HA       ILE  39  -2.237   4.504  -5.282
  321    HB   ILE  39           HB       ILE  39  -2.682   2.991  -3.206
  322   1HG1  ILE  39          1HG1      ILE  39  -5.317   3.551  -4.185
  323   2HG1  ILE  39          2HG1      ILE  39  -4.185   3.759  -5.506
  324   1HG2  ILE  39          1HG2      ILE  39  -3.146   4.768  -1.613
  325   2HG2  ILE  39          2HG2      ILE  39  -4.497   5.345  -2.618
  326   3HG2  ILE  39          3HG2      ILE  39  -4.585   3.745  -1.845
  327   1HD1  ILE  39          1HD1      ILE  39  -3.574   1.533  -5.529
  328   2HD1  ILE  39          2HD1      ILE  39  -3.743   1.361  -3.764
  329   3HD1  ILE  39          3HD1      ILE  39  -5.189   1.341  -4.804
  330    H    ASP  40           H        ASP  40  -4.447   5.761  -5.423
  331    HA   ASP  40           HA       ASP  40  -3.748   8.493  -4.773
  332   1HB   ASP  40          1HB       ASP  40  -6.150   8.419  -6.293
  333   2HB   ASP  40          2HB       ASP  40  -4.554   8.873  -6.855
  334    H    VAL  41           H        VAL  41  -6.419   6.047  -4.573
  335    HA   VAL  41           HA       VAL  41  -7.594   7.663  -2.419
  336    HB   VAL  41           HB       VAL  41  -9.343   5.902  -4.040
  337   1HG1  VAL  41          1HG1      VAL  41  -9.631   8.667  -2.819
  338   2HG1  VAL  41          2HG1      VAL  41 -10.918   7.803  -3.694
  339   3HG1  VAL  41          3HG1      VAL  41 -10.272   7.136  -2.176
  340   1HG2  VAL  41          1HG2      VAL  41  -9.675   7.699  -5.749
  341   2HG2  VAL  41          2HG2      VAL  41  -8.231   8.518  -5.106
  342   3HG2  VAL  41          3HG2      VAL  41  -8.085   6.903  -5.840
  343    H    CYS  42           H        CYS  42  -8.474   6.473  -0.641
  344    HA   CYS  42           HA       CYS  42  -7.060   4.087  -0.123
  345   1HB   CYS  42          1HB       CYS  42  -7.919   5.931   1.496
  346   2HB   CYS  42          2HB       CYS  42  -9.421   5.027   1.480
  347    HA   PRO  43           HA       PRO  43 -10.082   1.701  -2.410
  348   1HB   PRO  43          1HB       PRO  43  -8.244  -0.569  -1.636
  349   2HB   PRO  43          2HB       PRO  43  -8.806  -0.074  -3.241
  350   1HG   PRO  43          1HG       PRO  43  -6.243   0.484  -2.479
  351   2HG   PRO  43          2HG       PRO  43  -7.175   1.725  -3.350
  352   1HD   PRO  43          1HD       PRO  43  -6.771   1.523  -0.297
  353   2HD   PRO  43          2HD       PRO  43  -6.472   2.920  -1.366
  354    H    LYS  44           H        LYS  44 -11.666   0.011  -2.208
  355    HA   LYS  44           HA       LYS  44 -12.684  -0.176   0.447
  356   1HB   LYS  44          1HB       LYS  44 -13.666  -1.543  -2.072
  357   2HB   LYS  44          2HB       LYS  44 -14.565  -1.293  -0.590
  358   1HG   LYS  44          1HG       LYS  44 -15.320   0.612  -1.602
  359   2HG   LYS  44          2HG       LYS  44 -13.772   1.291  -1.140
  360   1HD   LYS  44          1HD       LYS  44 -12.917   1.188  -3.292
  361   2HD   LYS  44          2HD       LYS  44 -13.786  -0.280  -3.689
  362   1HE   LYS  44          1HE       LYS  44 -15.675   0.855  -4.403
  363   2HE   LYS  44          2HE       LYS  44 -15.495   2.131  -3.214
  364   1HZ   LYS  44          1HZ       LYS  44 -14.476   1.991  -5.864
  365   2HZ   LYS  44          2HZ       LYS  44 -14.737   3.297  -4.918
  366   3HZ   LYS  44          3HZ       LYS  44 -13.344   2.455  -4.783
  367    H    ASN  45           H        ASN  45 -12.594  -1.861   1.892
  368    HA   ASN  45           HA       ASN  45 -10.667  -3.873   1.262
  369   1HB   ASN  45          1HB       ASN  45 -12.358  -3.658   3.798
  370   2HB   ASN  45          2HB       ASN  45 -10.803  -4.447   3.628
  371   1HD2  ASN  45          1HD2      ASN  45 -12.390  -1.700   4.592
  372   2HD2  ASN  45          2HD2      ASN  45 -11.079  -0.570   4.652
  373    H    SER  46           H        SER  46 -11.190  -6.248   1.664
  374    HA   SER  46           HA       SER  46 -14.018  -6.760   1.162
  375   1HB   SER  46          1HB       SER  46 -13.257  -8.777  -0.146
  376   2HB   SER  46          2HB       SER  46 -12.802  -7.248  -0.871
  377    HG   SER  46           HG       SER  46 -11.141  -9.140  -0.540
  378    H    LEU  47           H        LEU  47 -14.448  -9.295   1.661
  379    HA   LEU  47           HA       LEU  47 -13.589  -9.628   4.403
  380   1HB   LEU  47          1HB       LEU  47 -15.597 -11.101   2.694
  381   2HB   LEU  47          2HB       LEU  47 -15.262 -11.471   4.374
  382    HG   LEU  47           HG       LEU  47 -16.040  -8.666   3.690
  383   1HD1  LEU  47          1HD1      LEU  47 -17.942  -9.252   2.701
  384   2HD1  LEU  47          2HD1      LEU  47 -17.678 -10.977   3.055
  385   3HD1  LEU  47          3HD1      LEU  47 -18.458  -9.929   4.264
  386   1HD2  LEU  47          1HD2      LEU  47 -17.385  -9.224   5.910
  387   2HD2  LEU  47          2HD2      LEU  47 -16.140 -10.488   6.049
  388   3HD2  LEU  47          3HD2      LEU  47 -15.663  -8.777   5.934
  389    H    LEU  48           H        LEU  48 -11.905 -10.061   1.771
  390    HA   LEU  48           HA       LEU  48 -11.012 -12.757   2.527
  391   1HB   LEU  48          1HB       LEU  48 -10.809 -11.458  -0.192
  392   2HB   LEU  48          2HB       LEU  48 -10.295 -13.077   0.240
  393    HG   LEU  48           HG       LEU  48 -13.175 -12.218   0.518
  394   1HD1  LEU  48          1HD1      LEU  48 -11.700 -13.066  -1.962
  395   2HD1  LEU  48          2HD1      LEU  48 -13.423 -13.460  -1.746
  396   3HD1  LEU  48          3HD1      LEU  48 -12.890 -11.761  -1.737
  397   1HD2  LEU  48          1HD2      LEU  48 -12.629 -14.975  -0.231
  398   2HD2  LEU  48          2HD2      LEU  48 -11.807 -14.518   1.280
  399   3HD2  LEU  48          3HD2      LEU  48 -13.570 -14.320   1.131
  400    H    VAL  49           H        VAL  49 -10.022  -9.515   1.249
  401    HA   VAL  49           HA       VAL  49  -7.512  -9.888   2.720
  402    HB   VAL  49           HB       VAL  49  -7.951  -9.478  -0.138
  403   1HG1  VAL  49          1HG1      VAL  49  -6.157  -7.854  -0.489
  404   2HG1  VAL  49          2HG1      VAL  49  -7.471  -7.137   0.474
  405   3HG1  VAL  49          3HG1      VAL  49  -5.967  -7.659   1.270
  406   1HG2  VAL  49          1HG2      VAL  49  -5.285  -9.955   1.164
  407   2HG2  VAL  49          2HG2      VAL  49  -6.534 -11.222   1.228
  408   3HG2  VAL  49          3HG2      VAL  49  -5.952 -10.624  -0.345
  409    H    LYS  50           H        LYS  50  -6.513  -7.837   3.416
  410    HA   LYS  50           HA       LYS  50  -8.556  -5.740   3.668
  411   1HB   LYS  50          1HB       LYS  50  -7.959  -6.994   5.768
  412   2HB   LYS  50          2HB       LYS  50  -6.327  -6.373   5.622
  413   1HG   LYS  50          1HG       LYS  50  -6.942  -4.210   6.184
  414   2HG   LYS  50          2HG       LYS  50  -8.509  -4.334   5.411
  415   1HD   LYS  50          1HD       LYS  50  -8.249  -6.165   7.713
  416   2HD   LYS  50          2HD       LYS  50  -8.010  -4.489   8.168
  417   1HE   LYS  50          1HE       LYS  50 -10.179  -3.842   7.440
  418   2HE   LYS  50          2HE       LYS  50 -10.352  -5.235   6.391
  419   1HZ   LYS  50          1HZ       LYS  50 -10.450  -6.621   8.358
  420   2HZ   LYS  50          2HZ       LYS  50 -10.306  -5.316   9.328
  421   3HZ   LYS  50          3HZ       LYS  50 -11.629  -5.492   8.387
  422    H    TYR  51           H        TYR  51  -7.779  -3.508   3.649
  423    HA   TYR  51           HA       TYR  51  -5.138  -3.233   2.397
  424   1HB   TYR  51          1HB       TYR  51  -7.714  -1.703   1.706
  425   2HB   TYR  51          2HB       TYR  51  -6.217  -1.677   0.794
  426    HD1  TYR  51           HD1      TYR  51  -6.064  -2.986  -1.121
  427    HD2  TYR  51           HD2      TYR  51  -8.823  -4.125   1.945
  428    HE1  TYR  51           HE1      TYR  51  -6.936  -4.866  -2.593
  429    HE2  TYR  51           HE2      TYR  51  -9.685  -6.001   0.463
  430    HH   TYR  51           HH       TYR  51  -9.018  -7.309  -1.351
  431    H    VAL  52           H        VAL  52  -3.877  -1.789   3.458
  432    HA   VAL  52           HA       VAL  52  -5.259   0.102   5.227
  433    HB   VAL  52           HB       VAL  52  -2.357  -0.431   5.505
  434   1HG1  VAL  52          1HG1      VAL  52  -2.823   0.704   7.371
  435   2HG1  VAL  52          2HG1      VAL  52  -4.576   0.568   7.085
  436   3HG1  VAL  52          3HG1      VAL  52  -3.712  -0.727   7.948
  437   1HG2  VAL  52          1HG2      VAL  52  -4.453  -2.551   5.801
  438   2HG2  VAL  52          2HG2      VAL  52  -2.760  -2.682   5.266
  439   3HG2  VAL  52          3HG2      VAL  52  -3.134  -2.483   6.994
  440    H    CYS  53           H        CYS  53  -4.538   2.314   5.280
  441    HA   CYS  53           HA       CYS  53  -2.964   3.040   2.918
  442   1HB   CYS  53          1HB       CYS  53  -5.331   4.565   4.024
  443   2HB   CYS  53          2HB       CYS  53  -4.338   5.039   2.662
  444    H    CYS  54           H        CYS  54  -1.716   5.087   3.218
  445    HA   CYS  54           HA       CYS  54  -1.587   6.143   5.882
  446   1HB   CYS  54          1HB       CYS  54   0.932   5.742   5.972
  447   2HB   CYS  54          2HB       CYS  54  -0.136   4.422   6.407
  448    H    ASN  55           H        ASN  55   0.164   7.985   5.871
  449    HA   ASN  55           HA       ASN  55   0.375   9.017   3.154
  450   1HB   ASN  55          1HB       ASN  55  -0.175  11.243   3.934
  451   2HB   ASN  55          2HB       ASN  55  -1.393  10.182   4.614
  452   1HD2  ASN  55          1HD2      ASN  55  -0.879   9.251   6.789
  453   2HD2  ASN  55          2HD2      ASN  55  -0.161  10.294   7.973
  454    H    THR  56           H        THR  56   1.998   7.744   5.736
  455    HA   THR  56           HA       THR  56   4.159   9.713   5.791
  456    HB   THR  56           HB       THR  56   4.950   8.180   7.671
  457    HG1  THR  56           HG1      THR  56   2.301   7.045   7.485
  458   1HG2  THR  56          1HG2      THR  56   2.737   8.469   9.094
  459   2HG2  THR  56          2HG2      THR  56   3.610   9.928   8.570
  460   3HG2  THR  56          3HG2      THR  56   2.161   9.393   7.685
  461    H    ASP  57           H        ASP  57   6.448   8.790   5.747
  462    HA   ASP  57           HA       ASP  57   6.648   7.393   3.280
  463   1HB   ASP  57          1HB       ASP  57   8.623   8.587   5.254
  464   2HB   ASP  57          2HB       ASP  57   9.197   7.584   3.937
  465    H    ARG  58           H        ARG  58   8.250   5.452   3.125
  466    HA   ARG  58           HA       ARG  58   8.413   3.312   3.588
  467   1HB   ARG  58          1HB       ARG  58   9.632   4.608   6.073
  468   2HB   ARG  58          2HB       ARG  58   9.824   2.905   5.709
  469   1HG   ARG  58          1HG       ARG  58  10.687   3.704   3.368
  470   2HG   ARG  58          2HG       ARG  58  10.835   5.285   4.109
  471   1HD   ARG  58          1HD       ARG  58  12.009   3.001   5.660
  472   2HD   ARG  58          2HD       ARG  58  12.825   3.410   4.165
  473    HE   ARG  58           HE       ARG  58  12.421   5.873   5.413
  474   1HH1  ARG  58          1HH1      ARG  58  13.999   2.854   6.298
  475   2HH1  ARG  58          2HH1      ARG  58  15.159   3.616   7.334
  476   1HH2  ARG  58          1HH2      ARG  58  13.951   6.878   6.781
  477   2HH2  ARG  58          2HH2      ARG  58  15.131   5.921   7.611
  478    H    CYS  59           H        CYS  59   5.780   4.307   4.330
  479    HA   CYS  59           HA       CYS  59   5.202   3.171   6.910
  480   1HB   CYS  59          1HB       CYS  59   2.955   3.958   6.561
  481   2HB   CYS  59          2HB       CYS  59   4.104   5.234   6.212
  482    H    ASN  60           H        ASN  60   4.407   2.618   3.408
  483    HA   ASN  60           HA       ASN  60   3.433  -0.009   4.164
  484   1HB   ASN  60          1HB       ASN  60   2.280  -0.038   2.032
  485   2HB   ASN  60          2HB       ASN  60   2.025   1.562   2.698
  486   1HD2  ASN  60          1HD2      ASN  60   4.107  -0.325   0.545
  487   2HD2  ASN  60          2HD2      ASN  60   4.512   0.948  -0.556
  488   1H    HOH  61          1H        HOH  61  -0.856 -12.530   4.278
  489   2H    HOH  61          2H        HOH  61  -0.248 -11.905   3.040
  Start of MODEL   18
    1   1H    LEU   1           H1       LEU   1   6.486  12.799  -1.128
    2    HA   LEU   1           HA       LEU   1   6.938  10.991   0.495
    3   1HB   LEU   1          1HB       LEU   1   4.490  11.141  -1.203
    4   2HB   LEU   1          2HB       LEU   1   4.631   9.820  -0.060
    5    HG   LEU   1           HG       LEU   1   5.032  11.547   1.748
    6   1HD1  LEU   1          1HD1      LEU   1   4.675  13.338  -0.589
    7   2HD1  LEU   1          2HD1      LEU   1   3.850  13.817   0.914
    8   3HD1  LEU   1          3HD1      LEU   1   5.610  13.562   0.909
    9   1HD2  LEU   1          1HD2      LEU   1   2.572  10.784   0.416
   10   2HD2  LEU   1          2HD2      LEU   1   2.927  10.956   2.152
   11   3HD2  LEU   1          3HD2      LEU   1   2.418  12.374   1.203
   12    H    LYS   2           H        LYS   2   8.143   9.184   0.647
   13    HA   LYS   2           HA       LYS   2   8.058   7.358  -1.653
   14   1HB   LYS   2          1HB       LYS   2  10.355   8.138   0.154
   15   2HB   LYS   2          2HB       LYS   2  10.395   6.710  -0.861
   16   1HG   LYS   2          1HG       LYS   2  10.455   7.939  -2.847
   17   2HG   LYS   2          2HG       LYS   2   9.574   9.293  -2.168
   18   1HD   LYS   2          1HD       LYS   2  11.768   9.512  -0.631
   19   2HD   LYS   2          2HD       LYS   2  12.513   8.643  -1.957
   20   1HE   LYS   2          1HE       LYS   2  10.771  10.862  -2.866
   21   2HE   LYS   2          2HE       LYS   2  12.095  11.404  -1.855
   22   1HZ   LYS   2          1HZ       LYS   2  13.242  11.266  -3.735
   23   2HZ   LYS   2          2HZ       LYS   2  13.294   9.654  -3.473
   24   3HZ   LYS   2          3HZ       LYS   2  12.170  10.283  -4.478
   25    H    CYS   3           H        CYS   3   7.870   5.124  -1.239
   26    HA   CYS   3           HA       CYS   3   7.499   4.417   1.568
   27   1HB   CYS   3          1HB       CYS   3   5.494   4.194  -0.630
   28   2HB   CYS   3          2HB       CYS   3   5.582   2.890   0.537
   29    H    ASN   4           H        ASN   4   7.534   1.923   1.787
   30    HA   ASN   4           HA       ASN   4   9.754   0.995   0.321
   31   1HB   ASN   4          1HB       ASN   4   7.963  -0.822   1.970
   32   2HB   ASN   4          2HB       ASN   4   9.708  -0.868   1.811
   33   1HD2  ASN   4          1HD2      ASN   4  10.990   0.719   2.841
   34   2HD2  ASN   4          2HD2      ASN   4  10.436   1.569   4.245
   35    H    LYS   5           H        LYS   5   9.636  -1.322  -0.740
   36    HA   LYS   5           HA       LYS   5   7.288  -1.349  -2.469
   37   1HB   LYS   5          1HB       LYS   5   9.999  -2.684  -2.720
   38   2HB   LYS   5          2HB       LYS   5   8.692  -2.862  -3.872
   39   1HG   LYS   5          1HG       LYS   5   9.186  -0.032  -3.243
   40   2HG   LYS   5          2HG       LYS   5  10.636  -0.816  -3.838
   41   1HD   LYS   5          1HD       LYS   5   9.574  -0.081  -5.821
   42   2HD   LYS   5          2HD       LYS   5   9.134  -1.775  -5.739
   43   1HE   LYS   5          1HE       LYS   5   7.035  -0.842  -6.132
   44   2HE   LYS   5          2HE       LYS   5   7.027  -0.860  -4.381
   45   1HZ   LYS   5          1HZ       LYS   5   7.861   1.438  -6.011
   46   2HZ   LYS   5          2HZ       LYS   5   6.398   1.278  -5.302
   47   3HZ   LYS   5          3HZ       LYS   5   7.741   1.410  -4.382
   48    H    LEU   6           H        LEU   6   7.615  -4.172  -3.198
   49    HA   LEU   6           HA       LEU   6   5.772  -5.348  -1.633
   50   1HB   LEU   6          1HB       LEU   6   7.180  -6.071  -3.793
   51   2HB   LEU   6          2HB       LEU   6   7.974  -7.087  -2.606
   52    HG   LEU   6           HG       LEU   6   6.223  -8.330  -3.693
   53   1HD1  LEU   6          1HD1      LEU   6   4.885  -9.039  -1.749
   54   2HD1  LEU   6          2HD1      LEU   6   6.612  -8.854  -1.356
   55   3HD1  LEU   6          3HD1      LEU   6   5.447  -7.606  -0.854
   56   1HD2  LEU   6          1HD2      LEU   6   4.231  -6.278  -2.700
   57   2HD2  LEU   6          2HD2      LEU   6   4.858  -6.351  -4.364
   58   3HD2  LEU   6          3HD2      LEU   6   3.908  -7.707  -3.711
   59    H    VAL   7           H        VAL   7   9.282  -5.050  -0.990
   60    HA   VAL   7           HA       VAL   7   8.716  -5.910   1.744
   61    HB   VAL   7           HB       VAL   7  10.726  -7.055  -0.166
   62   1HG1  VAL   7          1HG1      VAL   7  11.820  -6.105   1.983
   63   2HG1  VAL   7          2HG1      VAL   7  10.996  -7.446   2.813
   64   3HG1  VAL   7          3HG1      VAL   7  12.171  -7.787   1.519
   65   1HG2  VAL   7          1HG2      VAL   7   8.330  -7.962   1.031
   66   2HG2  VAL   7          2HG2      VAL   7   9.478  -8.892   0.036
   67   3HG2  VAL   7          3HG2      VAL   7   9.654  -8.865   1.807
   68    HA   PRO   8           HA       PRO   8  10.804  -2.239   2.728
   69   1HB   PRO   8          1HB       PRO   8  11.835  -3.669   5.189
   70   2HB   PRO   8          2HB       PRO   8  10.860  -2.196   5.070
   71   1HG   PRO   8          1HG       PRO   8   9.669  -4.528   5.828
   72   2HG   PRO   8          2HG       PRO   8   8.827  -3.474   4.670
   73   1HD   PRO   8          1HD       PRO   8  10.539  -5.954   4.003
   74   2HD   PRO   8          2HD       PRO   8   8.871  -5.585   3.487
   75    H    ILE   9           H        ILE   9  12.605  -4.524   1.337
   76    HA   ILE   9           HA       ILE   9  15.186  -3.500   2.231
   77    HB   ILE   9           HB       ILE   9  16.155  -5.355   1.143
   78   1HG1  ILE   9          1HG1      ILE   9  13.906  -6.790   0.087
   79   2HG1  ILE   9          2HG1      ILE   9  13.911  -5.179  -0.605
   80   1HG2  ILE   9          1HG2      ILE   9  14.722  -7.285   2.105
   81   2HG2  ILE   9          2HG2      ILE   9  15.392  -6.066   3.216
   82   3HG2  ILE   9          3HG2      ILE   9  13.681  -5.984   2.733
   83   1HD1  ILE   9          1HD1      ILE   9  15.328  -7.049  -1.769
   84   2HD1  ILE   9          2HD1      ILE   9  16.063  -5.442  -1.555
   85   3HD1  ILE   9          3HD1      ILE   9  16.488  -6.770  -0.449
   86    H    ALA  10           H        ALA  10  12.739  -2.761   0.027
   87    HA   ALA  10           HA       ALA  10  14.557  -1.080  -1.452
   88   1HB   ALA  10          1HB       ALA  10  13.570  -3.609  -2.513
   89   2HB   ALA  10          2HB       ALA  10  13.000  -2.234  -3.489
   90   3HB   ALA  10          3HB       ALA  10  14.743  -2.468  -3.213
   91    H    TYR  11           H        TYR  11  13.587   0.876  -1.745
   92    HA   TYR  11           HA       TYR  11  10.651   0.914  -1.756
   93   1HB   TYR  11          1HB       TYR  11  10.847   2.895  -0.236
   94   2HB   TYR  11          2HB       TYR  11  11.654   1.523   0.498
   95    HD1  TYR  11           HD1      TYR  11  12.120   4.811  -1.069
   96    HD2  TYR  11           HD2      TYR  11  14.100   1.449   0.688
   97    HE1  TYR  11           HE1      TYR  11  14.255   6.172  -0.853
   98    HE2  TYR  11           HE2      TYR  11  16.229   2.822   0.898
   99    HH   TYR  11           HH       TYR  11  17.193   4.854  -0.387
  100    H    LYS  12           H        LYS  12   9.698   2.682  -2.926
  101    HA   LYS  12           HA       LYS  12  11.587   4.295  -4.463
  102   1HB   LYS  12          1HB       LYS  12   9.366   2.608  -5.651
  103   2HB   LYS  12          2HB       LYS  12  10.227   3.861  -6.519
  104   1HG   LYS  12          1HG       LYS  12  12.354   2.448  -5.526
  105   2HG   LYS  12          2HG       LYS  12  11.175   1.157  -5.648
  106   1HD   LYS  12          1HD       LYS  12  10.965   1.377  -7.992
  107   2HD   LYS  12          2HD       LYS  12  11.519   3.039  -7.992
  108   1HE   LYS  12          1HE       LYS  12  13.777   1.903  -7.039
  109   2HE   LYS  12          2HE       LYS  12  13.134   0.496  -7.865
  110   1HZ   LYS  12          1HZ       LYS  12  13.871   1.381  -9.722
  111   2HZ   LYS  12          2HZ       LYS  12  12.825   2.627  -9.575
  112   3HZ   LYS  12          3HZ       LYS  12  14.339   2.756  -8.974
  113    H    THR  13           H        THR  13  10.058   5.928  -5.864
  114    HA   THR  13           HA       THR  13   8.521   7.281  -3.808
  115    HB   THR  13           HB       THR  13  10.003   7.932  -6.291
  116    HG1  THR  13           HG1      THR  13   8.935   9.494  -4.052
  117   1HG2  THR  13          1HG2      THR  13   8.675   9.875  -6.901
  118   2HG2  THR  13          2HG2      THR  13   7.571   8.480  -6.953
  119   3HG2  THR  13          3HG2      THR  13   7.539   9.590  -5.562
  120    H    CYS  14           H        CYS  14   6.343   7.964  -4.014
  121    HA   CYS  14           HA       CYS  14   4.731   5.977  -5.233
  122   1HB   CYS  14          1HB       CYS  14   4.038   8.571  -3.842
  123   2HB   CYS  14          2HB       CYS  14   2.847   7.425  -4.426
  124    HA   PRO  15           HA       PRO  15   4.862   7.753  -9.292
  125   1HB   PRO  15          1HB       PRO  15   2.432   6.509 -10.136
  126   2HB   PRO  15          2HB       PRO  15   4.066   5.836 -10.274
  127   1HG   PRO  15          1HG       PRO  15   1.925   5.379  -8.095
  128   2HG   PRO  15          2HG       PRO  15   3.049   4.217  -8.838
  129   1HD   PRO  15          1HD       PRO  15   3.614   5.194  -6.362
  130   2HD   PRO  15          2HD       PRO  15   4.922   4.903  -7.541
  131    H    GLU  16           H        GLU  16   3.319   8.797 -11.010
  132    HA   GLU  16           HA       GLU  16   2.402  11.156  -9.860
  133   1HB   GLU  16          1HB       GLU  16   1.932  10.000 -12.643
  134   2HB   GLU  16          2HB       GLU  16   1.570  11.652 -12.188
  135   1HG   GLU  16          1HG       GLU  16   4.311  10.869 -11.425
  136   2HG   GLU  16          2HG       GLU  16   4.032  10.698 -13.146
  137    H    GLY  17           H        GLY  17   0.324  11.921  -9.357
  138   1HA   GLY  17          1HA       GLY  17  -1.924  11.883  -9.074
  139   2HA   GLY  17          2HA       GLY  17  -2.033  10.471 -10.107
  140    H    LYS  18           H        LYS  18   0.375   9.756  -7.878
  141    HA   LYS  18           HA       LYS  18  -1.548   8.734  -5.916
  142   1HB   LYS  18          1HB       LYS  18   0.738   7.152  -7.130
  143   2HB   LYS  18          2HB       LYS  18  -0.327   6.607  -5.849
  144   1HG   LYS  18          1HG       LYS  18  -1.930   6.002  -7.338
  145   2HG   LYS  18          2HG       LYS  18  -1.921   7.590  -8.081
  146   1HD   LYS  18          1HD       LYS  18   0.148   6.910  -9.385
  147   2HD   LYS  18          2HD       LYS  18  -0.005   5.298  -8.715
  148   1HE   LYS  18          1HE       LYS  18  -1.594   4.741 -10.239
  149   2HE   LYS  18          2HE       LYS  18  -2.576   6.126  -9.799
  150   1HZ   LYS  18          1HZ       LYS  18  -0.225   6.665 -11.385
  151   2HZ   LYS  18          2HZ       LYS  18  -1.449   5.890 -12.138
  152   3HZ   LYS  18          3HZ       LYS  18  -1.707   7.349 -11.453
  153    H    ASN  19           H        ASN  19  -1.110   9.969  -4.153
  154    HA   ASN  19           HA       ASN  19   1.714  10.385  -3.576
  155   1HB   ASN  19          1HB       ASN  19   0.519  12.503  -3.780
  156   2HB   ASN  19          2HB       ASN  19  -0.798  11.933  -2.776
  157   1HD2  ASN  19          1HD2      ASN  19  -0.816  12.728  -0.831
  158   2HD2  ASN  19          2HD2      ASN  19   0.545  13.166   0.147
  159    H    LEU  20           H        LEU  20  -1.256   8.808  -2.659
  160    HA   LEU  20           HA       LEU  20  -0.505   8.535   0.126
  161   1HB   LEU  20          1HB       LEU  20  -2.902   7.900  -1.537
  162   2HB   LEU  20          2HB       LEU  20  -2.658   7.018  -0.043
  163    HG   LEU  20           HG       LEU  20  -2.732  10.042  -0.209
  164   1HD1  LEU  20          1HD1      LEU  20  -4.886   9.431  -0.888
  165   2HD1  LEU  20          2HD1      LEU  20  -4.949   8.045   0.225
  166   3HD1  LEU  20          3HD1      LEU  20  -5.039   9.704   0.864
  167   1HD2  LEU  20          1HD2      LEU  20  -3.118   9.892   2.228
  168   2HD2  LEU  20          2HD2      LEU  20  -2.876   8.132   2.140
  169   3HD2  LEU  20          3HD2      LEU  20  -1.539   9.235   1.735
  170    H    CYS  21           H        CYS  21  -0.518   6.265   1.094
  171    HA   CYS  21           HA       CYS  21   0.781   4.449  -0.806
  172   1HB   CYS  21          1HB       CYS  21   1.519   5.234   1.981
  173   2HB   CYS  21          2HB       CYS  21   1.841   3.591   1.466
  174    H    TYR  22           H        TYR  22   0.104   2.250  -0.710
  175    HA   TYR  22           HA       TYR  22  -1.932   1.619   1.301
  176   1HB   TYR  22          1HB       TYR  22  -3.434   0.944  -0.457
  177   2HB   TYR  22          2HB       TYR  22  -2.719   2.399  -1.119
  178    HD1  TYR  22           HD1      TYR  22  -3.313  -1.085  -1.639
  179    HD2  TYR  22           HD2      TYR  22  -0.664   2.109  -2.680
  180    HE1  TYR  22           HE1      TYR  22  -2.531  -2.388  -3.676
  181    HE2  TYR  22           HE2      TYR  22   0.110   0.795  -4.714
  182    HH   TYR  22           HH       TYR  22  -1.251  -2.418  -5.408
  183    H    LYS  23           H        LYS  23  -2.157  -0.660   1.751
  184    HA   LYS  23           HA       LYS  23  -0.295  -2.437   0.431
  185   1HB   LYS  23          1HB       LYS  23   0.612  -3.173   2.693
  186   2HB   LYS  23          2HB       LYS  23   1.222  -1.665   2.044
  187   1HG   LYS  23          1HG       LYS  23  -0.469  -0.414   3.439
  188   2HG   LYS  23          2HG       LYS  23  -0.997  -1.936   4.128
  189   1HD   LYS  23          1HD       LYS  23   1.708  -2.133   4.557
  190   2HD   LYS  23          2HD       LYS  23   1.516  -0.392   4.630
  191   1HE   LYS  23          1HE       LYS  23  -0.034  -0.519   6.455
  192   2HE   LYS  23          2HE       LYS  23  -0.352  -2.221   6.185
  193   1HZ   LYS  23          1HZ       LYS  23   1.409  -1.265   7.939
  194   2HZ   LYS  23          2HZ       LYS  23   1.444  -2.784   7.337
  195   3HZ   LYS  23          3HZ       LYS  23   2.395  -1.626   6.688
  196    H    MET  24           H        MET  24  -1.303  -4.346   0.082
  197    HA   MET  24           HA       MET  24  -3.783  -4.748   1.511
  198   1HB   MET  24          1HB       MET  24  -2.500  -6.064  -0.944
  199   2HB   MET  24          2HB       MET  24  -4.024  -6.611  -0.273
  200   1HG   MET  24          1HG       MET  24  -5.157  -4.607  -0.857
  201   2HG   MET  24          2HG       MET  24  -3.676  -3.676  -0.952
  202   1HE   MET  24          1HE       MET  24  -6.142  -6.037  -3.130
  203   2HE   MET  24          2HE       MET  24  -4.850  -6.991  -3.897
  204   3HE   MET  24          3HE       MET  24  -5.024  -6.992  -2.126
  205    H    PHE  25           H        PHE  25  -4.250  -6.609   2.764
  206    HA   PHE  25           HA       PHE  25  -2.021  -8.468   3.131
  207   1HB   PHE  25          1HB       PHE  25  -3.654  -6.845   5.157
  208   2HB   PHE  25          2HB       PHE  25  -2.846  -8.321   5.650
  209    HD1  PHE  25           HD1      PHE  25  -2.249  -4.951   4.228
  210    HD2  PHE  25           HD2      PHE  25  -0.547  -8.321   6.167
  211    HE1  PHE  25           HE1      PHE  25  -0.130  -3.661   4.611
  212    HE2  PHE  25           HE2      PHE  25   1.571  -7.031   6.550
  213    HZ   PHE  25           HZ       PHE  25   1.754  -4.717   5.768
  214    H    MET  26           H        MET  26  -2.632 -10.610   3.325
  215    HA   MET  26           HA       MET  26  -5.332 -11.182   2.713
  216   1HB   MET  26          1HB       MET  26  -3.025 -13.025   3.555
  217   2HB   MET  26          2HB       MET  26  -4.507 -13.558   2.786
  218   1HG   MET  26          1HG       MET  26  -3.839 -11.820   0.893
  219   2HG   MET  26          2HG       MET  26  -2.237 -11.938   1.592
  220   1HE   MET  26          1HE       MET  26  -4.367 -14.895  -1.054
  221   2HE   MET  26          2HE       MET  26  -5.268 -14.352   0.382
  222   3HE   MET  26          3HE       MET  26  -4.649 -13.158  -0.784
  223    H    MET  27           H        MET  27  -6.706 -12.740   3.984
  224    HA   MET  27           HA       MET  27  -6.991 -11.824   6.587
  225   1HB   MET  27          1HB       MET  27  -8.140 -14.045   4.878
  226   2HB   MET  27          2HB       MET  27  -8.457 -14.119   6.600
  227   1HG   MET  27          1HG       MET  27  -8.919 -11.500   5.155
  228   2HG   MET  27          2HG       MET  27 -10.097 -12.783   4.963
  229   1HE   MET  27          1HE       MET  27  -9.809  -9.922   6.069
  230   2HE   MET  27          2HE       MET  27 -11.173  -9.918   7.214
  231   3HE   MET  27          3HE       MET  27  -9.505  -9.750   7.815
  232    H    SER  28           H        SER  28  -5.314 -14.656   5.188
  233    HA   SER  28           HA       SER  28  -5.039 -16.069   7.560
  234   1HB   SER  28          1HB       SER  28  -4.651 -17.170   5.444
  235   2HB   SER  28          2HB       SER  28  -3.414 -16.016   4.989
  236    HG   SER  28           HG       SER  28  -2.191 -16.832   6.930
  237    H    ASP  29           H        ASP  29  -2.002 -15.147   5.971
  238    HA   ASP  29           HA       ASP  29  -0.909 -14.427   8.468
  239   1HB   ASP  29          1HB       ASP  29   0.200 -15.476   6.303
  240   2HB   ASP  29          2HB       ASP  29   0.369 -13.811   5.784
  241    H    LEU  30           H        LEU  30  -2.386 -12.566   8.990
  242    HA   LEU  30           HA       LEU  30  -2.452 -10.304   7.274
  243   1HB   LEU  30          1HB       LEU  30  -3.282 -10.753  10.140
  244   2HB   LEU  30          2HB       LEU  30  -3.508  -9.235   9.296
  245    HG   LEU  30           HG       LEU  30  -4.583 -11.646   7.933
  246   1HD1  LEU  30          1HD1      LEU  30  -6.012 -10.524  10.353
  247   2HD1  LEU  30          2HD1      LEU  30  -6.518 -11.878   9.314
  248   3HD1  LEU  30          3HD1      LEU  30  -5.084 -12.043  10.357
  249   1HD2  LEU  30          1HD2      LEU  30  -5.517  -8.806   8.381
  250   2HD2  LEU  30          2HD2      LEU  30  -4.939  -9.554   6.873
  251   3HD2  LEU  30          3HD2      LEU  30  -6.501 -10.047   7.571
  252    H    THR  31           H        THR  31  -0.023 -11.638   9.224
  253    HA   THR  31           HA       THR  31   1.082  -9.088  10.061
  254    HB   THR  31           HB       THR  31   1.280 -11.912  10.788
  255    HG1  THR  31           HG1      THR  31   0.910  -9.809  12.027
  256   1HG2  THR  31          1HG2      THR  31   3.459 -12.008   9.699
  257   2HG2  THR  31          2HG2      THR  31   3.865 -10.365  10.251
  258   3HG2  THR  31          3HG2      THR  31   3.763 -11.699  11.426
  259    H    ILE  32           H        ILE  32   1.292 -11.334   7.372
  260    HA   ILE  32           HA       ILE  32   3.623  -9.822   6.417
  261    HB   ILE  32           HB       ILE  32   2.876 -12.692   6.278
  262   1HG1  ILE  32          1HG1      ILE  32   5.616 -11.424   6.265
  263   2HG1  ILE  32          2HG1      ILE  32   4.688 -11.592   7.742
  264   1HG2  ILE  32          1HG2      ILE  32   4.222 -13.067   4.276
  265   2HG2  ILE  32          2HG2      ILE  32   2.813 -12.038   3.920
  266   3HG2  ILE  32          3HG2      ILE  32   4.431 -11.311   4.073
  267   1HD1  ILE  32          1HD1      ILE  32   6.357 -13.532   6.734
  268   2HD1  ILE  32          2HD1      ILE  32   5.001 -13.859   7.839
  269   3HD1  ILE  32          3HD1      ILE  32   4.787 -14.059   6.084
  270    HA   PRO  33           HA       PRO  33   0.641  -8.120   3.669
  271   1HB   PRO  33          1HB       PRO  33   2.485  -6.672   2.115
  272   2HB   PRO  33          2HB       PRO  33   1.815  -6.133   3.664
  273   1HG   PRO  33          1HG       PRO  33   4.533  -7.457   3.050
  274   2HG   PRO  33          2HG       PRO  33   4.136  -6.170   4.213
  275   1HD   PRO  33          1HD       PRO  33   4.450  -8.817   5.019
  276   2HD   PRO  33          2HD       PRO  33   3.421  -7.647   5.889
  277    H    VAL  34           H        VAL  34  -0.005  -7.904   1.381
  278    HA   VAL  34           HA       VAL  34   1.070 -10.136  -0.202
  279    HB   VAL  34           HB       VAL  34  -1.158 -10.595   0.539
  280   1HG1  VAL  34          1HG1      VAL  34  -1.653  -7.750  -0.235
  281   2HG1  VAL  34          2HG1      VAL  34  -2.985  -8.913  -0.441
  282   3HG1  VAL  34          3HG1      VAL  34  -2.247  -8.680   1.162
  283   1HG2  VAL  34          1HG2      VAL  34  -0.391 -10.886  -1.968
  284   2HG2  VAL  34          2HG2      VAL  34  -2.072 -11.217  -1.486
  285   3HG2  VAL  34          3HG2      VAL  34  -1.660  -9.675  -2.274
  286    H    LYS  35           H        LYS  35  -0.018  -6.727  -0.117
  287    HA   LYS  35           HA       LYS  35   1.444  -6.333  -2.611
  288   1HB   LYS  35          1HB       LYS  35  -1.290  -5.112  -2.182
  289   2HB   LYS  35          2HB       LYS  35  -0.306  -5.076  -3.631
  290   1HG   LYS  35          1HG       LYS  35  -1.215  -7.720  -2.434
  291   2HG   LYS  35          2HG       LYS  35  -2.269  -6.807  -3.494
  292   1HD   LYS  35          1HD       LYS  35  -0.376  -6.780  -5.214
  293   2HD   LYS  35          2HD       LYS  35   0.510  -7.872  -4.170
  294   1HE   LYS  35          1HE       LYS  35  -0.554  -9.446  -5.503
  295   2HE   LYS  35          2HE       LYS  35  -1.781  -9.278  -4.264
  296   1HZ   LYS  35          1HZ       LYS  35  -3.138  -8.244  -5.674
  297   2HZ   LYS  35          2HZ       LYS  35  -1.961  -7.365  -6.389
  298   3HZ   LYS  35          3HZ       LYS  35  -2.220  -8.911  -6.848
  299    H    ARG  36           H        ARG  36   2.394  -4.242  -2.806
  300    HA   ARG  36           HA       ARG  36   1.915  -2.417  -0.653
  301   1HB   ARG  36          1HB       ARG  36   4.472  -3.990  -0.976
  302   2HB   ARG  36          2HB       ARG  36   4.613  -2.313  -0.484
  303   1HG   ARG  36          1HG       ARG  36   2.825  -2.872   1.326
  304   2HG   ARG  36          2HG       ARG  36   3.129  -4.555   0.945
  305   1HD   ARG  36          1HD       ARG  36   5.308  -4.510   1.808
  306   2HD   ARG  36          2HD       ARG  36   5.525  -2.802   1.477
  307    HE   ARG  36           HE       ARG  36   3.525  -2.792   3.378
  308   1HH1  ARG  36          1HH1      ARG  36   6.705  -4.293   3.241
  309   2HH1  ARG  36          2HH1      ARG  36   6.945  -4.240   4.955
  310   1HH2  ARG  36          1HH2      ARG  36   3.843  -2.721   5.640
  311   2HH2  ARG  36          2HH2      ARG  36   5.306  -3.339   6.330
  312    H    GLY  37           H        GLY  37   1.602  -0.521  -1.781
  313   1HA   GLY  37          1HA       GLY  37   3.651   0.420  -3.584
  314   2HA   GLY  37          2HA       GLY  37   2.143   0.007  -4.378
  315    H    CYS  38           H        CYS  38   1.644   2.191  -4.939
  316    HA   CYS  38           HA       CYS  38   0.813   3.778  -2.626
  317   1HB   CYS  38          1HB       CYS  38   2.099   4.875  -5.136
  318   2HB   CYS  38          2HB       CYS  38   1.473   5.818  -3.797
  319    H    ILE  39           H        ILE  39  -0.975   5.364  -3.256
  320    HA   ILE  39           HA       ILE  39  -2.334   4.762  -5.729
  321    HB   ILE  39           HB       ILE  39  -2.970   3.048  -3.882
  322   1HG1  ILE  39          1HG1      ILE  39  -5.517   3.980  -4.856
  323   2HG1  ILE  39          2HG1      ILE  39  -4.309   4.181  -6.110
  324   1HG2  ILE  39          1HG2      ILE  39  -3.345   4.681  -2.096
  325   2HG2  ILE  39          2HG2      ILE  39  -4.661   5.418  -3.041
  326   3HG2  ILE  39          3HG2      ILE  39  -4.818   3.747  -2.450
  327   1HD1  ILE  39          1HD1      ILE  39  -5.096   1.632  -4.658
  328   2HD1  ILE  39          2HD1      ILE  39  -5.098   1.957  -6.408
  329   3HD1  ILE  39          3HD1      ILE  39  -3.556   1.755  -5.541
  330    H    ASP  40           H        ASP  40  -4.629   6.097  -5.517
  331    HA   ASP  40           HA       ASP  40  -3.692   8.731  -4.762
  332   1HB   ASP  40          1HB       ASP  40  -4.598   8.213  -7.099
  333   2HB   ASP  40          2HB       ASP  40  -6.168   7.950  -6.368
  334    H    VAL  41           H        VAL  41  -6.502   6.448  -4.501
  335    HA   VAL  41           HA       VAL  41  -7.351   7.937  -2.115
  336    HB   VAL  41           HB       VAL  41  -8.840   7.091  -4.526
  337   1HG1  VAL  41          1HG1      VAL  41  -9.777   5.519  -2.916
  338   2HG1  VAL  41          2HG1      VAL  41 -10.047   6.837  -1.750
  339   3HG1  VAL  41          3HG1      VAL  41 -10.959   6.799  -3.279
  340   1HG2  VAL  41          1HG2      VAL  41 -10.047   9.073  -2.749
  341   2HG2  VAL  41          2HG2      VAL  41  -8.360   9.464  -3.162
  342   3HG2  VAL  41          3HG2      VAL  41  -9.557   9.212  -4.455
  343    H    CYS  42           H        CYS  42  -8.511   6.561  -0.502
  344    HA   CYS  42           HA       CYS  42  -7.053   4.175  -0.112
  345   1HB   CYS  42          1HB       CYS  42  -8.083   5.841   1.607
  346   2HB   CYS  42          2HB       CYS  42  -9.539   4.887   1.415
  347    HA   PRO  43           HA       PRO  43  -9.819   1.914  -2.801
  348   1HB   PRO  43          1HB       PRO  43  -8.022  -0.384  -2.004
  349   2HB   PRO  43          2HB       PRO  43  -8.451   0.201  -3.620
  350   1HG   PRO  43          1HG       PRO  43  -5.975   0.744  -2.603
  351   2HG   PRO  43          2HG       PRO  43  -6.850   2.023  -3.478
  352   1HD   PRO  43          1HD       PRO  43  -6.698   1.648  -0.420
  353   2HD   PRO  43          2HD       PRO  43  -6.356   3.114  -1.380
  354    H    LYS  44           H        LYS  44 -10.975  -0.332  -2.860
  355    HA   LYS  44           HA       LYS  44 -12.689  -0.390  -0.617
  356   1HB   LYS  44          1HB       LYS  44 -12.467  -2.392  -2.883
  357   2HB   LYS  44          2HB       LYS  44 -13.837  -2.158  -1.815
  358   1HG   LYS  44          1HG       LYS  44 -13.375   0.422  -2.799
  359   2HG   LYS  44          2HG       LYS  44 -13.012  -0.590  -4.184
  360   1HD   LYS  44          1HD       LYS  44 -15.230  -1.760  -3.864
  361   2HD   LYS  44          2HD       LYS  44 -15.593  -0.659  -2.549
  362   1HE   LYS  44          1HE       LYS  44 -15.114   1.245  -4.301
  363   2HE   LYS  44          2HE       LYS  44 -15.285  -0.018  -5.504
  364   1HZ   LYS  44          1HZ       LYS  44 -17.420   0.596  -5.304
  365   2HZ   LYS  44          2HZ       LYS  44 -17.424  -0.479  -4.074
  366   3HZ   LYS  44          3HZ       LYS  44 -17.284   1.118  -3.762
  367    H    ASN  45           H        ASN  45 -13.237  -2.783   0.288
  368    HA   ASN  45           HA       ASN  45 -10.815  -4.239   0.768
  369   1HB   ASN  45          1HB       ASN  45 -12.427  -3.201   3.149
  370   2HB   ASN  45          2HB       ASN  45 -10.896  -4.051   3.201
  371   1HD2  ASN  45          1HD2      ASN  45 -12.437  -1.144   1.862
  372   2HD2  ASN  45          2HD2      ASN  45 -11.086  -0.075   2.030
  373    H    SER  46           H        SER  46 -11.322  -6.447   1.307
  374    HA   SER  46           HA       SER  46 -14.185  -6.978   1.508
  375   1HB   SER  46          1HB       SER  46 -13.674  -9.176   0.387
  376   2HB   SER  46          2HB       SER  46 -13.390  -7.780  -0.632
  377    HG   SER  46           HG       SER  46 -11.628  -9.718   0.118
  378    H    LEU  47           H        LEU  47 -14.373  -9.503   2.368
  379    HA   LEU  47           HA       LEU  47 -13.122  -9.388   4.966
  380   1HB   LEU  47          1HB       LEU  47 -15.199 -11.210   3.749
  381   2HB   LEU  47          2HB       LEU  47 -14.590 -11.378   5.384
  382    HG   LEU  47           HG       LEU  47 -15.842  -8.803   4.431
  383   1HD1  LEU  47          1HD1      LEU  47 -17.526 -10.422   3.962
  384   2HD1  LEU  47          2HD1      LEU  47 -17.245 -11.257   5.508
  385   3HD1  LEU  47          3HD1      LEU  47 -17.964  -9.628   5.494
  386   1HD2  LEU  47          1HD2      LEU  47 -15.286  -8.113   6.463
  387   2HD2  LEU  47          2HD2      LEU  47 -16.381  -9.337   7.148
  388   3HD2  LEU  47          3HD2      LEU  47 -14.664  -9.725   6.886
  389    H    LEU  48           H        LEU  48 -11.917 -10.198   2.078
  390    HA   LEU  48           HA       LEU  48 -10.657 -12.661   3.058
  391   1HB   LEU  48          1HB       LEU  48 -10.813 -11.633   0.224
  392   2HB   LEU  48          2HB       LEU  48 -10.173 -13.176   0.753
  393    HG   LEU  48           HG       LEU  48 -13.059 -12.387   1.184
  394   1HD1  LEU  48          1HD1      LEU  48 -12.148 -14.143  -1.084
  395   2HD1  LEU  48          2HD1      LEU  48 -13.708 -13.320  -0.847
  396   3HD1  LEU  48          3HD1      LEU  48 -12.259 -12.376  -1.270
  397   1HD2  LEU  48          1HD2      LEU  48 -12.532 -15.203   0.837
  398   2HD2  LEU  48          2HD2      LEU  48 -11.512 -14.530   2.132
  399   3HD2  LEU  48          3HD2      LEU  48 -13.282 -14.345   2.204
  400    H    VAL  49           H        VAL  49 -10.041  -9.505   1.388
  401    HA   VAL  49           HA       VAL  49  -7.355  -9.601   2.568
  402    HB   VAL  49           HB       VAL  49  -6.392  -8.755   0.597
  403   1HG1  VAL  49          1HG1      VAL  49  -6.363 -10.915  -0.018
  404   2HG1  VAL  49          2HG1      VAL  49  -8.068 -11.160   0.431
  405   3HG1  VAL  49          3HG1      VAL  49  -7.656 -10.471  -1.158
  406   1HG2  VAL  49          1HG2      VAL  49  -7.542  -7.252  -0.597
  407   2HG2  VAL  49          2HG2      VAL  49  -8.344  -8.627  -1.394
  408   3HG2  VAL  49          3HG2      VAL  49  -9.103  -7.851   0.017
  409    H    LYS  50           H        LYS  50  -6.634  -7.678   3.499
  410    HA   LYS  50           HA       LYS  50  -8.641  -5.533   3.512
  411   1HB   LYS  50          1HB       LYS  50  -8.208  -6.815   5.666
  412   2HB   LYS  50          2HB       LYS  50  -6.603  -6.111   5.674
  413   1HG   LYS  50          1HG       LYS  50  -8.501  -3.992   5.158
  414   2HG   LYS  50          2HG       LYS  50  -9.081  -4.913   6.533
  415   1HD   LYS  50          1HD       LYS  50  -7.315  -4.287   7.880
  416   2HD   LYS  50          2HD       LYS  50  -6.154  -4.334   6.569
  417   1HE   LYS  50          1HE       LYS  50  -6.345  -2.097   6.210
  418   2HE   LYS  50          2HE       LYS  50  -8.090  -2.199   6.099
  419   1HZ   LYS  50          1HZ       LYS  50  -6.444  -1.651   8.411
  420   2HZ   LYS  50          2HZ       LYS  50  -7.873  -0.995   7.973
  421   3HZ   LYS  50          3HZ       LYS  50  -7.833  -2.472   8.670
  422    H    TYR  51           H        TYR  51  -7.942  -3.369   3.254
  423    HA   TYR  51           HA       TYR  51  -5.208  -3.169   2.183
  424   1HB   TYR  51          1HB       TYR  51  -7.750  -1.490   1.714
  425   2HB   TYR  51          2HB       TYR  51  -6.248  -1.311   0.830
  426    HD1  TYR  51           HD1      TYR  51  -6.088  -2.308  -1.262
  427    HD2  TYR  51           HD2      TYR  51  -8.790  -3.965   1.612
  428    HE1  TYR  51           HE1      TYR  51  -6.917  -3.976  -2.993
  429    HE2  TYR  51           HE2      TYR  51  -9.610  -5.627  -0.128
  430    HH   TYR  51           HH       TYR  51  -9.613  -5.452  -2.923
  431    H    VAL  52           H        VAL  52  -3.799  -1.951   3.336
  432    HA   VAL  52           HA       VAL  52  -4.962  -0.086   5.281
  433    HB   VAL  52           HB       VAL  52  -2.115  -0.938   5.402
  434   1HG1  VAL  52          1HG1      VAL  52  -4.233  -0.669   7.559
  435   2HG1  VAL  52          2HG1      VAL  52  -2.471  -0.788   7.780
  436   3HG1  VAL  52          3HG1      VAL  52  -3.177   0.656   7.017
  437   1HG2  VAL  52          1HG2      VAL  52  -4.387  -2.777   6.228
  438   2HG2  VAL  52          2HG2      VAL  52  -3.282  -3.042   4.859
  439   3HG2  VAL  52          3HG2      VAL  52  -2.652  -3.041   6.524
  440    H    CYS  53           H        CYS  53  -4.928   2.008   4.670
  441    HA   CYS  53           HA       CYS  53  -3.020   2.775   2.624
  442   1HB   CYS  53          1HB       CYS  53  -5.253   4.431   3.806
  443   2HB   CYS  53          2HB       CYS  53  -4.338   4.762   2.349
  444    H    CYS  54           H        CYS  54  -1.856   4.936   2.962
  445    HA   CYS  54           HA       CYS  54  -1.604   5.866   5.638
  446   1HB   CYS  54          1HB       CYS  54   0.909   5.408   5.687
  447   2HB   CYS  54          2HB       CYS  54  -0.184   4.105   6.113
  448    H    ASN  55           H        ASN  55  -0.108   7.800   5.670
  449    HA   ASN  55           HA       ASN  55   0.313   8.790   2.960
  450   1HB   ASN  55          1HB       ASN  55  -0.053  11.124   4.185
  451   2HB   ASN  55          2HB       ASN  55  -1.445  10.184   3.688
  452   1HD2  ASN  55          1HD2      ASN  55   0.828  10.558   6.397
  453   2HD2  ASN  55          2HD2      ASN  55  -0.316  10.344   7.680
  454    H    THR  56           H        THR  56   1.792   7.607   5.648
  455    HA   THR  56           HA       THR  56   3.822   9.694   5.899
  456    HB   THR  56           HB       THR  56   4.485   8.400   7.887
  457    HG1  THR  56           HG1      THR  56   2.342   6.570   7.159
  458   1HG2  THR  56          1HG2      THR  56   1.839   7.840   8.636
  459   2HG2  THR  56          2HG2      THR  56   2.674   9.391   8.892
  460   3HG2  THR  56          3HG2      THR  56   1.656   9.154   7.451
  461    H    ASP  57           H        ASP  57   6.145   9.031   5.904
  462    HA   ASP  57           HA       ASP  57   6.635   7.699   3.473
  463   1HB   ASP  57          1HB       ASP  57   8.346   8.903   5.667
  464   2HB   ASP  57          2HB       ASP  57   9.108   7.947   4.412
  465    H    ARG  58           H        ARG  58   8.164   5.771   3.295
  466    HA   ARG  58           HA       ARG  58   8.354   3.621   3.686
  467   1HB   ARG  58          1HB       ARG  58   9.520   4.844   6.232
  468   2HB   ARG  58          2HB       ARG  58   9.733   3.154   5.820
  469   1HG   ARG  58          1HG       ARG  58  10.501   4.274   3.455
  470   2HG   ARG  58          2HG       ARG  58  10.922   5.590   4.534
  471   1HD   ARG  58          1HD       ARG  58  11.829   3.187   5.806
  472   2HD   ARG  58          2HD       ARG  58  12.302   3.061   4.124
  473    HE   ARG  58           HE       ARG  58  13.871   4.750   4.485
  474   1HH1  ARG  58          1HH1      ARG  58  11.396   4.962   6.977
  475   2HH1  ARG  58          2HH1      ARG  58  12.205   6.220   7.852
  476   1HH2  ARG  58          1HH2      ARG  58  14.938   6.409   5.638
  477   2HH2  ARG  58          2HH2      ARG  58  14.232   7.049   7.085
  478    H    CYS  59           H        CYS  59   5.694   4.285   4.226
  479    HA   CYS  59           HA       CYS  59   5.025   3.298   6.845
  480   1HB   CYS  59          1HB       CYS  59   2.745   3.800   6.261
  481   2HB   CYS  59          2HB       CYS  59   3.778   5.163   5.883
  482    H    ASN  60           H        ASN  60   4.601   2.378   3.357
  483    HA   ASN  60           HA       ASN  60   3.915  -0.291   4.287
  484   1HB   ASN  60          1HB       ASN  60   2.901  -0.634   2.073
  485   2HB   ASN  60          2HB       ASN  60   2.291   0.869   2.735
  486   1HD2  ASN  60          1HD2      ASN  60   4.456  -0.617   0.434
  487   2HD2  ASN  60          2HD2      ASN  60   4.724   0.760  -0.583
  488   1H    HOH  61          1H        HOH  61  -0.906 -12.166   4.474
  489   2H    HOH  61          2H        HOH  61  -0.160 -11.706   3.241
  Start of MODEL   19
    1   1H    LEU   1           H1       LEU   1   5.926  11.656  -2.597
    2    HA   LEU   1           HA       LEU   1   6.571  11.055   0.206
    3   1HB   LEU   1          1HB       LEU   1   4.095  11.592  -0.837
    4   2HB   LEU   1          2HB       LEU   1   4.150   9.843  -0.936
    5    HG   LEU   1           HG       LEU   1   3.099  10.578   1.131
    6   1HD1  LEU   1          1HD1      LEU   1   4.652   9.383   2.770
    7   2HD1  LEU   1          2HD1      LEU   1   4.120   8.474   1.335
    8   3HD1  LEU   1          3HD1      LEU   1   5.757   9.173   1.390
    9   1HD2  LEU   1          1HD2      LEU   1   5.338  12.423   1.210
   10   2HD2  LEU   1          2HD2      LEU   1   3.788  12.465   2.082
   11   3HD2  LEU   1          3HD2      LEU   1   5.157  11.540   2.744
   12    H    LYS   2           H        LYS   2   7.792   9.273   0.509
   13    HA   LYS   2           HA       LYS   2   7.802   7.314  -1.682
   14   1HB   LYS   2          1HB       LYS   2  10.036   8.404   0.024
   15   2HB   LYS   2          2HB       LYS   2  10.167   6.822  -0.717
   16   1HG   LYS   2          1HG       LYS   2  10.064   7.695  -2.924
   17   2HG   LYS   2          2HG       LYS   2   9.316   9.192  -2.405
   18   1HD   LYS   2          1HD       LYS   2  11.327  10.161  -1.806
   19   2HD   LYS   2          2HD       LYS   2  12.009   8.652  -1.229
   20   1HE   LYS   2          1HE       LYS   2  11.716   8.209  -3.989
   21   2HE   LYS   2          2HE       LYS   2  12.199   9.892  -3.903
   22   1HZ   LYS   2          1HZ       LYS   2  13.943   7.995  -3.866
   23   2HZ   LYS   2          2HZ       LYS   2  14.178   9.346  -2.980
   24   3HZ   LYS   2          3HZ       LYS   2  13.638   7.982  -2.263
   25    H    CYS   3           H        CYS   3   7.700   5.104  -1.138
   26    HA   CYS   3           HA       CYS   3   7.355   4.542   1.702
   27   1HB   CYS   3          1HB       CYS   3   5.357   4.112  -0.474
   28   2HB   CYS   3          2HB       CYS   3   5.491   2.894   0.778
   29    H    ASN   4           H        ASN   4   7.248   1.952   1.901
   30    HA   ASN   4           HA       ASN   4   9.594   1.055   0.577
   31   1HB   ASN   4          1HB       ASN   4   7.749  -0.693   2.256
   32   2HB   ASN   4          2HB       ASN   4   9.488  -0.819   2.081
   33   1HD2  ASN   4          1HD2      ASN   4   7.132   0.011   4.137
   34   2HD2  ASN   4          2HD2      ASN   4   7.924   1.178   5.142
   35    H    LYS   5           H        LYS   5   9.548  -1.283  -0.435
   36    HA   LYS   5           HA       LYS   5   7.274  -1.381  -2.250
   37   1HB   LYS   5          1HB       LYS   5   9.989  -2.732  -2.317
   38   2HB   LYS   5          2HB       LYS   5   8.737  -2.963  -3.520
   39   1HG   LYS   5          1HG       LYS   5   9.936  -0.250  -2.784
   40   2HG   LYS   5          2HG       LYS   5  10.438  -1.210  -4.161
   41   1HD   LYS   5          1HD       LYS   5   7.649  -0.060  -3.687
   42   2HD   LYS   5          2HD       LYS   5   8.811   0.501  -4.873
   43   1HE   LYS   5          1HE       LYS   5   8.569  -2.277  -5.379
   44   2HE   LYS   5          2HE       LYS   5   6.932  -1.746  -5.044
   45   1HZ   LYS   5          1HZ       LYS   5   7.818   0.195  -6.625
   46   2HZ   LYS   5          2HZ       LYS   5   8.635  -1.077  -7.241
   47   3HZ   LYS   5          3HZ       LYS   5   7.005  -1.117  -7.161
   48    H    LEU   6           H        LEU   6   7.492  -4.189  -2.889
   49    HA   LEU   6           HA       LEU   6   5.621  -5.279  -1.291
   50   1HB   LEU   6          1HB       LEU   6   6.971  -6.072  -3.463
   51   2HB   LEU   6          2HB       LEU   6   7.745  -7.106  -2.278
   52    HG   LEU   6           HG       LEU   6   4.839  -7.145  -2.009
   53   1HD1  LEU   6          1HD1      LEU   6   5.660  -8.526  -4.506
   54   2HD1  LEU   6          2HD1      LEU   6   4.105  -7.788  -4.051
   55   3HD1  LEU   6          3HD1      LEU   6   5.454  -6.761  -4.593
   56   1HD2  LEU   6          1HD2      LEU   6   6.612  -8.736  -1.073
   57   2HD2  LEU   6          2HD2      LEU   6   5.145  -9.457  -1.778
   58   3HD2  LEU   6          3HD2      LEU   6   6.664  -9.443  -2.706
   59    H    VAL   7           H        VAL   7   9.132  -5.046  -0.673
   60    HA   VAL   7           HA       VAL   7   8.574  -5.963   2.049
   61    HB   VAL   7           HB       VAL   7  11.121  -6.725   0.667
   62   1HG1  VAL   7          1HG1      VAL   7   9.518  -7.818   2.997
   63   2HG1  VAL   7          2HG1      VAL   7  10.929  -8.647   2.296
   64   3HG1  VAL   7          3HG1      VAL   7  11.118  -7.039   3.036
   65   1HG2  VAL   7          1HG2      VAL   7   8.528  -8.303   0.538
   66   2HG2  VAL   7          2HG2      VAL   7   9.374  -7.543  -0.832
   67   3HG2  VAL   7          3HG2      VAL   7  10.130  -8.898   0.041
   68    HA   PRO   8           HA       PRO   8  10.504  -2.204   3.066
   69   1HB   PRO   8          1HB       PRO   8  11.371  -3.571   5.622
   70   2HB   PRO   8          2HB       PRO   8  10.383  -2.118   5.402
   71   1HG   PRO   8          1HG       PRO   8   9.180  -4.458   6.121
   72   2HG   PRO   8          2HG       PRO   8   8.406  -3.438   4.885
   73   1HD   PRO   8          1HD       PRO   8  10.204  -5.896   4.389
   74   2HD   PRO   8          2HD       PRO   8   8.568  -5.573   3.753
   75    H    ILE   9           H        ILE   9  12.445  -4.599   1.964
   76    HA   ILE   9           HA       ILE   9  14.934  -3.495   2.985
   77    HB   ILE   9           HB       ILE   9  14.939  -5.822   2.990
   78   1HG1  ILE   9          1HG1      ILE   9  16.626  -6.452   1.271
   79   2HG1  ILE   9          2HG1      ILE   9  16.347  -4.927   0.457
   80   1HG2  ILE   9          1HG2      ILE   9  13.577  -5.617   0.316
   81   2HG2  ILE   9          2HG2      ILE   9  14.437  -7.101   0.794
   82   3HG2  ILE   9          3HG2      ILE   9  13.080  -6.502   1.778
   83   1HD1  ILE   9          1HD1      ILE   9  16.763  -4.230   3.174
   84   2HD1  ILE   9          2HD1      ILE   9  17.980  -5.476   2.808
   85   3HD1  ILE   9          3HD1      ILE   9  17.896  -3.996   1.822
   86    H    ALA  10           H        ALA  10  12.662  -2.836   0.569
   87    HA   ALA  10           HA       ALA  10  14.575  -1.160  -0.791
   88   1HB   ALA  10          1HB       ALA  10  13.995  -3.729  -1.824
   89   2HB   ALA  10          2HB       ALA  10  13.054  -2.583  -2.810
   90   3HB   ALA  10          3HB       ALA  10  14.817  -2.387  -2.658
   91    H    TYR  11           H        TYR  11  13.595   0.788  -0.991
   92    HA   TYR  11           HA       TYR  11  10.663   0.770  -1.252
   93   1HB   TYR  11          1HB       TYR  11  10.791   2.854   0.133
   94   2HB   TYR  11          2HB       TYR  11  11.587   1.545   0.985
   95    HD1  TYR  11           HD1      TYR  11  12.076   4.719  -0.800
   96    HD2  TYR  11           HD2      TYR  11  14.022   1.518   1.265
   97    HE1  TYR  11           HE1      TYR  11  14.190   6.117  -0.613
   98    HE2  TYR  11           HE2      TYR  11  16.131   2.927   1.446
   99    HH   TYR  11           HH       TYR  11  16.138   6.247   0.829
  100    H    LYS  12           H        LYS  12   9.735   2.560  -2.479
  101    HA   LYS  12           HA       LYS  12  11.672   3.981  -4.144
  102   1HB   LYS  12          1HB       LYS  12   9.306   2.413  -5.213
  103   2HB   LYS  12          2HB       LYS  12  10.322   3.485  -6.155
  104   1HG   LYS  12          1HG       LYS  12  12.099   1.730  -4.760
  105   2HG   LYS  12          2HG       LYS  12  10.810   0.721  -5.387
  106   1HD   LYS  12          1HD       LYS  12  11.147   1.703  -7.664
  107   2HD   LYS  12          2HD       LYS  12  12.432   2.717  -7.039
  108   1HE   LYS  12          1HE       LYS  12  13.723   0.950  -7.807
  109   2HE   LYS  12          2HE       LYS  12  13.414   0.365  -6.184
  110   1HZ   LYS  12          1HZ       LYS  12  12.880  -1.351  -7.662
  111   2HZ   LYS  12          2HZ       LYS  12  11.443  -0.775  -7.141
  112   3HZ   LYS  12          3HZ       LYS  12  11.986  -0.388  -8.631
  113    H    THR  13           H        THR  13   9.788   5.322  -5.767
  114    HA   THR  13           HA       THR  13   8.415   6.914  -3.710
  115    HB   THR  13           HB       THR  13   9.729   8.517  -4.716
  116    HG1  THR  13           HG1      THR  13   8.652   9.115  -6.873
  117   1HG2  THR  13          1HG2      THR  13   9.811   6.783  -7.241
  118   2HG2  THR  13          2HG2      THR  13  10.759   8.262  -6.955
  119   3HG2  THR  13          3HG2      THR  13  11.076   6.801  -5.989
  120    H    CYS  14           H        CYS  14   6.286   7.700  -4.084
  121    HA   CYS  14           HA       CYS  14   4.687   5.758  -5.401
  122   1HB   CYS  14          1HB       CYS  14   3.870   8.404  -4.184
  123   2HB   CYS  14          2HB       CYS  14   2.799   7.093  -4.635
  124    HA   PRO  15           HA       PRO  15   5.390   7.733  -9.364
  125   1HB   PRO  15          1HB       PRO  15   3.387   6.164 -10.649
  126   2HB   PRO  15          2HB       PRO  15   5.103   5.755 -10.496
  127   1HG   PRO  15          1HG       PRO  15   2.710   4.882  -8.747
  128   2HG   PRO  15          2HG       PRO  15   4.107   3.934  -9.307
  129   1HD   PRO  15          1HD       PRO  15   4.085   4.865  -6.749
  130   2HD   PRO  15          2HD       PRO  15   5.605   4.820  -7.683
  131    H    GLU  16           H        GLU  16   3.927   8.525 -11.323
  132    HA   GLU  16           HA       GLU  16   2.551  10.718 -10.355
  133   1HB   GLU  16          1HB       GLU  16   2.604   9.414 -13.107
  134   2HB   GLU  16          2HB       GLU  16   1.798  10.938 -12.797
  135   1HG   GLU  16          1HG       GLU  16   4.504  10.951 -11.668
  136   2HG   GLU  16          2HG       GLU  16   4.547  10.549 -13.374
  137    H    GLY  17           H        GLY  17   0.342  11.202 -10.096
  138   1HA   GLY  17          1HA       GLY  17  -1.934  10.793 -10.316
  139   2HA   GLY  17          2HA       GLY  17  -1.612   9.133 -10.778
  140    H    LYS  18           H        LYS  18   0.397   8.764  -8.529
  141    HA   LYS  18           HA       LYS  18  -1.581   8.141  -6.509
  142   1HB   LYS  18          1HB       LYS  18   1.249   7.307  -7.077
  143   2HB   LYS  18          2HB       LYS  18   0.587   7.077  -5.471
  144   1HG   LYS  18          1HG       LYS  18  -0.665   5.307  -6.150
  145   2HG   LYS  18          2HG       LYS  18  -1.354   6.220  -7.478
  146   1HD   LYS  18          1HD       LYS  18   0.939   5.830  -8.680
  147   2HD   LYS  18          2HD       LYS  18   1.228   4.612  -7.454
  148   1HE   LYS  18          1HE       LYS  18  -1.163   3.709  -8.130
  149   2HE   LYS  18          2HE       LYS  18  -0.938   4.666  -9.580
  150   1HZ   LYS  18          1HZ       LYS  18  -0.089   2.237  -9.434
  151   2HZ   LYS  18          2HZ       LYS  18   0.762   3.359 -10.260
  152   3HZ   LYS  18          3HZ       LYS  18   1.229   2.923  -8.758
  153    H    ASN  19           H        ASN  19  -1.199   8.680  -4.206
  154    HA   ASN  19           HA       ASN  19   0.532  10.961  -3.841
  155   1HB   ASN  19          1HB       ASN  19  -1.569  12.077  -4.323
  156   2HB   ASN  19          2HB       ASN  19  -2.483  10.934  -3.361
  157   1HD2  ASN  19          1HD2      ASN  19  -3.371  12.211  -1.879
  158   2HD2  ASN  19          2HD2      ASN  19  -2.516  13.193  -0.735
  159    H    LEU  20           H        LEU  20  -1.898   8.637  -2.479
  160    HA   LEU  20           HA       LEU  20  -0.465   8.708   0.071
  161   1HB   LEU  20          1HB       LEU  20  -3.148   7.465  -0.522
  162   2HB   LEU  20          2HB       LEU  20  -2.429   7.768   1.047
  163    HG   LEU  20           HG       LEU  20  -3.121  10.003  -0.867
  164   1HD1  LEU  20          1HD1      LEU  20  -5.290   9.801  -0.461
  165   2HD1  LEU  20          2HD1      LEU  20  -4.966   8.266   0.379
  166   3HD1  LEU  20          3HD1      LEU  20  -5.001   9.793   1.294
  167   1HD2  LEU  20          1HD2      LEU  20  -1.523  10.190   1.224
  168   2HD2  LEU  20          2HD2      LEU  20  -2.708  11.463   0.848
  169   3HD2  LEU  20          3HD2      LEU  20  -3.064  10.262   2.112
  170    H    CYS  21           H        CYS  21  -0.360   6.468   1.199
  171    HA   CYS  21           HA       CYS  21   0.647   4.609  -0.815
  172   1HB   CYS  21          1HB       CYS  21   1.402   5.214   2.011
  173   2HB   CYS  21          2HB       CYS  21   1.648   3.584   1.416
  174    H    TYR  22           H        TYR  22  -0.015   2.367  -0.708
  175    HA   TYR  22           HA       TYR  22  -2.217   1.817   1.151
  176   1HB   TYR  22          1HB       TYR  22  -3.577   1.138  -0.705
  177   2HB   TYR  22          2HB       TYR  22  -2.739   2.522  -1.377
  178    HD1  TYR  22           HD1      TYR  22  -0.438   1.964  -2.590
  179    HD2  TYR  22           HD2      TYR  22  -3.570  -0.865  -1.893
  180    HE1  TYR  22           HE1      TYR  22   0.454   0.503  -4.469
  181    HE2  TYR  22           HE2      TYR  22  -2.667  -2.317  -3.774
  182    HH   TYR  22           HH       TYR  22   0.302  -1.405  -5.488
  183    H    LYS  23           H        LYS  23  -2.216  -0.246   2.012
  184    HA   LYS  23           HA       LYS  23  -0.371  -2.167   0.804
  185   1HB   LYS  23          1HB       LYS  23   1.035  -2.186   2.528
  186   2HB   LYS  23          2HB       LYS  23   0.255  -0.727   3.104
  187   1HG   LYS  23          1HG       LYS  23  -1.446  -2.191   4.311
  188   2HG   LYS  23          2HG       LYS  23  -0.504  -3.592   3.838
  189   1HD   LYS  23          1HD       LYS  23   1.262  -3.077   5.275
  190   2HD   LYS  23          2HD       LYS  23   0.981  -1.350   5.187
  191   1HE   LYS  23          1HE       LYS  23  -1.375  -2.366   6.369
  192   2HE   LYS  23          2HE       LYS  23  -0.093  -3.314   7.097
  193   1HZ   LYS  23          1HZ       LYS  23   0.757  -1.512   8.097
  194   2HZ   LYS  23          2HZ       LYS  23   0.383  -0.478   6.889
  195   3HZ   LYS  23          3HZ       LYS  23  -0.765  -0.937   7.955
  196    H    MET  24           H        MET  24  -1.387  -4.061   0.422
  197    HA   MET  24           HA       MET  24  -3.872  -4.480   1.878
  198   1HB   MET  24          1HB       MET  24  -2.969  -5.988  -0.617
  199   2HB   MET  24          2HB       MET  24  -4.608  -5.737  -0.048
  200   1HG   MET  24          1HG       MET  24  -4.305  -3.242  -0.486
  201   2HG   MET  24          2HG       MET  24  -2.750  -3.606  -1.207
  202   1HE   MET  24          1HE       MET  24  -5.586  -2.409  -1.793
  203   2HE   MET  24          2HE       MET  24  -5.436  -2.451  -3.567
  204   3HE   MET  24          3HE       MET  24  -6.698  -3.409  -2.756
  205    H    PHE  25           H        PHE  25  -4.051  -6.162   3.314
  206    HA   PHE  25           HA       PHE  25  -1.875  -8.133   3.257
  207   1HB   PHE  25          1HB       PHE  25  -3.549  -6.784   5.436
  208   2HB   PHE  25          2HB       PHE  25  -2.733  -8.297   5.778
  209    HD1  PHE  25           HD1      PHE  25  -1.767  -6.663   7.589
  210    HD2  PHE  25           HD2      PHE  25  -0.824  -6.463   3.456
  211    HE1  PHE  25           HE1      PHE  25   0.336  -5.404   8.131
  212    HE2  PHE  25           HE2      PHE  25   1.280  -5.204   3.998
  213    HZ   PHE  25           HZ       PHE  25   1.834  -4.691   6.328
  214    H    MET  26           H        MET  26  -2.396 -10.300   3.169
  215    HA   MET  26           HA       MET  26  -5.079 -10.912   2.528
  216   1HB   MET  26          1HB       MET  26  -2.588 -12.633   3.026
  217   2HB   MET  26          2HB       MET  26  -4.101 -13.292   2.437
  218   1HG   MET  26          1HG       MET  26  -3.978 -12.013   0.385
  219   2HG   MET  26          2HG       MET  26  -2.695 -10.996   1.009
  220   1HE   MET  26          1HE       MET  26  -2.289 -14.854  -1.223
  221   2HE   MET  26          2HE       MET  26  -3.673 -14.631  -0.127
  222   3HE   MET  26          3HE       MET  26  -3.376 -13.460  -1.434
  223    H    MET  27           H        MET  27  -6.512 -12.406   3.650
  224    HA   MET  27           HA       MET  27  -6.602 -11.945   6.380
  225   1HB   MET  27          1HB       MET  27  -8.004 -13.753   4.395
  226   2HB   MET  27          2HB       MET  27  -8.260 -14.081   6.097
  227   1HG   MET  27          1HG       MET  27  -8.535 -11.224   5.159
  228   2HG   MET  27          2HG       MET  27  -9.815 -12.347   4.745
  229   1HE   MET  27          1HE       MET  27 -10.228  -9.893   6.205
  230   2HE   MET  27          2HE       MET  27 -10.716 -10.045   7.910
  231   3HE   MET  27          3HE       MET  27  -9.008  -9.767   7.495
  232    H    SER  28           H        SER  28  -5.133 -14.538   4.436
  233    HA   SER  28           HA       SER  28  -4.891 -16.354   6.561
  234   1HB   SER  28          1HB       SER  28  -4.765 -17.268   4.371
  235   2HB   SER  28          2HB       SER  28  -3.605 -16.071   3.832
  236    HG   SER  28           HG       SER  28  -3.088 -18.157   5.778
  237    H    ASP  29           H        ASP  29  -1.918 -15.477   4.824
  238    HA   ASP  29           HA       ASP  29  -0.547 -15.237   7.271
  239   1HB   ASP  29          1HB       ASP  29   0.245 -16.000   4.848
  240   2HB   ASP  29          2HB       ASP  29   0.560 -14.292   4.612
  241    H    LEU  30           H        LEU  30  -1.719 -13.371   8.254
  242    HA   LEU  30           HA       LEU  30  -1.719 -10.863   6.892
  243   1HB   LEU  30          1HB       LEU  30  -2.437 -11.736   9.688
  244   2HB   LEU  30          2HB       LEU  30  -2.506 -10.062   9.170
  245    HG   LEU  30           HG       LEU  30  -3.973 -12.139   7.575
  246   1HD1  LEU  30          1HD1      LEU  30  -5.734 -12.371   9.015
  247   2HD1  LEU  30          2HD1      LEU  30  -4.393 -12.267  10.181
  248   3HD1  LEU  30          3HD1      LEU  30  -5.401 -10.837   9.855
  249   1HD2  LEU  30          1HD2      LEU  30  -5.381 -10.352   6.944
  250   2HD2  LEU  30          2HD2      LEU  30  -4.776  -9.305   8.251
  251   3HD2  LEU  30          3HD2      LEU  30  -3.721  -9.713   6.876
  252    H    THR  31           H        THR  31   0.611 -12.706   8.628
  253    HA   THR  31           HA       THR  31   2.050 -10.369   9.584
  254    HB   THR  31           HB       THR  31   1.914 -12.404  10.990
  255    HG1  THR  31           HG1      THR  31   3.916 -11.206  11.029
  256   1HG2  THR  31          1HG2      THR  31   3.192 -14.448  10.236
  257   2HG2  THR  31          2HG2      THR  31   1.729 -14.169   9.263
  258   3HG2  THR  31          3HG2      THR  31   3.327 -13.727   8.615
  259    H    ILE  32           H        ILE  32   1.548 -11.612   6.589
  260    HA   ILE  32           HA       ILE  32   4.123 -10.595   5.712
  261    HB   ILE  32           HB       ILE  32   3.236 -13.417   5.487
  262   1HG1  ILE  32          1HG1      ILE  32   5.095 -12.808   6.939
  263   2HG1  ILE  32          2HG1      ILE  32   5.640 -13.829   5.623
  264   1HG2  ILE  32          1HG2      ILE  32   3.117 -13.186   3.219
  265   2HG2  ILE  32          2HG2      ILE  32   4.244 -11.808   3.181
  266   3HG2  ILE  32          3HG2      ILE  32   4.866 -13.462   3.399
  267   1HD1  ILE  32          1HD1      ILE  32   6.580 -11.215   6.332
  268   2HD1  ILE  32          2HD1      ILE  32   7.127 -12.247   4.989
  269   3HD1  ILE  32          3HD1      ILE  32   5.800 -11.086   4.737
  270    HA   PRO  33           HA       PRO  33   0.917  -8.494   3.436
  271   1HB   PRO  33          1HB       PRO  33   3.450  -7.355   2.170
  272   2HB   PRO  33          2HB       PRO  33   1.989  -6.506   2.702
  273   1HG   PRO  33          1HG       PRO  33   4.204  -6.455   4.286
  274   2HG   PRO  33          2HG       PRO  33   2.618  -6.723   5.046
  275   1HD   PRO  33          1HD       PRO  33   4.742  -8.832   4.376
  276   2HD   PRO  33          2HD       PRO  33   3.759  -8.656   5.855
  277    H    VAL  34           H        VAL  34   0.233  -8.016   1.169
  278    HA   VAL  34           HA       VAL  34   1.208 -10.099  -0.662
  279    HB   VAL  34           HB       VAL  34  -0.910 -10.791   0.162
  280   1HG1  VAL  34          1HG1      VAL  34  -1.784  -7.941  -0.360
  281   2HG1  VAL  34          2HG1      VAL  34  -2.946  -9.275  -0.160
  282   3HG1  VAL  34          3HG1      VAL  34  -1.832  -8.859   1.166
  283   1HG2  VAL  34          1HG2      VAL  34  -0.473 -10.117  -2.575
  284   2HG2  VAL  34          2HG2      VAL  34  -1.470 -11.427  -1.898
  285   3HG2  VAL  34          3HG2      VAL  34  -2.191  -9.830  -2.208
  286    H    LYS  35           H        LYS  35  -0.109  -6.798  -0.168
  287    HA   LYS  35           HA       LYS  35   1.137  -6.069  -2.707
  288   1HB   LYS  35          1HB       LYS  35  -1.616  -5.077  -1.944
  289   2HB   LYS  35          2HB       LYS  35  -0.762  -4.835  -3.454
  290   1HG   LYS  35          1HG       LYS  35  -0.759  -7.596  -3.285
  291   2HG   LYS  35          2HG       LYS  35  -2.275  -7.216  -2.495
  292   1HD   LYS  35          1HD       LYS  35  -2.218  -5.521  -4.762
  293   2HD   LYS  35          2HD       LYS  35  -1.575  -7.045  -5.339
  294   1HE   LYS  35          1HE       LYS  35  -3.596  -8.181  -4.190
  295   2HE   LYS  35          2HE       LYS  35  -4.261  -6.575  -3.971
  296   1HZ   LYS  35          1HZ       LYS  35  -4.896  -6.583  -6.064
  297   2HZ   LYS  35          2HZ       LYS  35  -3.388  -6.888  -6.612
  298   3HZ   LYS  35          3HZ       LYS  35  -4.383  -8.124  -6.227
  299    H    ARG  36           H        ARG  36   2.294  -4.177  -2.602
  300    HA   ARG  36           HA       ARG  36   1.707  -2.372  -0.458
  301   1HB   ARG  36          1HB       ARG  36   4.212  -4.056  -0.602
  302   2HB   ARG  36          2HB       ARG  36   4.377  -2.404  -0.044
  303   1HG   ARG  36          1HG       ARG  36   2.113  -3.366   1.343
  304   2HG   ARG  36          2HG       ARG  36   3.216  -4.728   1.337
  305   1HD   ARG  36          1HD       ARG  36   4.659  -2.242   1.916
  306   2HD   ARG  36          2HD       ARG  36   3.324  -2.453   3.033
  307    HE   ARG  36           HE       ARG  36   4.897  -4.895   2.641
  308   1HH1  ARG  36          1HH1      ARG  36   4.617  -1.908   4.481
  309   2HH1  ARG  36          2HH1      ARG  36   5.526  -2.505   5.830
  310   1HH2  ARG  36          1HH2      ARG  36   6.097  -5.682   4.420
  311   2HH2  ARG  36          2HH2      ARG  36   6.374  -4.665   5.795
  312    H    GLY  37           H        GLY  37   1.524  -0.482  -1.631
  313   1HA   GLY  37          1HA       GLY  37   3.785   0.460  -3.148
  314   2HA   GLY  37          2HA       GLY  37   2.398   0.054  -4.139
  315    H    CYS  38           H        CYS  38   1.674   2.091  -4.754
  316    HA   CYS  38           HA       CYS  38   0.785   3.779  -2.535
  317   1HB   CYS  38          1HB       CYS  38   1.953   4.831  -5.117
  318   2HB   CYS  38          2HB       CYS  38   1.397   5.772  -3.747
  319    H    ILE  39           H        ILE  39  -1.039   5.296  -3.301
  320    HA   ILE  39           HA       ILE  39  -2.384   4.458  -5.709
  321    HB   ILE  39           HB       ILE  39  -2.983   2.843  -3.804
  322   1HG1  ILE  39          1HG1      ILE  39  -5.563   3.817  -4.713
  323   2HG1  ILE  39          2HG1      ILE  39  -4.391   3.851  -6.016
  324   1HG2  ILE  39          1HG2      ILE  39  -3.311   4.874  -2.212
  325   2HG2  ILE  39          2HG2      ILE  39  -4.922   4.978  -2.961
  326   3HG2  ILE  39          3HG2      ILE  39  -4.428   3.491  -2.117
  327   1HD1  ILE  39          1HD1      ILE  39  -5.712   1.641  -5.624
  328   2HD1  ILE  39          2HD1      ILE  39  -3.952   1.519  -5.859
  329   3HD1  ILE  39          3HD1      ILE  39  -4.640   1.412  -4.222
  330    H    ASP  40           H        ASP  40  -4.460   5.831  -5.984
  331    HA   ASP  40           HA       ASP  40  -3.706   8.495  -5.185
  332   1HB   ASP  40          1HB       ASP  40  -6.114   8.437  -6.775
  333   2HB   ASP  40          2HB       ASP  40  -4.535   9.052  -7.220
  334    H    VAL  41           H        VAL  41  -6.334   6.050  -4.924
  335    HA   VAL  41           HA       VAL  41  -7.595   7.751  -2.889
  336    HB   VAL  41           HB       VAL  41  -9.273   5.861  -4.437
  337   1HG1  VAL  41          1HG1      VAL  41 -10.616   8.220  -4.310
  338   2HG1  VAL  41          2HG1      VAL  41 -10.649   6.981  -3.032
  339   3HG1  VAL  41          3HG1      VAL  41  -9.551   8.375  -2.892
  340   1HG2  VAL  41          1HG2      VAL  41  -9.611   7.460  -6.279
  341   2HG2  VAL  41          2HG2      VAL  41  -8.311   8.486  -5.625
  342   3HG2  VAL  41          3HG2      VAL  41  -7.938   6.856  -6.233
  343    H    CYS  42           H        CYS  42  -7.948   6.771  -0.934
  344    HA   CYS  42           HA       CYS  42  -6.700   4.324  -0.442
  345   1HB   CYS  42          1HB       CYS  42  -6.811   5.830   1.344
  346   2HB   CYS  42          2HB       CYS  42  -8.532   6.096   1.149
  347    HA   PRO  43           HA       PRO  43 -10.129   2.018  -2.192
  348   1HB   PRO  43          1HB       PRO  43  -8.286  -0.313  -1.658
  349   2HB   PRO  43          2HB       PRO  43  -9.059   0.188  -3.172
  350   1HG   PRO  43          1HG       PRO  43  -6.387   0.636  -2.803
  351   2HG   PRO  43          2HG       PRO  43  -7.382   1.902  -3.560
  352   1HD   PRO  43          1HD       PRO  43  -6.555   1.736  -0.590
  353   2HD   PRO  43          2HD       PRO  43  -6.341   3.095  -1.726
  354    H    LYS  44           H        LYS  44 -11.733   0.424  -1.687
  355    HA   LYS  44           HA       LYS  44 -12.280   0.306   1.114
  356   1HB   LYS  44          1HB       LYS  44 -13.797  -1.010  -1.153
  357   2HB   LYS  44          2HB       LYS  44 -14.392  -0.632   0.451
  358   1HG   LYS  44          1HG       LYS  44 -13.893   1.837  -0.056
  359   2HG   LYS  44          2HG       LYS  44 -13.569   1.358  -1.711
  360   1HD   LYS  44          1HD       LYS  44 -15.944   0.194  -1.570
  361   2HD   LYS  44          2HD       LYS  44 -16.193   1.252  -0.195
  362   1HE   LYS  44          1HE       LYS  44 -15.396   3.177  -1.790
  363   2HE   LYS  44          2HE       LYS  44 -15.668   2.032  -3.088
  364   1HZ   LYS  44          1HZ       LYS  44 -17.864   2.165  -2.818
  365   2HZ   LYS  44          2HZ       LYS  44 -17.807   2.235  -1.187
  366   3HZ   LYS  44          3HZ       LYS  44 -17.549   3.583  -2.070
  367    H    ASN  45           H        ASN  45 -12.068  -1.403   2.522
  368    HA   ASN  45           HA       ASN  45 -10.357  -3.489   1.623
  369   1HB   ASN  45          1HB       ASN  45 -11.759  -3.334   4.331
  370   2HB   ASN  45          2HB       ASN  45 -10.235  -4.117   3.963
  371   1HD2  ASN  45          1HD2      ASN  45 -11.314  -1.760   5.684
  372   2HD2  ASN  45          2HD2      ASN  45 -10.133  -0.511   5.475
  373    H    SER  46           H        SER  46 -10.953  -5.868   2.221
  374    HA   SER  46           HA       SER  46 -13.830  -6.258   1.971
  375   1HB   SER  46          1HB       SER  46 -13.372  -8.199   0.467
  376   2HB   SER  46          2HB       SER  46 -12.861  -6.674  -0.229
  377    HG   SER  46           HG       SER  46 -10.798  -7.297  -0.182
  378    H    LEU  47           H        LEU  47 -14.133  -8.921   2.288
  379    HA   LEU  47           HA       LEU  47 -13.107  -9.340   4.955
  380   1HB   LEU  47          1HB       LEU  47 -15.118 -10.807   3.248
  381   2HB   LEU  47          2HB       LEU  47 -14.638 -11.333   4.849
  382    HG   LEU  47           HG       LEU  47 -15.810  -8.596   4.319
  383   1HD1  LEU  47          1HD1      LEU  47 -17.232 -11.189   4.947
  384   2HD1  LEU  47          2HD1      LEU  47 -17.952  -9.583   5.212
  385   3HD1  LEU  47          3HD1      LEU  47 -17.492 -10.094   3.569
  386   1HD2  LEU  47          1HD2      LEU  47 -15.086  -8.300   6.416
  387   2HD2  LEU  47          2HD2      LEU  47 -16.466  -9.324   6.878
  388   3HD2  LEU  47          3HD2      LEU  47 -14.849 -10.043   6.687
  389    H    LEU  48           H        LEU  48 -11.728  -9.663   2.025
  390    HA   LEU  48           HA       LEU  48 -10.550 -12.275   2.665
  391   1HB   LEU  48          1HB       LEU  48 -10.586 -10.822   0.017
  392   2HB   LEU  48          2HB       LEU  48  -9.952 -12.427   0.326
  393    HG   LEU  48           HG       LEU  48 -12.829 -11.911   0.964
  394   1HD1  LEU  48          1HD1      LEU  48 -13.429 -11.339  -1.091
  395   2HD1  LEU  48          2HD1      LEU  48 -11.728 -11.358  -1.613
  396   3HD1  LEU  48          3HD1      LEU  48 -12.709 -12.840  -1.720
  397   1HD2  LEU  48          1HD2      LEU  48 -12.861 -14.293  -0.134
  398   2HD2  LEU  48          2HD2      LEU  48 -11.110 -14.242   0.189
  399   3HD2  LEU  48          3HD2      LEU  48 -12.268 -14.069   1.529
  400    H    VAL  49           H        VAL  49  -9.774  -8.966   1.386
  401    HA   VAL  49           HA       VAL  49  -7.218  -9.204   2.803
  402    HB   VAL  49           HB       VAL  49  -6.596  -9.603   0.591
  403   1HG1  VAL  49          1HG1      VAL  49  -8.194  -9.253  -0.953
  404   2HG1  VAL  49          2HG1      VAL  49  -8.897  -7.886  -0.057
  405   3HG1  VAL  49          3HG1      VAL  49  -7.482  -7.628  -1.105
  406   1HG2  VAL  49          1HG2      VAL  49  -5.290  -7.671  -0.057
  407   2HG2  VAL  49          2HG2      VAL  49  -6.333  -6.594   0.900
  408   3HG2  VAL  49          3HG2      VAL  49  -5.304  -7.793   1.719
  409    H    LYS  50           H        LYS  50  -6.526  -7.320   3.851
  410    HA   LYS  50           HA       LYS  50  -8.536  -5.184   3.858
  411   1HB   LYS  50          1HB       LYS  50  -8.121  -6.468   5.984
  412   2HB   LYS  50          2HB       LYS  50  -6.488  -5.837   5.993
  413   1HG   LYS  50          1HG       LYS  50  -7.341  -4.057   7.129
  414   2HG   LYS  50          2HG       LYS  50  -7.984  -3.527   5.587
  415   1HD   LYS  50          1HD       LYS  50  -9.989  -3.588   6.712
  416   2HD   LYS  50          2HD       LYS  50  -9.946  -5.283   6.275
  417   1HE   LYS  50          1HE       LYS  50  -8.455  -5.337   8.590
  418   2HE   LYS  50          2HE       LYS  50  -9.532  -4.000   8.943
  419   1HZ   LYS  50          1HZ       LYS  50 -10.232  -6.440   9.389
  420   2HZ   LYS  50          2HZ       LYS  50 -11.333  -5.347   8.878
  421   3HZ   LYS  50          3HZ       LYS  50 -10.687  -6.412   7.821
  422    H    TYR  51           H        TYR  51  -7.995  -3.145   3.206
  423    HA   TYR  51           HA       TYR  51  -5.210  -2.797   2.353
  424   1HB   TYR  51          1HB       TYR  51  -7.787  -1.230   1.726
  425   2HB   TYR  51          2HB       TYR  51  -6.273  -1.093   0.855
  426    HD1  TYR  51           HD1      TYR  51  -9.213  -1.849  -0.075
  427    HD2  TYR  51           HD2      TYR  51  -5.653  -4.095   0.689
  428    HE1  TYR  51           HE1      TYR  51  -9.984  -3.640  -1.706
  429    HE2  TYR  51           HE2      TYR  51  -6.437  -5.879  -0.944
  430    HH   TYR  51           HH       TYR  51  -7.873  -6.318  -2.573
  431    H    VAL  52           H        VAL  52  -3.912  -1.495   3.540
  432    HA   VAL  52           HA       VAL  52  -5.243   0.412   5.330
  433    HB   VAL  52           HB       VAL  52  -2.752  -1.233   5.484
  434   1HG1  VAL  52          1HG1      VAL  52  -2.403   0.401   7.622
  435   2HG1  VAL  52          2HG1      VAL  52  -1.572   0.612   6.063
  436   3HG1  VAL  52          3HG1      VAL  52  -3.030   1.563   6.430
  437   1HG2  VAL  52          1HG2      VAL  52  -4.856  -0.496   7.545
  438   2HG2  VAL  52          2HG2      VAL  52  -4.857  -1.978   6.559
  439   3HG2  VAL  52          3HG2      VAL  52  -3.553  -1.693   7.736
  440    H    CYS  53           H        CYS  53  -5.242   2.478   4.629
  441    HA   CYS  53           HA       CYS  53  -3.257   3.221   2.649
  442   1HB   CYS  53          1HB       CYS  53  -5.556   4.905   3.636
  443   2HB   CYS  53          2HB       CYS  53  -4.623   5.103   2.166
  444    H    CYS  54           H        CYS  54  -1.806   5.019   2.992
  445    HA   CYS  54           HA       CYS  54  -1.836   6.230   5.621
  446   1HB   CYS  54          1HB       CYS  54   0.675   5.776   5.803
  447   2HB   CYS  54          2HB       CYS  54  -0.442   4.499   6.242
  448    H    ASN  55           H        ASN  55  -0.099   8.059   5.643
  449    HA   ASN  55           HA       ASN  55   0.304   8.999   2.915
  450   1HB   ASN  55          1HB       ASN  55   0.082  11.363   4.215
  451   2HB   ASN  55          2HB       ASN  55  -1.319  10.549   3.546
  452   1HD2  ASN  55          1HD2      ASN  55   0.736  10.278   6.449
  453   2HD2  ASN  55          2HD2      ASN  55  -0.542  10.208   7.615
  454    H    THR  56           H        THR  56   1.772   7.765   5.558
  455    HA   THR  56           HA       THR  56   3.877   9.781   5.798
  456    HB   THR  56           HB       THR  56   4.575   8.163   7.685
  457    HG1  THR  56           HG1      THR  56   3.320   6.327   7.784
  458   1HG2  THR  56          1HG2      THR  56   3.123  10.139   8.214
  459   2HG2  THR  56          2HG2      THR  56   1.688   9.191   7.756
  460   3HG2  THR  56          3HG2      THR  56   2.653   8.717   9.175
  461    H    ASP  57           H        ASP  57   6.175   9.011   5.801
  462    HA   ASP  57           HA       ASP  57   6.579   7.634   3.368
  463   1HB   ASP  57          1HB       ASP  57   8.812   8.143   5.334
  464   2HB   ASP  57          2HB       ASP  57   8.831   8.290   3.588
  465    H    ARG  58           H        ARG  58   7.990   5.641   3.186
  466    HA   ARG  58           HA       ARG  58   8.125   3.499   3.630
  467   1HB   ARG  58          1HB       ARG  58   9.425   4.716   6.116
  468   2HB   ARG  58          2HB       ARG  58   9.586   3.024   5.690
  469   1HG   ARG  58          1HG       ARG  58  10.665   3.598   3.560
  470   2HG   ARG  58          2HG       ARG  58  10.351   5.303   3.809
  471   1HD   ARG  58          1HD       ARG  58  11.844   3.950   6.021
  472   2HD   ARG  58          2HD       ARG  58  12.706   4.062   4.499
  473    HE   ARG  58           HE       ARG  58  11.760   6.613   4.759
  474   1HH1  ARG  58          1HH1      ARG  58  13.421   4.500   7.030
  475   2HH1  ARG  58          2HH1      ARG  58  14.168   5.803   7.893
  476   1HH2  ARG  58          1HH2      ARG  58  12.745   8.333   5.896
  477   2HH2  ARG  58          2HH2      ARG  58  13.781   7.997   7.244
  478    H    CYS  59           H        CYS  59   5.519   4.383   4.323
  479    HA   CYS  59           HA       CYS  59   4.937   3.413   6.965
  480   1HB   CYS  59          1HB       CYS  59   2.656   4.049   6.500
  481   2HB   CYS  59          2HB       CYS  59   3.754   5.355   6.099
  482    H    ASN  60           H        ASN  60   4.302   2.530   3.503
  483    HA   ASN  60           HA       ASN  60   3.408  -0.066   4.451
  484   1HB   ASN  60          1HB       ASN  60   2.322  -0.326   2.300
  485   2HB   ASN  60          2HB       ASN  60   1.977   1.311   2.821
  486   1HD2  ASN  60          1HD2      ASN  60   4.009  -0.700   0.775
  487   2HD2  ASN  60          2HD2      ASN  60   4.460   0.511  -0.379
  488   1H    HOH  61          1H        HOH  61  -0.698 -11.793   3.597
  489   2H    HOH  61          2H        HOH  61   0.088 -11.193   2.452
  Start of MODEL   20
    1   1H    LEU   1           H1       LEU   1   7.299  12.403  -1.199
    2    HA   LEU   1           HA       LEU   1   7.086  11.115   0.640
    3   1HB   LEU   1          1HB       LEU   1   4.870  11.584   1.149
    4   2HB   LEU   1          2HB       LEU   1   4.262  10.860  -0.327
    5    HG   LEU   1           HG       LEU   1   5.494   8.739   1.024
    6   1HD1  LEU   1          1HD1      LEU   1   5.669   9.520   3.145
    7   2HD1  LEU   1          2HD1      LEU   1   4.375  10.724   2.934
    8   3HD1  LEU   1          3HD1      LEU   1   3.964   9.013   3.204
    9   1HD2  LEU   1          1HD2      LEU   1   2.978   8.179   1.508
   10   2HD2  LEU   1          2HD2      LEU   1   2.676   9.606   0.487
   11   3HD2  LEU   1          3HD2      LEU   1   3.593   8.225  -0.162
   12    H    LYS   2           H        LYS   2   8.136   9.177   0.801
   13    HA   LYS   2           HA       LYS   2   7.882   7.411  -1.534
   14   1HB   LYS   2          1HB       LYS   2  10.331   7.929   0.180
   15   2HB   LYS   2          2HB       LYS   2  10.235   6.788  -1.146
   16   1HG   LYS   2          1HG       LYS   2  11.016   8.563  -2.381
   17   2HG   LYS   2          2HG       LYS   2   9.322   9.012  -2.432
   18   1HD   LYS   2          1HD       LYS   2   9.897  10.971  -1.441
   19   2HD   LYS   2          2HD       LYS   2  10.212  10.064   0.025
   20   1HE   LYS   2          1HE       LYS   2  12.575   9.602  -0.945
   21   2HE   LYS   2          2HE       LYS   2  12.209  10.820  -2.151
   22   1HZ   LYS   2          1HZ       LYS   2  12.007  12.439  -0.508
   23   2HZ   LYS   2          2HZ       LYS   2  11.928  11.360   0.715
   24   3HZ   LYS   2          3HZ       LYS   2  13.336  11.595  -0.077
   25    H    CYS   3           H        CYS   3   7.711   5.170  -1.165
   26    HA   CYS   3           HA       CYS   3   7.559   4.384   1.639
   27   1HB   CYS   3          1HB       CYS   3   5.382   4.202  -0.404
   28   2HB   CYS   3          2HB       CYS   3   5.547   2.908   0.767
   29    H    ASN   4           H        ASN   4   7.519   1.857   1.746
   30    HA   ASN   4           HA       ASN   4   9.636   0.962   0.109
   31   1HB   ASN   4          1HB       ASN   4   7.919  -0.887   1.800
   32   2HB   ASN   4          2HB       ASN   4   9.645  -0.968   1.512
   33   1HD2  ASN   4          1HD2      ASN   4  11.056   0.370   2.615
   34   2HD2  ASN   4          2HD2      ASN   4  10.620   1.233   4.052
   35    H    LYS   5           H        LYS   5   9.498  -1.023  -1.304
   36    HA   LYS   5           HA       LYS   5   6.909  -1.127  -2.641
   37   1HB   LYS   5          1HB       LYS   5   9.699  -1.949  -3.481
   38   2HB   LYS   5          2HB       LYS   5   8.267  -2.321  -4.420
   39   1HG   LYS   5          1HG       LYS   5   8.428   0.521  -3.563
   40   2HG   LYS   5          2HG       LYS   5   9.740   0.027  -4.614
   41   1HD   LYS   5          1HD       LYS   5   8.213   0.560  -6.260
   42   2HD   LYS   5          2HD       LYS   5   7.707  -1.096  -5.999
   43   1HE   LYS   5          1HE       LYS   5   5.635  -0.205  -5.627
   44   2HE   LYS   5          2HE       LYS   5   6.254   0.203  -4.039
   45   1HZ   LYS   5          1HZ       LYS   5   5.696   2.246  -4.703
   46   2HZ   LYS   5          2HZ       LYS   5   7.146   2.241  -5.455
   47   3HZ   LYS   5          3HZ       LYS   5   5.787   1.912  -6.298
   48    H    LEU   6           H        LEU   6   7.035  -3.665  -3.807
   49    HA   LEU   6           HA       LEU   6   5.833  -5.254  -1.991
   50   1HB   LEU   6          1HB       LEU   6   6.397  -5.439  -4.593
   51   2HB   LEU   6          2HB       LEU   6   7.583  -6.581  -3.994
   52    HG   LEU   6           HG       LEU   6   5.179  -7.255  -2.689
   53   1HD1  LEU   6          1HD1      LEU   6   4.734  -6.477  -5.568
   54   2HD1  LEU   6          2HD1      LEU   6   3.753  -7.727  -4.767
   55   3HD1  LEU   6          3HD1      LEU   6   3.769  -6.066  -4.130
   56   1HD2  LEU   6          1HD2      LEU   6   7.059  -8.434  -4.628
   57   2HD2  LEU   6          2HD2      LEU   6   6.365  -9.108  -3.135
   58   3HD2  LEU   6          3HD2      LEU   6   5.423  -9.134  -4.644
   59    H    VAL   7           H        VAL   7   9.374  -5.104  -2.707
   60    HA   VAL   7           HA       VAL   7   9.824  -6.861  -0.420
   61    HB   VAL   7           HB       VAL   7  11.366  -6.040  -2.845
   62   1HG1  VAL   7          1HG1      VAL   7  13.274  -7.425  -1.519
   63   2HG1  VAL   7          2HG1      VAL   7  13.180  -5.647  -1.537
   64   3HG1  VAL   7          3HG1      VAL   7  12.522  -6.559  -0.157
   65   1HG2  VAL   7          1HG2      VAL   7  10.618  -8.092  -3.371
   66   2HG2  VAL   7          2HG2      VAL   7  11.890  -8.689  -2.277
   67   3HG2  VAL   7          3HG2      VAL   7  10.225  -8.485  -1.681
   68    HA   PRO   8           HA       PRO   8  10.320  -3.062   1.838
   69   1HB   PRO   8          1HB       PRO   8  10.911  -5.028   4.066
   70   2HB   PRO   8          2HB       PRO   8   9.754  -3.686   4.027
   71   1HG   PRO   8          1HG       PRO   8   8.843  -6.245   3.782
   72   2HG   PRO   8          2HG       PRO   8   8.163  -4.986   2.724
   73   1HD   PRO   8          1HD       PRO   8  10.390  -6.998   2.011
   74   2HD   PRO   8          2HD       PRO   8   8.892  -6.631   1.113
   75    H    ILE   9           H        ILE   9  12.847  -4.750   0.635
   76    HA   ILE   9           HA       ILE   9  14.836  -3.667   2.468
   77    HB   ILE   9           HB       ILE   9  16.377  -5.098   1.466
   78   1HG1  ILE   9          1HG1      ILE   9  15.033  -6.393  -0.671
   79   2HG1  ILE   9          2HG1      ILE   9  14.818  -4.672  -0.917
   80   1HG2  ILE   9          1HG2      ILE   9  15.232  -7.330   1.452
   81   2HG2  ILE   9          2HG2      ILE   9  14.912  -6.327   2.888
   82   3HG2  ILE   9          3HG2      ILE   9  13.682  -6.467   1.608
   83   1HD1  ILE   9          1HD1      ILE   9  17.178  -4.255  -0.924
   84   2HD1  ILE   9          2HD1      ILE   9  17.537  -5.857  -0.234
   85   3HD1  ILE   9          3HD1      ILE   9  16.954  -5.720  -1.910
   86    H    ALA  10           H        ALA  10  12.978  -2.622  -0.114
   87    HA   ALA  10           HA       ALA  10  14.823  -0.464  -0.610
   88   1HB   ALA  10          1HB       ALA  10  15.721  -1.668  -2.361
   89   2HB   ALA  10          2HB       ALA  10  14.244  -2.632  -2.599
   90   3HB   ALA  10          3HB       ALA  10  14.317  -0.957  -3.194
   91    H    TYR  11           H        TYR  11  13.721   1.429  -1.145
   92    HA   TYR  11           HA       TYR  11  10.840   1.125  -1.637
   93   1HB   TYR  11          1HB       TYR  11  10.561   3.023  -0.024
   94   2HB   TYR  11          2HB       TYR  11  11.412   1.713   0.770
   95    HD1  TYR  11           HD1      TYR  11  11.907   4.998  -0.915
   96    HD2  TYR  11           HD2      TYR  11  13.581   2.035   1.678
   97    HE1  TYR  11           HE1      TYR  11  13.801   6.584  -0.312
   98    HE2  TYR  11           HE2      TYR  11  15.469   3.630   2.271
   99    HH   TYR  11           HH       TYR  11  15.425   6.961   1.175
  100    H    LYS  12           H        LYS  12   9.842   3.026  -2.688
  101    HA   LYS  12           HA       LYS  12  11.788   4.773  -3.992
  102   1HB   LYS  12          1HB       LYS  12   9.721   3.058  -5.387
  103   2HB   LYS  12          2HB       LYS  12  10.466   4.455  -6.138
  104   1HG   LYS  12          1HG       LYS  12  12.157   3.075  -6.770
  105   2HG   LYS  12          2HG       LYS  12  12.662   3.065  -5.091
  106   1HD   LYS  12          1HD       LYS  12  11.454   1.035  -4.623
  107   2HD   LYS  12          2HD       LYS  12  10.527   1.149  -6.107
  108   1HE   LYS  12          1HE       LYS  12  13.461   1.101  -6.558
  109   2HE   LYS  12          2HE       LYS  12  12.858  -0.344  -5.772
  110   1HZ   LYS  12          1HZ       LYS  12  12.518   0.478  -8.436
  111   2HZ   LYS  12          2HZ       LYS  12  12.194  -0.972  -7.759
  112   3HZ   LYS  12          3HZ       LYS  12  11.063   0.206  -7.747
  113    H    THR  13           H        THR  13   9.921   6.167  -5.605
  114    HA   THR  13           HA       THR  13   8.370   7.475  -3.486
  115    HB   THR  13           HB       THR  13   9.547   9.226  -4.410
  116    HG1  THR  13           HG1      THR  13   8.305  10.055  -6.229
  117   1HG2  THR  13          1HG2      THR  13   9.763   7.558  -6.973
  118   2HG2  THR  13          2HG2      THR  13  10.483   9.170  -6.746
  119   3HG2  THR  13          3HG2      THR  13  11.056   7.794  -5.771
  120    H    CYS  14           H        CYS  14   6.173   7.930  -3.682
  121    HA   CYS  14           HA       CYS  14   4.710   5.984  -5.049
  122   1HB   CYS  14          1HB       CYS  14   3.799   8.602  -3.836
  123   2HB   CYS  14          2HB       CYS  14   2.734   7.320  -4.379
  124    HA   PRO  15           HA       PRO  15   5.309   7.879  -9.070
  125   1HB   PRO  15          1HB       PRO  15   3.425   6.140 -10.314
  126   2HB   PRO  15          2HB       PRO  15   5.164   5.852 -10.140
  127   1HG   PRO  15          1HG       PRO  15   2.821   4.874  -8.377
  128   2HG   PRO  15          2HG       PRO  15   4.284   4.006  -8.899
  129   1HD   PRO  15          1HD       PRO  15   4.180   5.010  -6.372
  130   2HD   PRO  15          2HD       PRO  15   5.706   5.039  -7.296
  131    H    GLU  16           H        GLU  16   3.969   8.716 -10.981
  132    HA   GLU  16           HA       GLU  16   2.292  10.695 -10.012
  133   1HB   GLU  16          1HB       GLU  16   2.622   9.644 -12.857
  134   2HB   GLU  16          2HB       GLU  16   1.843  11.157 -12.438
  135   1HG   GLU  16          1HG       GLU  16   4.015  11.851 -11.274
  136   2HG   GLU  16          2HG       GLU  16   4.760  10.410 -11.936
  137    H    GLY  17           H        GLY  17   0.060  10.876  -9.802
  138   1HA   GLY  17          1HA       GLY  17  -2.136  10.262 -10.459
  139   2HA   GLY  17          2HA       GLY  17  -1.574   8.643 -10.822
  140    H    LYS  18           H        LYS  18   0.176   9.028  -8.169
  141    HA   LYS  18           HA       LYS  18  -2.003   8.666  -6.259
  142   1HB   LYS  18          1HB       LYS  18  -0.727   6.676  -5.330
  143   2HB   LYS  18          2HB       LYS  18  -1.597   6.421  -6.830
  144   1HG   LYS  18          1HG       LYS  18   0.758   7.173  -7.907
  145   2HG   LYS  18          2HG       LYS  18   1.376   6.614  -6.365
  146   1HD   LYS  18          1HD       LYS  18   1.295   4.495  -7.168
  147   2HD   LYS  18          2HD       LYS  18  -0.453   4.604  -7.156
  148   1HE   LYS  18          1HE       LYS  18   0.661   5.986  -9.493
  149   2HE   LYS  18          2HE       LYS  18   1.214   4.325  -9.429
  150   1HZ   LYS  18          1HZ       LYS  18  -1.191   3.768  -9.016
  151   2HZ   LYS  18          2HZ       LYS  18  -1.546   5.290  -9.489
  152   3HZ   LYS  18          3HZ       LYS  18  -0.808   4.265 -10.524
  153    H    ASN  19           H        ASN  19  -1.195   8.809  -3.965
  154    HA   ASN  19           HA       ASN  19   1.362  10.137  -3.781
  155   1HB   ASN  19          1HB       ASN  19  -0.138  12.042  -4.011
  156   2HB   ASN  19          2HB       ASN  19  -1.315  11.333  -2.923
  157   1HD2  ASN  19          1HD2      ASN  19   0.843  13.692  -3.150
  158   2HD2  ASN  19          2HD2      ASN  19   1.386  13.863  -1.515
  159    H    LEU  20           H        LEU  20  -1.633   8.827  -2.242
  160    HA   LEU  20           HA       LEU  20  -0.373   8.527   0.315
  161   1HB   LEU  20          1HB       LEU  20  -3.051   7.963  -0.874
  162   2HB   LEU  20          2HB       LEU  20  -2.596   7.122   0.595
  163    HG   LEU  20           HG       LEU  20  -2.233  10.084   0.548
  164   1HD1  LEU  20          1HD1      LEU  20  -4.573   9.256  -0.454
  165   2HD1  LEU  20          2HD1      LEU  20  -4.954   9.140   1.280
  166   3HD1  LEU  20          3HD1      LEU  20  -4.417  10.689   0.589
  167   1HD2  LEU  20          1HD2      LEU  20  -1.573   8.697   2.489
  168   2HD2  LEU  20          2HD2      LEU  20  -2.819   9.905   2.884
  169   3HD2  LEU  20          3HD2      LEU  20  -3.271   8.196   2.678
  170    H    CYS  21           H        CYS  21  -0.126   6.395   1.400
  171    HA   CYS  21           HA       CYS  21   0.834   4.459  -0.563
  172   1HB   CYS  21          1HB       CYS  21   1.584   5.020   2.299
  173   2HB   CYS  21          2HB       CYS  21   1.993   3.499   1.530
  174    H    TYR  22           H        TYR  22   0.132   2.249  -0.412
  175    HA   TYR  22           HA       TYR  22  -2.018   1.762   1.528
  176   1HB   TYR  22          1HB       TYR  22  -3.376   0.938  -0.290
  177   2HB   TYR  22          2HB       TYR  22  -2.618   2.355  -0.989
  178    HD1  TYR  22           HD1      TYR  22  -0.921   2.151  -2.727
  179    HD2  TYR  22           HD2      TYR  22  -2.672  -1.327  -0.955
  180    HE1  TYR  22           HE1      TYR  22   0.021   0.714  -4.600
  181    HE2  TYR  22           HE2      TYR  22  -1.724  -2.752  -2.835
  182    HH   TYR  22           HH       TYR  22  -0.974  -2.539  -5.050
  183    H    LYS  23           H        LYS  23  -2.110  -0.330   2.381
  184    HA   LYS  23           HA       LYS  23  -0.094  -2.194   1.351
  185   1HB   LYS  23          1HB       LYS  23   0.217  -2.842   3.828
  186   2HB   LYS  23          2HB       LYS  23   1.020  -1.406   3.229
  187   1HG   LYS  23          1HG       LYS  23  -1.719  -0.865   4.217
  188   2HG   LYS  23          2HG       LYS  23  -0.666  -1.521   5.454
  189   1HD   LYS  23          1HD       LYS  23   0.287   0.751   3.677
  190   2HD   LYS  23          2HD       LYS  23  -0.720   1.083   5.073
  191   1HE   LYS  23          1HE       LYS  23   1.766  -0.640   5.359
  192   2HE   LYS  23          2HE       LYS  23   1.900   1.107   5.350
  193   1HZ   LYS  23          1HZ       LYS  23   1.464   0.882   7.502
  194   2HZ   LYS  23          2HZ       LYS  23  -0.099   0.714   7.063
  195   3HZ   LYS  23          3HZ       LYS  23   0.813  -0.609   7.358
  196    H    MET  24           H        MET  24  -0.963  -4.121   0.805
  197    HA   MET  24           HA       MET  24  -3.640  -4.634   1.818
  198   1HB   MET  24          1HB       MET  24  -2.207  -6.080  -0.465
  199   2HB   MET  24          2HB       MET  24  -3.934  -5.998  -0.178
  200   1HG   MET  24          1HG       MET  24  -3.696  -3.422  -0.501
  201   2HG   MET  24          2HG       MET  24  -2.100  -3.762  -1.138
  202   1HE   MET  24          1HE       MET  24  -4.927  -3.041  -3.975
  203   2HE   MET  24          2HE       MET  24  -5.664  -3.125  -2.357
  204   3HE   MET  24          3HE       MET  24  -4.133  -2.249  -2.594
  205    H    PHE  25           H        PHE  25  -4.065  -6.375   3.145
  206    HA   PHE  25           HA       PHE  25  -1.904  -8.339   3.433
  207   1HB   PHE  25          1HB       PHE  25  -3.796  -7.251   5.598
  208   2HB   PHE  25          2HB       PHE  25  -2.410  -8.289   5.869
  209    HD1  PHE  25           HD1      PHE  25  -0.095  -7.308   5.160
  210    HD2  PHE  25           HD2      PHE  25  -3.562  -4.953   5.830
  211    HE1  PHE  25           HE1      PHE  25   1.348  -5.286   5.525
  212    HE2  PHE  25           HE2      PHE  25  -2.119  -2.932   6.195
  213    HZ   PHE  25           HZ       PHE  25   0.319  -3.122   6.038
  214    H    MET  26           H        MET  26  -2.583 -10.504   4.019
  215    HA   MET  26           HA       MET  26  -5.156 -11.088   2.929
  216   1HB   MET  26          1HB       MET  26  -2.924 -12.824   4.122
  217   2HB   MET  26          2HB       MET  26  -4.367 -13.490   3.384
  218   1HG   MET  26          1HG       MET  26  -3.743 -12.091   1.280
  219   2HG   MET  26          2HG       MET  26  -2.182 -11.846   2.038
  220   1HE   MET  26          1HE       MET  26  -4.125 -15.816   0.951
  221   2HE   MET  26          2HE       MET  26  -4.883 -14.231   1.241
  222   3HE   MET  26          3HE       MET  26  -4.079 -14.563  -0.313
  223    H    MET  27           H        MET  27  -6.624 -12.733   4.092
  224    HA   MET  27           HA       MET  27  -7.370 -11.625   6.533
  225   1HB   MET  27          1HB       MET  27  -8.129 -14.043   4.870
  226   2HB   MET  27          2HB       MET  27  -8.728 -13.975   6.516
  227   1HG   MET  27          1HG       MET  27  -9.043 -11.451   4.938
  228   2HG   MET  27          2HG       MET  27  -9.998 -12.808   4.377
  229   1HE   MET  27          1HE       MET  27  -9.827 -10.420   8.016
  230   2HE   MET  27          2HE       MET  27  -9.500 -10.065   6.303
  231   3HE   MET  27          3HE       MET  27 -11.140  -9.846   6.960
  232    H    SER  28           H        SER  28  -5.446 -14.524   5.647
  233    HA   SER  28           HA       SER  28  -5.435 -15.573   8.252
  234   1HB   SER  28          1HB       SER  28  -5.006 -17.043   6.381
  235   2HB   SER  28          2HB       SER  28  -3.688 -16.041   5.805
  236    HG   SER  28           HG       SER  28  -2.596 -16.558   7.910
  237    H    ASP  29           H        ASP  29  -2.280 -15.093   6.707
  238    HA   ASP  29           HA       ASP  29  -1.283 -13.960   9.089
  239   1HB   ASP  29          1HB       ASP  29  -0.121 -15.458   7.239
  240   2HB   ASP  29          2HB       ASP  29   0.174 -13.934   6.426
  241    H    LEU  30           H        LEU  30  -2.510 -11.923   9.266
  242    HA   LEU  30           HA       LEU  30  -2.449 -10.046   7.119
  243   1HB   LEU  30          1HB       LEU  30  -3.172  -9.493   9.988
  244   2HB   LEU  30          2HB       LEU  30  -3.700  -8.643   8.549
  245    HG   LEU  30           HG       LEU  30  -4.528 -11.330   8.216
  246   1HD1  LEU  30          1HD1      LEU  30  -4.102 -11.470  10.717
  247   2HD1  LEU  30          2HD1      LEU  30  -5.451 -10.325  10.911
  248   3HD1  LEU  30          3HD1      LEU  30  -5.733 -11.913  10.158
  249   1HD2  LEU  30          1HD2      LEU  30  -6.290 -10.224   7.453
  250   2HD2  LEU  30          2HD2      LEU  30  -6.681  -9.639   9.089
  251   3HD2  LEU  30          3HD2      LEU  30  -5.571  -8.710   8.052
  252    H    THR  31           H        THR  31  -0.175 -11.098   9.440
  253    HA   THR  31           HA       THR  31   1.109  -8.509   9.710
  254    HB   THR  31           HB       THR  31   1.047 -11.082  11.090
  255    HG1  THR  31           HG1      THR  31   1.270  -9.504  12.639
  256   1HG2  THR  31          1HG2      THR  31   3.453 -11.115  11.740
  257   2HG2  THR  31          2HG2      THR  31   3.279 -11.458  10.002
  258   3HG2  THR  31          3HG2      THR  31   3.797  -9.843  10.543
  259    H    ILE  32           H        ILE  32   1.021 -11.068   7.431
  260    HA   ILE  32           HA       ILE  32   3.672 -10.263   6.452
  261    HB   ILE  32           HB       ILE  32   2.223 -12.856   6.523
  262   1HG1  ILE  32          1HG1      ILE  32   5.156 -12.107   6.697
  263   2HG1  ILE  32          2HG1      ILE  32   4.084 -12.325   8.065
  264   1HG2  ILE  32          1HG2      ILE  32   2.337 -12.720   4.183
  265   2HG2  ILE  32          2HG2      ILE  32   3.937 -11.941   4.215
  266   3HG2  ILE  32          3HG2      ILE  32   3.775 -13.656   4.657
  267   1HD1  ILE  32          1HD1      ILE  32   5.073 -14.443   7.914
  268   2HD1  ILE  32          2HD1      ILE  32   3.592 -14.687   6.959
  269   3HD1  ILE  32          3HD1      ILE  32   5.144 -14.394   6.136
  270    HA   PRO  33           HA       PRO  33   1.028  -7.971   3.670
  271   1HB   PRO  33          1HB       PRO  33   3.791  -7.387   2.525
  272   2HB   PRO  33          2HB       PRO  33   2.459  -6.268   2.860
  273   1HG   PRO  33          1HG       PRO  33   4.568  -6.415   4.592
  274   2HG   PRO  33          2HG       PRO  33   2.917  -6.306   5.247
  275   1HD   PRO  33          1HD       PRO  33   4.650  -8.823   4.978
  276   2HD   PRO  33          2HD       PRO  33   3.627  -8.300   6.345
  277    H    VAL  34           H        VAL  34   0.136  -8.095   1.617
  278    HA   VAL  34           HA       VAL  34   1.155 -10.313  -0.015
  279    HB   VAL  34           HB       VAL  34  -1.029 -10.741   0.878
  280   1HG1  VAL  34          1HG1      VAL  34  -2.936  -9.144   0.045
  281   2HG1  VAL  34          2HG1      VAL  34  -1.992  -8.726   1.496
  282   3HG1  VAL  34          3HG1      VAL  34  -1.622  -7.947  -0.060
  283   1HG2  VAL  34          1HG2      VAL  34  -2.338 -10.449  -1.492
  284   2HG2  VAL  34          2HG2      VAL  34  -0.647 -10.276  -2.020
  285   3HG2  VAL  34          3HG2      VAL  34  -1.161 -11.740  -1.145
  286    H    LYS  35           H        LYS  35  -0.002  -6.915   0.034
  287    HA   LYS  35           HA       LYS  35   1.391  -6.537  -2.498
  288   1HB   LYS  35          1HB       LYS  35  -1.384  -5.409  -2.109
  289   2HB   LYS  35          2HB       LYS  35  -0.422  -5.458  -3.573
  290   1HG   LYS  35          1HG       LYS  35  -1.290  -8.006  -2.147
  291   2HG   LYS  35          2HG       LYS  35  -2.319  -7.217  -3.327
  292   1HD   LYS  35          1HD       LYS  35  -0.704  -7.522  -5.096
  293   2HD   LYS  35          2HD       LYS  35   0.567  -7.947  -3.967
  294   1HE   LYS  35          1HE       LYS  35  -0.053 -10.137  -3.963
  295   2HE   LYS  35          2HE       LYS  35  -1.722  -9.732  -3.616
  296   1HZ   LYS  35          1HZ       LYS  35  -2.223 -10.083  -5.717
  297   2HZ   LYS  35          2HZ       LYS  35  -1.090  -9.037  -6.257
  298   3HZ   LYS  35          3HZ       LYS  35  -0.699 -10.602  -5.998
  299    H    ARG  36           H        ARG  36   2.259  -4.430  -2.755
  300    HA   ARG  36           HA       ARG  36   1.712  -2.582  -0.619
  301   1HB   ARG  36          1HB       ARG  36   4.278  -4.070  -0.976
  302   2HB   ARG  36          2HB       ARG  36   4.468  -2.341  -0.760
  303   1HG   ARG  36          1HG       ARG  36   3.004  -2.485   1.304
  304   2HG   ARG  36          2HG       ARG  36   2.954  -4.226   1.109
  305   1HD   ARG  36          1HD       ARG  36   5.459  -4.309   1.285
  306   2HD   ARG  36          2HD       ARG  36   5.496  -2.571   1.506
  307    HE   ARG  36           HE       ARG  36   3.712  -3.863   3.411
  308   1HH1  ARG  36          1HH1      ARG  36   7.083  -3.097   2.756
  309   2HH1  ARG  36          2HH1      ARG  36   7.552  -3.144   4.424
  310   1HH2  ARG  36          1HH2      ARG  36   4.329  -3.925   5.611
  311   2HH2  ARG  36          2HH2      ARG  36   5.974  -3.619   6.058
  312    H    GLY  37           H        GLY  37   1.622  -0.496  -1.447
  313   1HA   GLY  37          1HA       GLY  37   3.339   0.492  -3.449
  314   2HA   GLY  37          2HA       GLY  37   1.836  -0.018  -4.192
  315    H    CYS  38           H        CYS  38   1.693   2.388  -4.678
  316    HA   CYS  38           HA       CYS  38   0.540   3.759  -2.357
  317   1HB   CYS  38          1HB       CYS  38   1.997   5.025  -4.686
  318   2HB   CYS  38          2HB       CYS  38   1.254   5.877  -3.347
  319    H    ILE  39           H        ILE  39  -1.148   5.468  -3.109
  320    HA   ILE  39           HA       ILE  39  -2.324   4.975  -5.682
  321    HB   ILE  39           HB       ILE  39  -3.104   3.115  -4.109
  322   1HG1  ILE  39          1HG1      ILE  39  -5.574   4.377  -5.042
  323   2HG1  ILE  39          2HG1      ILE  39  -4.297   4.437  -6.242
  324   1HG2  ILE  39          1HG2      ILE  39  -5.128   3.817  -2.743
  325   2HG2  ILE  39          2HG2      ILE  39  -3.532   4.252  -2.088
  326   3HG2  ILE  39          3HG2      ILE  39  -4.529   5.486  -2.896
  327   1HD1  ILE  39          1HD1      ILE  39  -5.449   1.980  -4.867
  328   2HD1  ILE  39          2HD1      ILE  39  -5.408   2.350  -6.607
  329   3HD1  ILE  39          3HD1      ILE  39  -3.905   1.929  -5.752
  330    H    ASP  40           H        ASP  40  -4.653   6.275  -5.560
  331    HA   ASP  40           HA       ASP  40  -3.803   8.865  -4.583
  332   1HB   ASP  40          1HB       ASP  40  -4.447   9.177  -6.793
  333   2HB   ASP  40          2HB       ASP  40  -5.598   7.855  -6.757
  334    H    VAL  41           H        VAL  41  -6.709   6.673  -4.768
  335    HA   VAL  41           HA       VAL  41  -7.804   8.082  -2.437
  336    HB   VAL  41           HB       VAL  41  -8.950   6.862  -4.877
  337   1HG1  VAL  41          1HG1      VAL  41 -11.114   6.377  -3.799
  338   2HG1  VAL  41          2HG1      VAL  41  -9.818   5.317  -3.190
  339   3HG1  VAL  41          3HG1      VAL  41 -10.385   6.687  -2.205
  340   1HG2  VAL  41          1HG2      VAL  41  -8.826   9.358  -4.155
  341   2HG2  VAL  41          2HG2      VAL  41 -10.334   8.740  -4.870
  342   3HG2  VAL  41          3HG2      VAL  41 -10.207   8.955  -3.107
  343    H    CYS  42           H        CYS  42  -8.776   6.769  -0.726
  344    HA   CYS  42           HA       CYS  42  -7.150   4.508  -0.171
  345   1HB   CYS  42          1HB       CYS  42  -8.154   6.281   1.443
  346   2HB   CYS  42          2HB       CYS  42  -9.591   5.278   1.403
  347    HA   PRO  43           HA       PRO  43 -10.005   1.941  -2.476
  348   1HB   PRO  43          1HB       PRO  43  -8.000  -0.211  -1.825
  349   2HB   PRO  43          2HB       PRO  43  -8.590   0.339  -3.402
  350   1HG   PRO  43          1HG       PRO  43  -6.068   1.017  -2.576
  351   2HG   PRO  43          2HG       PRO  43  -7.069   2.230  -3.408
  352   1HD   PRO  43          1HD       PRO  43  -6.709   1.917  -0.357
  353   2HD   PRO  43          2HD       PRO  43  -6.458   3.373  -1.357
  354    H    LYS  44           H        LYS  44 -11.510   0.222  -2.271
  355    HA   LYS  44           HA       LYS  44 -12.368  -0.190   0.418
  356   1HB   LYS  44          1HB       LYS  44 -13.406  -1.204  -2.245
  357   2HB   LYS  44          2HB       LYS  44 -14.190  -1.500  -0.705
  358   1HG   LYS  44          1HG       LYS  44 -15.311   0.436  -1.355
  359   2HG   LYS  44          2HG       LYS  44 -14.002   1.146  -0.432
  360   1HD   LYS  44          1HD       LYS  44 -12.807   1.807  -2.371
  361   2HD   LYS  44          2HD       LYS  44 -13.616   0.636  -3.393
  362   1HE   LYS  44          1HE       LYS  44 -15.795   1.960  -2.961
  363   2HE   LYS  44          2HE       LYS  44 -14.792   3.204  -2.242
  364   1HZ   LYS  44          1HZ       LYS  44 -14.864   2.309  -5.011
  365   2HZ   LYS  44          2HZ       LYS  44 -14.902   3.830  -4.418
  366   3HZ   LYS  44          3HZ       LYS  44 -13.499   2.994  -4.431
  367    H    ASN  45           H        ASN  45 -12.286  -2.056   1.673
  368    HA   ASN  45           HA       ASN  45 -10.223  -3.867   0.885
  369   1HB   ASN  45          1HB       ASN  45 -11.991  -4.054   3.370
  370   2HB   ASN  45          2HB       ASN  45 -10.378  -4.708   3.164
  371   1HD2  ASN  45          1HD2      ASN  45 -11.999  -2.433   4.712
  372   2HD2  ASN  45          2HD2      ASN  45 -10.842  -1.150   4.827
  373    H    SER  46           H        SER  46 -10.696  -6.347   1.341
  374    HA   SER  46           HA       SER  46 -13.396  -6.925   0.398
  375   1HB   SER  46          1HB       SER  46 -12.382  -8.931  -0.754
  376   2HB   SER  46          2HB       SER  46 -11.864  -7.391  -1.412
  377    HG   SER  46           HG       SER  46  -9.845  -7.615  -0.498
  378    H    LEU  47           H        LEU  47 -13.824  -9.483   0.823
  379    HA   LEU  47           HA       LEU  47 -13.465  -9.780   3.671
  380   1HB   LEU  47          1HB       LEU  47 -15.050 -11.301   1.603
  381   2HB   LEU  47          2HB       LEU  47 -14.971 -11.764   3.292
  382    HG   LEU  47           HG       LEU  47 -15.908  -9.026   2.418
  383   1HD1  LEU  47          1HD1      LEU  47 -17.189 -11.320   1.653
  384   2HD1  LEU  47          2HD1      LEU  47 -17.986 -10.952   3.201
  385   3HD1  LEU  47          3HD1      LEU  47 -17.967  -9.738   1.899
  386   1HD2  LEU  47          1HD2      LEU  47 -16.472 -10.578   4.956
  387   2HD2  LEU  47          2HD2      LEU  47 -15.190  -9.356   4.783
  388   3HD2  LEU  47          3HD2      LEU  47 -16.897  -8.887   4.598
  389    H    LEU  48           H        LEU  48 -11.385 -10.217   1.250
  390    HA   LEU  48           HA       LEU  48 -10.449 -12.801   2.289
  391   1HB   LEU  48          1HB       LEU  48  -9.898 -11.588  -0.421
  392   2HB   LEU  48          2HB       LEU  48  -9.369 -13.156   0.155
  393    HG   LEU  48           HG       LEU  48 -12.104 -13.320   0.469
  394   1HD1  LEU  48          1HD1      LEU  48 -13.129 -11.783  -0.760
  395   2HD1  LEU  48          2HD1      LEU  48 -11.583 -11.193  -1.418
  396   3HD1  LEU  48          3HD1      LEU  48 -12.426 -12.548  -2.206
  397   1HD2  LEU  48          1HD2      LEU  48 -12.044 -14.835  -1.431
  398   2HD2  LEU  48          2HD2      LEU  48 -10.489 -14.147  -1.958
  399   3HD2  LEU  48          3HD2      LEU  48 -10.592 -15.042  -0.423
  400    H    VAL  49           H        VAL  49  -9.463  -9.545   1.050
  401    HA   VAL  49           HA       VAL  49  -7.199  -9.707   2.907
  402    HB   VAL  49           HB       VAL  49  -5.708  -8.841   1.315
  403   1HG1  VAL  49          1HG1      VAL  49  -5.595 -10.550  -0.347
  404   2HG1  VAL  49          2HG1      VAL  49  -6.325 -11.286   1.100
  405   3HG1  VAL  49          3HG1      VAL  49  -7.352 -10.827  -0.279
  406   1HG2  VAL  49          1HG2      VAL  49  -8.045  -8.466  -0.589
  407   2HG2  VAL  49          2HG2      VAL  49  -7.204  -7.173   0.299
  408   3HG2  VAL  49          3HG2      VAL  49  -6.336  -8.112  -0.940
  409    H    LYS  50           H        LYS  50  -6.346  -7.489   3.475
  410    HA   LYS  50           HA       LYS  50  -8.515  -5.514   3.298
  411   1HB   LYS  50          1HB       LYS  50  -8.421  -6.579   5.531
  412   2HB   LYS  50          2HB       LYS  50  -6.750  -6.080   5.699
  413   1HG   LYS  50          1HG       LYS  50  -7.323  -3.750   5.735
  414   2HG   LYS  50          2HG       LYS  50  -8.925  -4.045   5.088
  415   1HD   LYS  50          1HD       LYS  50  -9.741  -4.188   7.195
  416   2HD   LYS  50          2HD       LYS  50  -8.745  -5.601   7.478
  417   1HE   LYS  50          1HE       LYS  50  -7.328  -2.965   7.627
  418   2HE   LYS  50          2HE       LYS  50  -8.500  -3.270   8.894
  419   1HZ   LYS  50          1HZ       LYS  50  -7.074  -5.591   8.590
  420   2HZ   LYS  50          2HZ       LYS  50  -5.961  -4.395   8.564
  421   3HZ   LYS  50          3HZ       LYS  50  -6.982  -4.533   9.831
  422    H    TYR  51           H        TYR  51  -7.894  -3.342   2.989
  423    HA   TYR  51           HA       TYR  51  -5.045  -3.029   2.316
  424   1HB   TYR  51          1HB       TYR  51  -7.544  -1.557   1.279
  425   2HB   TYR  51          2HB       TYR  51  -5.932  -1.429   0.607
  426    HD1  TYR  51           HD1      TYR  51  -5.164  -4.345   0.561
  427    HD2  TYR  51           HD2      TYR  51  -8.795  -2.370  -0.544
  428    HE1  TYR  51           HE1      TYR  51  -5.699  -6.224  -1.066
  429    HE2  TYR  51           HE2      TYR  51  -9.317  -4.256  -2.168
  430    HH   TYR  51           HH       TYR  51  -7.172  -7.072  -2.409
  431    H    VAL  52           H        VAL  52  -3.948  -1.659   3.623
  432    HA   VAL  52           HA       VAL  52  -5.544   0.314   5.099
  433    HB   VAL  52           HB       VAL  52  -3.089  -1.281   5.710
  434   1HG1  VAL  52          1HG1      VAL  52  -3.204   0.509   7.803
  435   2HG1  VAL  52          2HG1      VAL  52  -2.020   0.543   6.474
  436   3HG1  VAL  52          3HG1      VAL  52  -3.485   1.551   6.389
  437   1HG2  VAL  52          1HG2      VAL  52  -4.787  -0.711   7.951
  438   2HG2  VAL  52          2HG2      VAL  52  -5.795  -1.226   6.579
  439   3HG2  VAL  52          3HG2      VAL  52  -4.472  -2.269   7.151
  440    H    CYS  53           H        CYS  53  -5.076   2.492   4.916
  441    HA   CYS  53           HA       CYS  53  -3.110   3.123   2.858
  442   1HB   CYS  53          1HB       CYS  53  -5.312   4.858   3.994
  443   2HB   CYS  53          2HB       CYS  53  -4.253   5.264   2.657
  444    H    CYS  54           H        CYS  54  -1.630   4.977   3.264
  445    HA   CYS  54           HA       CYS  54  -1.455   5.959   5.946
  446   1HB   CYS  54          1HB       CYS  54   0.966   5.208   6.159
  447   2HB   CYS  54          2HB       CYS  54  -0.289   4.030   6.490
  448    H    ASN  55           H        ASN  55  -0.644   8.051   5.815
  449    HA   ASN  55           HA       ASN  55   0.285   8.847   3.202
  450   1HB   ASN  55          1HB       ASN  55  -0.528  10.960   3.731
  451   2HB   ASN  55          2HB       ASN  55  -1.493  10.044   4.873
  452   1HD2  ASN  55          1HD2      ASN  55   0.191   9.360   6.832
  453   2HD2  ASN  55          2HD2      ASN  55   0.847  10.742   7.646
  454    H    THR  56           H        THR  56   1.735   7.421   5.706
  455    HA   THR  56           HA       THR  56   3.899   9.350   6.094
  456    HB   THR  56           HB       THR  56   4.570   7.590   7.836
  457    HG1  THR  56           HG1      THR  56   2.575   6.116   8.159
  458   1HG2  THR  56          1HG2      THR  56   1.687   8.622   7.964
  459   2HG2  THR  56          2HG2      THR  56   2.596   7.963   9.345
  460   3HG2  THR  56          3HG2      THR  56   3.123   9.478   8.574
  461    H    ASP  57           H        ASP  57   6.170   8.571   5.960
  462    HA   ASP  57           HA       ASP  57   6.463   7.276   3.443
  463   1HB   ASP  57          1HB       ASP  57   8.807   7.855   5.247
  464   2HB   ASP  57          2HB       ASP  57   8.681   8.046   3.510
  465    H    ARG  58           H        ARG  58   8.082   5.399   3.204
  466    HA   ARG  58           HA       ARG  58   8.341   3.256   3.610
  467   1HB   ARG  58          1HB       ARG  58   9.617   4.556   6.063
  468   2HB   ARG  58          2HB       ARG  58   9.843   2.862   5.680
  469   1HG   ARG  58          1HG       ARG  58  11.349   3.327   4.033
  470   2HG   ARG  58          2HG       ARG  58  10.316   4.553   3.325
  471   1HD   ARG  58          1HD       ARG  58  12.035   5.933   4.042
  472   2HD   ARG  58          2HD       ARG  58  11.073   5.947   5.506
  473    HE   ARG  58           HE       ARG  58  12.689   3.734   5.860
  474   1HH1  ARG  58          1HH1      ARG  58  13.334   7.101   5.070
  475   2HH1  ARG  58          2HH1      ARG  58  14.893   7.112   5.823
  476   1HH2  ARG  58          1HH2      ARG  58  14.748   3.747   6.853
  477   2HH2  ARG  58          2HH2      ARG  58  15.703   5.192   6.844
  478    H    CYS  59           H        CYS  59   5.697   4.008   4.385
  479    HA   CYS  59           HA       CYS  59   5.235   2.919   7.007
  480   1HB   CYS  59          1HB       CYS  59   2.925   3.485   6.643
  481   2HB   CYS  59          2HB       CYS  59   3.953   4.845   6.238
  482    H    ASN  60           H        ASN  60   4.596   2.134   3.527
  483    HA   ASN  60           HA       ASN  60   3.850  -0.539   4.400
  484   1HB   ASN  60          1HB       ASN  60   2.653  -0.764   2.305
  485   2HB   ASN  60          2HB       ASN  60   2.254   0.829   2.917
  486   1HD2  ASN  60          1HD2      ASN  60   4.131  -1.001   0.606
  487   2HD2  ASN  60          2HD2      ASN  60   4.498   0.287  -0.492
  488   1H    HOH  61          1H        HOH  61  -0.774 -12.310   4.721
  489   2H    HOH  61          2H        HOH  61  -0.154 -11.692   3.486