*HEADER    TOXIN                                   10-SEP-17   6AZA              
*TITLE     NMR STRUCTURE OF SEA ANEMONE TOXIN KAPPA-ACTITOXIN-ATE1A              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ARG-CYS-LYS-THR-CYS-SER-LYS-GLY-ARG-CYS-ARG-PRO-LYS-PRO-   
*COMPND   3 ASN-CYS-GLY-NH2;                                                     
*COMPND   4 CHAIN: A;                                                            
*COMPND   5 ENGINEERED: YES;                                                     
*COMPND   6 OTHER_DETAILS: RCKTCSKGRCRPKPNCG NH2                                 
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: ACTINIA TENEBROSA;                              
*SOURCE   4 ORGANISM_TAXID: 6105                                                 
*KEYWDS    SEA ANEMONE; ACTINIA TENEBROSA; NEUROTOXIN; ION CHANNELS, TOXIN       
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    Y.K.-Y.CHIN,B.MADIO,G.F.KING,E.A.B.UNDHEIM                            
*REVDAT   1   12-SEP-18 6AZA    0                                                
# Restraints file 1: ate-final.aco
   1 ARG   PHI    -175.0    75.0 5.00E-01 type=2
   1 ARG   PSI     -75.0   185.0 5.00E-01 type=2
   1 ARG   PHI    -255.0   -25.0 5.00E-01 type=2 OR
   1 ARG   PSI      25.0    55.0 5.00E-01 type=2
   1 ARG   PHI    -135.0    75.0 5.00E-01 type=2 OR
   1 ARG   PSI     105.0   185.0 5.00E-01 type=2
   2 CYSS  PHI    -175.0    75.0 5.00E-01 type=2
   2 CYSS  PSI     -75.0   185.0 5.00E-01 type=2
   2 CYSS  PHI    -255.0   -25.0 5.00E-01 type=2 OR
   2 CYSS  PSI      25.0    55.0 5.00E-01 type=2
   2 CYSS  PHI    -135.0    75.0 5.00E-01 type=2 OR
   2 CYSS  PSI     105.0   185.0 5.00E-01 type=2
   3 LYS   PHI    -175.0    75.0 5.00E-01 type=2
   3 LYS   PSI     -75.0   185.0 5.00E-01 type=2
   3 LYS   PHI    -255.0   -25.0 5.00E-01 type=2 OR
   3 LYS   PSI      25.0    55.0 5.00E-01 type=2
   3 LYS   PHI    -135.0    75.0 5.00E-01 type=2 OR
   3 LYS   PSI     105.0   185.0 5.00E-01 type=2
   4 THR   PHI    -175.0    75.0 5.00E-01 type=2
   4 THR   PSI     -75.0   185.0 5.00E-01 type=2
   4 THR   PHI    -255.0   -25.0 5.00E-01 type=2 OR
   4 THR   PSI      25.0    55.0 5.00E-01 type=2
   4 THR   PHI    -135.0    75.0 5.00E-01 type=2 OR
   4 THR   PSI     105.0   185.0 5.00E-01 type=2
   5 CYSS  PHI    -175.0    75.0 5.00E-01 type=2
   5 CYSS  PSI     -75.0   185.0 5.00E-01 type=2
   5 CYSS  PHI    -255.0   -25.0 5.00E-01 type=2 OR
   5 CYSS  PSI      25.0    55.0 5.00E-01 type=2
   5 CYSS  PHI    -135.0    75.0 5.00E-01 type=2 OR
   5 CYSS  PSI     105.0   185.0 5.00E-01 type=2
   6 SER   PHI    -175.0    75.0 5.00E-01 type=2
   6 SER   PSI     -75.0   185.0 5.00E-01 type=2
   6 SER   PHI    -255.0   -25.0 5.00E-01 type=2 OR
   6 SER   PSI      25.0    55.0 5.00E-01 type=2
   6 SER   PHI    -135.0    75.0 5.00E-01 type=2 OR
   6 SER   PSI     105.0   185.0 5.00E-01 type=2
   7 LYS   PHI    -175.0    75.0 5.00E-01 type=2
   7 LYS   PSI     -75.0   185.0 5.00E-01 type=2
   7 LYS   PHI    -255.0   -25.0 5.00E-01 type=2 OR
   7 LYS   PSI      25.0    55.0 5.00E-01 type=2
   7 LYS   PHI    -135.0    75.0 5.00E-01 type=2 OR
   7 LYS   PSI     105.0   185.0 5.00E-01 type=2
   9 ARG   PHI    -175.0    75.0 5.00E-01 type=2
   9 ARG   PSI     -75.0   185.0 5.00E-01 type=2
   9 ARG   PHI    -255.0   -25.0 5.00E-01 type=2 OR
   9 ARG   PSI      25.0    55.0 5.00E-01 type=2
   9 ARG   PHI    -135.0    75.0 5.00E-01 type=2 OR
   9 ARG   PSI     105.0   185.0 5.00E-01 type=2
  10 CYSS  PHI    -175.0    75.0 5.00E-01 type=2
  10 CYSS  PSI     -75.0   185.0 5.00E-01 type=2
  10 CYSS  PHI    -255.0   -25.0 5.00E-01 type=2 OR
  10 CYSS  PSI      25.0    55.0 5.00E-01 type=2
  10 CYSS  PHI    -135.0    75.0 5.00E-01 type=2 OR
  10 CYSS  PSI     105.0   185.0 5.00E-01 type=2
  15 ASN   PHI    -175.0    75.0 5.00E-01 type=2
  15 ASN   PSI     -75.0   185.0 5.00E-01 type=2
  15 ASN   PHI    -255.0   -25.0 5.00E-01 type=2 OR
  15 ASN   PSI      25.0    55.0 5.00E-01 type=2
  15 ASN   PHI    -135.0    75.0 5.00E-01 type=2 OR
  15 ASN   PSI     105.0   185.0 5.00E-01 type=2
  16 CYSS  PHI    -175.0    75.0 5.00E-01 type=2
  16 CYSS  PSI     -75.0   185.0 5.00E-01 type=2
  16 CYSS  PHI    -255.0   -25.0 5.00E-01 type=2 OR
  16 CYSS  PSI      25.0    55.0 5.00E-01 type=2
  16 CYSS  PHI    -135.0    75.0 5.00E-01 type=2 OR
  16 CYSS  PSI     105.0   185.0 5.00E-01 type=2
   1 ARG   CHI1    -90.0   210.0 2.00E-01 type=2
   1 ARG   CHI1   -330.0   -30.0 2.00E-01 type=2
   1 ARG   CHI1   -210.0    90.0 2.00E-01 type=2
   1 ARG   CHI2    -90.0   210.0 2.00E-01 type=2
   1 ARG   CHI2   -330.0   -30.0 2.00E-01 type=2
   1 ARG   CHI2   -210.0    90.0 2.00E-01 type=2
   1 ARG   CHI3    -90.0   210.0 2.00E-01 type=2
   1 ARG   CHI3   -330.0   -30.0 2.00E-01 type=2
   1 ARG   CHI3   -210.0    90.0 2.00E-01 type=2
   2 CYSS  CHI1    -90.0   210.0 2.00E-01 type=2
   2 CYSS  CHI1   -330.0   -30.0 2.00E-01 type=2
   2 CYSS  CHI1   -210.0    90.0 2.00E-01 type=2
   3 LYS   CHI1    -90.0   210.0 2.00E-01 type=2
   3 LYS   CHI1   -330.0   -30.0 2.00E-01 type=2
   3 LYS   CHI1   -210.0    90.0 2.00E-01 type=2
   3 LYS   CHI2    -90.0   210.0 2.00E-01 type=2
   3 LYS   CHI2   -330.0   -30.0 2.00E-01 type=2
   3 LYS   CHI2   -210.0    90.0 2.00E-01 type=2
   3 LYS   CHI3    -90.0   210.0 2.00E-01 type=2
   3 LYS   CHI3   -330.0   -30.0 2.00E-01 type=2
   3 LYS   CHI3   -210.0    90.0 2.00E-01 type=2
   3 LYS   CHI4    -90.0   210.0 2.00E-01 type=2
   3 LYS   CHI4   -330.0   -30.0 2.00E-01 type=2
   3 LYS   CHI4   -210.0    90.0 2.00E-01 type=2
   4 THR   CHI1    -90.0   210.0 2.00E-01 type=2
   4 THR   CHI1   -330.0   -30.0 2.00E-01 type=2
   4 THR   CHI1   -210.0    90.0 2.00E-01 type=2
   5 CYSS  CHI1    -90.0   210.0 2.00E-01 type=2
   5 CYSS  CHI1   -330.0   -30.0 2.00E-01 type=2
   5 CYSS  CHI1   -210.0    90.0 2.00E-01 type=2
   6 SER   CHI1    -90.0   210.0 2.00E-01 type=2
   6 SER   CHI1   -330.0   -30.0 2.00E-01 type=2
   6 SER   CHI1   -210.0    90.0 2.00E-01 type=2
   7 LYS   CHI1    -90.0   210.0 2.00E-01 type=2
   7 LYS   CHI1   -330.0   -30.0 2.00E-01 type=2
   7 LYS   CHI1   -210.0    90.0 2.00E-01 type=2
   7 LYS   CHI2    -90.0   210.0 2.00E-01 type=2
   7 LYS   CHI2   -330.0   -30.0 2.00E-01 type=2
   7 LYS   CHI2   -210.0    90.0 2.00E-01 type=2
   7 LYS   CHI3    -90.0   210.0 2.00E-01 type=2
   7 LYS   CHI3   -330.0   -30.0 2.00E-01 type=2
   7 LYS   CHI3   -210.0    90.0 2.00E-01 type=2
   7 LYS   CHI4    -90.0   210.0 2.00E-01 type=2
   7 LYS   CHI4   -330.0   -30.0 2.00E-01 type=2
   7 LYS   CHI4   -210.0    90.0 2.00E-01 type=2
   9 ARG   CHI1    -90.0   210.0 2.00E-01 type=2
   9 ARG   CHI1   -330.0   -30.0 2.00E-01 type=2
   9 ARG   CHI1   -210.0    90.0 2.00E-01 type=2
   9 ARG   CHI2    -90.0   210.0 2.00E-01 type=2
   9 ARG   CHI2   -330.0   -30.0 2.00E-01 type=2
   9 ARG   CHI2   -210.0    90.0 2.00E-01 type=2
   9 ARG   CHI3    -90.0   210.0 2.00E-01 type=2
   9 ARG   CHI3   -330.0   -30.0 2.00E-01 type=2
   9 ARG   CHI3   -210.0    90.0 2.00E-01 type=2
  10 CYSS  CHI1    -90.0   210.0 2.00E-01 type=2
  10 CYSS  CHI1   -330.0   -30.0 2.00E-01 type=2
  10 CYSS  CHI1   -210.0    90.0 2.00E-01 type=2
  11 ARG   CHI1    -90.0   210.0 2.00E-01 type=2
  11 ARG   CHI1   -330.0   -30.0 2.00E-01 type=2
  11 ARG   CHI1   -210.0    90.0 2.00E-01 type=2
  11 ARG   CHI2    -90.0   210.0 2.00E-01 type=2
  11 ARG   CHI2   -330.0   -30.0 2.00E-01 type=2
  11 ARG   CHI2   -210.0    90.0 2.00E-01 type=2
  11 ARG   CHI3    -90.0   210.0 2.00E-01 type=2
  11 ARG   CHI3   -330.0   -30.0 2.00E-01 type=2
  11 ARG   CHI3   -210.0    90.0 2.00E-01 type=2
  13 LYS   CHI1    -90.0   210.0 2.00E-01 type=2
  13 LYS   CHI1   -330.0   -30.0 2.00E-01 type=2
  13 LYS   CHI1   -210.0    90.0 2.00E-01 type=2
  13 LYS   CHI2    -90.0   210.0 2.00E-01 type=2
  13 LYS   CHI2   -330.0   -30.0 2.00E-01 type=2
  13 LYS   CHI2   -210.0    90.0 2.00E-01 type=2
  13 LYS   CHI3    -90.0   210.0 2.00E-01 type=2
  13 LYS   CHI3   -330.0   -30.0 2.00E-01 type=2
  13 LYS   CHI3   -210.0    90.0 2.00E-01 type=2
  13 LYS   CHI4    -90.0   210.0 2.00E-01 type=2
  13 LYS   CHI4   -330.0   -30.0 2.00E-01 type=2
  13 LYS   CHI4   -210.0    90.0 2.00E-01 type=2
  15 ASN   CHI1    -90.0   210.0 2.00E-01 type=2
  15 ASN   CHI1   -330.0   -30.0 2.00E-01 type=2
  15 ASN   CHI1   -210.0    90.0 2.00E-01 type=2
  16 CYSS  CHI1    -90.0   210.0 2.00E-01 type=2
  16 CYSS  CHI1   -330.0   -30.0 2.00E-01 type=2
  16 CYSS  CHI1   -210.0    90.0 2.00E-01 type=2
# Restraints file 2: ate-final.upl
 10 CYSS HB2    11 ARG  H       5.50            #peak 8 #SUP 0.80 #QF 0.80
  4 THR  HB      5 CYSS H       5.50            #peak 18 #SUP 0.96 #QF 0.96
 11 ARG  H      11 ARG  QD      5.50            #peak 19 #SUP 0.75 #QF 0.75
 10 CYSS HB3    11 ARG  H       5.50            #peak 22 #SUP 0.91 #QF 0.91
  4 THR  QG2     5 CYSS H       5.50            #peak 23 #SUP 0.89 #QF 0.89
 11 ARG  H      11 ARG  QG      5.50            #peak 26 #SUP 0.94 #QF 0.94
  4 THR  H       5 CYSS H       5.50            #peak 43 #SUP 0.78 #QF 0.78
  7 LYS  H       8 GLY  H       5.50            #peak 44 #SUP 0.93 #QF 0.93
  8 GLY  H       9 ARG  H       5.50            #peak 45 #SUP 0.96 #QF 0.96
  6 SER  H       9 ARG  H       5.50            #peak 46 #SUP 0.97 #QF 0.55
  9 ARG  H      10 CYSS H       5.50            #peak 46 #SUP 0.97 #QF 0.55
  4 THR  H       4 THR  QG2     5.50            #peak 58 #SUP 1.00
  7 LYS  HB3     8 GLY  H       5.50            #peak 59 #SUP 0.94 #QF 0.94
  3 LYS  HB2     4 THR  H       5.50            #peak 60 #SUP 0.96 #QF 0.85
  3 LYS  HB3     4 THR  H       5.50            #peak 60 #SUP 0.96 #QF 0.85
  7 LYS  HB2     8 GLY  H       5.50            #peak 62 #SUP 0.97 #QF 0.97
  3 LYS  H       3 LYS  HG3     5.50            #peak 63 #SUP 0.99 #QF 0.99
  3 LYS  H       3 LYS  HG2     5.50            #peak 70 #SUP 0.95 #QF 0.95
  3 LYS  H       3 LYS  QE      5.50            #peak 75 #SUP 0.79 #QF 0.79
 14 PRO  HD3    15 ASN  H       5.50            #peak 77 #SUP 0.97 #QF 0.97
 13 LYS  H      13 LYS  QD      5.50            #peak 83 #SUP 0.73 #QF 0.73
 13 LYS  H      13 LYS  QE      5.50            #peak 86 #SUP 0.82 #QF 0.75
 14 PRO  HD2    15 ASN  H       5.50            #peak 106 #SUP 0.99 #QF 0.99
 16 CYSS HB2    17 GLY  H       5.50            #peak 107 #SUP 1.00
 16 CYSS HB3    17 GLY  H       5.50            #peak 108 #SUP 0.95 #QF 0.95
 13 LYS  H      13 LYS  QG      5.50            #peak 134 #SUP 1.00
 13 LYS  QG     15 ASN  H       5.50            #peak 135 #SUP 0.98 #QF 0.98
 12 PRO  HG3    13 LYS  H       5.50            #peak 140 #SUP 0.79 #QF 0.79
 12 PRO  HG2    13 LYS  H       5.50            #peak 141 #SUP 0.88 #QF 0.88
  9 ARG  H       9 ARG  HG2     5.50            #peak 145 #SUP 0.83 #QF 0.83
  9 ARG  H       9 ARG  HG3     5.50            #peak 146 #SUP 0.98 #QF 0.98
 13 LYS  H      14 PRO  HD2     5.50            #peak 149 #SUP 0.98 #QF 0.73
 13 LYS  H      14 PRO  HD3     5.50            #peak 150 #SUP 1.00
  7 LYS  HA      9 ARG  H       5.50            #peak 156 #SUP 0.89 #QF 0.67
  5 CYSS HB3     6 SER  H       5.50            #peak 163 #SUP 0.78 #QF 0.35
  5 CYSS HB2     6 SER  H       5.50            #peak 165 #SUP 0.75 #QF 0.51
 11 ARG  QG     12 PRO  HD3     5.50            #peak 195 #SUP 0.94 #QF 0.89
 13 LYS  QD     14 PRO  HD2     5.50            #peak 195 #SUP 0.94 #QF 0.89
 11 ARG  QG     12 PRO  HD2     5.50            #peak 198 #SUP 0.87 #QF 0.87
 13 LYS  QD     14 PRO  HD3     5.50            #peak 207 #SUP 0.61 #QF 0.21
  5 CYSS HB2    10 CYSS HA      5.50            #peak 218 #SUP 0.93 #QF 0.90
  5 CYSS HB3    10 CYSS HA      5.50            #peak 219 #SUP 0.75 #QF 0.28
  7 LYS  HA      7 LYS  QD      5.50            #peak 232 #SUP 0.81 #QF 0.81
 11 ARG  HA     12 PRO  HG3     5.50            #peak 241 #SUP 0.83 #QF 0.83
 11 ARG  HA     12 PRO  HG2     5.50            #peak 242 #SUP 0.91 #QF 0.91
 13 LYS  QG     14 PRO  HD2     5.50            #peak 252 #SUP 1.00
 13 LYS  QG     14 PRO  HD3     5.50            #peak 253 #SUP 0.99 #QF 0.25
  9 ARG  HA      9 ARG  HG2     2.70            #peak 268 #SUP 0.86 #QF 0.86
  9 ARG  HA      9 ARG  HG3     2.70            #peak 269 #SUP 0.90 #QF 0.90
  1 ARG  QB      1 ARG  QD      2.40            #peak 273 #SUP 1.00
  1 ARG  QG      1 ARG  QD      2.62            #peak 276 #SUP 1.00 #QF 0.66
 11 ARG  QG     11 ARG  QD      2.87            #peak 276 #SUP 1.00 #QF 0.66
  3 LYS  QG      4 THR  H       5.34            #peak 57
  6 SER  H       9 ARG  QB      5.34            #peak 61
  7 LYS  QB      8 GLY  QA      5.18            #peak 206
  7 LYS  QG      8 GLY  H       5.34            #peak 57
  9 ARG  HA      9 ARG  QB      2.52            #peak 267
  9 ARG  QB      9 ARG  QD      2.39            #peak 277
  9 ARG  QG      9 ARG  QD      2.31            #peak 271
 11 ARG  QB     11 ARG  QD      2.39            #peak 275
 11 ARG  QB     12 PRO  QD      4.53            #peak 199
 12 PRO  QD     13 LYS  H       4.96            #peak 149
 13 LYS  H      16 CYSS QB      5.34            #peak 86
 13 LYS  QB     14 PRO  QD      4.76            #peak 208
 13 LYS  QB     15 ASN  H       5.34            #peak 137
 14 PRO  QG     15 ASN  H       5.03            #peak 67
# Restraints file 3: ate-ssbond.upl
  5 CYSS SG     10 CYSS SG     2.10   1.0 
  5 CYSS SG     10 CYSS CB     3.10   1.0 
  5 CYSS CB     10 CYSS SG     3.10   1.0 
 16 CYSS SG      2 CYSS SG     2.10   1.0 
 16 CYSS SG      2 CYSS CB     3.10   1.0 
 16 CYSS CB      2 CYSS SG     3.10   1.0 
# Restraints file 4: ate-ssbond.lol
  5 CYSS SG     10 CYSS SG      2.00   1.0 
  5 CYSS SG     10 CYSS CB      3.00   1.0 
  5 CYSS CB     10 CYSS SG      3.00   1.0 
 16 CYSS SG      2 CYSS SG      2.00   1.0 
 16 CYSS SG      2 CYSS CB      3.00   1.0 
 16 CYSS CB      2 CYSS SG      3.00   1.0
# Restraints file 5: ate.aco
# REMARK  error margins are set to conservative default values of double the standard deviation 
#         observed in TALOS-N capped at a minimum of +/-20 degree.

# Phi/Psi Angles From 'Strong' Predictions 
   3   LYS  PHI    -122.8   -45.3
   3   LYS  PSI     114.5   166.0
   4   THR  PHI    -133.4   -42.4
   4   THR  PSI     116.7   156.7
   5   CYSS PHI    -173.1   -43.4
   5   CYSS PSI     121.8   174.9
   8   GLY  PHI      68.0   108.0
   8   GLY  PSI     -26.4    13.6
   9   ARG  PHI    -115.4   -56.7
   9   ARG  PSI     112.8   152.8
  10   CYSS PHI    -148.9   -41.5
  10   CYSS PSI     110.0   160.9
  11   ARG  PHI    -153.8   -47.4
  11   ARG  PSI     107.0   175.4
  12   PRO  PSI     125.9   165.9
  13   LYS  PHI     -82.8   -42.8
  13   LYS  PSI     116.8   156.8
  14   PRO  PSI     -41.9    -1.9
  15   ASN  PHI    -105.8   -65.8
  15   ASN  PSI     -27.4    12.6

# Phi/Psi Angles From 'Generous' Predictions 
   6   SER  PHI    -106.4   -42.1
   6   SER  PSI     130.3   170.3

#Chi1 angle
   9   ARG  CHI1    -80.0   -40.0
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   ARG   1           H        ARG   1   1.807   0.001   0.855
    2    HA   ARG   1           HA       ARG   1   3.142  -0.021  -0.986
    3    HB2  ARG   1           HB2      ARG   1   2.249  -1.162  -3.031
    4    HB3  ARG   1           HB3      ARG   1   2.130  -2.114  -1.557
    5    HG2  ARG   1           HG2      ARG   1  -0.204  -0.458  -2.359
    6    HG3  ARG   1           HG3      ARG   1   0.129  -1.945  -3.251
    7    HD2  ARG   1           HD2      ARG   1   0.351  -2.929  -0.805
    8    HD3  ARG   1           HD3      ARG   1  -0.693  -1.562  -0.419
    9    HE   ARG   1           HE       ARG   1  -1.846  -2.820  -2.587
   10   HH11  ARG   1          HH11      ARG   1  -1.002  -3.650   0.687
   11   HH12  ARG   1          HH12      ARG   1  -2.280  -4.807   0.861
   12   HH21  ARG   1          HH21      ARG   1  -3.532  -4.341  -2.370
   13   HH22  ARG   1          HH22      ARG   1  -3.718  -5.200  -0.879
   14    H    CYS   2           H        CYS   2   2.118   2.404  -0.443
   15    HA   CYS   2           HA       CYS   2   1.061   3.494  -2.947
   16    HB2  CYS   2           HB2      CYS   2   0.119   4.029  -0.588
   17    HB3  CYS   2           HB3      CYS   2   1.518   5.087  -0.439
   18    H    LYS   3           H        LYS   3   3.837   3.679  -0.799
   19    HA   LYS   3           HA       LYS   3   5.142   5.851  -2.025
   20    HB2  LYS   3           HB2      LYS   3   5.687   4.805   0.215
   21    HB3  LYS   3           HB3      LYS   3   6.492   3.515  -0.669
   22    HG2  LYS   3           HG2      LYS   3   7.956   5.243  -1.713
   23    HG3  LYS   3           HG3      LYS   3   7.227   6.432  -0.631
   24    HD2  LYS   3           HD2      LYS   3   9.113   5.825   0.551
   25    HD3  LYS   3           HD3      LYS   3   7.904   4.734   1.232
   26    HE2  LYS   3           HE2      LYS   3   8.692   2.910  -0.047
   27    HE3  LYS   3           HE3      LYS   3   9.661   3.958  -1.082
   28    HZ1  LYS   3           HZ1      LYS   3  10.198   3.778   1.814
   29    HZ2  LYS   3           HZ2      LYS   3  11.236   4.268   0.572
   30    HZ3  LYS   3           HZ3      LYS   3  10.836   2.634   0.744
   31    H    THR   4           H        THR   4   6.347   6.028  -3.817
   32    HA   THR   4           HA       THR   4   7.057   3.557  -5.257
   33    HB   THR   4           HB       THR   4   6.207   6.146  -6.566
   34    HG1  THR   4           HG1      THR   4   4.759   3.701  -6.316
   35   HG21  THR   4          HG21      THR   4   5.928   4.004  -8.327
   36   HG22  THR   4          HG22      THR   4   7.473   3.726  -7.522
   37   HG23  THR   4          HG23      THR   4   7.178   5.247  -8.364
   38    H    CYS   5           H        CYS   5   9.016   3.532  -6.345
   39    HA   CYS   5           HA       CYS   5  10.863   5.694  -5.599
   40    HB2  CYS   5           HB2      CYS   5  11.161   2.758  -5.977
   41    HB3  CYS   5           HB3      CYS   5  12.534   3.771  -6.412
   42    H    SER   6           H        SER   6  11.513   7.046  -7.125
   43    HA   SER   6           HA       SER   6  10.733   6.852  -9.812
   44    HB2  SER   6           HB2      SER   6  13.120   8.484  -9.031
   45    HB3  SER   6           HB3      SER   6  11.799   8.889 -10.126
   46    HG   SER   6           HG       SER   6  10.739   9.697  -8.506
   47    H    LYS   7           H        LYS   7  12.370   7.009 -11.659
   48    HA   LYS   7           HA       LYS   7  13.818   4.567 -11.763
   49    HB2  LYS   7           HB2      LYS   7  13.441   6.891 -13.610
   50    HB3  LYS   7           HB3      LYS   7  14.702   5.715 -13.959
   51    HG2  LYS   7           HG2      LYS   7  12.808   5.037 -15.180
   52    HG3  LYS   7           HG3      LYS   7  12.922   3.937 -13.804
   53    HD2  LYS   7           HD2      LYS   7  11.079   4.841 -12.757
   54    HD3  LYS   7           HD3      LYS   7  11.255   6.401 -13.564
   55    HE2  LYS   7           HE2      LYS   7  10.377   5.556 -15.591
   56    HE3  LYS   7           HE3      LYS   7  10.511   3.887 -15.039
   57    HZ1  LYS   7           HZ1      LYS   7   8.653   4.063 -13.752
   58    HZ2  LYS   7           HZ2      LYS   7   8.234   5.135 -14.991
   59    HZ3  LYS   7           HZ3      LYS   7   8.814   5.731 -13.518
   60    H    GLY   8           H        GLY   8  15.397   4.594 -10.157
   61    HA2  GLY   8           HA2      GLY   8  17.796   4.739  -9.992
   62    HA3  GLY   8           HA3      GLY   8  17.713   6.302 -10.791
   63    H    ARG   9           H        ARG   9  15.388   7.086  -9.092
   64    HA   ARG   9           HA       ARG   9  16.910   7.668  -6.638
   65    HB2  ARG   9           HB2      ARG   9  14.985   9.322  -8.241
   66    HB3  ARG   9           HB3      ARG   9  15.251   9.665  -6.537
   67    HG2  ARG   9           HG2      ARG   9  17.490  10.241  -6.882
   68    HG3  ARG   9           HG3      ARG   9  17.531   9.477  -8.473
   69    HD2  ARG   9           HD2      ARG   9  16.282  11.196  -9.456
   70    HD3  ARG   9           HD3      ARG   9  15.716  11.795  -7.897
   71    HE   ARG   9           HE       ARG   9  18.503  12.032  -7.979
   72   HH11  ARG   9          HH11      ARG   9  15.677  13.377  -9.503
   73   HH12  ARG   9          HH12      ARG   9  16.417  14.911  -9.820
   74   HH21  ARG   9          HH21      ARG   9  19.489  14.047  -8.391
   75   HH22  ARG   9          HH22      ARG   9  18.586  15.290  -9.188
   76    H    CYS  10           H        CYS  10  15.760   7.766  -4.650
   77    HA   CYS  10           HA       CYS  10  13.136   6.432  -4.672
   78    HB2  CYS  10           HB2      CYS  10  15.628   5.661  -3.256
   79    HB3  CYS  10           HB3      CYS  10  14.129   5.526  -2.342
   80    H    ARG  11           H        ARG  11  11.730   7.899  -3.970
   81    HA   ARG  11           HA       ARG  11  12.284   9.268  -1.447
   82    HB2  ARG  11           HB2      ARG  11  11.823  10.566  -4.083
   83    HB3  ARG  11           HB3      ARG  11  11.046  11.289  -2.681
   84    HG2  ARG  11           HG2      ARG  11  12.996  12.443  -2.646
   85    HG3  ARG  11           HG3      ARG  11  13.485  11.053  -1.674
   86    HD2  ARG  11           HD2      ARG  11  15.217  11.096  -3.154
   87    HD3  ARG  11           HD3      ARG  11  14.099  10.071  -4.053
   88    HE   ARG  11           HE       ARG  11  13.859  11.742  -5.607
   89   HH11  ARG  11          HH11      ARG  11  15.432  13.009  -2.772
   90   HH12  ARG  11          HH12      ARG  11  15.828  14.526  -3.509
   91   HH21  ARG  11          HH21      ARG  11  14.374  13.736  -6.589
   92   HH22  ARG  11          HH22      ARG  11  15.225  14.939  -5.681
   93    HA   PRO  12           HA       PRO  12   8.103   8.386  -0.458
   94    HB2  PRO  12           HB2      PRO  12   7.353  10.586   0.946
   95    HB3  PRO  12           HB3      PRO  12   8.474   9.376   1.582
   96    HG2  PRO  12           HG2      PRO  12   9.063  12.032   0.333
   97    HG3  PRO  12           HG3      PRO  12   9.789  11.284   1.768
   98    HD2  PRO  12           HD2      PRO  12  11.003  11.276  -0.653
   99    HD3  PRO  12           HD3      PRO  12  11.195   9.954   0.517
  100    H    LYS  13           H        LYS  13   5.851   9.096  -0.699
  101    HA   LYS  13           HA       LYS  13   5.469  10.437  -3.228
  102    HB2  LYS  13           HB2      LYS  13   3.786   8.825  -1.379
  103    HB3  LYS  13           HB3      LYS  13   2.961   9.951  -2.448
  104    HG2  LYS  13           HG2      LYS  13   4.491   8.800  -4.265
  105    HG3  LYS  13           HG3      LYS  13   4.475   7.482  -3.091
  106    HD2  LYS  13           HD2      LYS  13   2.194   7.156  -3.292
  107    HD3  LYS  13           HD3      LYS  13   1.909   8.795  -3.881
  108    HE2  LYS  13           HE2      LYS  13   3.497   6.821  -5.485
  109    HE3  LYS  13           HE3      LYS  13   1.735   6.835  -5.546
  110    HZ1  LYS  13           HZ1      LYS  13   2.601   9.462  -5.853
  111    HZ2  LYS  13           HZ2      LYS  13   1.859   8.474  -7.007
  112    HZ3  LYS  13           HZ3      LYS  13   3.546   8.514  -6.888
  113    HA   PRO  14           HA       PRO  14   4.318  14.422  -1.796
  114    HB2  PRO  14           HB2      PRO  14   2.323  15.081  -3.516
  115    HB3  PRO  14           HB3      PRO  14   4.023  15.012  -3.997
  116    HG2  PRO  14           HG2      PRO  14   1.860  12.980  -4.389
  117    HG3  PRO  14           HG3      PRO  14   3.108  13.519  -5.527
  118    HD2  PRO  14           HD2      PRO  14   3.311  11.208  -4.131
  119    HD3  PRO  14           HD3      PRO  14   4.727  12.178  -4.583
  120    H    ASN  15           H        ASN  15   1.607  12.202  -2.349
  121    HA   ASN  15           HA       ASN  15   0.093  13.576  -0.238
  122    HB2  ASN  15           HB2      ASN  15  -0.823  11.650  -2.383
  123    HB3  ASN  15           HB3      ASN  15  -1.867  12.315  -1.131
  124   HD21  ASN  15          HD21      ASN  15  -2.611  12.718  -3.646
  125   HD22  ASN  15          HD22      ASN  15  -2.346  14.356  -4.128
  126    H    CYS  16           H        CYS  16   1.588  10.565  -1.126
  127    HA   CYS  16           HA       CYS  16   0.520   9.259   1.274
  128    HB2  CYS  16           HB2      CYS  16   1.663   8.282  -1.301
  129    HB3  CYS  16           HB3      CYS  16   1.876   7.277   0.129
  130    H    GLY  17           H        GLY  17   1.900  10.683   2.598
  131    HA2  GLY  17           HA2      GLY  17   4.763  10.256   2.461
  132    HA3  GLY  17           HA3      GLY  17   3.911  11.269   3.617
  133    HN1  NH2  18           H1       NH2  18   4.841   7.968   2.835
  134    HN2  NH2  18           H2       NH2  18   4.698   7.302   4.401
  Start of MODEL    2
    1    H1   ARG   1           H        ARG   1   0.909  -0.220  -0.570
    2    HA   ARG   1           HA       ARG   1   3.369   1.206   0.116
    3    HB2  ARG   1           HB2      ARG   1   4.412  -0.255  -1.603
    4    HB3  ARG   1           HB3      ARG   1   3.636  -1.155  -0.306
    5    HG2  ARG   1           HG2      ARG   1   1.862  -1.826  -1.670
    6    HG3  ARG   1           HG3      ARG   1   2.218  -0.595  -2.884
    7    HD2  ARG   1           HD2      ARG   1   2.896  -2.808  -3.651
    8    HD3  ARG   1           HD3      ARG   1   4.292  -1.750  -3.453
    9    HE   ARG   1           HE       ARG   1   5.070  -3.141  -1.809
   10   HH11  ARG   1          HH11      ARG   1   1.723  -3.866  -2.435
   11   HH12  ARG   1          HH12      ARG   1   1.710  -5.288  -1.442
   12   HH21  ARG   1          HH21      ARG   1   5.067  -5.009  -0.500
   13   HH22  ARG   1          HH22      ARG   1   3.612  -5.935  -0.341
   14    H    CYS   2           H        CYS   2   1.287   2.810  -0.835
   15    HA   CYS   2           HA       CYS   2   1.178   3.305  -3.550
   16    HB2  CYS   2           HB2      CYS   2   0.611   5.656  -2.918
   17    HB3  CYS   2           HB3      CYS   2  -0.312   4.442  -2.037
   18    H    LYS   3           H        LYS   3   3.618   4.272  -1.214
   19    HA   LYS   3           HA       LYS   3   5.015   6.139  -2.748
   20    HB2  LYS   3           HB2      LYS   3   6.938   5.631  -1.301
   21    HB3  LYS   3           HB3      LYS   3   5.455   5.811  -0.374
   22    HG2  LYS   3           HG2      LYS   3   5.288   3.261  -0.498
   23    HG3  LYS   3           HG3      LYS   3   6.978   3.311  -1.005
   24    HD2  LYS   3           HD2      LYS   3   7.603   4.437   1.037
   25    HD3  LYS   3           HD3      LYS   3   5.912   4.555   1.529
   26    HE2  LYS   3           HE2      LYS   3   6.779   2.735   2.737
   27    HE3  LYS   3           HE3      LYS   3   5.866   2.014   1.413
   28    HZ1  LYS   3           HZ1      LYS   3   8.755   2.075   1.862
   29    HZ2  LYS   3           HZ2      LYS   3   8.210   2.120   0.262
   30    HZ3  LYS   3           HZ3      LYS   3   7.782   0.827   1.266
   31    H    THR   4           H        THR   4   6.396   6.005  -4.412
   32    HA   THR   4           HA       THR   4   7.411   3.355  -5.187
   33    HB   THR   4           HB       THR   4   5.454   3.969  -6.608
   34    HG1  THR   4           HG1      THR   4   6.819   2.641  -7.661
   35   HG21  THR   4          HG21      THR   4   6.245   6.486  -6.524
   36   HG22  THR   4          HG22      THR   4   5.373   5.852  -7.919
   37   HG23  THR   4          HG23      THR   4   7.127   6.020  -7.978
   38    H    CYS   5           H        CYS   5   9.325   3.402  -6.519
   39    HA   CYS   5           HA       CYS   5  10.821   5.934  -6.353
   40    HB2  CYS   5           HB2      CYS   5  11.941   3.165  -5.864
   41    HB3  CYS   5           HB3      CYS   5  12.849   4.673  -5.822
   42    H    SER   6           H        SER   6  11.469   6.625  -8.273
   43    HA   SER   6           HA       SER   6  11.212   5.004 -10.612
   44    HB2  SER   6           HB2      SER   6  11.004   7.628 -10.273
   45    HB3  SER   6           HB3      SER   6  12.722   7.581 -10.673
   46    HG   SER   6           HG       SER   6  10.534   6.699 -12.237
   47    H    LYS   7           H        LYS   7  13.068   4.990 -12.252
   48    HA   LYS   7           HA       LYS   7  15.181   3.456 -11.199
   49    HB2  LYS   7           HB2      LYS   7  16.181   3.739 -13.500
   50    HB3  LYS   7           HB3      LYS   7  14.549   3.085 -13.463
   51    HG2  LYS   7           HG2      LYS   7  13.718   4.797 -14.621
   52    HG3  LYS   7           HG3      LYS   7  14.610   5.989 -13.673
   53    HD2  LYS   7           HD2      LYS   7  16.611   5.565 -14.986
   54    HD3  LYS   7           HD3      LYS   7  15.771   4.307 -15.896
   55    HE2  LYS   7           HE2      LYS   7  15.391   5.971 -17.363
   56    HE3  LYS   7           HE3      LYS   7  14.087   6.391 -16.253
   57    HZ1  LYS   7           HZ1      LYS   7  15.164   8.216 -15.537
   58    HZ2  LYS   7           HZ2      LYS   7  15.954   8.108 -17.029
   59    HZ3  LYS   7           HZ3      LYS   7  16.698   7.506 -15.634
   60    H    GLY   8           H        GLY   8  16.430   4.460  -9.686
   61    HA2  GLY   8           HA2      GLY   8  18.576   5.559  -9.472
   62    HA3  GLY   8           HA3      GLY   8  18.034   6.735 -10.659
   63    H    ARG   9           H        ARG   9  15.363   6.892  -9.337
   64    HA   ARG   9           HA       ARG   9  16.183   8.547  -7.040
   65    HB2  ARG   9           HB2      ARG   9  14.060   8.951  -9.130
   66    HB3  ARG   9           HB3      ARG   9  13.946   9.747  -7.566
   67    HG2  ARG   9           HG2      ARG   9  15.815  11.061  -7.952
   68    HG3  ARG   9           HG3      ARG   9  16.430   9.988  -9.210
   69    HD2  ARG   9           HD2      ARG   9  15.382  11.156 -10.781
   70    HD3  ARG   9           HD3      ARG   9  13.840  10.952  -9.951
   71    HE   ARG   9           HE       ARG   9  15.543  13.272  -9.908
   72   HH11  ARG   9          HH11      ARG   9  13.022  11.525  -8.261
   73   HH12  ARG   9          HH12      ARG   9  12.427  12.917  -7.420
   74   HH21  ARG   9          HH21      ARG   9  14.769  15.112  -8.805
   75   HH22  ARG   9          HH22      ARG   9  13.421  14.958  -7.731
   76    H    CYS  10           H        CYS  10  15.066   8.383  -5.135
   77    HA   CYS  10           HA       CYS  10  12.698   6.702  -4.986
   78    HB2  CYS  10           HB2      CYS  10  14.658   5.164  -4.750
   79    HB3  CYS  10           HB3      CYS  10  15.144   6.073  -3.324
   80    H    ARG  11           H        ARG  11  11.334   8.018  -3.974
   81    HA   ARG  11           HA       ARG  11  12.005   9.005  -1.337
   82    HB2  ARG  11           HB2      ARG  11  11.681  10.787  -3.703
   83    HB3  ARG  11           HB3      ARG  11  10.994  11.316  -2.174
   84    HG2  ARG  11           HG2      ARG  11  13.218  11.028  -1.126
   85    HG3  ARG  11           HG3      ARG  11  13.874  10.636  -2.718
   86    HD2  ARG  11           HD2      ARG  11  13.511  12.794  -3.529
   87    HD3  ARG  11           HD3      ARG  11  12.361  13.180  -2.250
   88    HE   ARG  11           HE       ARG  11  15.218  13.420  -2.137
   89   HH11  ARG  11          HH11      ARG  11  12.313  12.993  -0.266
   90   HH12  ARG  11          HH12      ARG  11  12.997  13.644   1.186
   91   HH21  ARG  11          HH21      ARG  11  16.129  14.282  -0.231
   92   HH22  ARG  11          HH22      ARG  11  15.167  14.379   1.204
   93    HA   PRO  12           HA       PRO  12   7.742   8.341  -0.543
   94    HB2  PRO  12           HB2      PRO  12   7.158  10.318   1.223
   95    HB3  PRO  12           HB3      PRO  12   8.154   8.919   1.642
   96    HG2  PRO  12           HG2      PRO  12   8.999  11.690   0.886
   97    HG3  PRO  12           HG3      PRO  12   9.627  10.640   2.170
   98    HD2  PRO  12           HD2      PRO  12  10.887  10.947  -0.207
   99    HD3  PRO  12           HD3      PRO  12  10.938   9.428   0.711
  100    H    LYS  13           H        LYS  13   5.602   9.124  -0.881
  101    HA   LYS  13           HA       LYS  13   5.435  11.084  -2.996
  102    HB2  LYS  13           HB2      LYS  13   3.809   8.901  -1.997
  103    HB3  LYS  13           HB3      LYS  13   2.840  10.342  -2.272
  104    HG2  LYS  13           HG2      LYS  13   3.068  10.235  -4.510
  105    HG3  LYS  13           HG3      LYS  13   4.724   9.632  -4.422
  106    HD2  LYS  13           HD2      LYS  13   3.376   7.521  -3.408
  107    HD3  LYS  13           HD3      LYS  13   2.173   8.163  -4.528
  108    HE2  LYS  13           HE2      LYS  13   4.407   8.261  -6.058
  109    HE3  LYS  13           HE3      LYS  13   4.752   6.850  -5.059
  110    HZ1  LYS  13           HZ1      LYS  13   2.073   6.884  -6.092
  111    HZ2  LYS  13           HZ2      LYS  13   3.227   5.647  -6.121
  112    HZ3  LYS  13           HZ3      LYS  13   3.248   6.849  -7.309
  113    HA   PRO  14           HA       PRO  14   4.138  14.571  -0.671
  114    HB2  PRO  14           HB2      PRO  14   2.297  15.692  -2.322
  115    HB3  PRO  14           HB3      PRO  14   4.033  15.724  -2.657
  116    HG2  PRO  14           HG2      PRO  14   1.926  13.901  -3.754
  117    HG3  PRO  14           HG3      PRO  14   3.264  14.701  -4.598
  118    HD2  PRO  14           HD2      PRO  14   3.359  12.101  -3.847
  119    HD3  PRO  14           HD3      PRO  14   4.804  13.130  -3.904
  120    H    ASN  15           H        ASN  15   1.560  12.520  -1.950
  121    HA   ASN  15           HA       ASN  15  -0.324  13.502   0.038
  122    HB2  ASN  15           HB2      ASN  15  -0.774  11.279  -1.955
  123    HB3  ASN  15           HB3      ASN  15  -1.989  12.241  -1.118
  124   HD21  ASN  15          HD21      ASN  15  -0.582  11.782  -3.999
  125   HD22  ASN  15          HD22      ASN  15  -0.769  13.354  -4.689
  126    H    CYS  16           H        CYS  16   1.733  10.765  -0.562
  127    HA   CYS  16           HA       CYS  16   0.489   9.078   1.412
  128    HB2  CYS  16           HB2      CYS  16   3.071   8.850  -0.139
  129    HB3  CYS  16           HB3      CYS  16   2.528   7.639   1.019
  130    H    GLY  17           H        GLY  17   0.564   9.909   3.436
  131    HA2  GLY  17           HA2      GLY  17   3.092  11.000   4.435
  132    HA3  GLY  17           HA3      GLY  17   1.527  11.121   5.227
  133    HN1  NH2  18           H1       NH2  18   3.859   8.623   4.208
  134    HN2  NH2  18           H2       NH2  18   3.748   7.639   5.600
  Start of MODEL    3
    1    H1   ARG   1           H        ARG   1  -1.333   7.475  -3.752
    2    HA   ARG   1           HA       ARG   1  -1.631   4.674  -3.135
    3    HB2  ARG   1           HB2      ARG   1  -0.873   3.941  -5.412
    4    HB3  ARG   1           HB3      ARG   1  -2.511   4.581  -5.356
    5    HG2  ARG   1           HG2      ARG   1  -1.581   6.774  -6.137
    6    HG3  ARG   1           HG3      ARG   1  -0.042   5.948  -6.390
    7    HD2  ARG   1           HD2      ARG   1  -0.957   4.542  -8.051
    8    HD3  ARG   1           HD3      ARG   1  -2.610   4.984  -7.620
    9    HE   ARG   1           HE       ARG   1  -1.479   7.334  -8.394
   10   HH11  ARG   1          HH11      ARG   1  -1.813   4.192  -9.857
   11   HH12  ARG   1          HH12      ARG   1  -1.857   4.806 -11.475
   12   HH21  ARG   1          HH21      ARG   1  -1.537   8.155 -10.522
   13   HH22  ARG   1          HH22      ARG   1  -1.700   7.060 -11.853
   14    H    CYS   2           H        CYS   2   0.215   3.974  -2.284
   15    HA   CYS   2           HA       CYS   2   2.583   5.639  -2.473
   16    HB2  CYS   2           HB2      CYS   2   2.135   3.097  -0.894
   17    HB3  CYS   2           HB3      CYS   2   3.487   4.209  -0.715
   18    H    LYS   3           H        LYS   3   2.737   5.079  -4.830
   19    HA   LYS   3           HA       LYS   3   3.439   2.489  -5.693
   20    HB2  LYS   3           HB2      LYS   3   3.831   5.238  -6.842
   21    HB3  LYS   3           HB3      LYS   3   4.512   3.825  -7.638
   22    HG2  LYS   3           HG2      LYS   3   2.341   2.873  -7.951
   23    HG3  LYS   3           HG3      LYS   3   1.594   4.132  -6.967
   24    HD2  LYS   3           HD2      LYS   3   1.240   4.594  -9.322
   25    HD3  LYS   3           HD3      LYS   3   2.302   5.815  -8.619
   26    HE2  LYS   3           HE2      LYS   3   4.249   4.599  -9.516
   27    HE3  LYS   3           HE3      LYS   3   3.158   3.432 -10.259
   28    HZ1  LYS   3           HZ1      LYS   3   2.735   4.809 -11.940
   29    HZ2  LYS   3           HZ2      LYS   3   4.079   5.698 -11.428
   30    HZ3  LYS   3           HZ3      LYS   3   2.527   6.151 -10.929
   31    H    THR   4           H        THR   4   5.573   1.866  -6.581
   32    HA   THR   4           HA       THR   4   7.594   2.165  -4.588
   33    HB   THR   4           HB       THR   4   8.991   0.774  -6.108
   34    HG1  THR   4           HG1      THR   4   6.697   0.642  -7.780
   35   HG21  THR   4          HG21      THR   4   6.254  -0.447  -5.947
   36   HG22  THR   4          HG22      THR   4   7.190  -0.114  -4.490
   37   HG23  THR   4          HG23      THR   4   7.825  -1.213  -5.713
   38    H    CYS   5           H        CYS   5   9.717   3.002  -4.869
   39    HA   CYS   5           HA       CYS   5   9.828   5.537  -6.063
   40    HB2  CYS   5           HB2      CYS   5  12.007   3.703  -5.062
   41    HB3  CYS   5           HB3      CYS   5  12.316   5.341  -5.630
   42    H    SER   6           H        SER   6  11.400   6.245  -7.720
   43    HA   SER   6           HA       SER   6  11.146   4.575 -10.071
   44    HB2  SER   6           HB2      SER   6  12.010   7.405  -9.566
   45    HB3  SER   6           HB3      SER   6  12.380   6.633 -11.109
   46    HG   SER   6           HG       SER   6  10.059   7.677 -10.260
   47    H    LYS   7           H        LYS   7  13.092   4.498 -11.589
   48    HA   LYS   7           HA       LYS   7  15.193   3.107 -10.264
   49    HB2  LYS   7           HB2      LYS   7  14.682   3.928 -13.107
   50    HB3  LYS   7           HB3      LYS   7  16.227   3.227 -12.643
   51    HG2  LYS   7           HG2      LYS   7  15.085   1.228 -11.837
   52    HG3  LYS   7           HG3      LYS   7  13.531   1.932 -12.286
   53    HD2  LYS   7           HD2      LYS   7  14.284   2.027 -14.633
   54    HD3  LYS   7           HD3      LYS   7  15.799   1.256 -14.161
   55    HE2  LYS   7           HE2      LYS   7  14.450  -0.482 -14.994
   56    HE3  LYS   7           HE3      LYS   7  14.374  -0.634 -13.239
   57    HZ1  LYS   7           HZ1      LYS   7  12.270   0.774 -13.447
   58    HZ2  LYS   7           HZ2      LYS   7  12.182  -0.847 -13.919
   59    HZ3  LYS   7           HZ3      LYS   7  12.304   0.367 -15.089
   60    H    GLY   8           H        GLY   8  16.502   4.275  -8.969
   61    HA2  GLY   8           HA2      GLY   8  18.527   5.499  -8.790
   62    HA3  GLY   8           HA3      GLY   8  18.105   6.364 -10.260
   63    H    ARG   9           H        ARG   9  15.338   6.819  -9.238
   64    HA   ARG   9           HA       ARG   9  15.998   8.975  -7.340
   65    HB2  ARG   9           HB2      ARG   9  14.005   8.851  -9.593
   66    HB3  ARG   9           HB3      ARG   9  13.854  10.028  -8.296
   67    HG2  ARG   9           HG2      ARG   9  15.820  11.130  -8.902
   68    HG3  ARG   9           HG3      ARG   9  16.383   9.771  -9.877
   69    HD2  ARG   9           HD2      ARG   9  15.655  11.413 -11.410
   70    HD3  ARG   9           HD3      ARG   9  14.388  10.187 -11.373
   71    HE   ARG   9           HE       ARG   9  13.868  12.287  -9.524
   72   HH11  ARG   9          HH11      ARG   9  13.720  11.441 -12.898
   73   HH12  ARG   9          HH12      ARG   9  12.433  12.545 -13.253
   74   HH21  ARG   9          HH21      ARG   9  12.174  13.746  -9.979
   75   HH22  ARG   9          HH22      ARG   9  11.555  13.857 -11.591
   76    H    CYS  10           H        CYS  10  15.160   8.776  -5.378
   77    HA   CYS  10           HA       CYS  10  12.549   7.500  -5.041
   78    HB2  CYS  10           HB2      CYS  10  14.233   5.738  -4.662
   79    HB3  CYS  10           HB3      CYS  10  14.997   6.740  -3.432
   80    H    ARG  11           H        ARG  11  11.373   9.064  -4.150
   81    HA   ARG  11           HA       ARG  11  12.405  10.385  -1.748
   82    HB2  ARG  11           HB2      ARG  11  11.541  11.696  -4.279
   83    HB3  ARG  11           HB3      ARG  11  11.082  12.463  -2.765
   84    HG2  ARG  11           HG2      ARG  11  13.064  13.506  -3.129
   85    HG3  ARG  11           HG3      ARG  11  13.640  12.109  -2.219
   86    HD2  ARG  11           HD2      ARG  11  14.513  11.083  -4.090
   87    HD3  ARG  11           HD3      ARG  11  13.432  11.936  -5.190
   88    HE   ARG  11           HE       ARG  11  14.956  13.643  -5.315
   89   HH11  ARG  11          HH11      ARG  11  15.749  11.589  -2.619
   90   HH12  ARG  11          HH12      ARG  11  17.271  12.360  -2.312
   91   HH21  ARG  11          HH21      ARG  11  16.955  14.665  -4.921
   92   HH22  ARG  11          HH22      ARG  11  17.955  14.111  -3.622
   93    HA   PRO  12           HA       PRO  12   8.418   9.711  -0.047
   94    HB2  PRO  12           HB2      PRO  12   8.024  11.950   1.437
   95    HB3  PRO  12           HB3      PRO  12   9.180  10.690   1.887
   96    HG2  PRO  12           HG2      PRO  12   9.669  13.309   0.524
   97    HG3  PRO  12           HG3      PRO  12  10.595  12.533   1.821
   98    HD2  PRO  12           HD2      PRO  12  11.373  12.456  -0.772
   99    HD3  PRO  12           HD3      PRO  12  11.702  11.131   0.365
  100    H    LYS  13           H        LYS  13   6.291  10.017  -0.508
  101    HA   LYS  13           HA       LYS  13   5.640  11.890  -2.609
  102    HB2  LYS  13           HB2      LYS  13   4.304   9.568  -1.316
  103    HB3  LYS  13           HB3      LYS  13   3.273  10.771  -2.079
  104    HG2  LYS  13           HG2      LYS  13   3.990  10.259  -4.178
  105    HG3  LYS  13           HG3      LYS  13   5.584   9.739  -3.630
  106    HD2  LYS  13           HD2      LYS  13   4.202   7.822  -2.478
  107    HD3  LYS  13           HD3      LYS  13   3.013   8.230  -3.716
  108    HE2  LYS  13           HE2      LYS  13   5.892   7.692  -4.382
  109    HE3  LYS  13           HE3      LYS  13   4.705   6.396  -4.262
  110    HZ1  LYS  13           HZ1      LYS  13   5.109   7.370  -6.544
  111    HZ2  LYS  13           HZ2      LYS  13   4.286   8.748  -6.007
  112    HZ3  LYS  13           HZ3      LYS  13   3.493   7.253  -6.054
  113    HA   PRO  14           HA       PRO  14   3.797  15.073  -0.217
  114    HB2  PRO  14           HB2      PRO  14   1.694  15.797  -1.773
  115    HB3  PRO  14           HB3      PRO  14   3.371  16.168  -2.191
  116    HG2  PRO  14           HG2      PRO  14   1.612  13.959  -3.187
  117    HG3  PRO  14           HG3      PRO  14   2.726  14.998  -4.095
  118    HD2  PRO  14           HD2      PRO  14   3.366  12.473  -3.355
  119    HD3  PRO  14           HD3      PRO  14   4.575  13.767  -3.480
  120    H    ASN  15           H        ASN  15   1.622  12.537  -1.364
  121    HA   ASN  15           HA       ASN  15  -0.225  13.104   0.840
  122    HB2  ASN  15           HB2      ASN  15  -1.671  11.384  -0.361
  123    HB3  ASN  15           HB3      ASN  15  -1.390  12.898  -1.215
  124   HD21  ASN  15          HD21      ASN  15  -0.399   9.537  -0.979
  125   HD22  ASN  15          HD22      ASN  15   0.170   9.398  -2.605
  126    H    CYS  16           H        CYS  16   2.063  10.756  -0.319
  127    HA   CYS  16           HA       CYS  16   1.427   9.020   1.975
  128    HB2  CYS  16           HB2      CYS  16   1.111   7.846  -0.118
  129    HB3  CYS  16           HB3      CYS  16   2.707   8.335  -0.677
  130    H    GLY  17           H        GLY  17   2.884   8.905   3.552
  131    HA2  GLY  17           HA2      GLY  17   5.716   9.076   3.003
  132    HA3  GLY  17           HA3      GLY  17   5.076  10.453   3.887
  133    HN1  NH2  18           H1       NH2  18   5.521  10.292   5.973
  134    HN2  NH2  18           H2       NH2  18   5.471   8.893   6.951
  Start of MODEL    4
    1    H1   ARG   1           H        ARG   1   5.587  -0.393   0.332
    2    HA   ARG   1           HA       ARG   1   5.543   2.406   1.065
    3    HB2  ARG   1           HB2      ARG   1   6.545   2.789  -1.127
    4    HB3  ARG   1           HB3      ARG   1   7.396   1.510  -0.272
    5    HG2  ARG   1           HG2      ARG   1   5.966  -0.121  -1.587
    6    HG3  ARG   1           HG3      ARG   1   5.505   1.260  -2.585
    7    HD2  ARG   1           HD2      ARG   1   7.622   1.511  -3.455
    8    HD3  ARG   1           HD3      ARG   1   8.395   0.732  -2.074
    9    HE   ARG   1           HE       ARG   1   7.478  -0.533  -4.455
   10   HH11  ARG   1          HH11      ARG   1   7.903  -0.999  -1.031
   11   HH12  ARG   1          HH12      ARG   1   8.050  -2.721  -1.153
   12   HH21  ARG   1          HH21      ARG   1   7.672  -2.799  -4.628
   13   HH22  ARG   1          HH22      ARG   1   7.919  -3.744  -3.198
   14    H    CYS   2           H        CYS   2   4.615   3.988  -0.563
   15    HA   CYS   2           HA       CYS   2   1.838   3.263  -1.019
   16    HB2  CYS   2           HB2      CYS   2   2.695   5.467   0.033
   17    HB3  CYS   2           HB3      CYS   2   3.049   5.949  -1.623
   18    H    LYS   3           H        LYS   3   4.222   5.068  -2.964
   19    HA   LYS   3           HA       LYS   3   3.139   3.724  -5.353
   20    HB2  LYS   3           HB2      LYS   3   2.756   6.269  -5.028
   21    HB3  LYS   3           HB3      LYS   3   4.461   6.422  -5.432
   22    HG2  LYS   3           HG2      LYS   3   3.301   6.764  -7.441
   23    HG3  LYS   3           HG3      LYS   3   3.933   5.119  -7.540
   24    HD2  LYS   3           HD2      LYS   3   1.727   4.930  -8.289
   25    HD3  LYS   3           HD3      LYS   3   1.657   4.392  -6.610
   26    HE2  LYS   3           HE2      LYS   3  -0.135   5.818  -6.658
   27    HE3  LYS   3           HE3      LYS   3   1.138   6.931  -6.164
   28    HZ1  LYS   3           HZ1      LYS   3   0.806   6.664  -9.023
   29    HZ2  LYS   3           HZ2      LYS   3   1.007   8.054  -8.082
   30    HZ3  LYS   3           HZ3      LYS   3  -0.522   7.345  -8.227
   31    H    THR   4           H        THR   4   4.619   3.269  -7.061
   32    HA   THR   4           HA       THR   4   7.104   2.252  -6.177
   33    HB   THR   4           HB       THR   4   5.846   1.299  -8.087
   34    HG1  THR   4           HG1      THR   4   8.353   2.131  -9.086
   35   HG21  THR   4          HG21      THR   4   5.432   3.732  -8.999
   36   HG22  THR   4          HG22      THR   4   5.554   2.365 -10.107
   37   HG23  THR   4          HG23      THR   4   6.937   3.431  -9.865
   38    H    CYS   5           H        CYS   5   9.227   2.874  -6.757
   39    HA   CYS   5           HA       CYS   5   9.497   5.761  -7.237
   40    HB2  CYS   5           HB2      CYS   5  11.159   3.756  -5.748
   41    HB3  CYS   5           HB3      CYS   5  11.902   5.232  -6.354
   42    H    SER   6           H        SER   6  11.651   6.343  -8.324
   43    HA   SER   6           HA       SER   6  11.754   4.875 -10.833
   44    HB2  SER   6           HB2      SER   6  13.311   7.370 -10.152
   45    HB3  SER   6           HB3      SER   6  12.851   6.773 -11.747
   46    HG   SER   6           HG       SER   6  11.117   7.923 -11.542
   47    H    LYS   7           H        LYS   7  13.905   4.501 -11.855
   48    HA   LYS   7           HA       LYS   7  15.521   2.906 -10.154
   49    HB2  LYS   7           HB2      LYS   7  15.083   2.797 -12.751
   50    HB3  LYS   7           HB3      LYS   7  16.495   3.842 -12.822
   51    HG2  LYS   7           HG2      LYS   7  17.366   1.706 -13.079
   52    HG3  LYS   7           HG3      LYS   7  17.641   2.066 -11.373
   53    HD2  LYS   7           HD2      LYS   7  15.399   0.889 -10.965
   54    HD3  LYS   7           HD3      LYS   7  15.576   0.266 -12.606
   55    HE2  LYS   7           HE2      LYS   7  17.763  -0.684 -11.976
   56    HE3  LYS   7           HE3      LYS   7  17.517  -0.111 -10.327
   57    HZ1  LYS   7           HZ1      LYS   7  16.893  -2.539 -11.012
   58    HZ2  LYS   7           HZ2      LYS   7  15.460  -1.812 -11.539
   59    HZ3  LYS   7           HZ3      LYS   7  15.928  -1.679  -9.920
   60    H    GLY   8           H        GLY   8  16.584   3.969  -8.558
   61    HA2  GLY   8           HA2      GLY   8  18.662   4.941  -7.917
   62    HA3  GLY   8           HA3      GLY   8  18.668   5.848  -9.422
   63    H    ARG   9           H        ARG   9  15.810   6.605  -9.017
   64    HA   ARG   9           HA       ARG   9  16.269   8.681  -6.978
   65    HB2  ARG   9           HB2      ARG   9  14.856   8.750  -9.625
   66    HB3  ARG   9           HB3      ARG   9  14.434   9.901  -8.363
   67    HG2  ARG   9           HG2      ARG   9  16.557  10.888  -8.398
   68    HG3  ARG   9           HG3      ARG   9  17.264   9.535  -9.283
   69    HD2  ARG   9           HD2      ARG   9  16.199  10.154 -11.287
   70    HD3  ARG   9           HD3      ARG   9  15.088  11.242 -10.455
   71    HE   ARG   9           HE       ARG   9  17.762  11.830 -11.326
   72   HH11  ARG   9          HH11      ARG   9  15.235  12.665  -9.082
   73   HH12  ARG   9          HH12      ARG   9  15.805  14.283  -8.840
   74   HH21  ARG   9          HH21      ARG   9  18.523  13.958 -11.016
   75   HH22  ARG   9          HH22      ARG   9  17.675  15.017  -9.941
   76    H    CYS  10           H        CYS  10  15.054   8.522  -5.223
   77    HA   CYS  10           HA       CYS  10  12.281   7.644  -5.444
   78    HB2  CYS  10           HB2      CYS  10  13.625   5.607  -4.952
   79    HB3  CYS  10           HB3      CYS  10  14.203   6.380  -3.480
   80    H    ARG  11           H        ARG  11  11.139   9.201  -4.519
   81    HA   ARG  11           HA       ARG  11  12.154  10.397  -2.027
   82    HB2  ARG  11           HB2      ARG  11  11.127  11.705  -4.496
   83    HB3  ARG  11           HB3      ARG  11  10.702  12.431  -2.953
   84    HG2  ARG  11           HG2      ARG  11  12.999  12.751  -2.389
   85    HG3  ARG  11           HG3      ARG  11  13.525  11.816  -3.790
   86    HD2  ARG  11           HD2      ARG  11  12.531  13.506  -5.271
   87    HD3  ARG  11           HD3      ARG  11  12.042  14.443  -3.859
   88    HE   ARG  11           HE       ARG  11  14.186  15.218  -3.679
   89   HH11  ARG  11          HH11      ARG  11  14.161  12.420  -5.749
   90   HH12  ARG  11          HH12      ARG  11  15.819  12.592  -6.220
   91   HH21  ARG  11          HH21      ARG  11  16.371  15.456  -4.291
   92   HH22  ARG  11          HH22      ARG  11  17.076  14.318  -5.390
   93    HA   PRO  12           HA       PRO  12   8.276   9.530  -0.166
   94    HB2  PRO  12           HB2      PRO  12   7.856  11.730   1.368
   95    HB3  PRO  12           HB3      PRO  12   9.081  10.514   1.749
   96    HG2  PRO  12           HG2      PRO  12   9.401  13.171   0.405
   97    HG3  PRO  12           HG3      PRO  12  10.414  12.417   1.651
   98    HD2  PRO  12           HD2      PRO  12  11.082  12.408  -0.974
   99    HD3  PRO  12           HD3      PRO  12  11.513  11.083   0.126
  100    H    LYS  13           H        LYS  13   6.121   9.754  -0.531
  101    HA   LYS  13           HA       LYS  13   5.276  11.485  -2.642
  102    HB2  LYS  13           HB2      LYS  13   4.032   9.359  -0.977
  103    HB3  LYS  13           HB3      LYS  13   2.949  10.516  -1.741
  104    HG2  LYS  13           HG2      LYS  13   3.063   8.804  -3.288
  105    HG3  LYS  13           HG3      LYS  13   4.243   9.966  -3.900
  106    HD2  LYS  13           HD2      LYS  13   5.205   7.881  -2.017
  107    HD3  LYS  13           HD3      LYS  13   4.796   7.377  -3.657
  108    HE2  LYS  13           HE2      LYS  13   6.485   9.798  -3.318
  109    HE3  LYS  13           HE3      LYS  13   7.222   8.227  -3.009
  110    HZ1  LYS  13           HZ1      LYS  13   7.591   8.709  -5.269
  111    HZ2  LYS  13           HZ2      LYS  13   5.990   9.192  -5.524
  112    HZ3  LYS  13           HZ3      LYS  13   6.349   7.561  -5.253
  113    HA   PRO  14           HA       PRO  14   3.774  14.974  -0.444
  114    HB2  PRO  14           HB2      PRO  14   1.538  15.602  -1.852
  115    HB3  PRO  14           HB3      PRO  14   3.171  15.862  -2.475
  116    HG2  PRO  14           HG2      PRO  14   1.263  13.625  -3.037
  117    HG3  PRO  14           HG3      PRO  14   2.302  14.518  -4.162
  118    HD2  PRO  14           HD2      PRO  14   2.952  12.067  -3.214
  119    HD3  PRO  14           HD3      PRO  14   4.173  13.294  -3.605
  120    H    ASN  15           H        ASN  15   1.378  12.453  -1.115
  121    HA   ASN  15           HA       ASN  15  -0.145  13.283   1.251
  122    HB2  ASN  15           HB2      ASN  15  -0.816  11.727  -1.214
  123    HB3  ASN  15           HB3      ASN  15  -1.743  11.431   0.255
  124   HD21  ASN  15          HD21      ASN  15  -2.333  13.622   1.380
  125   HD22  ASN  15          HD22      ASN  15  -3.065  14.783   0.330
  126    H    CYS  16           H        CYS  16   1.804  10.715  -0.049
  127    HA   CYS  16           HA       CYS  16   1.243   9.043   2.300
  128    HB2  CYS  16           HB2      CYS  16   2.255   8.470  -0.456
  129    HB3  CYS  16           HB3      CYS  16   2.706   7.388   0.859
  130    H    GLY  17           H        GLY  17   2.640   9.073   3.926
  131    HA2  GLY  17           HA2      GLY  17   5.103   8.568   4.347
  132    HA3  GLY  17           HA3      GLY  17   5.384  10.013   3.388
  133    HN1  NH2  18           H1       NH2  18   5.736   9.117   6.346
  134    HN2  NH2  18           H2       NH2  18   5.192  10.452   7.263
  Start of MODEL    5
    1    H1   ARG   1           H        ARG   1   3.903   0.501   0.444
    2    HA   ARG   1           HA       ARG   1   1.894   1.787   2.170
    3    HB2  ARG   1           HB2      ARG   1   4.885   2.005   2.048
    4    HB3  ARG   1           HB3      ARG   1   3.925   3.310   2.728
    5    HG2  ARG   1           HG2      ARG   1   2.959   1.737   4.347
    6    HG3  ARG   1           HG3      ARG   1   3.974   0.456   3.682
    7    HD2  ARG   1           HD2      ARG   1   5.970   1.622   4.347
    8    HD3  ARG   1           HD3      ARG   1   5.028   3.022   4.859
    9    HE   ARG   1           HE       ARG   1   4.029   1.021   6.377
   10   HH11  ARG   1          HH11      ARG   1   7.257   2.170   5.757
   11   HH12  ARG   1          HH12      ARG   1   7.860   1.709   7.315
   12   HH21  ARG   1          HH21      ARG   1   4.810   0.409   8.431
   13   HH22  ARG   1          HH22      ARG   1   6.467   0.707   8.834
   14    H    CYS   2           H        CYS   2   4.382   2.617  -0.249
   15    HA   CYS   2           HA       CYS   2   2.531   4.648  -1.311
   16    HB2  CYS   2           HB2      CYS   2   5.534   4.907  -1.044
   17    HB3  CYS   2           HB3      CYS   2   4.470   6.088  -1.799
   18    H    LYS   3           H        LYS   3   3.283   5.365  -3.575
   19    HA   LYS   3           HA       LYS   3   3.274   3.072  -5.249
   20    HB2  LYS   3           HB2      LYS   3   3.495   6.027  -5.750
   21    HB3  LYS   3           HB3      LYS   3   3.679   4.875  -7.066
   22    HG2  LYS   3           HG2      LYS   3   1.405   3.943  -6.149
   23    HG3  LYS   3           HG3      LYS   3   1.266   5.568  -5.473
   24    HD2  LYS   3           HD2      LYS   3   0.262   5.859  -7.523
   25    HD3  LYS   3           HD3      LYS   3   1.928   6.302  -7.901
   26    HE2  LYS   3           HE2      LYS   3   1.502   4.861  -9.623
   27    HE3  LYS   3           HE3      LYS   3   2.128   3.725  -8.429
   28    HZ1  LYS   3           HZ1      LYS   3   0.244   2.622  -8.840
   29    HZ2  LYS   3           HZ2      LYS   3  -0.526   3.959  -9.532
   30    HZ3  LYS   3           HZ3      LYS   3  -0.499   3.776  -7.849
   31    H    THR   4           H        THR   4   4.852   2.325  -6.687
   32    HA   THR   4           HA       THR   4   7.447   2.132  -5.738
   33    HB   THR   4           HB       THR   4   6.792   1.916  -8.671
   34    HG1  THR   4           HG1      THR   4   5.554   0.253  -8.252
   35   HG21  THR   4          HG21      THR   4   8.369  -0.138  -8.232
   36   HG22  THR   4          HG22      THR   4   8.858   0.802  -6.822
   37   HG23  THR   4          HG23      THR   4   9.044   1.478  -8.440
   38    H    CYS   5           H        CYS   5   9.452   2.966  -6.546
   39    HA   CYS   5           HA       CYS   5   9.193   5.715  -7.562
   40    HB2  CYS   5           HB2      CYS   5  11.419   6.100  -6.548
   41    HB3  CYS   5           HB3      CYS   5  10.219   5.599  -5.362
   42    H    SER   6           H        SER   6  11.271   6.444  -8.746
   43    HA   SER   6           HA       SER   6  11.597   4.663 -10.997
   44    HB2  SER   6           HB2      SER   6  13.143   6.654 -11.737
   45    HB3  SER   6           HB3      SER   6  11.391   6.859 -11.726
   46    HG   SER   6           HG       SER   6  11.529   8.144 -10.018
   47    H    LYS   7           H        LYS   7  13.831   4.396 -11.950
   48    HA   LYS   7           HA       LYS   7  15.488   3.078 -10.045
   49    HB2  LYS   7           HB2      LYS   7  15.656   3.623 -12.985
   50    HB3  LYS   7           HB3      LYS   7  17.072   3.021 -12.135
   51    HG2  LYS   7           HG2      LYS   7  14.416   1.640 -11.963
   52    HG3  LYS   7           HG3      LYS   7  15.563   1.313 -13.263
   53    HD2  LYS   7           HD2      LYS   7  17.254   0.984 -11.299
   54    HD3  LYS   7           HD3      LYS   7  15.793   0.742 -10.338
   55    HE2  LYS   7           HE2      LYS   7  15.119  -0.929 -12.173
   56    HE3  LYS   7           HE3      LYS   7  16.813  -0.866 -12.657
   57    HZ1  LYS   7           HZ1      LYS   7  15.969  -1.483  -9.886
   58    HZ2  LYS   7           HZ2      LYS   7  17.490  -1.717 -10.587
   59    HZ3  LYS   7           HZ3      LYS   7  16.185  -2.682 -11.059
   60    H    GLY   8           H        GLY   8  16.768   4.107  -8.660
   61    HA2  GLY   8           HA2      GLY   8  18.724   5.331  -8.158
   62    HA3  GLY   8           HA3      GLY   8  18.545   6.196  -9.678
   63    H    ARG   9           H        ARG   9  15.661   6.695  -9.097
   64    HA   ARG   9           HA       ARG   9  16.051   8.849  -7.124
   65    HB2  ARG   9           HB2      ARG   9  14.469   8.745  -9.677
   66    HB3  ARG   9           HB3      ARG   9  14.066   9.900  -8.414
   67    HG2  ARG   9           HG2      ARG   9  16.081  11.044  -8.648
   68    HG3  ARG   9           HG3      ARG   9  16.851   9.702  -9.496
   69    HD2  ARG   9           HD2      ARG   9  15.338  10.069 -11.403
   70    HD3  ARG   9           HD3      ARG   9  14.626  11.443 -10.555
   71    HE   ARG   9           HE       ARG   9  17.126  11.385 -11.962
   72   HH11  ARG   9          HH11      ARG   9  15.331  12.922  -9.404
   73   HH12  ARG   9          HH12      ARG   9  16.233  14.400  -9.483
   74   HH21  ARG   9          HH21      ARG   9  18.320  13.326 -12.074
   75   HH22  ARG   9          HH22      ARG   9  17.932  14.628 -11.003
   76    H    CYS  10           H        CYS  10  15.079   8.388  -5.268
   77    HA   CYS  10           HA       CYS  10  12.320   7.429  -5.313
   78    HB2  CYS  10           HB2      CYS  10  14.526   6.122  -3.707
   79    HB3  CYS  10           HB3      CYS  10  12.810   5.777  -3.526
   80    H    ARG  11           H        ARG  11  11.164   8.803  -4.150
   81    HA   ARG  11           HA       ARG  11  12.180   9.733  -1.578
   82    HB2  ARG  11           HB2      ARG  11  11.621  11.465  -3.938
   83    HB3  ARG  11           HB3      ARG  11  11.157  12.063  -2.350
   84    HG2  ARG  11           HG2      ARG  11  13.395  11.989  -1.570
   85    HG3  ARG  11           HG3      ARG  11  13.926  11.084  -2.991
   86    HD2  ARG  11           HD2      ARG  11  12.665  13.768  -3.338
   87    HD3  ARG  11           HD3      ARG  11  14.346  13.661  -2.822
   88    HE   ARG  11           HE       ARG  11  14.265  12.038  -4.981
   89   HH11  ARG  11          HH11      ARG  11  13.254  15.323  -4.421
   90   HH12  ARG  11          HH12      ARG  11  13.539  15.827  -6.054
   91   HH21  ARG  11          HH21      ARG  11  14.642  12.689  -7.135
   92   HH22  ARG  11          HH22      ARG  11  14.327  14.328  -7.596
   93    HA   PRO  12           HA       PRO  12   8.033   9.270  -0.223
   94    HB2  PRO  12           HB2      PRO  12   7.759  11.316   1.541
   95    HB3  PRO  12           HB3      PRO  12   8.747   9.888   1.871
   96    HG2  PRO  12           HG2      PRO  12   9.594  12.600   0.927
   97    HG3  PRO  12           HG3      PRO  12  10.342  11.558   2.151
   98    HD2  PRO  12           HD2      PRO  12  11.294  11.751  -0.377
   99    HD3  PRO  12           HD3      PRO  12  11.405  10.255   0.575
  100    H    LYS  13           H        LYS  13   5.986   9.867  -0.757
  101    HA   LYS  13           HA       LYS  13   5.679  12.068  -2.603
  102    HB2  LYS  13           HB2      LYS  13   4.024   9.754  -1.729
  103    HB3  LYS  13           HB3      LYS  13   3.181  11.155  -2.377
  104    HG2  LYS  13           HG2      LYS  13   4.471  11.000  -4.434
  105    HG3  LYS  13           HG3      LYS  13   5.358   9.621  -3.783
  106    HD2  LYS  13           HD2      LYS  13   3.762   8.523  -5.000
  107    HD3  LYS  13           HD3      LYS  13   2.923   8.654  -3.453
  108    HE2  LYS  13           HE2      LYS  13   1.288   9.416  -4.858
  109    HE3  LYS  13           HE3      LYS  13   2.097  10.935  -4.480
  110    HZ1  LYS  13           HZ1      LYS  13   1.633   9.945  -6.976
  111    HZ2  LYS  13           HZ2      LYS  13   3.269   9.597  -6.721
  112    HZ3  LYS  13           HZ3      LYS  13   2.714  11.188  -6.588
  113    HA   PRO  14           HA       PRO  14   3.998  15.080   0.111
  114    HB2  PRO  14           HB2      PRO  14   2.095  16.235  -1.444
  115    HB3  PRO  14           HB3      PRO  14   3.827  16.472  -1.710
  116    HG2  PRO  14           HG2      PRO  14   1.931  14.625  -3.108
  117    HG3  PRO  14           HG3      PRO  14   3.205  15.649  -3.794
  118    HD2  PRO  14           HD2      PRO  14   3.534  12.992  -3.387
  119    HD3  PRO  14           HD3      PRO  14   4.873  14.151  -3.257
  120    H    ASN  15           H        ASN  15   1.652  12.996  -1.521
  121    HA   ASN  15           HA       ASN  15  -0.350  13.517   0.528
  122    HB2  ASN  15           HB2      ASN  15  -0.385  11.894  -2.019
  123    HB3  ASN  15           HB3      ASN  15  -1.726  11.906  -0.877
  124   HD21  ASN  15          HD21      ASN  15  -0.529  13.274  -3.618
  125   HD22  ASN  15          HD22      ASN  15  -1.426  14.750  -3.616
  126    H    CYS  16           H        CYS  16   1.952  11.084  -0.406
  127    HA   CYS  16           HA       CYS  16   0.827   9.059   1.329
  128    HB2  CYS  16           HB2      CYS  16   2.177   8.762  -0.912
  129    HB3  CYS  16           HB3      CYS  16   3.573   8.863   0.155
  130    H    GLY  17           H        GLY  17   4.044  10.606   1.166
  131    HA2  GLY  17           HA2      GLY  17   4.206  10.298   4.100
  132    HA3  GLY  17           HA3      GLY  17   5.595  10.299   3.023
  133    HN1  NH2  18           H1       NH2  18   2.807  12.429   3.679
  134    HN2  NH2  18           H2       NH2  18   3.674  13.896   3.784
  Start of MODEL    6
    1    H1   ARG   1           H        ARG   1   3.839   0.716   2.917
    2    HA   ARG   1           HA       ARG   1   4.238   0.036   0.703
    3    HB2  ARG   1           HB2      ARG   1   1.260  -0.290   1.114
    4    HB3  ARG   1           HB3      ARG   1   2.239  -1.183  -0.044
    5    HG2  ARG   1           HG2      ARG   1   2.623  -1.268   2.942
    6    HG3  ARG   1           HG3      ARG   1   1.712  -2.456   2.007
    7    HD2  ARG   1           HD2      ARG   1   3.889  -2.665   0.616
    8    HD3  ARG   1           HD3      ARG   1   4.654  -1.899   2.008
    9    HE   ARG   1           HE       ARG   1   3.032  -4.156   2.716
   10   HH11  ARG   1          HH11      ARG   1   6.167  -3.151   1.583
   11   HH12  ARG   1          HH12      ARG   1   6.981  -4.560   2.182
   12   HH21  ARG   1          HH21      ARG   1   4.090  -6.014   3.507
   13   HH22  ARG   1          HH22      ARG   1   5.796  -6.188   3.275
   14    H    CYS   2           H        CYS   2   4.341   2.679   0.407
   15    HA   CYS   2           HA       CYS   2   2.331   3.776  -1.281
   16    HB2  CYS   2           HB2      CYS   2   4.223   4.921   0.179
   17    HB3  CYS   2           HB3      CYS   2   5.128   4.820  -1.328
   18    H    LYS   3           H        LYS   3   2.822   4.586  -3.509
   19    HA   LYS   3           HA       LYS   3   3.262   2.505  -5.275
   20    HB2  LYS   3           HB2      LYS   3   2.322   4.962  -5.594
   21    HB3  LYS   3           HB3      LYS   3   3.966   5.278  -6.131
   22    HG2  LYS   3           HG2      LYS   3   3.777   3.856  -7.960
   23    HG3  LYS   3           HG3      LYS   3   2.389   3.006  -7.277
   24    HD2  LYS   3           HD2      LYS   3   1.623   4.425  -9.059
   25    HD3  LYS   3           HD3      LYS   3   1.061   5.093  -7.526
   26    HE2  LYS   3           HE2      LYS   3   1.897   6.853  -8.987
   27    HE3  LYS   3           HE3      LYS   3   2.903   6.700  -7.549
   28    HZ1  LYS   3           HZ1      LYS   3   4.633   5.807  -8.743
   29    HZ2  LYS   3           HZ2      LYS   3   4.001   6.904  -9.866
   30    HZ3  LYS   3           HZ3      LYS   3   3.645   5.255 -10.001
   31    H    THR   4           H        THR   4   4.986   2.173  -6.840
   32    HA   THR   4           HA       THR   4   7.532   2.021  -5.588
   33    HB   THR   4           HB       THR   4   7.268   1.719  -8.548
   34    HG1  THR   4           HG1      THR   4   6.268  -0.292  -8.259
   35   HG21  THR   4          HG21      THR   4   9.082   0.922  -6.473
   36   HG22  THR   4          HG22      THR   4   9.255   0.764  -8.222
   37   HG23  THR   4          HG23      THR   4   8.457  -0.506  -7.295
   38    H    CYS   5           H        CYS   5   9.527   2.945  -6.368
   39    HA   CYS   5           HA       CYS   5   9.140   5.689  -7.329
   40    HB2  CYS   5           HB2      CYS   5  11.411   6.101  -6.423
   41    HB3  CYS   5           HB3      CYS   5  10.291   5.516  -5.196
   42    H    SER   6           H        SER   6  11.186   6.518  -8.554
   43    HA   SER   6           HA       SER   6  11.401   4.884 -10.926
   44    HB2  SER   6           HB2      SER   6  11.147   7.462 -10.806
   45    HB3  SER   6           HB3      SER   6  12.882   7.466 -10.489
   46    HG   SER   6           HG       SER   6  11.540   7.043 -12.824
   47    H    LYS   7           H        LYS   7  13.623   4.761 -12.004
   48    HA   LYS   7           HA       LYS   7  15.355   3.296 -10.267
   49    HB2  LYS   7           HB2      LYS   7  15.994   4.197 -13.072
   50    HB3  LYS   7           HB3      LYS   7  16.639   2.805 -12.212
   51    HG2  LYS   7           HG2      LYS   7  13.783   3.138 -13.113
   52    HG3  LYS   7           HG3      LYS   7  15.013   2.158 -13.916
   53    HD2  LYS   7           HD2      LYS   7  14.096   1.750 -11.070
   54    HD3  LYS   7           HD3      LYS   7  13.471   0.853 -12.456
   55    HE2  LYS   7           HE2      LYS   7  16.324   0.898 -11.474
   56    HE3  LYS   7           HE3      LYS   7  15.185  -0.440 -11.331
   57    HZ1  LYS   7           HZ1      LYS   7  15.101  -0.169 -13.916
   58    HZ2  LYS   7           HZ2      LYS   7  16.337  -1.058 -13.181
   59    HZ3  LYS   7           HZ3      LYS   7  16.626   0.528 -13.692
   60    H    GLY   8           H        GLY   8  16.685   4.251  -8.873
   61    HA2  GLY   8           HA2      GLY   8  18.659   5.448  -8.380
   62    HA3  GLY   8           HA3      GLY   8  18.424   6.392  -9.843
   63    H    ARG   9           H        ARG   9  15.566   6.860  -9.125
   64    HA   ARG   9           HA       ARG   9  16.036   8.906  -7.056
   65    HB2  ARG   9           HB2      ARG   9  14.371   8.938  -9.555
   66    HB3  ARG   9           HB3      ARG   9  13.991  10.010  -8.214
   67    HG2  ARG   9           HG2      ARG   9  15.973  11.201  -8.441
   68    HG3  ARG   9           HG3      ARG   9  16.749   9.916  -9.368
   69    HD2  ARG   9           HD2      ARG   9  14.750  10.433 -11.034
   70    HD3  ARG   9           HD3      ARG   9  14.829  12.006 -10.243
   71    HE   ARG   9           HE       ARG   9  16.770  12.423 -11.372
   72   HH11  ARG   9          HH11      ARG   9  16.151   8.998 -11.429
   73   HH12  ARG   9          HH12      ARG   9  17.454   8.649 -12.514
   74   HH21  ARG   9          HH21      ARG   9  18.491  11.976 -12.801
   75   HH22  ARG   9          HH22      ARG   9  18.786  10.342 -13.293
   76    H    CYS  10           H        CYS  10  15.140   8.347  -5.190
   77    HA   CYS  10           HA       CYS  10  12.391   7.341  -5.191
   78    HB2  CYS  10           HB2      CYS  10  14.680   6.071  -3.676
   79    HB3  CYS  10           HB3      CYS  10  12.980   5.678  -3.434
   80    H    ARG  11           H        ARG  11  11.227   8.674  -3.986
   81    HA   ARG  11           HA       ARG  11  12.190   9.507  -1.379
   82    HB2  ARG  11           HB2      ARG  11  11.874  11.356  -3.688
   83    HB3  ARG  11           HB3      ARG  11  11.321  11.920  -2.117
   84    HG2  ARG  11           HG2      ARG  11  13.647  11.196  -1.283
   85    HG3  ARG  11           HG3      ARG  11  14.086  11.197  -2.991
   86    HD2  ARG  11           HD2      ARG  11  14.640  13.345  -2.400
   87    HD3  ARG  11           HD3      ARG  11  12.983  13.570  -2.959
   88    HE   ARG  11           HE       ARG  11  12.988  13.039  -0.192
   89   HH11  ARG  11          HH11      ARG  11  13.830  15.530  -2.474
   90   HH12  ARG  11          HH12      ARG  11  13.565  16.826  -1.355
   91   HH21  ARG  11          HH21      ARG  11  12.637  14.736   1.291
   92   HH22  ARG  11          HH22      ARG  11  12.889  16.373   0.787
   93    HA   PRO  12           HA       PRO  12   7.962   9.225  -0.249
   94    HB2  PRO  12           HB2      PRO  12   7.709  11.209   1.589
   95    HB3  PRO  12           HB3      PRO  12   8.600   9.715   1.903
   96    HG2  PRO  12           HG2      PRO  12   9.640  12.411   1.121
   97    HG3  PRO  12           HG3      PRO  12  10.267  11.279   2.334
   98    HD2  PRO  12           HD2      PRO  12  11.355  11.520  -0.134
   99    HD3  PRO  12           HD3      PRO  12  11.336   9.984   0.755
  100    H    LYS  13           H        LYS  13   5.980   9.958  -0.855
  101    HA   LYS  13           HA       LYS  13   5.888  12.248  -2.613
  102    HB2  LYS  13           HB2      LYS  13   4.075   9.992  -1.932
  103    HB3  LYS  13           HB3      LYS  13   3.333  11.464  -2.544
  104    HG2  LYS  13           HG2      LYS  13   4.263  11.237  -4.620
  105    HG3  LYS  13           HG3      LYS  13   5.645  10.318  -4.021
  106    HD2  LYS  13           HD2      LYS  13   4.226   8.846  -5.287
  107    HD3  LYS  13           HD3      LYS  13   4.115   8.410  -3.580
  108    HE2  LYS  13           HE2      LYS  13   1.918   8.407  -4.665
  109    HE3  LYS  13           HE3      LYS  13   2.015   9.619  -3.388
  110    HZ1  LYS  13           HZ1      LYS  13   1.113  10.105  -5.857
  111    HZ2  LYS  13           HZ2      LYS  13   2.733  10.561  -6.029
  112    HZ3  LYS  13           HZ3      LYS  13   1.771  11.289  -4.843
  113    HA   PRO  14           HA       PRO  14   4.233  15.231   0.147
  114    HB2  PRO  14           HB2      PRO  14   2.478  16.557  -1.447
  115    HB3  PRO  14           HB3      PRO  14   4.232  16.707  -1.615
  116    HG2  PRO  14           HG2      PRO  14   2.314  15.030  -3.188
  117    HG3  PRO  14           HG3      PRO  14   3.676  16.009  -3.763
  118    HD2  PRO  14           HD2      PRO  14   3.840  13.323  -3.458
  119    HD3  PRO  14           HD3      PRO  14   5.230  14.398  -3.213
  120    H    ASN  15           H        ASN  15   1.883  13.325  -1.675
  121    HA   ASN  15           HA       ASN  15  -0.205  13.886   0.275
  122    HB2  ASN  15           HB2      ASN  15  -1.669  12.617  -1.219
  123    HB3  ASN  15           HB3      ASN  15  -0.786  13.847  -2.120
  124   HD21  ASN  15          HD21      ASN  15  -1.770  10.724  -2.158
  125   HD22  ASN  15          HD22      ASN  15  -0.617  10.066  -3.264
  126    H    CYS  16           H        CYS  16   2.029  11.371  -0.604
  127    HA   CYS  16           HA       CYS  16   0.720   9.305   0.903
  128    HB2  CYS  16           HB2      CYS  16   2.401   9.131  -1.119
  129    HB3  CYS  16           HB3      CYS  16   3.614   9.166   0.156
  130    H    GLY  17           H        GLY  17   3.773  11.105   1.331
  131    HA2  GLY  17           HA2      GLY  17   3.429  10.770   4.243
  132    HA3  GLY  17           HA3      GLY  17   4.977  10.435   3.480
  133    HN1  NH2  18           H1       NH2  18   2.545  13.033   3.686
  134    HN2  NH2  18           H2       NH2  18   3.632  14.345   3.784
  Start of MODEL    7
    1    H1   ARG   1           H        ARG   1  -0.968   0.230   0.711
    2    HA   ARG   1           HA       ARG   1   1.817   0.422   0.162
    3    HB2  ARG   1           HB2      ARG   1  -0.431  -0.992  -1.275
    4    HB3  ARG   1           HB3      ARG   1   1.259  -1.128  -1.743
    5    HG2  ARG   1           HG2      ARG   1   0.415  -1.757   1.053
    6    HG3  ARG   1           HG3      ARG   1   0.207  -2.943  -0.238
    7    HD2  ARG   1           HD2      ARG   1   2.847  -1.596   0.083
    8    HD3  ARG   1           HD3      ARG   1   2.402  -2.880   1.207
    9    HE   ARG   1           HE       ARG   1   3.193  -3.185  -1.516
   10   HH11  ARG   1          HH11      ARG   1   1.183  -4.537   0.986
   11   HH12  ARG   1          HH12      ARG   1   1.202  -6.135   0.316
   12   HH21  ARG   1          HH21      ARG   1   3.223  -5.284  -2.406
   13   HH22  ARG   1          HH22      ARG   1   2.362  -6.559  -1.613
   14    H    CYS   2           H        CYS   2   1.597   2.852  -0.199
   15    HA   CYS   2           HA       CYS   2   1.144   3.348  -3.070
   16    HB2  CYS   2           HB2      CYS   2   0.603   5.707  -2.422
   17    HB3  CYS   2           HB3      CYS   2  -0.563   4.520  -1.846
   18    H    LYS   3           H        LYS   3   3.581   2.439  -2.220
   19    HA   LYS   3           HA       LYS   3   5.297   4.808  -2.011
   20    HB2  LYS   3           HB2      LYS   3   5.711   1.889  -1.453
   21    HB3  LYS   3           HB3      LYS   3   7.092   2.942  -1.725
   22    HG2  LYS   3           HG2      LYS   3   4.999   3.600   0.317
   23    HG3  LYS   3           HG3      LYS   3   6.354   2.528   0.683
   24    HD2  LYS   3           HD2      LYS   3   6.898   5.180  -0.571
   25    HD3  LYS   3           HD3      LYS   3   6.515   5.106   1.150
   26    HE2  LYS   3           HE2      LYS   3   8.618   3.347  -0.071
   27    HE3  LYS   3           HE3      LYS   3   8.984   4.991   0.451
   28    HZ1  LYS   3           HZ1      LYS   3   8.282   2.644   2.063
   29    HZ2  LYS   3           HZ2      LYS   3   7.848   4.174   2.637
   30    HZ3  LYS   3           HZ3      LYS   3   9.473   3.816   2.329
   31    H    THR   4           H        THR   4   6.271   5.584  -3.754
   32    HA   THR   4           HA       THR   4   6.441   3.881  -6.146
   33    HB   THR   4           HB       THR   4   6.552   5.898  -7.469
   34    HG1  THR   4           HG1      THR   4   6.335   7.393  -5.057
   35   HG21  THR   4          HG21      THR   4   4.364   6.900  -6.944
   36   HG22  THR   4          HG22      THR   4   4.379   6.089  -5.379
   37   HG23  THR   4          HG23      THR   4   4.319   5.140  -6.863
   38    H    CYS   5           H        CYS   5   8.343   3.943  -7.445
   39    HA   CYS   5           HA       CYS   5  10.738   5.136  -6.304
   40    HB2  CYS   5           HB2      CYS   5  10.288   2.703  -5.412
   41    HB3  CYS   5           HB3      CYS   5  10.898   2.227  -6.993
   42    H    SER   6           H        SER   6  11.972   5.939  -7.869
   43    HA   SER   6           HA       SER   6  11.484   5.030 -10.621
   44    HB2  SER   6           HB2      SER   6  12.966   7.556  -9.993
   45    HB3  SER   6           HB3      SER   6  11.937   7.176 -11.374
   46    HG   SER   6           HG       SER   6  10.739   8.510 -10.121
   47    H    LYS   7           H        LYS   7  13.442   5.294 -12.092
   48    HA   LYS   7           HA       LYS   7  15.518   3.613 -11.131
   49    HB2  LYS   7           HB2      LYS   7  14.669   3.851 -13.533
   50    HB3  LYS   7           HB3      LYS   7  15.657   5.305 -13.622
   51    HG2  LYS   7           HG2      LYS   7  17.045   3.702 -14.522
   52    HG3  LYS   7           HG3      LYS   7  17.576   3.753 -12.839
   53    HD2  LYS   7           HD2      LYS   7  16.055   1.824 -12.383
   54    HD3  LYS   7           HD3      LYS   7  15.744   1.726 -14.117
   55    HE2  LYS   7           HE2      LYS   7  18.508   1.595 -12.931
   56    HE3  LYS   7           HE3      LYS   7  17.515   0.166 -13.214
   57    HZ1  LYS   7           HZ1      LYS   7  17.504   1.665 -15.558
   58    HZ2  LYS   7           HZ2      LYS   7  18.223   0.158 -15.294
   59    HZ3  LYS   7           HZ3      LYS   7  19.113   1.574 -15.046
   60    H    GLY   8           H        GLY   8  16.686   4.469  -9.470
   61    HA2  GLY   8           HA2      GLY   8  18.690   5.560  -8.852
   62    HA3  GLY   8           HA3      GLY   8  18.454   6.693 -10.175
   63    H    ARG   9           H        ARG   9  15.608   7.091  -9.371
   64    HA   ARG   9           HA       ARG   9  16.118   8.836  -7.052
   65    HB2  ARG   9           HB2      ARG   9  14.442   9.229  -9.513
   66    HB3  ARG   9           HB3      ARG   9  14.085  10.116  -8.038
   67    HG2  ARG   9           HG2      ARG   9  16.077  11.306  -8.121
   68    HG3  ARG   9           HG3      ARG   9  16.841  10.137  -9.199
   69    HD2  ARG   9           HD2      ARG   9  16.380  11.877 -10.642
   70    HD3  ARG   9           HD3      ARG   9  14.965  10.846 -10.855
   71    HE   ARG   9           HE       ARG   9  13.687  12.546 -10.043
   72   HH11  ARG   9          HH11      ARG   9  16.964  13.013  -8.961
   73   HH12  ARG   9          HH12      ARG   9  16.636  14.542  -8.214
   74   HH21  ARG   9          HH21      ARG   9  13.245  14.557  -9.062
   75   HH22  ARG   9          HH22      ARG   9  14.521  15.419  -8.271
   76    H    CYS  10           H        CYS  10  15.207   8.071  -5.270
   77    HA   CYS  10           HA       CYS  10  12.474   7.007  -5.431
   78    HB2  CYS  10           HB2      CYS  10  14.439   5.259  -5.201
   79    HB3  CYS  10           HB3      CYS  10  14.398   5.757  -3.514
   80    H    ARG  11           H        ARG  11  11.279   8.391  -4.305
   81    HA   ARG  11           HA       ARG  11  12.065   9.038  -1.574
   82    HB2  ARG  11           HB2      ARG  11  12.001  10.959  -3.791
   83    HB3  ARG  11           HB3      ARG  11  11.061  11.458  -2.391
   84    HG2  ARG  11           HG2      ARG  11  13.280  10.726  -1.127
   85    HG3  ARG  11           HG3      ARG  11  13.986  11.119  -2.698
   86    HD2  ARG  11           HD2      ARG  11  12.400  12.909  -0.871
   87    HD3  ARG  11           HD3      ARG  11  14.074  13.097  -1.393
   88    HE   ARG  11           HE       ARG  11  12.709  13.187  -3.716
   89   HH11  ARG  11          HH11      ARG  11  12.353  14.870  -0.691
   90   HH12  ARG  11          HH12      ARG  11  11.702  16.304  -1.414
   91   HH21  ARG  11          HH21      ARG  11  11.854  15.069  -4.681
   92   HH22  ARG  11          HH22      ARG  11  11.417  16.415  -3.684
   93    HA   PRO  12           HA       PRO  12   7.798   8.584  -0.669
   94    HB2  PRO  12           HB2      PRO  12   7.402  10.453   1.260
   95    HB3  PRO  12           HB3      PRO  12   8.320   8.967   1.535
   96    HG2  PRO  12           HG2      PRO  12   9.318  11.729   0.954
   97    HG3  PRO  12           HG3      PRO  12   9.918  10.547   2.132
   98    HD2  PRO  12           HD2      PRO  12  11.115  10.955  -0.262
   99    HD3  PRO  12           HD3      PRO  12  11.099   9.371   0.539
  100    H    LYS  13           H        LYS  13   5.827   9.298  -1.330
  101    HA   LYS  13           HA       LYS  13   5.734  11.604  -3.034
  102    HB2  LYS  13           HB2      LYS  13   3.812   9.450  -2.254
  103    HB3  LYS  13           HB3      LYS  13   3.194  10.909  -3.018
  104    HG2  LYS  13           HG2      LYS  13   5.005  10.446  -4.808
  105    HG3  LYS  13           HG3      LYS  13   5.006   8.814  -4.136
  106    HD2  LYS  13           HD2      LYS  13   2.578  10.270  -5.182
  107    HD3  LYS  13           HD3      LYS  13   3.484   9.036  -6.060
  108    HE2  LYS  13           HE2      LYS  13   3.017   7.593  -3.935
  109    HE3  LYS  13           HE3      LYS  13   1.721   8.757  -3.662
  110    HZ1  LYS  13           HZ1      LYS  13   0.500   7.854  -5.269
  111    HZ2  LYS  13           HZ2      LYS  13   1.569   6.544  -5.234
  112    HZ3  LYS  13           HZ3      LYS  13   1.793   7.789  -6.357
  113    HA   PRO  14           HA       PRO  14   4.180  14.650  -0.282
  114    HB2  PRO  14           HB2      PRO  14   2.432  15.996  -1.865
  115    HB3  PRO  14           HB3      PRO  14   4.186  16.106  -2.059
  116    HG2  PRO  14           HG2      PRO  14   2.212  14.456  -3.589
  117    HG3  PRO  14           HG3      PRO  14   3.587  15.401  -4.191
  118    HD2  PRO  14           HD2      PRO  14   3.697  12.715  -3.864
  119    HD3  PRO  14           HD3      PRO  14   5.114  13.763  -3.646
  120    H    ASN  15           H        ASN  15   1.724  12.856  -2.097
  121    HA   ASN  15           HA       ASN  15  -0.379  13.514  -0.246
  122    HB2  ASN  15           HB2      ASN  15  -0.134  11.892  -2.729
  123    HB3  ASN  15           HB3      ASN  15  -1.452  11.493  -1.631
  124   HD21  ASN  15          HD21      ASN  15  -1.925  12.408  -4.175
  125   HD22  ASN  15          HD22      ASN  15  -2.625  13.985  -4.097
  126    H    CYS  16           H        CYS  16   1.941  10.955  -0.652
  127    HA   CYS  16           HA       CYS  16   0.706   9.497   1.591
  128    HB2  CYS  16           HB2      CYS  16   2.124   8.587  -0.864
  129    HB3  CYS  16           HB3      CYS  16   2.370   7.653   0.608
  130    H    GLY  17           H        GLY  17   1.760  10.884   3.114
  131    HA2  GLY  17           HA2      GLY  17   4.687  10.550   3.246
  132    HA3  GLY  17           HA3      GLY  17   3.789  11.861   3.997
  133    HN1  NH2  18           H1       NH2  18   5.661   9.618   4.960
  134    HN2  NH2  18           H2       NH2  18   4.887   8.947   6.326
  Start of MODEL    8
    1    H1   ARG   1           H        ARG   1   1.113  -1.902  -0.093
    2    HA   ARG   1           HA       ARG   1  -0.441   0.052  -0.892
    3    HB2  ARG   1           HB2      ARG   1  -0.301  -1.028   1.448
    4    HB3  ARG   1           HB3      ARG   1   0.706   0.351   1.870
    5    HG2  ARG   1           HG2      ARG   1  -1.154   1.843   1.154
    6    HG3  ARG   1           HG3      ARG   1  -2.154   0.405   0.942
    7    HD2  ARG   1           HD2      ARG   1  -1.490  -0.130   3.381
    8    HD3  ARG   1           HD3      ARG   1  -1.029   1.570   3.461
    9    HE   ARG   1           HE       ARG   1  -3.559   1.615   2.457
   10   HH11  ARG   1          HH11      ARG   1  -2.078   0.244   5.295
   11   HH12  ARG   1          HH12      ARG   1  -3.504   0.388   6.266
   12   HH21  ARG   1          HH21      ARG   1  -5.444   1.807   3.727
   13   HH22  ARG   1          HH22      ARG   1  -5.418   1.276   5.373
   14    H    CYS   2           H        CYS   2   0.264   1.636  -2.231
   15    HA   CYS   2           HA       CYS   2   1.168   3.614  -2.895
   16    HB2  CYS   2           HB2      CYS   2   0.135   4.260  -0.622
   17    HB3  CYS   2           HB3      CYS   2   1.787   4.224  -0.013
   18    H    LYS   3           H        LYS   3   2.865   1.836  -3.509
   19    HA   LYS   3           HA       LYS   3   5.461   2.608  -2.345
   20    HB2  LYS   3           HB2      LYS   3   4.378   0.002  -3.286
   21    HB3  LYS   3           HB3      LYS   3   6.078   0.324  -3.601
   22    HG2  LYS   3           HG2      LYS   3   5.813  -0.899  -1.531
   23    HG3  LYS   3           HG3      LYS   3   6.441   0.720  -1.212
   24    HD2  LYS   3           HD2      LYS   3   4.431   1.458  -0.307
   25    HD3  LYS   3           HD3      LYS   3   3.496   0.186  -1.100
   26    HE2  LYS   3           HE2      LYS   3   4.099  -1.408   0.455
   27    HE3  LYS   3           HE3      LYS   3   5.571  -0.553   0.914
   28    HZ1  LYS   3           HZ1      LYS   3   4.412   0.149   2.660
   29    HZ2  LYS   3           HZ2      LYS   3   2.933  -0.345   2.006
   30    HZ3  LYS   3           HZ3      LYS   3   3.574   1.167   1.597
   31    H    THR   4           H        THR   4   6.565   3.931  -3.615
   32    HA   THR   4           HA       THR   4   6.555   3.444  -6.514
   33    HB   THR   4           HB       THR   4   5.080   5.358  -6.082
   34    HG1  THR   4           HG1      THR   4   5.934   5.918  -7.936
   35   HG21  THR   4          HG21      THR   4   5.579   7.086  -4.722
   36   HG22  THR   4          HG22      THR   4   7.261   7.144  -5.248
   37   HG23  THR   4          HG23      THR   4   6.758   5.972  -4.030
   38    H    CYS   5           H        CYS   5   8.490   3.723  -7.548
   39    HA   CYS   5           HA       CYS   5  10.707   5.086  -6.379
   40    HB2  CYS   5           HB2      CYS   5  10.520   2.825  -5.125
   41    HB3  CYS   5           HB3      CYS   5  11.114   2.116  -6.623
   42    H    SER   6           H        SER   6  11.876   5.843  -8.008
   43    HA   SER   6           HA       SER   6  11.659   4.510 -10.619
   44    HB2  SER   6           HB2      SER   6  12.838   7.236 -10.368
   45    HB3  SER   6           HB3      SER   6  11.815   6.566 -11.638
   46    HG   SER   6           HG       SER   6  11.032   8.160  -9.788
   47    H    LYS   7           H        LYS   7  13.647   4.809 -12.040
   48    HA   LYS   7           HA       LYS   7  15.849   3.538 -10.783
   49    HB2  LYS   7           HB2      LYS   7  15.291   4.605 -13.520
   50    HB3  LYS   7           HB3      LYS   7  16.945   4.193 -13.091
   51    HG2  LYS   7           HG2      LYS   7  14.745   2.225 -12.635
   52    HG3  LYS   7           HG3      LYS   7  15.444   2.429 -14.242
   53    HD2  LYS   7           HD2      LYS   7  17.713   2.136 -13.058
   54    HD3  LYS   7           HD3      LYS   7  16.763   1.489 -11.717
   55    HE2  LYS   7           HE2      LYS   7  17.450  -0.362 -13.037
   56    HE3  LYS   7           HE3      LYS   7  15.734  -0.115 -13.354
   57    HZ1  LYS   7           HZ1      LYS   7  17.031  -0.530 -15.379
   58    HZ2  LYS   7           HZ2      LYS   7  17.931   0.872 -15.090
   59    HZ3  LYS   7           HZ3      LYS   7  16.274   0.983 -15.407
   60    H    GLY   8           H        GLY   8  16.842   4.726  -9.220
   61    HA2  GLY   8           HA2      GLY   8  18.687   6.126  -8.712
   62    HA3  GLY   8           HA3      GLY   8  18.336   7.069 -10.152
   63    H    ARG   9           H        ARG   9  15.443   7.165  -9.425
   64    HA   ARG   9           HA       ARG   9  15.670   9.240  -7.348
   65    HB2  ARG   9           HB2      ARG   9  13.876   8.994  -9.752
   66    HB3  ARG   9           HB3      ARG   9  13.476  10.062  -8.413
   67    HG2  ARG   9           HG2      ARG   9  15.311  11.445  -8.810
   68    HG3  ARG   9           HG3      ARG   9  16.125  10.230  -9.799
   69    HD2  ARG   9           HD2      ARG   9  13.977  10.503 -11.297
   70    HD3  ARG   9           HD3      ARG   9  13.887  12.069 -10.495
   71    HE   ARG   9           HE       ARG   9  15.746  11.276 -12.516
   72   HH11  ARG   9          HH11      ARG   9  15.302  13.336  -9.745
   73   HH12  ARG   9          HH12      ARG   9  16.482  14.497 -10.254
   74   HH21  ARG   9          HH21      ARG   9  17.302  12.797 -13.198
   75   HH22  ARG   9          HH22      ARG   9  17.619  14.190 -12.220
   76    H    CYS  10           H        CYS  10  14.902   8.614  -5.449
   77    HA   CYS  10           HA       CYS  10  12.330   7.238  -5.330
   78    HB2  CYS  10           HB2      CYS  10  14.468   5.663  -5.201
   79    HB3  CYS  10           HB3      CYS  10  14.467   6.203  -3.524
   80    H    ARG  11           H        ARG  11  11.144   8.595  -4.160
   81    HA   ARG  11           HA       ARG  11  12.039   9.334  -1.502
   82    HB2  ARG  11           HB2      ARG  11  11.723  11.283  -3.732
   83    HB3  ARG  11           HB3      ARG  11  11.161  11.764  -2.138
   84    HG2  ARG  11           HG2      ARG  11  13.609  10.789  -1.531
   85    HG3  ARG  11           HG3      ARG  11  13.890  11.418  -3.156
   86    HD2  ARG  11           HD2      ARG  11  12.399  13.126  -1.237
   87    HD3  ARG  11           HD3      ARG  11  14.135  12.936  -0.995
   88    HE   ARG  11           HE       ARG  11  13.954  13.566  -3.614
   89   HH11  ARG  11          HH11      ARG  11  12.663  15.014  -0.723
   90   HH12  ARG  11          HH12      ARG  11  12.678  16.624  -1.366
   91   HH21  ARG  11          HH21      ARG  11  13.978  15.679  -4.470
   92   HH22  ARG  11          HH22      ARG  11  13.426  17.000  -3.498
   93    HA   PRO  12           HA       PRO  12   7.792   8.941  -0.480
   94    HB2  PRO  12           HB2      PRO  12   7.469  10.838   1.435
   95    HB3  PRO  12           HB3      PRO  12   8.375   9.344   1.704
   96    HG2  PRO  12           HG2      PRO  12   9.389  12.088   1.064
   97    HG3  PRO  12           HG3      PRO  12  10.007  10.913   2.239
   98    HD2  PRO  12           HD2      PRO  12  11.145  11.279  -0.190
   99    HD3  PRO  12           HD3      PRO  12  11.131   9.704   0.631
  100    H    LYS  13           H        LYS  13   5.812   9.669  -1.098
  101    HA   LYS  13           HA       LYS  13   5.676  11.888  -2.882
  102    HB2  LYS  13           HB2      LYS  13   3.862   9.764  -1.939
  103    HB3  LYS  13           HB3      LYS  13   3.067  11.267  -2.390
  104    HG2  LYS  13           HG2      LYS  13   4.616  11.015  -4.523
  105    HG3  LYS  13           HG3      LYS  13   4.532   9.312  -4.069
  106    HD2  LYS  13           HD2      LYS  13   2.031  10.945  -4.214
  107    HD3  LYS  13           HD3      LYS  13   2.757  10.311  -5.693
  108    HE2  LYS  13           HE2      LYS  13   2.081   8.612  -3.299
  109    HE3  LYS  13           HE3      LYS  13   0.986   8.860  -4.657
  110    HZ1  LYS  13           HZ1      LYS  13   2.122   7.437  -5.918
  111    HZ2  LYS  13           HZ2      LYS  13   2.844   6.903  -4.485
  112    HZ3  LYS  13           HZ3      LYS  13   3.627   8.050  -5.450
  113    HA   PRO  14           HA       PRO  14   4.508  15.193  -0.242
  114    HB2  PRO  14           HB2      PRO  14   2.708  16.526  -1.776
  115    HB3  PRO  14           HB3      PRO  14   4.442  16.526  -2.113
  116    HG2  PRO  14           HG2      PRO  14   2.269  14.888  -3.362
  117    HG3  PRO  14           HG3      PRO  14   3.635  15.712  -4.137
  118    HD2  PRO  14           HD2      PRO  14   3.636  13.052  -3.626
  119    HD3  PRO  14           HD3      PRO  14   5.117  14.032  -3.596
  120    H    ASN  15           H        ASN  15   1.766  13.539  -1.784
  121    HA   ASN  15           HA       ASN  15   0.013  14.290   0.417
  122    HB2  ASN  15           HB2      ASN  15  -0.898  14.427  -1.838
  123    HB3  ASN  15           HB3      ASN  15  -0.527  12.729  -2.117
  124   HD21  ASN  15          HD21      ASN  15  -2.726  12.376  -2.596
  125   HD22  ASN  15          HD22      ASN  15  -3.903  12.248  -1.337
  126    H    CYS  16           H        CYS  16   1.787  11.547  -0.774
  127    HA   CYS  16           HA       CYS  16   0.630   9.882   1.364
  128    HB2  CYS  16           HB2      CYS  16   0.279   9.024  -0.939
  129    HB3  CYS  16           HB3      CYS  16   2.025   8.968  -1.159
  130    H    GLY  17           H        GLY  17   2.025  10.591   2.993
  131    HA2  GLY  17           HA2      GLY  17   4.889  10.031   2.572
  132    HA3  GLY  17           HA3      GLY  17   4.243  11.124   3.788
  133    HN1  NH2  18           H1       NH2  18   3.821  10.367   5.788
  134    HN2  NH2  18           H2       NH2  18   3.937   8.743   6.302
  Start of MODEL    9
    1    H1   ARG   1           H        ARG   1   0.550  -0.555   0.707
    2    HA   ARG   1           HA       ARG   1   3.371   0.263   0.627
    3    HB2  ARG   1           HB2      ARG   1   2.066  -1.545  -1.417
    4    HB3  ARG   1           HB3      ARG   1   3.738  -1.001  -1.412
    5    HG2  ARG   1           HG2      ARG   1   2.444  -2.821   0.607
    6    HG3  ARG   1           HG3      ARG   1   3.599  -3.285  -0.646
    7    HD2  ARG   1           HD2      ARG   1   4.995  -3.096   1.161
    8    HD3  ARG   1           HD3      ARG   1   5.095  -1.461   0.506
    9    HE   ARG   1           HE       ARG   1   4.131  -0.698   2.425
   10   HH11  ARG   1          HH11      ARG   1   3.427  -4.093   2.104
   11   HH12  ARG   1          HH12      ARG   1   2.659  -4.214   3.652
   12   HH21  ARG   1          HH21      ARG   1   3.121  -0.845   4.466
   13   HH22  ARG   1          HH22      ARG   1   2.485  -2.365   4.995
   14    H    CYS   2           H        CYS   2   3.727   2.082  -0.484
   15    HA   CYS   2           HA       CYS   2   1.464   3.291  -1.889
   16    HB2  CYS   2           HB2      CYS   2   3.989   4.368  -0.675
   17    HB3  CYS   2           HB3      CYS   2   3.104   5.317  -1.865
   18    H    LYS   3           H        LYS   3   2.387   4.887  -3.716
   19    HA   LYS   3           HA       LYS   3   2.987   3.334  -5.919
   20    HB2  LYS   3           HB2      LYS   3   2.342   5.936  -5.553
   21    HB3  LYS   3           HB3      LYS   3   4.042   6.098  -5.975
   22    HG2  LYS   3           HG2      LYS   3   3.723   5.416  -8.116
   23    HG3  LYS   3           HG3      LYS   3   2.379   4.351  -7.693
   24    HD2  LYS   3           HD2      LYS   3   1.285   6.742  -7.110
   25    HD3  LYS   3           HD3      LYS   3   2.386   7.217  -8.405
   26    HE2  LYS   3           HE2      LYS   3   0.597   6.651  -9.682
   27    HE3  LYS   3           HE3      LYS   3   1.325   5.051  -9.542
   28    HZ1  LYS   3           HZ1      LYS   3  -0.407   4.305  -8.390
   29    HZ2  LYS   3           HZ2      LYS   3  -1.227   5.707  -8.864
   30    HZ3  LYS   3           HZ3      LYS   3  -0.438   5.653  -7.368
   31    H    THR   4           H        THR   4   4.855   2.913  -7.106
   32    HA   THR   4           HA       THR   4   7.259   2.693  -5.515
   33    HB   THR   4           HB       THR   4   6.556   0.831  -6.974
   34    HG1  THR   4           HG1      THR   4   8.617   0.394  -7.112
   35   HG21  THR   4          HG21      THR   4   7.443   2.416  -9.356
   36   HG22  THR   4          HG22      THR   4   5.771   2.507  -8.802
   37   HG23  THR   4          HG23      THR   4   6.456   0.957  -9.290
   38    H    CYS   5           H        CYS   5   9.340   3.446  -6.212
   39    HA   CYS   5           HA       CYS   5   9.161   6.005  -7.642
   40    HB2  CYS   5           HB2      CYS   5  11.328   6.526  -6.551
   41    HB3  CYS   5           HB3      CYS   5  10.047   6.188  -5.391
   42    H    SER   6           H        SER   6  10.976   6.608  -9.041
   43    HA   SER   6           HA       SER   6  11.498   4.626 -10.977
   44    HB2  SER   6           HB2      SER   6  11.432   7.191 -11.256
   45    HB3  SER   6           HB3      SER   6  13.109   7.157 -10.710
   46    HG   SER   6           HG       SER   6  13.079   7.030 -12.942
   47    H    LYS   7           H        LYS   7  13.795   4.198 -11.778
   48    HA   LYS   7           HA       LYS   7  15.232   2.910  -9.662
   49    HB2  LYS   7           HB2      LYS   7  15.589   3.145 -12.629
   50    HB3  LYS   7           HB3      LYS   7  16.888   2.495 -11.638
   51    HG2  LYS   7           HG2      LYS   7  15.695   0.610 -11.070
   52    HG3  LYS   7           HG3      LYS   7  14.135   1.380 -11.369
   53    HD2  LYS   7           HD2      LYS   7  16.109   0.798 -13.565
   54    HD3  LYS   7           HD3      LYS   7  14.878  -0.363 -13.056
   55    HE2  LYS   7           HE2      LYS   7  13.244   1.630 -13.411
   56    HE3  LYS   7           HE3      LYS   7  14.549   2.294 -14.392
   57    HZ1  LYS   7           HZ1      LYS   7  14.459   0.446 -15.838
   58    HZ2  LYS   7           HZ2      LYS   7  12.859   0.947 -15.621
   59    HZ3  LYS   7           HZ3      LYS   7  13.433  -0.421 -14.809
   60    H    GLY   8           H        GLY   8  16.620   3.898  -8.359
   61    HA2  GLY   8           HA2      GLY   8  18.647   5.026  -7.921
   62    HA3  GLY   8           HA3      GLY   8  18.529   5.800  -9.494
   63    H    ARG   9           H        ARG   9  15.682   6.521  -8.964
   64    HA   ARG   9           HA       ARG   9  16.205   8.768  -7.132
   65    HB2  ARG   9           HB2      ARG   9  14.632   8.597  -9.685
   66    HB3  ARG   9           HB3      ARG   9  14.283   9.848  -8.499
   67    HG2  ARG   9           HG2      ARG   9  16.391  10.838  -8.759
   68    HG3  ARG   9           HG3      ARG   9  17.047   9.421  -9.580
   69    HD2  ARG   9           HD2      ARG   9  15.451   9.852 -11.445
   70    HD3  ARG   9           HD3      ARG   9  14.986  11.349 -10.638
   71    HE   ARG   9           HE       ARG   9  16.926  12.312 -11.376
   72   HH11  ARG   9          HH11      ARG   9  17.164   8.854 -11.714
   73   HH12  ARG   9          HH12      ARG   9  18.653   8.911 -12.597
   74   HH21  ARG   9          HH21      ARG   9  18.886  12.400 -12.540
   75   HH22  ARG   9          HH22      ARG   9  19.632  10.929 -13.066
   76    H    CYS  10           H        CYS  10  15.205   8.499  -5.254
   77    HA   CYS  10           HA       CYS  10  12.403   7.642  -5.259
   78    HB2  CYS  10           HB2      CYS  10  14.204   5.796  -4.648
   79    HB3  CYS  10           HB3      CYS  10  14.168   6.605  -3.085
   80    H    ARG  11           H        ARG  11  11.216   9.082  -4.214
   81    HA   ARG  11           HA       ARG  11  12.320  10.415  -1.850
   82    HB2  ARG  11           HB2      ARG  11  11.394  11.714  -4.366
   83    HB3  ARG  11           HB3      ARG  11  10.996  12.499  -2.844
   84    HG2  ARG  11           HG2      ARG  11  13.389  12.510  -2.256
   85    HG3  ARG  11           HG3      ARG  11  13.753  11.803  -3.831
   86    HD2  ARG  11           HD2      ARG  11  14.110  14.111  -4.094
   87    HD3  ARG  11           HD3      ARG  11  12.542  13.796  -4.836
   88    HE   ARG  11           HE       ARG  11  12.048  14.502  -2.204
   89   HH11  ARG  11          HH11      ARG  11  13.458  15.952  -5.038
   90   HH12  ARG  11          HH12      ARG  11  13.009  17.567  -4.595
   91   HH21  ARG  11          HH21      ARG  11  11.452  16.622  -1.610
   92   HH22  ARG  11          HH22      ARG  11  11.870  17.946  -2.645
   93    HA   PRO  12           HA       PRO  12   8.374   9.790  -0.040
   94    HB2  PRO  12           HB2      PRO  12   8.040  12.045   1.434
   95    HB3  PRO  12           HB3      PRO  12   9.195  10.779   1.865
   96    HG2  PRO  12           HG2      PRO  12   9.671  13.383   0.467
   97    HG3  PRO  12           HG3      PRO  12  10.624  12.609   1.746
   98    HD2  PRO  12           HD2      PRO  12  11.334  12.503  -0.864
   99    HD3  PRO  12           HD3      PRO  12  11.681  11.184   0.273
  100    H    LYS  13           H        LYS  13   6.239  10.112  -0.449
  101    HA   LYS  13           HA       LYS  13   5.549  11.974  -2.548
  102    HB2  LYS  13           HB2      LYS  13   4.111   9.761  -1.123
  103    HB3  LYS  13           HB3      LYS  13   3.211  10.907  -2.108
  104    HG2  LYS  13           HG2      LYS  13   5.561   9.364  -3.164
  105    HG3  LYS  13           HG3      LYS  13   3.907   8.750  -3.224
  106    HD2  LYS  13           HD2      LYS  13   4.591  11.461  -4.309
  107    HD3  LYS  13           HD3      LYS  13   4.832  10.006  -5.278
  108    HE2  LYS  13           HE2      LYS  13   2.206  10.443  -3.936
  109    HE3  LYS  13           HE3      LYS  13   2.581  11.349  -5.399
  110    HZ1  LYS  13           HZ1      LYS  13   3.180   8.555  -5.629
  111    HZ2  LYS  13           HZ2      LYS  13   2.282   9.553  -6.658
  112    HZ3  LYS  13           HZ3      LYS  13   1.544   8.842  -5.310
  113    HA   PRO  14           HA       PRO  14   3.798  15.192  -0.135
  114    HB2  PRO  14           HB2      PRO  14   1.661  15.923  -1.643
  115    HB3  PRO  14           HB3      PRO  14   3.330  16.274  -2.108
  116    HG2  PRO  14           HG2      PRO  14   1.527  14.074  -3.038
  117    HG3  PRO  14           HG3      PRO  14   2.625  15.095  -3.984
  118    HD2  PRO  14           HD2      PRO  14   3.262  12.571  -3.239
  119    HD3  PRO  14           HD3      PRO  14   4.478  13.852  -3.407
  120    H    ASN  15           H        ASN  15   1.581  12.658  -1.196
  121    HA   ASN  15           HA       ASN  15  -0.207  13.261   1.047
  122    HB2  ASN  15           HB2      ASN  15  -0.528  11.674  -1.486
  123    HB3  ASN  15           HB3      ASN  15  -1.637  11.451  -0.136
  124   HD21  ASN  15          HD21      ASN  15  -3.444  12.306  -0.990
  125   HD22  ASN  15          HD22      ASN  15  -3.602  13.954  -1.483
  126    H    CYS  16           H        CYS  16   2.033  10.887  -0.149
  127    HA   CYS  16           HA       CYS  16   1.432   9.164   2.165
  128    HB2  CYS  16           HB2      CYS  16   1.092   7.965   0.102
  129    HB3  CYS  16           HB3      CYS  16   2.658   8.484  -0.513
  130    H    GLY  17           H        GLY  17   2.742  10.182   3.667
  131    HA2  GLY  17           HA2      GLY  17   5.534  10.687   3.047
  132    HA3  GLY  17           HA3      GLY  17   4.722  11.027   4.569
  133    HN1  NH2  18           H1       NH2  18   4.707   9.498   6.187
  134    HN2  NH2  18           H2       NH2  18   5.602   8.043   6.164
  Start of MODEL   10
    1    H1   ARG   1           H        ARG   1  -2.605   3.605   0.255
    2    HA   ARG   1           HA       ARG   1  -0.325   1.741   0.171
    3    HB2  ARG   1           HB2      ARG   1  -0.766   1.539  -2.286
    4    HB3  ARG   1           HB3      ARG   1  -2.016   0.841  -1.265
    5    HG2  ARG   1           HG2      ARG   1  -2.354   3.648  -2.171
    6    HG3  ARG   1           HG3      ARG   1  -2.600   2.350  -3.341
    7    HD2  ARG   1           HD2      ARG   1  -4.083   1.314  -1.473
    8    HD3  ARG   1           HD3      ARG   1  -4.109   2.956  -0.832
    9    HE   ARG   1           HE       ARG   1  -5.564   3.522  -2.492
   10   HH11  ARG   1          HH11      ARG   1  -3.895   0.610  -3.419
   11   HH12  ARG   1          HH12      ARG   1  -4.839   0.371  -4.854
   12   HH21  ARG   1          HH21      ARG   1  -6.812   3.218  -4.377
   13   HH22  ARG   1          HH22      ARG   1  -6.497   1.854  -5.397
   14    H    CYS   2           H        CYS   2   1.043   2.402  -1.935
   15    HA   CYS   2           HA       CYS   2   1.248   5.255  -2.318
   16    HB2  CYS   2           HB2      CYS   2   2.506   4.507  -0.120
   17    HB3  CYS   2           HB3      CYS   2   3.740   3.982  -1.262
   18    H    LYS   3           H        LYS   3   2.974   5.814  -3.868
   19    HA   LYS   3           HA       LYS   3   3.084   3.840  -5.969
   20    HB2  LYS   3           HB2      LYS   3   3.728   6.735  -5.707
   21    HB3  LYS   3           HB3      LYS   3   4.541   5.837  -6.982
   22    HG2  LYS   3           HG2      LYS   3   1.590   5.576  -6.718
   23    HG3  LYS   3           HG3      LYS   3   2.258   7.056  -7.412
   24    HD2  LYS   3           HD2      LYS   3   3.046   4.319  -8.380
   25    HD3  LYS   3           HD3      LYS   3   1.660   5.193  -9.037
   26    HE2  LYS   3           HE2      LYS   3   2.973   6.803 -10.021
   27    HE3  LYS   3           HE3      LYS   3   4.297   6.574  -8.878
   28    HZ1  LYS   3           HZ1      LYS   3   4.081   4.184 -10.199
   29    HZ2  LYS   3           HZ2      LYS   3   5.262   5.367 -10.451
   30    HZ3  LYS   3           HZ3      LYS   3   3.870   5.345 -11.412
   31    H    THR   4           H        THR   4   5.113   3.341  -7.107
   32    HA   THR   4           HA       THR   4   7.191   2.677  -5.184
   33    HB   THR   4           HB       THR   4   7.130   1.943  -8.111
   34    HG1  THR   4           HG1      THR   4   6.168   0.352  -5.958
   35   HG21  THR   4          HG21      THR   4   8.414  -0.057  -7.125
   36   HG22  THR   4          HG22      THR   4   8.625   0.958  -5.697
   37   HG23  THR   4          HG23      THR   4   9.262   1.484  -7.255
   38    H    CYS   5           H        CYS   5   9.419   3.134  -5.534
   39    HA   CYS   5           HA       CYS   5   9.874   5.775  -6.569
   40    HB2  CYS   5           HB2      CYS   5  11.672   3.727  -5.275
   41    HB3  CYS   5           HB3      CYS   5  12.268   5.276  -5.859
   42    H    SER   6           H        SER   6  11.679   6.261  -8.051
   43    HA   SER   6           HA       SER   6  11.565   4.483 -10.350
   44    HB2  SER   6           HB2      SER   6  12.456   7.321  -9.928
   45    HB3  SER   6           HB3      SER   6  12.921   6.448 -11.387
   46    HG   SER   6           HG       SER   6  10.790   7.740 -11.205
   47    H    LYS   7           H        LYS   7  13.661   4.303 -11.653
   48    HA   LYS   7           HA       LYS   7  15.578   2.945 -10.051
   49    HB2  LYS   7           HB2      LYS   7  15.756   3.786 -12.951
   50    HB3  LYS   7           HB3      LYS   7  16.797   2.613 -12.155
   51    HG2  LYS   7           HG2      LYS   7  13.850   2.176 -12.149
   52    HG3  LYS   7           HG3      LYS   7  14.776   1.833 -13.612
   53    HD2  LYS   7           HD2      LYS   7  15.727   0.763 -10.992
   54    HD3  LYS   7           HD3      LYS   7  14.384  -0.034 -11.815
   55    HE2  LYS   7           HE2      LYS   7  15.733  -0.417 -13.763
   56    HE3  LYS   7           HE3      LYS   7  17.048   0.551 -13.100
   57    HZ1  LYS   7           HZ1      LYS   7  17.375  -1.072 -11.379
   58    HZ2  LYS   7           HZ2      LYS   7  17.425  -1.850 -12.881
   59    HZ3  LYS   7           HZ3      LYS   7  16.047  -1.976 -11.907
   60    H    GLY   8           H        GLY   8  16.830   4.086  -8.697
   61    HA2  GLY   8           HA2      GLY   8  18.818   5.305  -8.323
   62    HA3  GLY   8           HA3      GLY   8  18.591   6.105  -9.871
   63    H    ARG   9           H        ARG   9  15.738   6.668  -9.202
   64    HA   ARG   9           HA       ARG   9  16.227   8.896  -7.337
   65    HB2  ARG   9           HB2      ARG   9  14.562   8.714  -9.831
   66    HB3  ARG   9           HB3      ARG   9  14.212   9.922  -8.601
   67    HG2  ARG   9           HG2      ARG   9  16.272  11.000  -8.916
   68    HG3  ARG   9           HG3      ARG   9  16.939   9.635  -9.815
   69    HD2  ARG   9           HD2      ARG   9  16.389  11.425 -11.341
   70    HD3  ARG   9           HD3      ARG   9  15.309  10.059 -11.614
   71    HE   ARG   9           HE       ARG   9  14.098  11.836  -9.810
   72   HH11  ARG   9          HH11      ARG   9  15.010  11.627 -13.164
   73   HH12  ARG   9          HH12      ARG   9  13.755  12.692 -13.706
   74   HH21  ARG   9          HH21      ARG   9  12.442  13.238 -10.511
   75   HH22  ARG   9          HH22      ARG   9  12.295  13.609 -12.196
   76    H    CYS  10           H        CYS  10  15.293   8.569  -5.437
   77    HA   CYS  10           HA       CYS  10  12.556   7.513  -5.371
   78    HB2  CYS  10           HB2      CYS  10  14.034   5.633  -4.847
   79    HB3  CYS  10           HB3      CYS  10  14.813   6.579  -3.585
   80    H    ARG  11           H        ARG  11  11.373   9.096  -4.536
   81    HA   ARG  11           HA       ARG  11  12.383  10.483  -2.144
   82    HB2  ARG  11           HB2      ARG  11  11.312  11.633  -4.675
   83    HB3  ARG  11           HB3      ARG  11  10.887  12.432  -3.168
   84    HG2  ARG  11           HG2      ARG  11  13.615  12.018  -2.959
   85    HG3  ARG  11           HG3      ARG  11  13.369  12.468  -4.647
   86    HD2  ARG  11           HD2      ARG  11  12.358  14.006  -2.259
   87    HD3  ARG  11           HD3      ARG  11  13.784  14.420  -3.210
   88    HE   ARG  11           HE       ARG  11  11.549  14.223  -4.908
   89   HH11  ARG  11          HH11      ARG  11  12.873  16.261  -2.415
   90   HH12  ARG  11          HH12      ARG  11  12.116  17.701  -3.010
   91   HH21  ARG  11          HH21      ARG  11  10.548  16.112  -5.701
   92   HH22  ARG  11          HH22      ARG  11  10.793  17.616  -4.878
   93    HA   PRO  12           HA       PRO  12   8.532   9.623  -0.229
   94    HB2  PRO  12           HB2      PRO  12   8.061  11.890   1.188
   95    HB3  PRO  12           HB3      PRO  12   9.315  10.726   1.628
   96    HG2  PRO  12           HG2      PRO  12   9.568  13.315   0.146
   97    HG3  PRO  12           HG3      PRO  12  10.602  12.652   1.425
   98    HD2  PRO  12           HD2      PRO  12  11.264  12.521  -1.197
   99    HD3  PRO  12           HD3      PRO  12  11.730  11.266  -0.030
  100    H    LYS  13           H        LYS  13   6.370   9.773  -0.599
  101    HA   LYS  13           HA       LYS  13   5.501  11.508  -2.737
  102    HB2  LYS  13           HB2      LYS  13   4.339   9.198  -1.248
  103    HB3  LYS  13           HB3      LYS  13   3.241  10.285  -2.087
  104    HG2  LYS  13           HG2      LYS  13   3.747   8.455  -3.533
  105    HG3  LYS  13           HG3      LYS  13   4.538   9.898  -4.170
  106    HD2  LYS  13           HD2      LYS  13   6.658   9.183  -3.465
  107    HD3  LYS  13           HD3      LYS  13   5.981   7.979  -2.365
  108    HE2  LYS  13           HE2      LYS  13   5.277   6.609  -4.195
  109    HE3  LYS  13           HE3      LYS  13   5.689   7.862  -5.362
  110    HZ1  LYS  13           HZ1      LYS  13   7.329   5.990  -5.117
  111    HZ2  LYS  13           HZ2      LYS  13   7.707   6.613  -3.590
  112    HZ3  LYS  13           HZ3      LYS  13   7.973   7.548  -4.976
  113    HA   PRO  14           HA       PRO  14   3.583  14.685  -0.395
  114    HB2  PRO  14           HB2      PRO  14   1.365  15.209  -1.870
  115    HB3  PRO  14           HB3      PRO  14   2.994  15.657  -2.390
  116    HG2  PRO  14           HG2      PRO  14   1.329  13.303  -3.197
  117    HG3  PRO  14           HG3      PRO  14   2.330  14.363  -4.205
  118    HD2  PRO  14           HD2      PRO  14   3.161  11.919  -3.389
  119    HD3  PRO  14           HD3      PRO  14   4.280  13.274  -3.634
  120    H    ASN  15           H        ASN  15   1.489  11.994  -1.336
  121    HA   ASN  15           HA       ASN  15  -0.414  12.585   0.771
  122    HB2  ASN  15           HB2      ASN  15  -0.914  11.589  -1.586
  123    HB3  ASN  15           HB3      ASN  15  -0.423  10.061  -0.858
  124   HD21  ASN  15          HD21      ASN  15  -2.994  10.672  -1.877
  125   HD22  ASN  15          HD22      ASN  15  -4.111  10.592  -0.562
  126    H    CYS  16           H        CYS  16   2.290  10.476   0.197
  127    HA   CYS  16           HA       CYS  16   1.714   8.891   2.578
  128    HB2  CYS  16           HB2      CYS  16   4.093   8.652   0.731
  129    HB3  CYS  16           HB3      CYS  16   3.507   7.457   1.883
  130    H    GLY  17           H        GLY  17   3.845   8.371   3.881
  131    HA2  GLY  17           HA2      GLY  17   6.012   9.736   4.370
  132    HA3  GLY  17           HA3      GLY  17   4.843  10.981   4.781
  133    HN1  NH2  18           H1       NH2  18   6.732   9.997   6.595
  134    HN2  NH2  18           H2       NH2  18   5.952   9.174   7.873
  Start of MODEL   11
    1    H1   ARG   1           H        ARG   1   3.314   0.120  -0.404
    2    HA   ARG   1           HA       ARG   1   0.711   0.305   0.952
    3    HB2  ARG   1           HB2      ARG   1   1.644   2.308   2.171
    4    HB3  ARG   1           HB3      ARG   1   2.298   0.754   2.665
    5    HG2  ARG   1           HG2      ARG   1   4.282   1.162   1.282
    6    HG3  ARG   1           HG3      ARG   1   3.628   2.738   0.833
    7    HD2  ARG   1           HD2      ARG   1   3.534   3.218   3.337
    8    HD3  ARG   1           HD3      ARG   1   4.554   1.793   3.531
    9    HE   ARG   1           HE       ARG   1   5.361   4.372   2.607
   10   HH11  ARG   1          HH11      ARG   1   6.014   0.961   2.354
   11   HH12  ARG   1          HH12      ARG   1   7.675   1.178   1.912
   12   HH21  ARG   1          HH21      ARG   1   7.547   4.671   2.024
   13   HH22  ARG   1          HH22      ARG   1   8.546   3.288   1.725
   14    H    CYS   2           H        CYS   2   3.127   1.909  -1.065
   15    HA   CYS   2           HA       CYS   2   0.968   3.300  -2.459
   16    HB2  CYS   2           HB2      CYS   2   3.198   4.583  -0.960
   17    HB3  CYS   2           HB3      CYS   2   2.727   5.302  -2.498
   18    H    LYS   3           H        LYS   3   2.102   4.614  -4.370
   19    HA   LYS   3           HA       LYS   3   3.038   2.764  -6.196
   20    HB2  LYS   3           HB2      LYS   3   3.548   5.745  -6.166
   21    HB3  LYS   3           HB3      LYS   3   3.741   4.696  -7.564
   22    HG2  LYS   3           HG2      LYS   3   1.245   4.102  -7.115
   23    HG3  LYS   3           HG3      LYS   3   1.248   5.625  -6.220
   24    HD2  LYS   3           HD2      LYS   3   2.283   5.433  -9.035
   25    HD3  LYS   3           HD3      LYS   3   0.573   5.702  -8.687
   26    HE2  LYS   3           HE2      LYS   3   0.945   7.796  -7.806
   27    HE3  LYS   3           HE3      LYS   3   2.613   7.430  -7.367
   28    HZ1  LYS   3           HZ1      LYS   3   2.126   7.336 -10.198
   29    HZ2  LYS   3           HZ2      LYS   3   3.351   8.125  -9.338
   30    HZ3  LYS   3           HZ3      LYS   3   1.840   8.862  -9.528
   31    H    THR   4           H        THR   4   5.160   2.702  -7.295
   32    HA   THR   4           HA       THR   4   7.304   2.700  -5.301
   33    HB   THR   4           HB       THR   4   6.975   0.588  -6.451
   34    HG1  THR   4           HG1      THR   4   9.172   0.535  -7.496
   35   HG21  THR   4          HG21      THR   4   7.922   1.157  -9.062
   36   HG22  THR   4          HG22      THR   4   6.590   2.261  -8.728
   37   HG23  THR   4          HG23      THR   4   6.348   0.520  -8.587
   38    H    CYS   5           H        CYS   5   9.393   3.529  -5.801
   39    HA   CYS   5           HA       CYS   5   9.275   5.932  -7.425
   40    HB2  CYS   5           HB2      CYS   5  11.459   6.454  -6.429
   41    HB3  CYS   5           HB3      CYS   5  10.271   6.056  -5.192
   42    H    SER   6           H        SER   6  11.289   6.467  -8.738
   43    HA   SER   6           HA       SER   6  11.603   4.438 -10.731
   44    HB2  SER   6           HB2      SER   6  12.743   7.210 -10.392
   45    HB3  SER   6           HB3      SER   6  13.215   6.161 -11.730
   46    HG   SER   6           HG       SER   6  11.407   7.642 -12.126
   47    H    LYS   7           H        LYS   7  13.872   3.991 -11.612
   48    HA   LYS   7           HA       LYS   7  15.376   2.729  -9.528
   49    HB2  LYS   7           HB2      LYS   7  15.652   2.932 -12.509
   50    HB3  LYS   7           HB3      LYS   7  16.962   2.267 -11.541
   51    HG2  LYS   7           HG2      LYS   7  15.291   0.647 -10.590
   52    HG3  LYS   7           HG3      LYS   7  14.161   1.217 -11.820
   53    HD2  LYS   7           HD2      LYS   7  15.799   0.589 -13.562
   54    HD3  LYS   7           HD3      LYS   7  16.853  -0.060 -12.304
   55    HE2  LYS   7           HE2      LYS   7  15.029  -1.608 -11.648
   56    HE3  LYS   7           HE3      LYS   7  14.077  -1.009 -13.005
   57    HZ1  LYS   7           HZ1      LYS   7  16.546  -2.620 -13.053
   58    HZ2  LYS   7           HZ2      LYS   7  16.103  -1.689 -14.394
   59    HZ3  LYS   7           HZ3      LYS   7  15.074  -2.909 -13.833
   60    H    GLY   8           H        GLY   8  16.587   3.944  -8.210
   61    HA2  GLY   8           HA2      GLY   8  18.657   5.036  -7.807
   62    HA3  GLY   8           HA3      GLY   8  18.601   5.686  -9.438
   63    H    ARG   9           H        ARG   9  15.751   6.485  -9.060
   64    HA   ARG   9           HA       ARG   9  16.258   8.869  -7.403
   65    HB2  ARG   9           HB2      ARG   9  14.726   8.500  -9.962
   66    HB3  ARG   9           HB3      ARG   9  14.386   9.857  -8.897
   67    HG2  ARG   9           HG2      ARG   9  16.536  10.764  -9.193
   68    HG3  ARG   9           HG3      ARG   9  17.148   9.275  -9.917
   69    HD2  ARG   9           HD2      ARG   9  16.784  10.957 -11.627
   70    HD3  ARG   9           HD3      ARG   9  15.661   9.616 -11.840
   71    HE   ARG   9           HE       ARG   9  14.422  11.592 -10.284
   72   HH11  ARG   9          HH11      ARG   9  15.543  11.067 -13.538
   73   HH12  ARG   9          HH12      ARG   9  14.376  12.131 -14.251
   74   HH21  ARG   9          HH21      ARG   9  12.882  12.996 -11.210
   75   HH22  ARG   9          HH22      ARG   9  12.865  13.229 -12.925
   76    H    CYS  10           H        CYS  10  15.191   8.816  -5.546
   77    HA   CYS  10           HA       CYS  10  12.382   8.012  -5.537
   78    HB2  CYS  10           HB2      CYS  10  14.411   6.926  -3.572
   79    HB3  CYS  10           HB3      CYS  10  12.676   6.628  -3.537
   80    H    ARG  11           H        ARG  11  11.126   9.138  -4.117
   81    HA   ARG  11           HA       ARG  11  12.341  10.748  -2.034
   82    HB2  ARG  11           HB2      ARG  11  11.210  11.887  -4.546
   83    HB3  ARG  11           HB3      ARG  11  10.887  12.735  -3.039
   84    HG2  ARG  11           HG2      ARG  11  13.262  12.956  -2.618
   85    HG3  ARG  11           HG3      ARG  11  13.625  12.027  -4.075
   86    HD2  ARG  11           HD2      ARG  11  13.880  14.410  -4.490
   87    HD3  ARG  11           HD3      ARG  11  12.548  13.751  -5.438
   88    HE   ARG  11           HE       ARG  11  11.748  14.888  -2.918
   89   HH11  ARG  11          HH11      ARG  11  12.386  15.511  -6.282
   90   HH12  ARG  11          HH12      ARG  11  11.386  16.925  -6.345
   91   HH21  ARG  11          HH21      ARG  11  10.429  16.749  -2.986
   92   HH22  ARG  11          HH22      ARG  11  10.275  17.629  -4.469
   93    HA   PRO  12           HA       PRO  12   8.537  10.081   0.045
   94    HB2  PRO  12           HB2      PRO  12   8.206  12.394   1.427
   95    HB3  PRO  12           HB3      PRO  12   9.433  11.191   1.845
   96    HG2  PRO  12           HG2      PRO  12   9.727  13.735   0.296
   97    HG3  PRO  12           HG3      PRO  12  10.783  13.062   1.550
   98    HD2  PRO  12           HD2      PRO  12  11.338  12.847  -1.090
   99    HD3  PRO  12           HD3      PRO  12  11.802  11.602   0.085
  100    H    LYS  13           H        LYS  13   6.371  10.307  -0.245
  101    HA   LYS  13           HA       LYS  13   5.485  12.020  -2.393
  102    HB2  LYS  13           HB2      LYS  13   4.197   9.877  -0.730
  103    HB3  LYS  13           HB3      LYS  13   3.216  10.924  -1.749
  104    HG2  LYS  13           HG2      LYS  13   5.558   9.409  -2.849
  105    HG3  LYS  13           HG3      LYS  13   3.959   8.677  -2.705
  106    HD2  LYS  13           HD2      LYS  13   3.007  10.190  -4.223
  107    HD3  LYS  13           HD3      LYS  13   4.363  11.313  -4.086
  108    HE2  LYS  13           HE2      LYS  13   5.808   9.579  -5.149
  109    HE3  LYS  13           HE3      LYS  13   4.363   8.604  -5.411
  110    HZ1  LYS  13           HZ1      LYS  13   3.446  10.463  -6.714
  111    HZ2  LYS  13           HZ2      LYS  13   4.864   9.834  -7.388
  112    HZ3  LYS  13           HZ3      LYS  13   4.907  11.297  -6.537
  113    HA   PRO  14           HA       PRO  14   3.798  15.341  -0.070
  114    HB2  PRO  14           HB2      PRO  14   1.545  15.916  -1.471
  115    HB3  PRO  14           HB3      PRO  14   3.169  16.280  -2.070
  116    HG2  PRO  14           HG2      PRO  14   1.375  13.977  -2.738
  117    HG3  PRO  14           HG3      PRO  14   2.377  14.965  -3.818
  118    HD2  PRO  14           HD2      PRO  14   3.138  12.511  -2.962
  119    HD3  PRO  14           HD3      PRO  14   4.302  13.811  -3.293
  120    H    ASN  15           H        ASN  15   1.419  12.844  -0.942
  121    HA   ASN  15           HA       ASN  15  -0.032  13.415   1.548
  122    HB2  ASN  15           HB2      ASN  15  -1.389  13.486  -0.492
  123    HB3  ASN  15           HB3      ASN  15  -0.897  11.842  -0.889
  124   HD21  ASN  15          HD21      ASN  15  -2.055  13.457   2.052
  125   HD22  ASN  15          HD22      ASN  15  -3.324  12.331   2.374
  126    H    CYS  16           H        CYS  16   1.796  10.991  -0.146
  127    HA   CYS  16           HA       CYS  16   1.260   9.047   1.993
  128    HB2  CYS  16           HB2      CYS  16   0.943   8.449  -0.488
  129    HB3  CYS  16           HB3      CYS  16   2.701   8.457  -0.586
  130    H    GLY  17           H        GLY  17   2.783  10.902   3.004
  131    HA2  GLY  17           HA2      GLY  17   5.599  10.360   2.521
  132    HA3  GLY  17           HA3      GLY  17   4.941  11.556   3.627
  133    HN1  NH2  18           H1       NH2  18   3.238   9.879   5.114
  134    HN2  NH2  18           H2       NH2  18   4.165   8.813   6.075
  Start of MODEL   12
    1    H1   ARG   1           H        ARG   1   8.267   4.918  -0.905
    2    HA   ARG   1           HA       ARG   1   7.836   2.822   0.984
    3    HB2  ARG   1           HB2      ARG   1   8.338   5.339   1.399
    4    HB3  ARG   1           HB3      ARG   1   6.603   5.550   1.206
    5    HG2  ARG   1           HG2      ARG   1   6.846   5.336   3.491
    6    HG3  ARG   1           HG3      ARG   1   6.411   3.700   2.995
    7    HD2  ARG   1           HD2      ARG   1   8.195   3.245   4.352
    8    HD3  ARG   1           HD3      ARG   1   9.022   3.423   2.806
    9    HE   ARG   1           HE       ARG   1  10.080   5.267   3.637
   10   HH11  ARG   1          HH11      ARG   1   7.283   4.596   5.601
   11   HH12  ARG   1          HH12      ARG   1   7.663   5.804   6.783
   12   HH21  ARG   1          HH21      ARG   1  10.589   6.862   5.188
   13   HH22  ARG   1          HH22      ARG   1   9.541   7.093   6.546
   14    H    CYS   2           H        CYS   2   5.665   4.891  -0.926
   15    HA   CYS   2           HA       CYS   2   3.424   3.139  -0.212
   16    HB2  CYS   2           HB2      CYS   2   3.337   5.799  -1.646
   17    HB3  CYS   2           HB3      CYS   2   1.969   4.909  -0.987
   18    H    LYS   3           H        LYS   3   4.485   4.909  -3.125
   19    HA   LYS   3           HA       LYS   3   3.621   2.588  -4.723
   20    HB2  LYS   3           HB2      LYS   3   2.497   4.955  -4.951
   21    HB3  LYS   3           HB3      LYS   3   3.929   5.322  -5.902
   22    HG2  LYS   3           HG2      LYS   3   2.267   4.655  -7.431
   23    HG3  LYS   3           HG3      LYS   3   3.386   3.297  -7.296
   24    HD2  LYS   3           HD2      LYS   3   1.380   2.197  -7.125
   25    HD3  LYS   3           HD3      LYS   3   1.705   2.527  -5.422
   26    HE2  LYS   3           HE2      LYS   3  -0.578   3.092  -5.876
   27    HE3  LYS   3           HE3      LYS   3   0.321   4.587  -5.625
   28    HZ1  LYS   3           HZ1      LYS   3  -0.163   3.491  -8.329
   29    HZ2  LYS   3           HZ2      LYS   3   0.293   5.062  -7.900
   30    HZ3  LYS   3           HZ3      LYS   3  -1.273   4.518  -7.570
   31    H    THR   4           H        THR   4   4.850   2.150  -6.674
   32    HA   THR   4           HA       THR   4   7.574   1.893  -6.257
   33    HB   THR   4           HB       THR   4   6.475   2.123  -9.043
   34    HG1  THR   4           HG1      THR   4   5.869  -0.164  -8.694
   35   HG21  THR   4          HG21      THR   4   7.974   0.066  -9.270
   36   HG22  THR   4          HG22      THR   4   8.601   0.491  -7.679
   37   HG23  THR   4          HG23      THR   4   8.775   1.616  -9.025
   38    H    CYS   5           H        CYS   5   9.401   2.943  -7.107
   39    HA   CYS   5           HA       CYS   5   8.928   5.708  -8.011
   40    HB2  CYS   5           HB2      CYS   5  11.138   6.221  -6.854
   41    HB3  CYS   5           HB3      CYS   5   9.764   5.900  -5.802
   42    H    SER   6           H        SER   6  10.927   6.643  -9.101
   43    HA   SER   6           HA       SER   6  11.566   5.030 -11.339
   44    HB2  SER   6           HB2      SER   6  11.452   7.615 -11.155
   45    HB3  SER   6           HB3      SER   6  13.115   7.496 -10.583
   46    HG   SER   6           HG       SER   6  13.752   7.051 -12.541
   47    H    LYS   7           H        LYS   7  13.913   4.798 -12.079
   48    HA   LYS   7           HA       LYS   7  15.288   3.225 -10.105
   49    HB2  LYS   7           HB2      LYS   7  15.094   2.760 -12.632
   50    HB3  LYS   7           HB3      LYS   7  16.374   3.952 -12.816
   51    HG2  LYS   7           HG2      LYS   7  17.574   2.461 -11.015
   52    HG3  LYS   7           HG3      LYS   7  16.473   1.227 -11.633
   53    HD2  LYS   7           HD2      LYS   7  18.276   2.894 -13.383
   54    HD3  LYS   7           HD3      LYS   7  18.716   1.304 -12.755
   55    HE2  LYS   7           HE2      LYS   7  16.505   0.516 -13.816
   56    HE3  LYS   7           HE3      LYS   7  16.567   2.030 -14.717
   57    HZ1  LYS   7           HZ1      LYS   7  18.040   1.156 -16.099
   58    HZ2  LYS   7           HZ2      LYS   7  17.852  -0.339 -15.332
   59    HZ3  LYS   7           HZ3      LYS   7  19.071   0.721 -14.831
   60    H    GLY   8           H        GLY   8  16.621   4.056  -8.644
   61    HA2  GLY   8           HA2      GLY   8  18.618   5.139  -8.005
   62    HA3  GLY   8           HA3      GLY   8  18.533   6.109  -9.468
   63    H    ARG   9           H        ARG   9  15.662   6.723  -8.939
   64    HA   ARG   9           HA       ARG   9  16.098   8.722  -6.819
   65    HB2  ARG   9           HB2      ARG   9  14.594   8.864  -9.416
   66    HB3  ARG   9           HB3      ARG   9  14.211   9.956  -8.093
   67    HG2  ARG   9           HG2      ARG   9  16.316  10.978  -8.175
   68    HG3  ARG   9           HG3      ARG   9  17.001   9.677  -9.149
   69    HD2  ARG   9           HD2      ARG   9  15.987  10.415 -11.087
   70    HD3  ARG   9           HD3      ARG   9  14.708  11.260 -10.216
   71    HE   ARG   9           HE       ARG   9  16.037  13.118 -10.149
   72   HH11  ARG   9          HH11      ARG   9  18.002  10.346 -10.909
   73   HH12  ARG   9          HH12      ARG   9  19.426  11.280 -11.233
   74   HH21  ARG   9          HH21      ARG   9  17.904  14.358 -10.572
   75   HH22  ARG   9          HH22      ARG   9  19.368  13.562 -11.041
   76    H    CYS  10           H        CYS  10  15.001   8.301  -5.030
   77    HA   CYS  10           HA       CYS  10  12.222   7.428  -5.224
   78    HB2  CYS  10           HB2      CYS  10  13.955   5.471  -4.880
   79    HB3  CYS  10           HB3      CYS  10  13.950   6.040  -3.214
   80    H    ARG  11           H        ARG  11  11.056   8.775  -4.037
   81    HA   ARG  11           HA       ARG  11  12.008   9.586  -1.404
   82    HB2  ARG  11           HB2      ARG  11  11.788  11.365  -3.730
   83    HB3  ARG  11           HB3      ARG  11  10.948  11.950  -2.301
   84    HG2  ARG  11           HG2      ARG  11  12.868  12.265  -1.124
   85    HG3  ARG  11           HG3      ARG  11  13.723  10.967  -1.960
   86    HD2  ARG  11           HD2      ARG  11  14.577  12.383  -3.454
   87    HD3  ARG  11           HD3      ARG  11  12.998  13.098  -3.775
   88    HE   ARG  11           HE       ARG  11  15.061  14.179  -2.137
   89   HH11  ARG  11          HH11      ARG  11  11.605  13.957  -2.487
   90   HH12  ARG  11          HH12      ARG  11  11.292  15.443  -1.652
   91   HH21  ARG  11          HH21      ARG  11  14.664  16.136  -1.035
   92   HH22  ARG  11          HH22      ARG  11  13.034  16.682  -0.827
   93    HA   PRO  12           HA       PRO  12   7.808   9.189  -0.202
   94    HB2  PRO  12           HB2      PRO  12   7.528  11.176   1.625
   95    HB3  PRO  12           HB3      PRO  12   8.466   9.711   1.935
   96    HG2  PRO  12           HG2      PRO  12   9.414  12.431   1.119
   97    HG3  PRO  12           HG3      PRO  12  10.093  11.326   2.329
   98    HD2  PRO  12           HD2      PRO  12  11.134  11.583  -0.157
   99    HD3  PRO  12           HD3      PRO  12  11.174  10.053   0.741
  100    H    LYS  13           H        LYS  13   5.797   9.857  -0.783
  101    HA   LYS  13           HA       LYS  13   5.598  12.093  -2.587
  102    HB2  LYS  13           HB2      LYS  13   3.803   9.880  -1.711
  103    HB3  LYS  13           HB3      LYS  13   3.064  11.316  -2.410
  104    HG2  LYS  13           HG2      LYS  13   3.450   9.568  -4.076
  105    HG3  LYS  13           HG3      LYS  13   4.359  11.038  -4.435
  106    HD2  LYS  13           HD2      LYS  13   6.379  10.041  -3.536
  107    HD3  LYS  13           HD3      LYS  13   5.484   8.595  -3.065
  108    HE2  LYS  13           HE2      LYS  13   5.900   9.597  -5.880
  109    HE3  LYS  13           HE3      LYS  13   6.721   8.226  -5.133
  110    HZ1  LYS  13           HZ1      LYS  13   4.984   7.332  -6.410
  111    HZ2  LYS  13           HZ2      LYS  13   3.858   8.463  -5.852
  112    HZ3  LYS  13           HZ3      LYS  13   4.432   7.258  -4.812
  113    HA   PRO  14           HA       PRO  14   4.053  15.179   0.124
  114    HB2  PRO  14           HB2      PRO  14   2.218  16.429  -1.439
  115    HB3  PRO  14           HB3      PRO  14   3.960  16.580  -1.693
  116    HG2  PRO  14           HG2      PRO  14   1.985  14.833  -3.108
  117    HG3  PRO  14           HG3      PRO  14   3.313  15.796  -3.783
  118    HD2  PRO  14           HD2      PRO  14   3.507  13.125  -3.380
  119    HD3  PRO  14           HD3      PRO  14   4.900  14.215  -3.241
  120    H    ASN  15           H        ASN  15   1.605  13.237  -1.538
  121    HA   ASN  15           HA       ASN  15  -0.386  13.852   0.489
  122    HB2  ASN  15           HB2      ASN  15  -1.873  12.415  -0.891
  123    HB3  ASN  15           HB3      ASN  15  -1.154  13.736  -1.808
  124   HD21  ASN  15          HD21      ASN  15  -0.220  13.247  -3.659
  125   HD22  ASN  15          HD22      ASN  15   0.274  11.669  -4.159
  126    H    CYS  16           H        CYS  16   1.819  11.308  -0.381
  127    HA   CYS  16           HA       CYS  16   0.707   9.613   1.755
  128    HB2  CYS  16           HB2      CYS  16   0.897   8.759  -0.687
  129    HB3  CYS  16           HB3      CYS  16   2.620   8.636  -0.348
  130    H    GLY  17           H        GLY  17   1.988  11.324   3.051
  131    HA2  GLY  17           HA2      GLY  17   4.448  10.049   3.877
  132    HA3  GLY  17           HA3      GLY  17   4.663  11.652   3.187
  133    HN1  NH2  18           H1       NH2  18   4.675  13.272   4.587
  134    HN2  NH2  18           H2       NH2  18   3.956  13.323   6.135
  Start of MODEL   13
    1    H1   ARG   1           H        ARG   1   0.117  -1.088  -2.771
    2    HA   ARG   1           HA       ARG   1   1.248   0.160  -0.362
    3    HB2  ARG   1           HB2      ARG   1   2.496  -1.747  -1.402
    4    HB3  ARG   1           HB3      ARG   1   2.711  -0.758  -2.841
    5    HG2  ARG   1           HG2      ARG   1   4.690  -0.363  -1.791
    6    HG3  ARG   1           HG3      ARG   1   3.722   0.947  -1.109
    7    HD2  ARG   1           HD2      ARG   1   3.746  -1.681   0.288
    8    HD3  ARG   1           HD3      ARG   1   5.170  -0.649   0.420
    9    HE   ARG   1           HE       ARG   1   2.800   0.812   0.965
   10   HH11  ARG   1          HH11      ARG   1   4.987  -1.520   2.341
   11   HH12  ARG   1          HH12      ARG   1   4.652  -1.064   3.979
   12   HH21  ARG   1          HH21      ARG   1   2.350   1.422   3.116
   13   HH22  ARG   1          HH22      ARG   1   3.151   0.610   4.419
   14    H    CYS   2           H        CYS   2   1.859   2.258  -0.353
   15    HA   CYS   2           HA       CYS   2   1.300   3.806  -2.792
   16    HB2  CYS   2           HB2      CYS   2   0.050   4.210  -0.540
   17    HB3  CYS   2           HB3      CYS   2   1.535   5.026  -0.060
   18    H    LYS   3           H        LYS   3   3.711   2.580  -2.805
   19    HA   LYS   3           HA       LYS   3   5.587   4.784  -2.245
   20    HB2  LYS   3           HB2      LYS   3   5.891   1.825  -1.868
   21    HB3  LYS   3           HB3      LYS   3   7.309   2.811  -2.205
   22    HG2  LYS   3           HG2      LYS   3   6.688   4.228  -0.241
   23    HG3  LYS   3           HG3      LYS   3   5.434   3.043   0.136
   24    HD2  LYS   3           HD2      LYS   3   7.378   1.326   0.024
   25    HD3  LYS   3           HD3      LYS   3   8.412   2.743   0.223
   26    HE2  LYS   3           HE2      LYS   3   7.297   3.308   2.294
   27    HE3  LYS   3           HE3      LYS   3   6.155   1.983   2.074
   28    HZ1  LYS   3           HZ1      LYS   3   7.875   0.401   2.374
   29    HZ2  LYS   3           HZ2      LYS   3   8.018   1.516   3.638
   30    HZ3  LYS   3           HZ3      LYS   3   9.083   1.586   2.325
   31    H    THR   4           H        THR   4   6.424   5.649  -4.015
   32    HA   THR   4           HA       THR   4   6.822   3.941  -6.379
   33    HB   THR   4           HB       THR   4   6.015   6.826  -6.646
   34    HG1  THR   4           HG1      THR   4   3.917   6.258  -6.604
   35   HG21  THR   4          HG21      THR   4   5.096   5.736  -8.837
   36   HG22  THR   4          HG22      THR   4   6.234   4.446  -8.444
   37   HG23  THR   4          HG23      THR   4   6.816   6.093  -8.687
   38    H    CYS   5           H        CYS   5   8.885   3.900  -6.955
   39    HA   CYS   5           HA       CYS   5  10.509   6.325  -6.591
   40    HB2  CYS   5           HB2      CYS   5  11.385   3.492  -5.988
   41    HB3  CYS   5           HB3      CYS   5  12.425   4.911  -5.937
   42    H    SER   6           H        SER   6  11.388   6.978  -8.432
   43    HA   SER   6           HA       SER   6  11.184   5.463 -10.826
   44    HB2  SER   6           HB2      SER   6  11.177   7.997 -10.629
   45    HB3  SER   6           HB3      SER   6  12.924   7.898 -10.410
   46    HG   SER   6           HG       SER   6  12.775   8.090 -12.541
   47    H    LYS   7           H        LYS   7  13.161   5.204 -12.290
   48    HA   LYS   7           HA       LYS   7  14.930   3.361 -11.088
   49    HB2  LYS   7           HB2      LYS   7  15.178   4.766 -13.754
   50    HB3  LYS   7           HB3      LYS   7  16.065   3.331 -13.265
   51    HG2  LYS   7           HG2      LYS   7  13.881   2.148 -13.034
   52    HG3  LYS   7           HG3      LYS   7  13.104   3.572 -13.730
   53    HD2  LYS   7           HD2      LYS   7  13.404   2.253 -15.598
   54    HD3  LYS   7           HD3      LYS   7  14.864   3.245 -15.634
   55    HE2  LYS   7           HE2      LYS   7  15.799   1.187 -15.927
   56    HE3  LYS   7           HE3      LYS   7  15.812   1.262 -14.165
   57    HZ1  LYS   7           HZ1      LYS   7  14.616  -0.583 -14.155
   58    HZ2  LYS   7           HZ2      LYS   7  14.492  -0.581 -15.841
   59    HZ3  LYS   7           HZ3      LYS   7  13.343   0.239 -14.908
   60    H    GLY   8           H        GLY   8  16.247   4.110  -9.509
   61    HA2  GLY   8           HA2      GLY   8  18.475   4.908  -9.087
   62    HA3  GLY   8           HA3      GLY   8  18.225   6.135 -10.319
   63    H    ARG   9           H        ARG   9  15.505   6.720  -9.238
   64    HA   ARG   9           HA       ARG   9  16.372   8.279  -6.892
   65    HB2  ARG   9           HB2      ARG   9  14.508   8.936  -9.154
   66    HB3  ARG   9           HB3      ARG   9  14.364   9.763  -7.608
   67    HG2  ARG   9           HG2      ARG   9  16.436  10.792  -7.822
   68    HG3  ARG   9           HG3      ARG   9  16.985   9.644  -9.045
   69    HD2  ARG   9           HD2      ARG   9  15.235  10.567 -10.575
   70    HD3  ARG   9           HD3      ARG   9  14.914  11.809  -9.365
   71    HE   ARG   9           HE       ARG   9  16.843  12.881  -9.993
   72   HH11  ARG   9          HH11      ARG   9  16.819   9.663 -11.324
   73   HH12  ARG   9          HH12      ARG   9  18.208   9.928 -12.327
   74   HH21  ARG   9          HH21      ARG   9  18.670  13.240 -11.309
   75   HH22  ARG   9          HH22      ARG   9  19.260  11.962 -12.317
   76    H    CYS  10           H        CYS  10  15.192   8.194  -5.052
   77    HA   CYS  10           HA       CYS  10  12.557   6.954  -5.065
   78    HB2  CYS  10           HB2      CYS  10  14.199   5.097  -4.772
   79    HB3  CYS  10           HB3      CYS  10  14.778   5.891  -3.310
   80    H    ARG  11           H        ARG  11  11.290   8.246  -3.924
   81    HA   ARG  11           HA       ARG  11  12.137   9.224  -1.333
   82    HB2  ARG  11           HB2      ARG  11  11.790  10.983  -3.711
   83    HB3  ARG  11           HB3      ARG  11  11.190  11.570  -2.165
   84    HG2  ARG  11           HG2      ARG  11  13.508  11.025  -1.253
   85    HG3  ARG  11           HG3      ARG  11  14.003  10.890  -2.942
   86    HD2  ARG  11           HD2      ARG  11  12.961  13.207  -3.239
   87    HD3  ARG  11           HD3      ARG  11  12.962  13.294  -1.477
   88    HE   ARG  11           HE       ARG  11  15.214  13.576  -3.216
   89   HH11  ARG  11          HH11      ARG  11  14.209  12.552  -0.044
   90   HH12  ARG  11          HH12      ARG  11  15.756  12.838   0.682
   91   HH21  ARG  11          HH21      ARG  11  17.255  13.955  -2.274
   92   HH22  ARG  11          HH22      ARG  11  17.488  13.636  -0.588
   93    HA   PRO  12           HA       PRO  12   7.894   8.780  -0.315
   94    HB2  PRO  12           HB2      PRO  12   7.496  10.809   1.444
   95    HB3  PRO  12           HB3      PRO  12   8.445   9.371   1.836
   96    HG2  PRO  12           HG2      PRO  12   9.381  12.085   0.992
   97    HG3  PRO  12           HG3      PRO  12  10.022  11.025   2.260
   98    HD2  PRO  12           HD2      PRO  12  11.174  11.235  -0.183
   99    HD3  PRO  12           HD3      PRO  12  11.198   9.730   0.758
  100    H    LYS  13           H        LYS  13   5.901   9.396  -1.002
  101    HA   LYS  13           HA       LYS  13   5.754  11.617  -2.844
  102    HB2  LYS  13           HB2      LYS  13   3.903   9.393  -2.054
  103    HB3  LYS  13           HB3      LYS  13   3.289  10.769  -2.962
  104    HG2  LYS  13           HG2      LYS  13   5.343  10.217  -4.521
  105    HG3  LYS  13           HG3      LYS  13   5.154   8.616  -3.803
  106    HD2  LYS  13           HD2      LYS  13   2.734  10.010  -4.841
  107    HD3  LYS  13           HD3      LYS  13   3.859   9.296  -5.998
  108    HE2  LYS  13           HE2      LYS  13   3.690   7.175  -4.585
  109    HE3  LYS  13           HE3      LYS  13   2.296   7.937  -3.821
  110    HZ1  LYS  13           HZ1      LYS  13   2.035   6.402  -5.912
  111    HZ2  LYS  13           HZ2      LYS  13   2.382   7.831  -6.746
  112    HZ3  LYS  13           HZ3      LYS  13   1.052   7.763  -5.703
  113    HA   PRO  14           HA       PRO  14   3.892  14.621  -0.242
  114    HB2  PRO  14           HB2      PRO  14   2.126  15.805  -1.929
  115    HB3  PRO  14           HB3      PRO  14   3.874  16.028  -2.058
  116    HG2  PRO  14           HG2      PRO  14   2.078  14.210  -3.616
  117    HG3  PRO  14           HG3      PRO  14   3.410  15.229  -4.191
  118    HD2  PRO  14           HD2      PRO  14   3.685  12.566  -3.783
  119    HD3  PRO  14           HD3      PRO  14   5.019  13.713  -3.540
  120    H    ASN  15           H        ASN  15   1.575  12.723  -2.154
  121    HA   ASN  15           HA       ASN  15  -0.628  13.261  -0.417
  122    HB2  ASN  15           HB2      ASN  15  -0.158  11.374  -2.705
  123    HB3  ASN  15           HB3      ASN  15  -1.609  11.229  -1.716
  124   HD21  ASN  15          HD21      ASN  15   0.133  13.195  -3.987
  125   HD22  ASN  15          HD22      ASN  15  -1.173  14.256  -4.380
  126    H    CYS  16           H        CYS  16   1.881  10.857  -0.560
  127    HA   CYS  16           HA       CYS  16   1.037   9.818   2.015
  128    HB2  CYS  16           HB2      CYS  16   1.162   7.462   1.258
  129    HB3  CYS  16           HB3      CYS  16  -0.161   8.345   0.502
  130    H    GLY  17           H        GLY  17   2.748   9.431   3.280
  131    HA2  GLY  17           HA2      GLY  17   4.923   8.482   3.661
  132    HA3  GLY  17           HA3      GLY  17   5.344   8.886   2.002
  133    HN1  NH2  18           H1       NH2  18   6.622   9.536   4.630
  134    HN2  NH2  18           H2       NH2  18   6.838  11.229   4.660
  Start of MODEL   14
    1    H1   ARG   1           H        ARG   1  -2.308   6.735  -6.121
    2    HA   ARG   1           HA       ARG   1  -2.054   4.799  -3.959
    3    HB2  ARG   1           HB2      ARG   1  -1.082   3.327  -5.636
    4    HB3  ARG   1           HB3      ARG   1  -2.595   4.004  -6.225
    5    HG2  ARG   1           HG2      ARG   1  -1.006   5.796  -7.298
    6    HG3  ARG   1           HG3      ARG   1   0.193   4.511  -7.128
    7    HD2  ARG   1           HD2      ARG   1  -1.549   3.009  -8.264
    8    HD3  ARG   1           HD3      ARG   1  -2.352   4.511  -8.717
    9    HE   ARG   1           HE       ARG   1   0.090   3.447  -9.812
   10   HH11  ARG   1          HH11      ARG   1  -1.850   6.296  -9.328
   11   HH12  ARG   1          HH12      ARG   1  -1.151   7.156 -10.660
   12   HH21  ARG   1          HH21      ARG   1   1.017   4.569 -11.568
   13   HH22  ARG   1          HH22      ARG   1   0.478   6.173 -11.934
   14    H    CYS   2           H        CYS   2  -0.069   4.083  -3.135
   15    HA   CYS   2           HA       CYS   2   2.055   6.091  -3.284
   16    HB2  CYS   2           HB2      CYS   2   0.992   5.108  -1.093
   17    HB3  CYS   2           HB3      CYS   2   2.099   3.771  -1.391
   18    H    LYS   3           H        LYS   3   2.419   5.125  -5.529
   19    HA   LYS   3           HA       LYS   3   3.450   2.603  -5.991
   20    HB2  LYS   3           HB2      LYS   3   2.941   4.622  -7.602
   21    HB3  LYS   3           HB3      LYS   3   4.655   4.958  -7.390
   22    HG2  LYS   3           HG2      LYS   3   5.306   3.061  -8.499
   23    HG3  LYS   3           HG3      LYS   3   3.809   2.202  -8.135
   24    HD2  LYS   3           HD2      LYS   3   2.752   4.086  -9.639
   25    HD3  LYS   3           HD3      LYS   3   4.393   4.188 -10.279
   26    HE2  LYS   3           HE2      LYS   3   3.089   1.518 -10.021
   27    HE3  LYS   3           HE3      LYS   3   2.630   2.574 -11.357
   28    HZ1  LYS   3           HZ1      LYS   3   5.089   2.738 -11.829
   29    HZ2  LYS   3           HZ2      LYS   3   4.369   1.244 -12.158
   30    HZ3  LYS   3           HZ3      LYS   3   5.299   1.443 -10.761
   31    H    THR   4           H        THR   4   5.744   2.046  -6.525
   32    HA   THR   4           HA       THR   4   7.418   2.711  -4.265
   33    HB   THR   4           HB       THR   4   7.247   0.380  -5.122
   34    HG1  THR   4           HG1      THR   4   9.915   1.286  -5.426
   35   HG21  THR   4          HG21      THR   4   7.304   1.231  -7.572
   36   HG22  THR   4          HG22      THR   4   8.104  -0.290  -7.177
   37   HG23  THR   4          HG23      THR   4   9.054   1.182  -7.373
   38    H    CYS   5           H        CYS   5   9.637   3.401  -4.472
   39    HA   CYS   5           HA       CYS   5   9.997   5.717  -5.930
   40    HB2  CYS   5           HB2      CYS   5  12.022   3.789  -4.793
   41    HB3  CYS   5           HB3      CYS   5  12.473   5.331  -5.511
   42    H    SER   6           H        SER   6  11.620   6.155  -7.642
   43    HA   SER   6           HA       SER   6  11.282   4.222  -9.805
   44    HB2  SER   6           HB2      SER   6  10.740   6.696 -10.067
   45    HB3  SER   6           HB3      SER   6  12.479   6.986 -10.016
   46    HG   SER   6           HG       SER   6  11.397   5.105 -11.807
   47    H    LYS   7           H        LYS   7  13.190   4.082 -11.370
   48    HA   LYS   7           HA       LYS   7  15.396   2.964  -9.977
   49    HB2  LYS   7           HB2      LYS   7  14.646   3.380 -12.824
   50    HB3  LYS   7           HB3      LYS   7  16.347   3.107 -12.474
   51    HG2  LYS   7           HG2      LYS   7  15.553   0.979 -12.900
   52    HG3  LYS   7           HG3      LYS   7  15.519   1.067 -11.137
   53    HD2  LYS   7           HD2      LYS   7  13.082   1.913 -12.608
   54    HD3  LYS   7           HD3      LYS   7  13.449   0.188 -12.555
   55    HE2  LYS   7           HE2      LYS   7  13.597   1.726 -10.017
   56    HE3  LYS   7           HE3      LYS   7  12.000   1.377 -10.680
   57    HZ1  LYS   7           HZ1      LYS   7  12.257  -0.857 -10.372
   58    HZ2  LYS   7           HZ2      LYS   7  13.164  -0.285  -9.064
   59    HZ3  LYS   7           HZ3      LYS   7  13.945  -0.808 -10.470
   60    H    GLY   8           H        GLY   8  16.730   4.253  -8.855
   61    HA2  GLY   8           HA2      GLY   8  18.653   5.623  -8.800
   62    HA3  GLY   8           HA3      GLY   8  18.170   6.322 -10.339
   63    H    ARG   9           H        ARG   9  15.393   6.726  -9.324
   64    HA   ARG   9           HA       ARG   9  15.953   9.078  -7.638
   65    HB2  ARG   9           HB2      ARG   9  14.003   8.654  -9.885
   66    HB3  ARG   9           HB3      ARG   9  13.722   9.897  -8.673
   67    HG2  ARG   9           HG2      ARG   9  15.648  11.091  -9.295
   68    HG3  ARG   9           HG3      ARG   9  16.285   9.733 -10.224
   69    HD2  ARG   9           HD2      ARG   9  13.768  11.251 -10.900
   70    HD3  ARG   9           HD3      ARG   9  15.344  11.551 -11.630
   71    HE   ARG   9           HE       ARG   9  14.916   8.897 -12.046
   72   HH11  ARG   9          HH11      ARG   9  13.128  11.799 -12.751
   73   HH12  ARG   9          HH12      ARG   9  12.377  11.148 -14.171
   74   HH21  ARG   9          HH21      ARG   9  13.935   8.028 -13.913
   75   HH22  ARG   9          HH22      ARG   9  12.837   9.004 -14.830
   76    H    CYS  10           H        CYS  10  15.305   8.774  -5.619
   77    HA   CYS  10           HA       CYS  10  12.698   7.501  -5.155
   78    HB2  CYS  10           HB2      CYS  10  14.466   5.847  -4.683
   79    HB3  CYS  10           HB3      CYS  10  15.205   6.969  -3.546
   80    H    ARG  11           H        ARG  11  11.405   8.833  -4.093
   81    HA   ARG  11           HA       ARG  11  12.431  10.441  -1.900
   82    HB2  ARG  11           HB2      ARG  11  11.460  11.559  -4.482
   83    HB3  ARG  11           HB3      ARG  11  10.980  12.385  -3.005
   84    HG2  ARG  11           HG2      ARG  11  13.543  12.239  -2.464
   85    HG3  ARG  11           HG3      ARG  11  13.678  12.075  -4.216
   86    HD2  ARG  11           HD2      ARG  11  13.843  14.368  -3.890
   87    HD3  ARG  11           HD3      ARG  11  12.143  14.144  -4.302
   88    HE   ARG  11           HE       ARG  11  12.577  14.053  -1.486
   89   HH11  ARG  11          HH11      ARG  11  12.243  16.209  -4.199
   90   HH12  ARG  11          HH12      ARG  11  11.670  17.535  -3.243
   91   HH21  ARG  11          HH21      ARG  11  11.822  15.791  -0.217
   92   HH22  ARG  11          HH22      ARG  11  11.432  17.297  -0.977
   93    HA   PRO  12           HA       PRO  12   8.517   9.659  -0.082
   94    HB2  PRO  12           HB2      PRO  12   8.033  11.954   1.283
   95    HB3  PRO  12           HB3      PRO  12   9.260  10.783   1.779
   96    HG2  PRO  12           HG2      PRO  12   9.587  13.343   0.262
   97    HG3  PRO  12           HG3      PRO  12  10.576  12.690   1.582
   98    HD2  PRO  12           HD2      PRO  12  11.312  12.507  -1.019
   99    HD3  PRO  12           HD3      PRO  12  11.728  11.266   0.182
  100    H    LYS  13           H        LYS  13   6.370   9.827  -0.515
  101    HA   LYS  13           HA       LYS  13   5.583  11.544  -2.703
  102    HB2  LYS  13           HB2      LYS  13   4.403   9.226  -1.262
  103    HB3  LYS  13           HB3      LYS  13   3.287  10.334  -2.051
  104    HG2  LYS  13           HG2      LYS  13   4.942   9.998  -4.080
  105    HG3  LYS  13           HG3      LYS  13   5.288   8.488  -3.232
  106    HD2  LYS  13           HD2      LYS  13   2.873   7.976  -3.226
  107    HD3  LYS  13           HD3      LYS  13   2.577   9.455  -4.142
  108    HE2  LYS  13           HE2      LYS  13   4.429   7.288  -5.105
  109    HE3  LYS  13           HE3      LYS  13   2.704   7.295  -5.471
  110    HZ1  LYS  13           HZ1      LYS  13   4.174   8.315  -7.198
  111    HZ2  LYS  13           HZ2      LYS  13   4.500   9.565  -6.107
  112    HZ3  LYS  13           HZ3      LYS  13   2.921   9.313  -6.654
  113    HA   PRO  14           HA       PRO  14   3.617  14.757  -0.452
  114    HB2  PRO  14           HB2      PRO  14   1.452  15.284  -2.002
  115    HB3  PRO  14           HB3      PRO  14   3.099  15.715  -2.474
  116    HG2  PRO  14           HG2      PRO  14   1.442  13.366  -3.311
  117    HG3  PRO  14           HG3      PRO  14   2.483  14.409  -4.298
  118    HD2  PRO  14           HD2      PRO  14   3.268  11.966  -3.433
  119    HD3  PRO  14           HD3      PRO  14   4.405  13.311  -3.654
  120    H    ASN  15           H        ASN  15   1.569  12.044  -1.405
  121    HA   ASN  15           HA       ASN  15  -0.383  12.675   0.660
  122    HB2  ASN  15           HB2      ASN  15  -0.922  11.772  -1.701
  123    HB3  ASN  15           HB3      ASN  15  -0.410  10.210  -1.068
  124   HD21  ASN  15          HD21      ASN  15  -1.704   9.122   0.344
  125   HD22  ASN  15          HD22      ASN  15  -3.304   9.629   0.753
  126    H    CYS  16           H        CYS  16   2.271  10.506   0.075
  127    HA   CYS  16           HA       CYS  16   1.617   8.840   2.368
  128    HB2  CYS  16           HB2      CYS  16   4.096   8.715   0.649
  129    HB3  CYS  16           HB3      CYS  16   3.455   7.458   1.702
  130    H    GLY  17           H        GLY  17   2.448   9.077   4.349
  131    HA2  GLY  17           HA2      GLY  17   4.320   9.541   5.803
  132    HA3  GLY  17           HA3      GLY  17   4.831  10.782   4.669
  133    HN1  NH2  18           H1       NH2  18   4.374  11.002   7.539
  134    HN2  NH2  18           H2       NH2  18   3.190  12.206   7.795
  Start of MODEL   15
    1    H1   ARG   1           H        ARG   1   1.070  -0.889  -2.556
    2    HA   ARG   1           HA       ARG   1   1.582   0.285   0.033
    3    HB2  ARG   1           HB2      ARG   1   3.952   0.834  -0.511
    4    HB3  ARG   1           HB3      ARG   1   3.667  -0.880  -0.248
    5    HG2  ARG   1           HG2      ARG   1   3.441  -1.015  -2.808
    6    HG3  ARG   1           HG3      ARG   1   4.229   0.563  -2.806
    7    HD2  ARG   1           HD2      ARG   1   6.079  -0.421  -1.476
    8    HD3  ARG   1           HD3      ARG   1   5.305  -1.999  -1.637
    9    HE   ARG   1           HE       ARG   1   5.816  -0.682  -4.145
   10   HH11  ARG   1          HH11      ARG   1   7.109  -2.773  -1.681
   11   HH12  ARG   1          HH12      ARG   1   8.266  -3.517  -2.736
   12   HH21  ARG   1          HH21      ARG   1   7.333  -1.653  -5.543
   13   HH22  ARG   1          HH22      ARG   1   8.392  -2.879  -4.932
   14    H    CYS   2           H        CYS   2   2.644   2.550  -0.340
   15    HA   CYS   2           HA       CYS   2   1.493   3.742  -2.775
   16    HB2  CYS   2           HB2      CYS   2   0.815   5.695  -1.458
   17    HB3  CYS   2           HB3      CYS   2   0.051   4.230  -0.848
   18    H    LYS   3           H        LYS   3   4.186   2.916  -2.423
   19    HA   LYS   3           HA       LYS   3   5.550   5.528  -2.417
   20    HB2  LYS   3           HB2      LYS   3   6.078   3.751  -0.557
   21    HB3  LYS   3           HB3      LYS   3   7.021   2.986  -1.831
   22    HG2  LYS   3           HG2      LYS   3   8.272   5.099  -2.119
   23    HG3  LYS   3           HG3      LYS   3   7.380   5.774  -0.753
   24    HD2  LYS   3           HD2      LYS   3   9.010   3.249  -0.573
   25    HD3  LYS   3           HD3      LYS   3   9.667   4.849  -0.220
   26    HE2  LYS   3           HE2      LYS   3   7.846   5.135   1.467
   27    HE3  LYS   3           HE3      LYS   3   7.395   3.454   1.188
   28    HZ1  LYS   3           HZ1      LYS   3  10.193   3.834   1.751
   29    HZ2  LYS   3           HZ2      LYS   3   9.101   2.720   2.403
   30    HZ3  LYS   3           HZ3      LYS   3   9.179   4.291   3.026
   31    H    THR   4           H        THR   4   6.122   6.085  -4.404
   32    HA   THR   4           HA       THR   4   6.842   3.965  -6.317
   33    HB   THR   4           HB       THR   4   6.097   6.759  -7.133
   34    HG1  THR   4           HG1      THR   4   4.037   6.345  -6.812
   35   HG21  THR   4          HG21      THR   4   5.143   4.840  -8.930
   36   HG22  THR   4          HG22      THR   4   6.745   4.277  -8.454
   37   HG23  THR   4          HG23      THR   4   6.545   5.891  -9.138
   38    H    CYS   5           H        CYS   5   8.941   3.786  -6.695
   39    HA   CYS   5           HA       CYS   5  10.618   6.203  -6.509
   40    HB2  CYS   5           HB2      CYS   5  11.436   3.321  -6.076
   41    HB3  CYS   5           HB3      CYS   5  12.488   4.726  -5.932
   42    H    SER   6           H        SER   6  11.448   6.900  -8.354
   43    HA   SER   6           HA       SER   6  11.165   5.423 -10.780
   44    HB2  SER   6           HB2      SER   6  11.220   8.029 -10.339
   45    HB3  SER   6           HB3      SER   6  12.951   7.816 -10.601
   46    HG   SER   6           HG       SER   6  10.992   7.933 -12.413
   47    H    LYS   7           H        LYS   7  13.099   5.260 -12.313
   48    HA   LYS   7           HA       LYS   7  14.961   3.449 -11.222
   49    HB2  LYS   7           HB2      LYS   7  14.125   3.861 -13.696
   50    HB3  LYS   7           HB3      LYS   7  15.554   4.885 -13.773
   51    HG2  LYS   7           HG2      LYS   7  16.231   2.793 -14.584
   52    HG3  LYS   7           HG3      LYS   7  16.864   2.884 -12.939
   53    HD2  LYS   7           HD2      LYS   7  15.236   1.407 -12.113
   54    HD3  LYS   7           HD3      LYS   7  14.217   1.598 -13.541
   55    HE2  LYS   7           HE2      LYS   7  15.735   0.351 -14.886
   56    HE3  LYS   7           HE3      LYS   7  16.961   0.362 -13.620
   57    HZ1  LYS   7           HZ1      LYS   7  14.673  -0.762 -12.523
   58    HZ2  LYS   7           HZ2      LYS   7  16.126  -1.540 -12.899
   59    HZ3  LYS   7           HZ3      LYS   7  14.877  -1.488 -14.038
   60    H    GLY   8           H        GLY   8  16.247   4.222  -9.614
   61    HA2  GLY   8           HA2      GLY   8  18.480   5.064  -9.232
   62    HA3  GLY   8           HA3      GLY   8  18.147   6.338 -10.395
   63    H    ARG   9           H        ARG   9  15.440   6.759  -9.212
   64    HA   ARG   9           HA       ARG   9  16.309   8.226  -6.809
   65    HB2  ARG   9           HB2      ARG   9  14.345   8.942  -8.970
   66    HB3  ARG   9           HB3      ARG   9  14.278   9.708  -7.389
   67    HG2  ARG   9           HG2      ARG   9  16.318  10.777  -7.679
   68    HG3  ARG   9           HG3      ARG   9  16.822   9.673  -8.959
   69    HD2  ARG   9           HD2      ARG   9  14.435  11.441  -9.323
   70    HD3  ARG   9           HD3      ARG   9  16.062  12.071  -9.577
   71    HE   ARG   9           HE       ARG   9  14.601  10.384 -11.331
   72   HH11  ARG   9          HH11      ARG   9  17.813  11.048 -10.167
   73   HH12  ARG   9          HH12      ARG   9  18.595  10.469 -11.602
   74   HH21  ARG   9          HH21      ARG   9  15.616   9.619 -13.225
   75   HH22  ARG   9          HH22      ARG   9  17.343   9.656 -13.340
   76    H    CYS  10           H        CYS  10  15.102   8.094  -4.967
   77    HA   CYS  10           HA       CYS  10  12.537   6.723  -5.004
   78    HB2  CYS  10           HB2      CYS  10  14.268   4.934  -4.777
   79    HB3  CYS  10           HB3      CYS  10  14.811   5.704  -3.290
   80    H    ARG  11           H        ARG  11  11.302   8.146  -3.972
   81    HA   ARG  11           HA       ARG  11  12.041   8.962  -1.280
   82    HB2  ARG  11           HB2      ARG  11  11.842  10.812  -3.599
   83    HB3  ARG  11           HB3      ARG  11  11.145  11.351  -2.078
   84    HG2  ARG  11           HG2      ARG  11  13.215  11.280  -0.978
   85    HG3  ARG  11           HG3      ARG  11  13.955  10.319  -2.259
   86    HD2  ARG  11           HD2      ARG  11  14.010  12.153  -3.739
   87    HD3  ARG  11           HD3      ARG  11  12.902  13.092  -2.740
   88    HE   ARG  11           HE       ARG  11  15.343  12.439  -1.389
   89   HH11  ARG  11          HH11      ARG  11  13.835  14.657  -3.610
   90   HH12  ARG  11          HH12      ARG  11  14.925  15.956  -3.258
   91   HH21  ARG  11          HH21      ARG  11  16.785  14.143  -0.917
   92   HH22  ARG  11          HH22      ARG  11  16.604  15.662  -1.727
   93    HA   PRO  12           HA       PRO  12   7.753   8.547  -0.451
   94    HB2  PRO  12           HB2      PRO  12   7.314  10.511   1.371
   95    HB3  PRO  12           HB3      PRO  12   8.225   9.043   1.743
   96    HG2  PRO  12           HG2      PRO  12   9.233  11.773   1.046
   97    HG3  PRO  12           HG3      PRO  12   9.809  10.654   2.294
   98    HD2  PRO  12           HD2      PRO  12  11.060  10.943  -0.089
   99    HD3  PRO  12           HD3      PRO  12  11.024   9.401   0.790
  100    H    LYS  13           H        LYS  13   5.798   9.224  -1.191
  101    HA   LYS  13           HA       LYS  13   5.755  11.498  -2.963
  102    HB2  LYS  13           HB2      LYS  13   4.082   9.141  -2.456
  103    HB3  LYS  13           HB3      LYS  13   3.166  10.590  -2.850
  104    HG2  LYS  13           HG2      LYS  13   4.109  10.765  -4.963
  105    HG3  LYS  13           HG3      LYS  13   5.483   9.739  -4.541
  106    HD2  LYS  13           HD2      LYS  13   4.014   8.485  -5.963
  107    HD3  LYS  13           HD3      LYS  13   3.901   7.824  -4.331
  108    HE2  LYS  13           HE2      LYS  13   1.818   8.923  -3.952
  109    HE3  LYS  13           HE3      LYS  13   1.973   9.854  -5.441
  110    HZ1  LYS  13           HZ1      LYS  13   0.531   7.656  -5.284
  111    HZ2  LYS  13           HZ2      LYS  13   2.014   6.950  -5.691
  112    HZ3  LYS  13           HZ3      LYS  13   1.325   8.115  -6.707
  113    HA   PRO  14           HA       PRO  14   3.910  14.492  -0.339
  114    HB2  PRO  14           HB2      PRO  14   2.223  15.766  -2.042
  115    HB3  PRO  14           HB3      PRO  14   3.980  15.943  -2.120
  116    HG2  PRO  14           HG2      PRO  14   2.175  14.214  -3.767
  117    HG3  PRO  14           HG3      PRO  14   3.550  15.206  -4.284
  118    HD2  PRO  14           HD2      PRO  14   3.739  12.528  -3.932
  119    HD3  PRO  14           HD3      PRO  14   5.097  13.629  -3.628
  120    H    ASN  15           H        ASN  15   1.667  12.565  -2.279
  121    HA   ASN  15           HA       ASN  15  -0.621  13.187  -0.679
  122    HB2  ASN  15           HB2      ASN  15  -0.580  12.396  -3.127
  123    HB3  ASN  15           HB3      ASN  15  -0.362  10.777  -2.468
  124   HD21  ASN  15          HD21      ASN  15  -2.406  13.621  -1.873
  125   HD22  ASN  15          HD22      ASN  15  -3.885  12.737  -1.735
  126    H    CYS  16           H        CYS  16   1.887  10.779  -0.599
  127    HA   CYS  16           HA       CYS  16   0.589   9.559   1.748
  128    HB2  CYS  16           HB2      CYS  16   1.095   8.248  -0.590
  129    HB3  CYS  16           HB3      CYS  16   2.570   7.916   0.313
  130    H    GLY  17           H        GLY  17   2.294  11.807   1.870
  131    HA2  GLY  17           HA2      GLY  17   4.600  10.612   3.275
  132    HA3  GLY  17           HA3      GLY  17   4.787  12.031   2.255
  133    HN1  NH2  18           H1       NH2  18   2.669  13.585   2.933
  134    HN2  NH2  18           H2       NH2  18   2.732  14.079   4.566
  Start of MODEL   16
    1    H1   ARG   1           H        ARG   1   1.634  -1.118  -2.001
    2    HA   ARG   1           HA       ARG   1   1.929  -0.207  -4.167
    3    HB2  ARG   1           HB2      ARG   1  -0.163  -1.702  -3.809
    4    HB3  ARG   1           HB3      ARG   1  -1.067  -0.204  -3.982
    5    HG2  ARG   1           HG2      ARG   1   0.282   0.074  -6.172
    6    HG3  ARG   1           HG3      ARG   1   0.586  -1.656  -6.002
    7    HD2  ARG   1           HD2      ARG   1  -2.110  -0.308  -6.140
    8    HD3  ARG   1           HD3      ARG   1  -1.356  -1.274  -7.406
    9    HE   ARG   1           HE       ARG   1  -1.471  -2.929  -5.227
   10   HH11  ARG   1          HH11      ARG   1  -3.775  -1.107  -7.098
   11   HH12  ARG   1          HH12      ARG   1  -5.076  -2.215  -6.815
   12   HH21  ARG   1          HH21      ARG   1  -3.177  -4.395  -4.849
   13   HH22  ARG   1          HH22      ARG   1  -4.736  -4.084  -5.536
   14    H    CYS   2           H        CYS   2   2.091   1.965  -2.347
   15    HA   CYS   2           HA       CYS   2   0.659   4.052  -3.859
   16    HB2  CYS   2           HB2      CYS   2  -0.181   3.929  -1.573
   17    HB3  CYS   2           HB3      CYS   2   1.456   4.060  -0.940
   18    H    LYS   3           H        LYS   3   3.645   3.096  -2.271
   19    HA   LYS   3           HA       LYS   3   5.038   5.493  -3.103
   20    HB2  LYS   3           HB2      LYS   3   5.423   3.985  -0.974
   21    HB3  LYS   3           HB3      LYS   3   6.451   3.070  -2.069
   22    HG2  LYS   3           HG2      LYS   3   6.796   6.024  -1.865
   23    HG3  LYS   3           HG3      LYS   3   7.449   4.976  -0.602
   24    HD2  LYS   3           HD2      LYS   3   8.002   4.346  -3.469
   25    HD3  LYS   3           HD3      LYS   3   8.914   5.629  -2.670
   26    HE2  LYS   3           HE2      LYS   3  10.267   3.852  -2.205
   27    HE3  LYS   3           HE3      LYS   3   9.198   3.780  -0.805
   28    HZ1  LYS   3           HZ1      LYS   3   8.304   1.858  -1.486
   29    HZ2  LYS   3           HZ2      LYS   3   9.699   1.713  -2.430
   30    HZ3  LYS   3           HZ3      LYS   3   8.272   2.310  -3.116
   31    H    THR   4           H        THR   4   5.703   5.733  -5.125
   32    HA   THR   4           HA       THR   4   6.872   3.417  -6.509
   33    HB   THR   4           HB       THR   4   4.722   3.602  -7.516
   34    HG1  THR   4           HG1      THR   4   5.531   3.594  -9.477
   35   HG21  THR   4          HG21      THR   4   4.547   6.129  -8.666
   36   HG22  THR   4          HG22      THR   4   5.099   6.433  -7.018
   37   HG23  THR   4          HG23      THR   4   3.611   5.527  -7.297
   38    H    CYS   5           H        CYS   5   8.587   3.858  -7.879
   39    HA   CYS   5           HA       CYS   5   9.371   6.469  -8.651
   40    HB2  CYS   5           HB2      CYS   5  11.348   6.751  -7.264
   41    HB3  CYS   5           HB3      CYS   5   9.920   6.623  -6.241
   42    H    SER   6           H        SER   6  11.785   6.405  -9.402
   43    HA   SER   6           HA       SER   6  12.042   3.997 -11.023
   44    HB2  SER   6           HB2      SER   6  13.907   6.335 -11.228
   45    HB3  SER   6           HB3      SER   6  13.334   5.249 -12.496
   46    HG   SER   6           HG       SER   6  12.302   7.229 -12.702
   47    H    LYS   7           H        LYS   7  14.365   3.257 -11.441
   48    HA   LYS   7           HA       LYS   7  15.456   2.363  -8.968
   49    HB2  LYS   7           HB2      LYS   7  16.255   2.073 -11.848
   50    HB3  LYS   7           HB3      LYS   7  17.332   1.532 -10.568
   51    HG2  LYS   7           HG2      LYS   7  14.480   0.621 -10.709
   52    HG3  LYS   7           HG3      LYS   7  15.762  -0.184 -11.615
   53    HD2  LYS   7           HD2      LYS   7  16.163   0.314  -8.706
   54    HD3  LYS   7           HD3      LYS   7  15.083  -0.991  -9.200
   55    HE2  LYS   7           HE2      LYS   7  16.925  -1.881 -10.623
   56    HE3  LYS   7           HE3      LYS   7  17.986  -0.650  -9.942
   57    HZ1  LYS   7           HZ1      LYS   7  17.867  -1.618  -7.834
   58    HZ2  LYS   7           HZ2      LYS   7  18.046  -2.932  -8.884
   59    HZ3  LYS   7           HZ3      LYS   7  16.526  -2.570  -8.232
   60    H    GLY   8           H        GLY   8  16.671   3.552  -7.658
   61    HA2  GLY   8           HA2      GLY   8  18.678   4.667  -7.110
   62    HA3  GLY   8           HA3      GLY   8  18.856   5.126  -8.797
   63    H    ARG   9           H        ARG   9  16.018   6.041  -8.885
   64    HA   ARG   9           HA       ARG   9  16.398   8.575  -7.432
   65    HB2  ARG   9           HB2      ARG   9  15.228   7.994 -10.139
   66    HB3  ARG   9           HB3      ARG   9  14.829   9.473  -9.276
   67    HG2  ARG   9           HG2      ARG   9  17.018  10.271  -9.393
   68    HG3  ARG   9           HG3      ARG   9  17.673   8.677  -9.771
   69    HD2  ARG   9           HD2      ARG   9  16.865   8.743 -11.971
   70    HD3  ARG   9           HD3      ARG   9  15.756  10.067 -11.613
   71    HE   ARG   9           HE       ARG   9  17.452  11.539 -12.028
   72   HH11  ARG   9          HH11      ARG   9  18.814   8.384 -11.473
   73   HH12  ARG   9          HH12      ARG   9  20.425   8.861 -11.894
   74   HH21  ARG   9          HH21      ARG   9  19.569  12.181 -12.585
   75   HH22  ARG   9          HH22      ARG   9  20.854  11.022 -12.525
   76    H    CYS  10           H        CYS  10  15.090   8.698  -5.737
   77    HA   CYS  10           HA       CYS  10  12.260   8.083  -6.080
   78    HB2  CYS  10           HB2      CYS  10  13.951   6.900  -3.869
   79    HB3  CYS  10           HB3      CYS  10  12.194   6.817  -3.947
   80    H    ARG  11           H        ARG  11  10.900   9.050  -4.466
   81    HA   ARG  11           HA       ARG  11  12.115  10.918  -2.605
   82    HB2  ARG  11           HB2      ARG  11  10.722  11.740  -5.103
   83    HB3  ARG  11           HB3      ARG  11  10.381  12.665  -3.646
   84    HG2  ARG  11           HG2      ARG  11  12.900  12.900  -3.392
   85    HG3  ARG  11           HG3      ARG  11  13.006  12.300  -5.048
   86    HD2  ARG  11           HD2      ARG  11  11.636  14.134  -5.836
   87    HD3  ARG  11           HD3      ARG  11  11.410  14.707  -4.183
   88    HE   ARG  11           HE       ARG  11  13.687  15.145  -5.869
   89   HH11  ARG  11          HH11      ARG  11  12.592  14.896  -2.573
   90   HH12  ARG  11          HH12      ARG  11  13.881  15.863  -1.934
   91   HH21  ARG  11          HH21      ARG  11  15.388  16.419  -5.039
   92   HH22  ARG  11          HH22      ARG  11  15.470  16.729  -3.338
   93    HA   PRO  12           HA       PRO  12   8.562  10.087  -0.171
   94    HB2  PRO  12           HB2      PRO  12   8.121  12.467   1.058
   95    HB3  PRO  12           HB3      PRO  12   9.483  11.417   1.460
   96    HG2  PRO  12           HG2      PRO  12   9.414  13.843  -0.293
   97    HG3  PRO  12           HG3      PRO  12  10.623  13.369   0.916
   98    HD2  PRO  12           HD2      PRO  12  10.992  12.990  -1.740
   99    HD3  PRO  12           HD3      PRO  12  11.661  11.891  -0.518
  100    H    LYS  13           H        LYS  13   6.369  10.093  -0.298
  101    HA   LYS  13           HA       LYS  13   5.163  11.558  -2.477
  102    HB2  LYS  13           HB2      LYS  13   4.258   9.391  -0.615
  103    HB3  LYS  13           HB3      LYS  13   3.068  10.292  -1.544
  104    HG2  LYS  13           HG2      LYS  13   5.355   9.249  -3.075
  105    HG3  LYS  13           HG3      LYS  13   4.260   8.040  -2.403
  106    HD2  LYS  13           HD2      LYS  13   3.053   8.406  -4.263
  107    HD3  LYS  13           HD3      LYS  13   2.510   9.864  -3.428
  108    HE2  LYS  13           HE2      LYS  13   4.879  10.669  -4.537
  109    HE3  LYS  13           HE3      LYS  13   4.254   9.561  -5.757
  110    HZ1  LYS  13           HZ1      LYS  13   3.424  12.196  -5.157
  111    HZ2  LYS  13           HZ2      LYS  13   2.123  11.134  -4.963
  112    HZ3  LYS  13           HZ3      LYS  13   2.949  11.198  -6.438
  113    HA   PRO  14           HA       PRO  14   3.320  14.846  -0.232
  114    HB2  PRO  14           HB2      PRO  14   0.925  15.107  -1.482
  115    HB3  PRO  14           HB3      PRO  14   2.456  15.586  -2.226
  116    HG2  PRO  14           HG2      PRO  14   0.863  13.081  -2.614
  117    HG3  PRO  14           HG3      PRO  14   1.678  14.086  -3.826
  118    HD2  PRO  14           HD2      PRO  14   2.744  11.780  -2.888
  119    HD3  PRO  14           HD3      PRO  14   3.743  13.162  -3.385
  120    H    ASN  15           H        ASN  15   1.177  12.062  -0.748
  121    HA   ASN  15           HA       ASN  15  -0.147  12.658   1.807
  122    HB2  ASN  15           HB2      ASN  15  -1.551  12.415  -0.276
  123    HB3  ASN  15           HB3      ASN  15  -1.068  10.722  -0.322
  124   HD21  ASN  15          HD21      ASN  15  -2.771   9.576   0.250
  125   HD22  ASN  15          HD22      ASN  15  -3.761   9.860   1.636
  126    H    CYS  16           H        CYS  16   1.784  10.317   0.111
  127    HA   CYS  16           HA       CYS  16   1.553   8.417   2.333
  128    HB2  CYS  16           HB2      CYS  16   2.441   8.203  -0.514
  129    HB3  CYS  16           HB3      CYS  16   3.067   7.051   0.660
  130    H    GLY  17           H        GLY  17   2.800  10.399   3.381
  131    HA2  GLY  17           HA2      GLY  17   5.444   9.443   3.882
  132    HA3  GLY  17           HA3      GLY  17   5.470  10.914   2.920
  133    HN1  NH2  18           H1       NH2  18   6.458  12.136   4.526
  134    HN2  NH2  18           H2       NH2  18   5.682  12.643   5.960
  Start of MODEL   17
    1    H1   ARG   1           H        ARG   1   0.949   2.441   2.069
    2    HA   ARG   1           HA       ARG   1   3.774   1.965   1.553
    3    HB2  ARG   1           HB2      ARG   1   1.558   0.171   0.652
    4    HB3  ARG   1           HB3      ARG   1   2.938   0.422  -0.410
    5    HG2  ARG   1           HG2      ARG   1   4.438  -0.504   1.162
    6    HG3  ARG   1           HG3      ARG   1   3.230  -0.460   2.446
    7    HD2  ARG   1           HD2      ARG   1   1.891  -2.008   0.802
    8    HD3  ARG   1           HD3      ARG   1   3.492  -2.334   0.140
    9    HE   ARG   1           HE       ARG   1   3.829  -2.709   2.799
   10   HH11  ARG   1          HH11      ARG   1   1.553  -3.943   0.473
   11   HH12  ARG   1          HH12      ARG   1   1.331  -5.452   1.294
   12   HH21  ARG   1          HH21      ARG   1   3.547  -4.691   3.890
   13   HH22  ARG   1          HH22      ARG   1   2.466  -5.876   3.240
   14    H    CYS   2           H        CYS   2   4.516   3.278   0.007
   15    HA   CYS   2           HA       CYS   2   2.613   4.968  -1.399
   16    HB2  CYS   2           HB2      CYS   2   5.637   5.086  -1.388
   17    HB3  CYS   2           HB3      CYS   2   4.543   6.324  -1.999
   18    H    LYS   3           H        LYS   3   3.628   5.621  -3.718
   19    HA   LYS   3           HA       LYS   3   3.323   3.227  -5.301
   20    HB2  LYS   3           HB2      LYS   3   3.563   6.156  -5.940
   21    HB3  LYS   3           HB3      LYS   3   3.645   4.943  -7.210
   22    HG2  LYS   3           HG2      LYS   3   1.416   4.095  -6.171
   23    HG3  LYS   3           HG3      LYS   3   1.347   5.717  -5.476
   24    HD2  LYS   3           HD2      LYS   3   1.927   5.417  -8.385
   25    HD3  LYS   3           HD3      LYS   3   0.268   5.199  -7.820
   26    HE2  LYS   3           HE2      LYS   3   0.207   7.399  -6.912
   27    HE3  LYS   3           HE3      LYS   3   1.941   7.612  -7.149
   28    HZ1  LYS   3           HZ1      LYS   3   1.609   7.578  -9.523
   29    HZ2  LYS   3           HZ2      LYS   3   0.623   8.765  -8.834
   30    HZ3  LYS   3           HZ3      LYS   3  -0.048   7.295  -9.331
   31    H    THR   4           H        THR   4   4.802   2.826  -7.169
   32    HA   THR   4           HA       THR   4   7.443   2.424  -6.250
   33    HB   THR   4           HB       THR   4   6.526   0.892  -7.865
   34    HG1  THR   4           HG1      THR   4   8.450   2.275  -9.392
   35   HG21  THR   4          HG21      THR   4   5.575   3.244  -9.120
   36   HG22  THR   4          HG22      THR   4   5.257   1.568  -9.565
   37   HG23  THR   4          HG23      THR   4   6.626   2.423 -10.273
   38    H    CYS   5           H        CYS   5   9.417   3.247  -7.173
   39    HA   CYS   5           HA       CYS   5   9.142   5.968  -8.274
   40    HB2  CYS   5           HB2      CYS   5  11.249   6.522  -7.044
   41    HB3  CYS   5           HB3      CYS   5   9.883   6.167  -5.992
   42    H    SER   6           H        SER   6  11.271   6.710  -9.301
   43    HA   SER   6           HA       SER   6  11.907   4.888 -11.391
   44    HB2  SER   6           HB2      SER   6  13.408   7.423 -10.724
   45    HB3  SER   6           HB3      SER   6  13.259   6.636 -12.295
   46    HG   SER   6           HG       SER   6  11.015   7.135 -12.224
   47    H    LYS   7           H        LYS   7  14.054   4.146 -11.962
   48    HA   LYS   7           HA       LYS   7  15.351   2.838  -9.818
   49    HB2  LYS   7           HB2      LYS   7  17.017   2.165 -11.532
   50    HB3  LYS   7           HB3      LYS   7  15.357   1.856 -12.023
   51    HG2  LYS   7           HG2      LYS   7  15.619   4.243 -13.128
   52    HG3  LYS   7           HG3      LYS   7  17.327   3.794 -13.097
   53    HD2  LYS   7           HD2      LYS   7  16.648   2.987 -15.157
   54    HD3  LYS   7           HD3      LYS   7  16.488   1.561 -14.131
   55    HE2  LYS   7           HE2      LYS   7  14.059   2.304 -13.800
   56    HE3  LYS   7           HE3      LYS   7  14.335   3.378 -15.170
   57    HZ1  LYS   7           HZ1      LYS   7  13.573   1.556 -16.258
   58    HZ2  LYS   7           HZ2      LYS   7  14.147   0.463 -15.102
   59    HZ3  LYS   7           HZ3      LYS   7  15.215   1.147 -16.223
   60    H    GLY   8           H        GLY   8  16.672   3.717  -8.375
   61    HA2  GLY   8           HA2      GLY   8  18.698   4.750  -7.741
   62    HA3  GLY   8           HA3      GLY   8  18.725   5.591  -9.281
   63    H    ARG   9           H        ARG   9  15.873   6.396  -8.933
   64    HA   ARG   9           HA       ARG   9  16.334   8.546  -6.971
   65    HB2  ARG   9           HB2      ARG   9  14.908   8.542  -9.621
   66    HB3  ARG   9           HB3      ARG   9  14.592   9.780  -8.412
   67    HG2  ARG   9           HG2      ARG   9  16.743  10.658  -8.568
   68    HG3  ARG   9           HG3      ARG   9  17.379   9.203  -9.336
   69    HD2  ARG   9           HD2      ARG   9  15.662   9.803 -11.214
   70    HD3  ARG   9           HD3      ARG   9  15.754  11.417 -10.508
   71    HE   ARG   9           HE       ARG   9  18.340  10.331 -11.010
   72   HH11  ARG   9          HH11      ARG   9  15.611  11.869 -12.529
   73   HH12  ARG   9          HH12      ARG   9  16.546  12.550 -13.820
   74   HH21  ARG   9          HH21      ARG   9  19.583  11.221 -12.705
   75   HH22  ARG   9          HH22      ARG   9  18.805  12.180 -13.919
   76    H    CYS  10           H        CYS  10  15.149   8.329  -5.201
   77    HA   CYS  10           HA       CYS  10  12.340   7.564  -5.444
   78    HB2  CYS  10           HB2      CYS  10  14.052   5.623  -4.771
   79    HB3  CYS  10           HB3      CYS  10  13.832   6.341  -3.179
   80    H    ARG  11           H        ARG  11  11.073   8.848  -4.270
   81    HA   ARG  11           HA       ARG  11  12.123  10.096  -1.842
   82    HB2  ARG  11           HB2      ARG  11  11.180  11.535  -4.294
   83    HB3  ARG  11           HB3      ARG  11  10.914  12.254  -2.711
   84    HG2  ARG  11           HG2      ARG  11  13.605  11.398  -3.754
   85    HG3  ARG  11           HG3      ARG  11  12.969  13.042  -3.848
   86    HD2  ARG  11           HD2      ARG  11  12.767  13.066  -1.386
   87    HD3  ARG  11           HD3      ARG  11  13.493  11.460  -1.335
   88    HE   ARG  11           HE       ARG  11  15.330  12.895  -2.683
   89   HH11  ARG  11          HH11      ARG  11  13.656  13.430   0.321
   90   HH12  ARG  11          HH12      ARG  11  14.957  14.327   1.036
   91   HH21  ARG  11          HH21      ARG  11  17.048  14.073  -1.754
   92   HH22  ARG  11          HH22      ARG  11  16.884  14.692  -0.146
   93    HA   PRO  12           HA       PRO  12   8.122   9.380  -0.192
   94    HB2  PRO  12           HB2      PRO  12   7.774  11.532   1.426
   95    HB3  PRO  12           HB3      PRO  12   8.901  10.221   1.799
   96    HG2  PRO  12           HG2      PRO  12   9.450  12.909   0.597
   97    HG3  PRO  12           HG3      PRO  12  10.357  12.034   1.846
   98    HD2  PRO  12           HD2      PRO  12  11.137  12.099  -0.746
   99    HD3  PRO  12           HD3      PRO  12  11.435  10.701   0.306
  100    H    LYS  13           H        LYS  13   6.004   9.759  -0.633
  101    HA   LYS  13           HA       LYS  13   5.397  11.771  -2.617
  102    HB2  LYS  13           HB2      LYS  13   3.878   9.496  -1.378
  103    HB3  LYS  13           HB3      LYS  13   3.035  10.714  -2.327
  104    HG2  LYS  13           HG2      LYS  13   5.434   9.515  -3.562
  105    HG3  LYS  13           HG3      LYS  13   4.027   8.463  -3.370
  106    HD2  LYS  13           HD2      LYS  13   3.399   9.350  -5.342
  107    HD3  LYS  13           HD3      LYS  13   2.861  10.706  -4.348
  108    HE2  LYS  13           HE2      LYS  13   5.394  11.441  -4.677
  109    HE3  LYS  13           HE3      LYS  13   5.221  10.465  -6.135
  110    HZ1  LYS  13           HZ1      LYS  13   3.952  12.007  -7.092
  111    HZ2  LYS  13           HZ2      LYS  13   4.502  13.063  -5.890
  112    HZ3  LYS  13           HZ3      LYS  13   3.024  12.262  -5.700
  113    HA   PRO  14           HA       PRO  14   3.622  14.844  -0.036
  114    HB2  PRO  14           HB2      PRO  14   1.537  15.708  -1.544
  115    HB3  PRO  14           HB3      PRO  14   3.222  16.065  -1.941
  116    HG2  PRO  14           HG2      PRO  14   1.416  13.960  -3.066
  117    HG3  PRO  14           HG3      PRO  14   2.552  15.027  -3.912
  118    HD2  PRO  14           HD2      PRO  14   3.135  12.448  -3.325
  119    HD3  PRO  14           HD3      PRO  14   4.374  13.719  -3.373
  120    H    ASN  15           H        ASN  15   1.393  12.429  -1.332
  121    HA   ASN  15           HA       ASN  15  -0.621  12.987   0.662
  122    HB2  ASN  15           HB2      ASN  15  -0.357  11.072  -1.624
  123    HB3  ASN  15           HB3      ASN  15  -1.561  10.757  -0.376
  124   HD21  ASN  15          HD21      ASN  15  -3.470  11.331  -1.109
  125   HD22  ASN  15          HD22      ASN  15  -3.839  12.792  -1.953
  126    H    CYS  16           H        CYS  16   2.033  10.786   0.221
  127    HA   CYS  16           HA       CYS  16   1.267   8.828   2.112
  128    HB2  CYS  16           HB2      CYS  16   3.760   9.572   0.687
  129    HB3  CYS  16           HB3      CYS  16   3.953   8.643   2.169
  130    H    GLY  17           H        GLY  17   2.729   8.413   4.103
  131    HA2  GLY  17           HA2      GLY  17   3.848   9.263   6.005
  132    HA3  GLY  17           HA3      GLY  17   3.431  10.891   5.493
  133    HN1  NH2  18           H1       NH2  18   1.777   7.882   6.464
  134    HN2  NH2  18           H2       NH2  18   0.599   8.597   7.473
  Start of MODEL   18
    1    H1   ARG   1           H        ARG   1   2.585   0.548   2.443
    2    HA   ARG   1           HA       ARG   1   4.696   1.132   0.653
    3    HB2  ARG   1           HB2      ARG   1   2.324  -0.699   0.583
    4    HB3  ARG   1           HB3      ARG   1   3.294  -0.467  -0.866
    5    HG2  ARG   1           HG2      ARG   1   5.293  -1.045   0.669
    6    HG3  ARG   1           HG3      ARG   1   4.059  -1.715   1.739
    7    HD2  ARG   1           HD2      ARG   1   3.231  -2.977  -0.335
    8    HD3  ARG   1           HD3      ARG   1   4.781  -2.546  -1.055
    9    HE   ARG   1           HE       ARG   1   5.416  -3.668   1.358
   10   HH11  ARG   1          HH11      ARG   1   3.632  -4.675  -1.456
   11   HH12  ARG   1          HH12      ARG   1   4.011  -6.353  -1.258
   12   HH21  ARG   1          HH21      ARG   1   5.924  -5.876   1.630
   13   HH22  ARG   1          HH22      ARG   1   5.315  -7.035   0.499
   14    H    CYS   2           H        CYS   2   4.763   2.906  -0.558
   15    HA   CYS   2           HA       CYS   2   2.269   3.946  -1.707
   16    HB2  CYS   2           HB2      CYS   2   4.949   5.336  -1.607
   17    HB3  CYS   2           HB3      CYS   2   3.377   6.056  -1.945
   18    H    LYS   3           H        LYS   3   3.134   5.362  -3.831
   19    HA   LYS   3           HA       LYS   3   3.383   3.427  -5.849
   20    HB2  LYS   3           HB2      LYS   3   2.488   5.852  -5.975
   21    HB3  LYS   3           HB3      LYS   3   4.169   6.304  -6.229
   22    HG2  LYS   3           HG2      LYS   3   3.268   6.125  -8.375
   23    HG3  LYS   3           HG3      LYS   3   4.160   4.620  -8.141
   24    HD2  LYS   3           HD2      LYS   3   2.205   3.780  -8.972
   25    HD3  LYS   3           HD3      LYS   3   1.814   3.785  -7.251
   26    HE2  LYS   3           HE2      LYS   3  -0.055   4.770  -8.211
   27    HE3  LYS   3           HE3      LYS   3   0.905   6.160  -7.702
   28    HZ1  LYS   3           HZ1      LYS   3   0.083   5.401 -10.320
   29    HZ2  LYS   3           HZ2      LYS   3   1.762   5.589 -10.245
   30    HZ3  LYS   3           HZ3      LYS   3   0.747   6.863  -9.787
   31    H    THR   4           H        THR   4   5.110   3.098  -7.365
   32    HA   THR   4           HA       THR   4   7.676   2.929  -6.064
   33    HB   THR   4           HB       THR   4   8.366   1.978  -8.361
   34    HG1  THR   4           HG1      THR   4   6.537   2.836  -9.498
   35   HG21  THR   4          HG21      THR   4   6.374   0.738  -6.489
   36   HG22  THR   4          HG22      THR   4   8.103   0.420  -6.641
   37   HG23  THR   4          HG23      THR   4   6.986  -0.153  -7.881
   38    H    CYS   5           H        CYS   5   9.661   3.735  -6.986
   39    HA   CYS   5           HA       CYS   5   9.279   6.233  -8.503
   40    HB2  CYS   5           HB2      CYS   5  11.537   5.704  -6.572
   41    HB3  CYS   5           HB3      CYS   5  11.054   7.244  -7.279
   42    H    SER   6           H        SER   6  11.504   6.941  -9.480
   43    HA   SER   6           HA       SER   6  12.136   5.227 -11.551
   44    HB2  SER   6           HB2      SER   6  12.682   7.625 -11.566
   45    HB3  SER   6           HB3      SER   6  13.914   7.356 -10.333
   46    HG   SER   6           HG       SER   6  14.705   7.425 -12.537
   47    H    LYS   7           H        LYS   7  14.421   4.385 -12.002
   48    HA   LYS   7           HA       LYS   7  15.015   2.399 -10.035
   49    HB2  LYS   7           HB2      LYS   7  15.218   2.297 -12.640
   50    HB3  LYS   7           HB3      LYS   7  16.808   2.994 -12.363
   51    HG2  LYS   7           HG2      LYS   7  16.023   0.582 -10.810
   52    HG3  LYS   7           HG3      LYS   7  16.457   0.396 -12.512
   53    HD2  LYS   7           HD2      LYS   7  18.542   1.792 -11.895
   54    HD3  LYS   7           HD3      LYS   7  18.137   1.375 -10.227
   55    HE2  LYS   7           HE2      LYS   7  19.719  -0.228 -11.039
   56    HE3  LYS   7           HE3      LYS   7  18.153  -1.025 -10.894
   57    HZ1  LYS   7           HZ1      LYS   7  18.248  -1.555 -13.026
   58    HZ2  LYS   7           HZ2      LYS   7  19.779  -0.849 -13.146
   59    HZ3  LYS   7           HZ3      LYS   7  18.396   0.069 -13.472
   60    H    GLY   8           H        GLY   8  15.704   3.501  -8.185
   61    HA2  GLY   8           HA2      GLY   8  17.779   3.803  -6.976
   62    HA3  GLY   8           HA3      GLY   8  18.436   4.590  -8.404
   63    H    ARG   9           H        ARG   9  15.893   6.105  -8.783
   64    HA   ARG   9           HA       ARG   9  16.418   8.153  -6.738
   65    HB2  ARG   9           HB2      ARG   9  15.511   8.297  -9.595
   66    HB3  ARG   9           HB3      ARG   9  15.168   9.619  -8.489
   67    HG2  ARG   9           HG2      ARG   9  17.444  10.095  -8.176
   68    HG3  ARG   9           HG3      ARG   9  17.944   8.557  -8.884
   69    HD2  ARG   9           HD2      ARG   9  16.895   9.366 -11.041
   70    HD3  ARG   9           HD3      ARG   9  16.771  10.951 -10.279
   71    HE   ARG   9           HE       ARG   9  19.372  10.352  -9.952
   72   HH11  ARG   9          HH11      ARG   9  17.273  10.275 -12.727
   73   HH12  ARG   9          HH12      ARG   9  18.539  10.620 -13.858
   74   HH21  ARG   9          HH21      ARG   9  21.048  10.808 -11.429
   75   HH22  ARG   9          HH22      ARG   9  20.687  10.923 -13.119
   76    H    CYS  10           H        CYS  10  14.916   8.522  -5.255
   77    HA   CYS  10           HA       CYS  10  12.096   8.248  -5.910
   78    HB2  CYS  10           HB2      CYS  10  12.865   6.003  -5.084
   79    HB3  CYS  10           HB3      CYS  10  13.266   6.767  -3.549
   80    H    ARG  11           H        ARG  11  10.709   9.346  -4.468
   81    HA   ARG  11           HA       ARG  11  11.983  10.928  -2.358
   82    HB2  ARG  11           HB2      ARG  11  10.657  11.972  -4.813
   83    HB3  ARG  11           HB3      ARG  11  10.386  12.834  -3.304
   84    HG2  ARG  11           HG2      ARG  11  12.637  13.396  -3.079
   85    HG3  ARG  11           HG3      ARG  11  13.152  12.160  -4.230
   86    HD2  ARG  11           HD2      ARG  11  11.895  13.451  -5.995
   87    HD3  ARG  11           HD3      ARG  11  11.711  14.740  -4.806
   88    HE   ARG  11           HE       ARG  11  14.431  13.986  -5.060
   89   HH11  ARG  11          HH11      ARG  11  11.899  15.743  -6.678
   90   HH12  ARG  11          HH12      ARG  11  12.987  16.807  -7.506
   91   HH21  ARG  11          HH21      ARG  11  15.875  15.382  -6.142
   92   HH22  ARG  11          HH22      ARG  11  15.249  16.600  -7.200
   93    HA   PRO  12           HA       PRO  12   8.349  10.153  -0.027
   94    HB2  PRO  12           HB2      PRO  12   8.015  12.478   1.334
   95    HB3  PRO  12           HB3      PRO  12   9.313  11.333   1.693
   96    HG2  PRO  12           HG2      PRO  12   9.405  13.857   0.085
   97    HG3  PRO  12           HG3      PRO  12  10.565  13.247   1.279
   98    HD2  PRO  12           HD2      PRO  12  10.960  13.004  -1.389
   99    HD3  PRO  12           HD3      PRO  12  11.546  11.800  -0.223
  100    H    LYS  13           H        LYS  13   6.162  10.288  -0.182
  101    HA   LYS  13           HA       LYS  13   5.076  11.942  -2.289
  102    HB2  LYS  13           HB2      LYS  13   4.004   9.735  -0.562
  103    HB3  LYS  13           HB3      LYS  13   2.901  10.741  -1.491
  104    HG2  LYS  13           HG2      LYS  13   5.220   9.295  -2.739
  105    HG3  LYS  13           HG3      LYS  13   3.619   8.573  -2.562
  106    HD2  LYS  13           HD2      LYS  13   2.654  10.420  -3.859
  107    HD3  LYS  13           HD3      LYS  13   4.263  11.122  -4.049
  108    HE2  LYS  13           HE2      LYS  13   3.676   8.313  -4.923
  109    HE3  LYS  13           HE3      LYS  13   3.311   9.689  -5.966
  110    HZ1  LYS  13           HZ1      LYS  13   5.426   9.119  -6.617
  111    HZ2  LYS  13           HZ2      LYS  13   5.927   8.694  -5.058
  112    HZ3  LYS  13           HZ3      LYS  13   5.753  10.324  -5.475
  113    HA   PRO  14           HA       PRO  14   3.373  15.187   0.124
  114    HB2  PRO  14           HB2      PRO  14   1.017  15.651  -1.144
  115    HB3  PRO  14           HB3      PRO  14   2.584  16.089  -1.837
  116    HG2  PRO  14           HG2      PRO  14   0.865  13.703  -2.396
  117    HG3  PRO  14           HG3      PRO  14   1.755  14.731  -3.533
  118    HD2  PRO  14           HD2      PRO  14   2.680  12.321  -2.722
  119    HD3  PRO  14           HD3      PRO  14   3.759  13.671  -3.120
  120    H    ASN  15           H        ASN  15   1.042  12.602  -0.618
  121    HA   ASN  15           HA       ASN  15  -0.249  13.088   1.976
  122    HB2  ASN  15           HB2      ASN  15  -1.700  13.158  -0.044
  123    HB3  ASN  15           HB3      ASN  15  -1.279  11.480  -0.371
  124   HD21  ASN  15          HD21      ASN  15  -3.208  13.625   1.468
  125   HD22  ASN  15          HD22      ASN  15  -4.100  12.433   2.342
  126    H    CYS  16           H        CYS  16   1.502  10.750   0.090
  127    HA   CYS  16           HA       CYS  16   1.110   8.699   2.150
  128    HB2  CYS  16           HB2      CYS  16   0.845   8.243  -0.376
  129    HB3  CYS  16           HB3      CYS  16   2.603   8.313  -0.434
  130    H    GLY  17           H        GLY  17   2.527  10.532   3.306
  131    HA2  GLY  17           HA2      GLY  17   5.357  10.325   2.781
  132    HA3  GLY  17           HA3      GLY  17   4.598  11.205   4.101
  133    HN1  NH2  18           H1       NH2  18   6.820   9.041   3.721
  134    HN2  NH2  18           H2       NH2  18   6.554   7.938   4.997
  Start of MODEL   19
    1    H1   ARG   1           H        ARG   1   3.549  -1.881  -0.190
    2    HA   ARG   1           HA       ARG   1   5.269   0.160  -0.199
    3    HB2  ARG   1           HB2      ARG   1   5.421  -2.055  -1.473
    4    HB3  ARG   1           HB3      ARG   1   4.630  -1.215  -2.800
    5    HG2  ARG   1           HG2      ARG   1   6.448   0.175  -3.174
    6    HG3  ARG   1           HG3      ARG   1   7.111  -0.100  -1.562
    7    HD2  ARG   1           HD2      ARG   1   6.933  -2.202  -3.716
    8    HD3  ARG   1           HD3      ARG   1   8.370  -1.232  -3.391
    9    HE   ARG   1           HE       ARG   1   7.384  -3.455  -1.844
   10   HH11  ARG   1          HH11      ARG   1   9.369  -0.595  -1.842
   11   HH12  ARG   1          HH12      ARG   1  10.355  -1.124  -0.519
   12   HH21  ARG   1          HH21      ARG   1   8.675  -4.161  -0.102
   13   HH22  ARG   1          HH22      ARG   1   9.961  -3.153   0.469
   14    H    CYS   2           H        CYS   2   3.191   1.722   0.045
   15    HA   CYS   2           HA       CYS   2   1.968   2.798  -2.210
   16    HB2  CYS   2           HB2      CYS   2   1.391   3.267   0.203
   17    HB3  CYS   2           HB3      CYS   2   2.766   4.368   0.245
   18    H    LYS   3           H        LYS   3   4.941   3.864  -0.569
   19    HA   LYS   3           HA       LYS   3   5.520   5.936  -2.414
   20    HB2  LYS   3           HB2      LYS   3   7.440   4.451  -0.613
   21    HB3  LYS   3           HB3      LYS   3   7.707   6.024  -1.351
   22    HG2  LYS   3           HG2      LYS   3   5.933   6.990  -0.023
   23    HG3  LYS   3           HG3      LYS   3   5.553   5.408   0.663
   24    HD2  LYS   3           HD2      LYS   3   8.266   6.684   0.930
   25    HD3  LYS   3           HD3      LYS   3   6.967   6.956   2.096
   26    HE2  LYS   3           HE2      LYS   3   6.848   4.359   2.161
   27    HE3  LYS   3           HE3      LYS   3   8.471   4.444   1.478
   28    HZ1  LYS   3           HZ1      LYS   3   8.800   6.118   3.452
   29    HZ2  LYS   3           HZ2      LYS   3   8.961   4.450   3.685
   30    HZ3  LYS   3           HZ3      LYS   3   7.530   5.233   4.135
   31    H    THR   4           H        THR   4   6.491   5.898  -4.343
   32    HA   THR   4           HA       THR   4   7.708   3.360  -5.222
   33    HB   THR   4           HB       THR   4   7.050   3.938  -7.519
   34    HG1  THR   4           HG1      THR   4   6.862   6.126  -7.542
   35   HG21  THR   4          HG21      THR   4   4.400   4.134  -6.696
   36   HG22  THR   4          HG22      THR   4   5.220   3.334  -5.354
   37   HG23  THR   4          HG23      THR   4   5.306   2.649  -6.978
   38    H    CYS   5           H        CYS   5   9.503   3.491  -6.663
   39    HA   CYS   5           HA       CYS   5  11.067   5.947  -6.285
   40    HB2  CYS   5           HB2      CYS   5  12.071   3.252  -7.208
   41    HB3  CYS   5           HB3      CYS   5  13.031   4.617  -6.647
   42    H    SER   6           H        SER   6  11.613   7.214  -7.948
   43    HA   SER   6           HA       SER   6  10.855   6.322 -10.646
   44    HB2  SER   6           HB2      SER   6  11.138   9.091  -9.466
   45    HB3  SER   6           HB3      SER   6  10.884   8.789 -11.184
   46    HG   SER   6           HG       SER   6   9.111   8.659  -9.093
   47    H    LYS   7           H        LYS   7  12.354   6.066 -12.174
   48    HA   LYS   7           HA       LYS   7  14.407   5.856 -13.138
   49    HB2  LYS   7           HB2      LYS   7  13.919   8.380 -13.224
   50    HB3  LYS   7           HB3      LYS   7  15.080   8.521 -11.911
   51    HG2  LYS   7           HG2      LYS   7  16.860   8.032 -13.245
   52    HG3  LYS   7           HG3      LYS   7  15.905   7.035 -14.344
   53    HD2  LYS   7           HD2      LYS   7  14.908   8.999 -15.329
   54    HD3  LYS   7           HD3      LYS   7  15.719  10.040 -14.156
   55    HE2  LYS   7           HE2      LYS   7  17.796   9.740 -15.135
   56    HE3  LYS   7           HE3      LYS   7  17.324   8.227 -15.910
   57    HZ1  LYS   7           HZ1      LYS   7  17.433   9.820 -17.610
   58    HZ2  LYS   7           HZ2      LYS   7  16.602  10.985 -16.707
   59    HZ3  LYS   7           HZ3      LYS   7  15.780   9.630 -17.300
   60    H    GLY   8           H        GLY   8  14.115   4.793 -10.459
   61    HA2  GLY   8           HA2      GLY   8  15.690   3.533  -9.244
   62    HA3  GLY   8           HA3      GLY   8  16.957   4.611  -9.811
   63    H    ARG   9           H        ARG   9  15.321   6.990  -9.064
   64    HA   ARG   9           HA       ARG   9  16.353   7.319  -6.437
   65    HB2  ARG   9           HB2      ARG   9  14.541   8.986  -8.171
   66    HB3  ARG   9           HB3      ARG   9  14.958   9.470  -6.532
   67    HG2  ARG   9           HG2      ARG   9  17.201   9.790  -7.064
   68    HG3  ARG   9           HG3      ARG   9  17.084   8.825  -8.537
   69    HD2  ARG   9           HD2      ARG   9  15.456  10.616  -9.364
   70    HD3  ARG   9           HD3      ARG   9  16.052  11.597  -8.026
   71    HE   ARG   9           HE       ARG   9  17.432  10.975 -10.469
   72   HH11  ARG   9          HH11      ARG   9  17.788  11.910  -7.135
   73   HH12  ARG   9          HH12      ARG   9  19.341  12.643  -7.371
   74   HH21  ARG   9          HH21      ARG   9  19.475  11.936 -10.793
   75   HH22  ARG   9          HH22      ARG   9  20.299  12.658  -9.452
   76    H    CYS  10           H        CYS  10  15.468   6.859  -4.533
   77    HA   CYS  10           HA       CYS  10  12.613   6.141  -4.467
   78    HB2  CYS  10           HB2      CYS  10  14.930   5.226  -2.760
   79    HB3  CYS  10           HB3      CYS  10  13.250   4.880  -2.369
   80    H    ARG  11           H        ARG  11  11.360   7.650  -3.609
   81    HA   ARG  11           HA       ARG  11  12.113   8.906  -1.104
   82    HB2  ARG  11           HB2      ARG  11  11.915  10.365  -3.693
   83    HB3  ARG  11           HB3      ARG  11  11.271  11.151  -2.257
   84    HG2  ARG  11           HG2      ARG  11  13.500  10.762  -1.170
   85    HG3  ARG  11           HG3      ARG  11  14.094  10.244  -2.750
   86    HD2  ARG  11           HD2      ARG  11  12.993  12.947  -1.999
   87    HD3  ARG  11           HD3      ARG  11  14.652  12.555  -2.446
   88    HE   ARG  11           HE       ARG  11  12.994  11.817  -4.565
   89   HH11  ARG  11          HH11      ARG  11  14.031  14.702  -2.916
   90   HH12  ARG  11          HH12      ARG  11  13.871  15.714  -4.312
   91   HH21  ARG  11          HH21      ARG  11  12.780  13.139  -6.411
   92   HH22  ARG  11          HH22      ARG  11  13.158  14.826  -6.300
   93    HA   PRO  12           HA       PRO  12   7.819   8.686  -0.237
   94    HB2  PRO  12           HB2      PRO  12   7.402  10.926   1.240
   95    HB3  PRO  12           HB3      PRO  12   8.292   9.525   1.850
   96    HG2  PRO  12           HG2      PRO  12   9.340  12.094   0.722
   97    HG3  PRO  12           HG3      PRO  12   9.896  11.184   2.140
   98    HD2  PRO  12           HD2      PRO  12  11.157  11.066  -0.255
   99    HD3  PRO  12           HD3      PRO  12  11.100   9.688   0.864
  100    H    LYS  13           H        LYS  13   5.875   9.259  -1.086
  101    HA   LYS  13           HA       LYS  13   5.860  11.180  -3.226
  102    HB2  LYS  13           HB2      LYS  13   4.103   9.037  -2.248
  103    HB3  LYS  13           HB3      LYS  13   3.249  10.416  -2.924
  104    HG2  LYS  13           HG2      LYS  13   4.000  10.028  -5.032
  105    HG3  LYS  13           HG3      LYS  13   5.521   9.323  -4.480
  106    HD2  LYS  13           HD2      LYS  13   4.548   7.244  -4.075
  107    HD3  LYS  13           HD3      LYS  13   2.915   7.913  -4.017
  108    HE2  LYS  13           HE2      LYS  13   3.352   8.528  -6.497
  109    HE3  LYS  13           HE3      LYS  13   4.645   7.334  -6.393
  110    HZ1  LYS  13           HZ1      LYS  13   3.063   5.659  -5.799
  111    HZ2  LYS  13           HZ2      LYS  13   2.522   6.418  -7.209
  112    HZ3  LYS  13           HZ3      LYS  13   1.805   6.786  -5.721
  113    HA   PRO  14           HA       PRO  14   4.178  14.680  -1.181
  114    HB2  PRO  14           HB2      PRO  14   2.497  15.677  -3.068
  115    HB3  PRO  14           HB3      PRO  14   4.257  15.769  -3.204
  116    HG2  PRO  14           HG2      PRO  14   2.357  13.830  -4.469
  117    HG3  PRO  14           HG3      PRO  14   3.753  14.657  -5.184
  118    HD2  PRO  14           HD2      PRO  14   3.858  12.086  -4.339
  119    HD3  PRO  14           HD3      PRO  14   5.260  13.173  -4.268
  120    H    ASN  15           H        ASN  15   1.843  12.482  -2.668
  121    HA   ASN  15           HA       ASN  15  -0.275  13.438  -0.905
  122    HB2  ASN  15           HB2      ASN  15  -0.330  11.337  -3.083
  123    HB3  ASN  15           HB3      ASN  15  -1.734  11.922  -2.194
  124   HD21  ASN  15          HD21      ASN  15  -0.415  12.094  -5.065
  125   HD22  ASN  15          HD22      ASN  15  -0.783  13.720  -5.518
  126    H    CYS  16           H        CYS  16   1.899  10.752  -1.296
  127    HA   CYS  16           HA       CYS  16   0.621   9.397   0.986
  128    HB2  CYS  16           HB2      CYS  16   0.902   8.250  -1.366
  129    HB3  CYS  16           HB3      CYS  16   2.558   8.004  -0.821
  130    H    GLY  17           H        GLY  17   2.195  11.476   1.657
  131    HA2  GLY  17           HA2      GLY  17   4.813  10.313   2.347
  132    HA3  GLY  17           HA3      GLY  17   4.447  12.032   2.309
  133    HN1  NH2  18           H1       NH2  18   5.699  11.228   4.487
  134    HN2  NH2  18           H2       NH2  18   4.690  11.122   5.862
  Start of MODEL   20
    1    H1   ARG   1           H        ARG   1   0.681   0.690   2.454
    2    HA   ARG   1           HA       ARG   1   1.815   0.313   0.399
    3    HB2  ARG   1           HB2      ARG   1  -1.172   0.346   0.116
    4    HB3  ARG   1           HB3      ARG   1  -0.155  -0.086  -1.251
    5    HG2  ARG   1           HG2      ARG   1  -0.575  -2.149  -0.368
    6    HG3  ARG   1           HG3      ARG   1   0.922  -1.740   0.474
    7    HD2  ARG   1           HD2      ARG   1  -0.161  -1.328   2.472
    8    HD3  ARG   1           HD3      ARG   1  -1.703  -0.998   1.686
    9    HE   ARG   1           HE       ARG   1  -0.761  -3.522   2.604
   10   HH11  ARG   1          HH11      ARG   1  -2.688  -1.989   0.143
   11   HH12  ARG   1          HH12      ARG   1  -3.680  -3.382  -0.133
   12   HH21  ARG   1          HH21      ARG   1  -2.060  -5.363   2.250
   13   HH22  ARG   1          HH22      ARG   1  -3.322  -5.301   1.066
   14    H    CYS   2           H        CYS   2   1.956   3.105   0.865
   15    HA   CYS   2           HA       CYS   2   1.463   4.167  -1.839
   16    HB2  CYS   2           HB2      CYS   2   1.510   6.428  -0.729
   17    HB3  CYS   2           HB3      CYS   2   0.140   5.414  -0.287
   18    H    LYS   3           H        LYS   3   3.612   2.898  -2.051
   19    HA   LYS   3           HA       LYS   3   5.823   4.770  -1.506
   20    HB2  LYS   3           HB2      LYS   3   5.939   1.749  -1.605
   21    HB3  LYS   3           HB3      LYS   3   7.327   2.812  -1.406
   22    HG2  LYS   3           HG2      LYS   3   5.958   3.698   0.648
   23    HG3  LYS   3           HG3      LYS   3   5.169   2.124   0.524
   24    HD2  LYS   3           HD2      LYS   3   7.517   1.133   0.495
   25    HD3  LYS   3           HD3      LYS   3   8.077   2.728   1.007
   26    HE2  LYS   3           HE2      LYS   3   5.890   1.308   2.488
   27    HE3  LYS   3           HE3      LYS   3   7.585   0.940   2.805
   28    HZ1  LYS   3           HZ1      LYS   3   6.190   2.892   4.013
   29    HZ2  LYS   3           HZ2      LYS   3   6.959   3.757   2.781
   30    HZ3  LYS   3           HZ3      LYS   3   7.876   2.862   3.884
   31    H    THR   4           H        THR   4   6.926   5.468  -3.224
   32    HA   THR   4           HA       THR   4   6.737   3.953  -5.737
   33    HB   THR   4           HB       THR   4   6.461   6.954  -5.488
   34    HG1  THR   4           HG1      THR   4   4.517   5.291  -6.643
   35   HG21  THR   4          HG21      THR   4   7.643   6.480  -7.503
   36   HG22  THR   4          HG22      THR   4   5.964   6.780  -7.952
   37   HG23  THR   4          HG23      THR   4   6.575   5.128  -7.884
   38    H    CYS   5           H        CYS   5   8.534   4.020  -7.067
   39    HA   CYS   5           HA       CYS   5  10.880   5.462  -6.024
   40    HB2  CYS   5           HB2      CYS   5  10.536   2.578  -6.582
   41    HB3  CYS   5           HB3      CYS   5  12.031   3.294  -7.174
   42    H    SER   6           H        SER   6  11.720   6.800  -7.467
   43    HA   SER   6           HA       SER   6  10.896   6.656 -10.239
   44    HB2  SER   6           HB2      SER   6  11.274   8.776  -8.677
   45    HB3  SER   6           HB3      SER   6  12.917   8.644  -9.305
   46    HG   SER   6           HG       SER   6  12.094   9.729 -10.916
   47    H    LYS   7           H        LYS   7  12.643   7.129 -11.928
   48    HA   LYS   7           HA       LYS   7  14.455   4.954 -11.956
   49    HB2  LYS   7           HB2      LYS   7  14.452   7.388 -13.749
   50    HB3  LYS   7           HB3      LYS   7  15.210   5.839 -14.089
   51    HG2  LYS   7           HG2      LYS   7  12.250   6.180 -13.681
   52    HG3  LYS   7           HG3      LYS   7  13.038   6.253 -15.260
   53    HD2  LYS   7           HD2      LYS   7  13.922   3.976 -14.886
   54    HD3  LYS   7           HD3      LYS   7  13.050   3.912 -13.353
   55    HE2  LYS   7           HE2      LYS   7  11.547   4.569 -15.841
   56    HE3  LYS   7           HE3      LYS   7  12.021   2.896 -15.552
   57    HZ1  LYS   7           HZ1      LYS   7   9.759   3.669 -14.699
   58    HZ2  LYS   7           HZ2      LYS   7  10.619   4.461 -13.478
   59    HZ3  LYS   7           HZ3      LYS   7  10.734   2.782 -13.638
   60    H    GLY   8           H        GLY   8  15.985   4.993 -10.372
   61    HA2  GLY   8           HA2      GLY   8  18.269   5.521  -9.923
   62    HA3  GLY   8           HA3      GLY   8  18.000   7.119 -10.602
   63    H    ARG   9           H        ARG   9  15.455   7.383  -9.069
   64    HA   ARG   9           HA       ARG   9  16.660   7.935  -6.436
   65    HB2  ARG   9           HB2      ARG   9  14.609   9.461  -8.032
   66    HB3  ARG   9           HB3      ARG   9  14.824   9.717  -6.305
   67    HG2  ARG   9           HG2      ARG   9  16.965  10.596  -6.578
   68    HG3  ARG   9           HG3      ARG   9  17.132   9.924  -8.202
   69    HD2  ARG   9           HD2      ARG   9  15.195  12.099  -7.417
   70    HD3  ARG   9           HD3      ARG   9  16.755  12.370  -8.193
   71    HE   ARG   9           HE       ARG   9  14.335  11.549  -9.455
   72   HH11  ARG   9          HH11      ARG   9  17.801  11.247  -9.590
   73   HH12  ARG   9          HH12      ARG   9  17.837  10.922 -11.291
   74   HH21  ARG   9          HH21      ARG   9  14.370  11.122 -11.695
   75   HH22  ARG   9          HH22      ARG   9  15.886  10.852 -12.488
   76    H    CYS  10           H        CYS  10  15.325   7.702  -4.577
   77    HA   CYS  10           HA       CYS  10  12.827   6.222  -4.943
   78    HB2  CYS  10           HB2      CYS  10  15.323   5.191  -3.727
   79    HB3  CYS  10           HB3      CYS  10  13.840   4.859  -2.838
   80    H    ARG  11           H        ARG  11  11.386   7.479  -3.959
   81    HA   ARG  11           HA       ARG  11  11.734   8.114  -1.158
   82    HB2  ARG  11           HB2      ARG  11  11.797  10.177  -3.307
   83    HB3  ARG  11           HB3      ARG  11  10.928  10.559  -1.826
   84    HG2  ARG  11           HG2      ARG  11  13.054   9.874  -0.601
   85    HG3  ARG  11           HG3      ARG  11  13.841   9.948  -2.178
   86    HD2  ARG  11           HD2      ARG  11  14.215  12.088  -1.506
   87    HD3  ARG  11           HD3      ARG  11  12.627  12.309  -2.240
   88    HE   ARG  11           HE       ARG  11  12.104  11.689   0.370
   89   HH11  ARG  11          HH11      ARG  11  13.976  14.125  -1.269
   90   HH12  ARG  11          HH12      ARG  11  13.754  15.314  -0.030
   91   HH21  ARG  11          HH21      ARG  11  11.805  13.248   2.008
   92   HH22  ARG  11          HH22      ARG  11  12.519  14.815   1.834
   93    HA   PRO  12           HA       PRO  12   7.383   7.584  -1.008
   94    HB2  PRO  12           HB2      PRO  12   6.638   9.365   0.901
   95    HB3  PRO  12           HB3      PRO  12   7.519   7.876   1.266
   96    HG2  PRO  12           HG2      PRO  12   8.556  10.669   0.976
   97    HG3  PRO  12           HG3      PRO  12   8.968   9.443   2.190
   98    HD2  PRO  12           HD2      PRO  12  10.546   9.963   0.052
   99    HD3  PRO  12           HD3      PRO  12  10.418   8.347   0.773
  100    H    LYS  13           H        LYS  13   5.561   8.296  -1.997
  101    HA   LYS  13           HA       LYS  13   5.646  10.439  -3.782
  102    HB2  LYS  13           HB2      LYS  13   3.120  10.134  -3.854
  103    HB3  LYS  13           HB3      LYS  13   4.093   8.718  -4.233
  104    HG2  LYS  13           HG2      LYS  13   3.537   7.644  -2.274
  105    HG3  LYS  13           HG3      LYS  13   3.146   9.147  -1.437
  106    HD2  LYS  13           HD2      LYS  13   1.092   8.022  -1.861
  107    HD3  LYS  13           HD3      LYS  13   1.181   9.382  -2.983
  108    HE2  LYS  13           HE2      LYS  13   0.435   7.588  -4.290
  109    HE3  LYS  13           HE3      LYS  13   2.155   7.712  -4.650
  110    HZ1  LYS  13           HZ1      LYS  13   2.528   5.937  -2.987
  111    HZ2  LYS  13           HZ2      LYS  13   1.612   5.430  -4.315
  112    HZ3  LYS  13           HZ3      LYS  13   0.852   5.757  -2.839
  113    HA   PRO  14           HA       PRO  14   4.653  14.035  -1.470
  114    HB2  PRO  14           HB2      PRO  14   3.127  15.418  -3.239
  115    HB3  PRO  14           HB3      PRO  14   4.874  15.219  -3.427
  116    HG2  PRO  14           HG2      PRO  14   2.644  13.715  -4.741
  117    HG3  PRO  14           HG3      PRO  14   4.145  14.336  -5.451
  118    HD2  PRO  14           HD2      PRO  14   3.826  11.738  -4.762
  119    HD3  PRO  14           HD3      PRO  14   5.396  12.563  -4.671
  120    H    ASN  15           H        ASN  15   1.955  12.339  -2.989
  121    HA   ASN  15           HA       ASN  15  -0.086  13.631  -1.485
  122    HB2  ASN  15           HB2      ASN  15   0.074  11.260  -3.286
  123    HB3  ASN  15           HB3      ASN  15  -1.312  11.374  -2.207
  124   HD21  ASN  15          HD21      ASN  15  -2.549  13.393  -2.286
  125   HD22  ASN  15          HD22      ASN  15  -2.714  14.196  -3.807
  126    H    CYS  16           H        CYS  16   2.002  10.907  -0.919
  127    HA   CYS  16           HA       CYS  16   0.652  10.457   1.664
  128    HB2  CYS  16           HB2      CYS  16   0.472   8.570  -0.031
  129    HB3  CYS  16           HB3      CYS  16   2.211   8.364   0.148
  130    H    GLY  17           H        GLY  17   2.094  12.126   2.484
  131    HA2  GLY  17           HA2      GLY  17   4.874  11.183   2.807
  132    HA3  GLY  17           HA3      GLY  17   4.385  12.869   2.863
  133    HN1  NH2  18           H1       NH2  18   3.511  13.719   4.741
  134    HN2  NH2  18           H2       NH2  18   3.510  12.923   6.251