*HEADER    ANTIMICROBIAL PROTEIN                   14-SEP-10   2L3I              
*TITLE     OXKI4A, SPIDER DERIVED ANTIMICROBIAL PEPTIDE                          
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: AOXKI4A, ANTIMICROBIAL PEPTIDE IN SPIDER VENOM;            
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 ORGANISM_SCIENTIFIC: ARANEAE;                                        
*SOURCE   4 ORGANISM_COMMON: SPIDER;                                             
*SOURCE   5 ORGANISM_TAXID: 6893                                                 
*KEYWDS    ANTIMICROBIAL PEPTIDE, ANTIMICROBIAL PROTEIN                          
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    20                                                                    
*AUTHOR    A.A.VASSILEVSKI, P.V.DUBOVSKII, O.V.SAMSONOVA, N.S.EGOROVA,           
*AUTHOR   2 S.A.KOZLOV, A.V.FEOFANOV, A.S.ARSENIEV, E.V.GRISHIN                  
*REVDAT   1   14-SEP-11 2L3I    0                                                


  4 CYSS SG     10 CYSS SG      2.00
  4 CYSS SG     10 CYSS CB      3.00
  4 CYSS CB     10 CYSS SG      3.00
  7 SER  O       9 LYS  H       2.10  9.00E+00
  7 SER  C       9 LYS  H       3.40  9.00E+00
  7 SER  O       9 LYS  N       3.00  9.00E+00
 11 LYS  O      15 GLN  H       2.10  9.00E+00
 11 LYS  C      15 GLN  H       3.40  9.00E+00
 11 LYS  O      15 GLN  N       3.00  9.00E+00
 12 ALA  O      16 ARG  H       2.10  9.00E+00
 12 ALA  C      16 ARG  H       3.40  9.00E+00
 12 ALA  O      16 ARG  N       3.00  9.00E+00
 13 PHE  O      17 VAL  H       2.10  9.00E+00
 13 PHE  C      17 VAL  H       3.40  9.00E+00
 13 PHE  O      17 VAL  N       3.00  9.00E+00
 14 LYS  O      18 LEU  H       2.10  9.00E+00
 14 LYS  C      18 LEU  H       3.40  9.00E+00
 14 LYS  O      18 LEU  N       3.00  9.00E+00
 16 ARG  O      20 ARG  H       2.10  9.00E+00
 16 ARG  C      20 ARG  H       3.40  9.00E+00
 16 ARG  O      20 ARG  N       3.00  9.00E+00
 17 VAL  O      21 LEU  H       2.10  9.00E+00
 17 VAL  C      21 LEU  H       3.40  9.00E+00
 17 VAL  O      21 LEU  N       3.00  9.00E+00
 19 LYS  O      22 LEU  H       2.10  9.00E+00
 19 LYS  C      22 LEU  H       3.40  9.00E+00
 19 LYS  O      22 LEU  N       3.00  9.00E+00
 19 LYS  O      23 ALA  H       2.10  9.00E+00
 19 LYS  C      23 ALA  H       3.40  9.00E+00
 19 LYS  O      23 ALA  N       3.00  9.00E+00
 20 ARG  O      24 MET  H       2.10  9.00E+00
 20 ARG  C      24 MET  H       3.40  9.00E+00
 20 ARG  O      24 MET  N       3.00  9.00E+00
 21 LEU  O      25 LEU  H       2.10  9.00E+00
 21 LEU  C      25 LEU  H       3.40  9.00E+00
 21 LEU  O      25 LEU  N       3.00  9.00E+00
 22 LEU  O      26 ARG  H       2.10  9.00E+00
 22 LEU  C      26 ARG  H       3.40  9.00E+00
 22 LEU  O      26 ARG  N       3.00  9.00E+00

  7 SER  O       9 LYS  H       1.70  9.00E+00
  7 SER  C       9 LYS  H       2.60  9.00E+00
  7 SER  O       9 LYS  N       2.60  9.00E+00
 11 LYS  O      15 GLN  H       1.70  9.00E+00
 11 LYS  C      15 GLN  H       2.60  9.00E+00
 11 LYS  O      15 GLN  N       2.60  9.00E+00
 12 ALA  O      16 ARG  H       1.70  9.00E+00
 12 ALA  C      16 ARG  H       2.60  9.00E+00
 12 ALA  O      16 ARG  N       2.60  9.00E+00
 13 PHE  O      17 VAL  H       1.70  9.00E+00
 13 PHE  C      17 VAL  H       2.60  9.00E+00
 13 PHE  O      17 VAL  N       2.60  9.00E+00
 14 LYS  O      18 LEU  H       1.70  9.00E+00
 14 LYS  C      18 LEU  H       2.60  9.00E+00
 14 LYS  O      18 LEU  N       2.60  9.00E+00
 16 ARG  O      20 ARG  H       1.70  9.00E+00
 16 ARG  C      20 ARG  H       2.60  9.00E+00
 16 ARG  O      20 ARG  N       2.60  9.00E+00
 17 VAL  O      21 LEU  H       1.70  9.00E+00
 17 VAL  C      21 LEU  H       2.60  9.00E+00
 17 VAL  O      21 LEU  N       2.60  9.00E+00
 19 LYS  O      22 LEU  H       1.70  9.00E+00
 19 LYS  C      22 LEU  H       2.60  9.00E+00
 19 LYS  O      22 LEU  N       2.60  9.00E+00
 19 LYS  O      23 ALA  H       1.70  9.00E+00
 19 LYS  C      23 ALA  H       2.60  9.00E+00
 19 LYS  O      23 ALA  N       2.60  9.00E+00
 20 ARG  O      24 MET  H       1.70  9.00E+00
 20 ARG  C      24 MET  H       2.60  9.00E+00
 20 ARG  O      24 MET  N       2.60  9.00E+00
 21 LEU  O      25 LEU  H       1.70  9.00E+00
 21 LEU  C      25 LEU  H       2.60  9.00E+00
 21 LEU  O      25 LEU  N       2.60  9.00E+00
 22 LEU  O      26 ARG  H       1.70  9.00E+00
 22 LEU  C      26 ARG  H       2.60  9.00E+00
 22 LEU  O      26 ARG  N       2.60  9.00E+00

 30 PHE  H      30 PHE  HA      2.83            #peak     9
 30 PHE  H      30 PHE  HB3     3.52            #peak    10
 30 PHE  H      30 PHE  HB2     2.93            #peak    11
 28 HIS  H      28 HIS  HA      2.74            #peak    12
 28 HIS  H      28 HIS  HB3     3.33            #peak    13
 28 HIS  H      28 HIS  HB2     2.90            #peak    14
 22 LEU  H      22 LEU  HA      2.93            #peak    18
 21 LEU  H      21 LEU  HA      2.87            #peak    19
 18 LEU  H      18 LEU  HA      2.83            #peak    21
 19 LYS  H      19 LYS  HA      2.90            #peak    23
 25 LEU  H      25 LEU  HA      2.80            #peak    24
 17 VAL  H      17 VAL  HA      2.80            #peak    31
 10 CYSS H      10 CYSS HA      2.40            #peak    32
  8 TRP  HA      9 LYS  H       2.74            #peak    35
  8 TRP  H       8 TRP  HB2     3.39            #peak    44
  8 TRP  H       8 TRP  HB3     3.39            #peak    45
 18 LEU  H      19 LYS  H       3.33            #peak    69
 19 LYS  HA     20 ARG  H       3.55            #peak    70
 19 LYS  H      20 ARG  H       2.99            #peak    72
 20 ARG  H      20 ARG  QB      3.74            #peak    73
 20 ARG  H      21 LEU  H       2.80            #peak    75
 20 ARG  QB     21 LEU  H       4.21            #peak    76
 21 LEU  QB     22 LEU  H       6.38            #peak    84
 21 LEU  HA     22 LEU  H       3.48            #peak    85
 22 LEU  H      23 ALA  H       2.87            #peak    87
 23 ALA  H      24 MET  H       2.83            #peak    91
 24 MET  H      24 MET  HB2     3.14            #peak    95
 24 MET  H      24 MET  HB3     2.74            #peak    96
 12 ALA  H      12 ALA  HA      2.74            #peak    99
 14 LYS  H      14 LYS  HB2     2.83            #peak   106
 14 LYS  H      14 LYS  HB3     2.83            #peak   107
 13 PHE  H      13 PHE  HB3     2.80            #peak   110
 13 PHE  H      13 PHE  HB2     2.71            #peak   111
 13 PHE  HB3    14 LYS  H       3.08            #peak   113
 29 ALA  HA     30 PHE  H       2.62            #peak   115
 22 LEU  HB3    23 ALA  H       2.99            #peak   118
 22 LEU  HB2    23 ALA  H       2.99            #peak   119
 28 HIS  HA     29 ALA  H       2.87            #peak   126
 28 HIS  HB2    29 ALA  H       4.26            #peak   128
 28 HIS  HB3    29 ALA  H       3.86            #peak   129
 27 GLN  H      28 HIS  H       3.02            #peak   130
 13 PHE  HB2    14 LYS  H       3.45            #peak   132
 13 PHE  H      13 PHE  HA      2.83            #peak   133
 13 PHE  H      14 LYS  H       2.99            #peak   135
 12 ALA  H      13 PHE  H       3.08            #peak   138
 15 GLN  H      15 GLN  HA      2.83            #peak   148
 11 LYS  H      11 LYS  HA      2.71            #peak   176
 27 GLN  H      27 GLN  HA      2.87            #peak   182
 10 CYSS HA     11 LYS  H       2.99            #peak   196
 17 VAL  HA     17 VAL  HB      2.99            #peak   213
 27 GLN  HA     28 HIS  H       3.17            #peak   292
 11 LYS  HA     12 ALA  H       3.21            #peak   656
 12 ALA  HA     13 PHE  H       3.55            #peak   657
 24 MET  H      24 MET  HA      2.87            #peak   658
  7 SER  HB3     8 TRP  H       4.14            #peak   660
 16 ARG  H      17 VAL  H       2.59            #peak   662
 16 ARG  HA     19 LYS  H       3.52            #peak   666
 17 VAL  H      17 VAL  HB      2.96            #peak   671
 14 LYS  HA     17 VAL  HB      3.86            #peak   672
 25 LEU  QB     26 ARG  H       4.55            #peak   676
 17 VAL  HA     20 ARG  QB      4.55            #peak   681
  7 SER  H       7 SER  HA      2.62            #peak   690
  7 SER  HA      8 TRP  H       3.14            #peak   691
  7 SER  HB2     8 TRP  H       4.14            #peak   694
  5 PRO  HA      6 LYS  H       3.02            #peak   700
  6 LYS  H       6 LYS  HA      2.43            #peak   701
  6 LYS  H       7 SER  H       3.55            #peak   704
  2 ILE  HA      3 ARG  H       2.96            #peak   705
 10 CYSS H      11 LYS  H       3.95            #peak   720
  2 ILE  H       2 ILE  HB      2.62            #peak   722
  2 ILE  HB      3 ARG  H       3.39            #peak   727
  6 LYS  H       6 LYS  QB      3.96            #peak   729
  7 SER  H       8 TRP  H       3.73            #peak   732
 15 GLN  H      16 ARG  H       3.02            #peak   739
 26 ARG  H      27 GLN  H       3.11            #peak   740
 17 VAL  HA     20 ARG  H       3.55            #peak   741
 17 VAL  HB     18 LEU  H       2.74            #peak   742
 22 LEU  HA     25 LEU  H       3.36            #peak   750
 20 ARG  HA     23 ALA  H       3.45            #peak   751
 19 LYS  HA     22 LEU  H       3.39            #peak   752
  8 TRP  HA      8 TRP  HD1     2.96            #peak    34
  8 TRP  H       8 TRP  HD1     3.39            #peak    36
  8 TRP  HB3     8 TRP  HE3     3.55            #peak    46
  8 TRP  HB2     8 TRP  HE3     3.55            #peak    47
 21 LEU  H      21 LEU  HG      5.50            #peak    80
 21 LEU  HG     22 LEU  H       5.50            #peak    83
 13 PHE  HA     13 PHE  QD      5.30            #peak   136
 13 PHE  H      13 PHE  QD      7.63            #peak   140
 13 PHE  QD     14 LYS  H       7.63            #peak   141
 16 ARG  H      16 ARG  HD2     4.72            #peak   153
 16 ARG  H      16 ARG  HD3     4.72            #peak   154
 16 ARG  H      16 ARG  QG      6.38            #peak   163
 24 MET  H      24 MET  HG2     4.88            #peak   188
 24 MET  H      24 MET  HG3     4.88            #peak   189
 13 PHE  QD     17 VAL  HB      6.54            #peak   209
 30 PHE  HA     30 PHE  QR      7.96            #peak   225
 29 ALA  HA     30 PHE  QR      7.96            #peak   226
 14 LYS  HA     14 LYS  QG      4.15            #peak   234
 26 ARG  H      26 ARG  QG      6.38            #peak   679
  6 LYS  H       6 LYS  QG      5.76            #peak   730
  6 LYS  H       6 LYS  QD      6.38            #peak   731
 12 ALA  H      13 PHE  QD      7.01            #peak   736
 15 GLN  H      15 GLN  HG2     3.95            #peak   737
 15 GLN  H      15 GLN  HG3     3.95            #peak   738
 29 ALA  H      29 ALA  QB      3.98            #peak    15
 23 ALA  H      23 ALA  QB      3.48            #peak    16
 29 ALA  QB     30 PHE  H       4.91            #peak    54
 29 ALA  QB     30 PHE  QR      8.98            #peak    55
 17 VAL  H      17 VAL  QG1     4.84            #peak    56
 17 VAL  H      17 VAL  QG2     4.84            #peak    57
 17 VAL  QG1    18 LEU  H       5.25            #peak    58
 17 VAL  QG2    18 LEU  H       5.25            #peak    59
 18 LEU  H      18 LEU  QD1     4.60            #peak    64
 18 LEU  H      18 LEU  QD2     4.60            #peak    65
 22 LEU  H      22 LEU  QQD     6.60            #peak    82
 23 ALA  QB     24 MET  H       4.32            #peak    90
 25 LEU  H      25 LEU  QQD     7.60            #peak   103
 12 ALA  H      12 ALA  QB      4.04            #peak   164
 12 ALA  QB     13 PHE  H       4.16            #peak   165
 17 VAL  HA     17 VAL  QG1     3.95            #peak   207
 17 VAL  HA     17 VAL  QG2     3.95            #peak   208
 20 ARG  HA     23 ALA  QB      6.02            #peak   680
  7 SER  H       7 SER  QB      3.48            #peak   693
  7 SER  QB      8 TRP  H       3.29            #peak   694
  8 TRP  H       8 TRP  QB      2.86            #peak    44
  8 TRP  QB      8 TRP  HE3     2.98            #peak    47
 13 PHE  QD     17 VAL  QQG     6.43            #peak    60
 13 PHE  QE     17 VAL  QQG     7.62            #peak   211
 15 GLN  H      15 GLN  QB      2.50            #peak   151
 15 GLN  QB     16 ARG  H       3.29            #peak    68
 16 ARG  H      16 ARG  QD      3.98            #peak   154
 16 ARG  QB     17 VAL  H       3.91            #peak   168
 17 VAL  H      17 VAL  QQG     3.64            #peak    56
 17 VAL  QQG    18 LEU  H       4.45            #peak    59
 18 LEU  H      18 LEU  QB      2.62            #peak   273
 18 LEU  H      18 LEU  QQD     3.94            #peak    64
 18 LEU  QB     19 LYS  H       3.17            #peak   155
 18 LEU  QQD    19 LYS  H       5.05            #peak   169
 21 LEU  H      21 LEU  QQD     4.40            #peak    77
 21 LEU  QQD    22 LEU  H       5.41            #peak    81
 24 MET  H      24 MET  QG      4.23            #peak   189
 26 ARG  H      26 ARG  QB      2.63            #peak   678
 27 GLN  HA     27 GLN  QB      2.63            #peak   265

   2 ILE   PHI    -115.0   -75.0
   2 ILE   PSI     155.0   165.0
   3 ARG   PHI    -315.0   -45.0
   3 ARG   PHI    -185.0    75.0
   3 ARG   CHI1   -335.0   -25.0
   3 ARG   CHI1   -205.0    95.0
   3 ARG   CHI2   -325.0   -35.0
   3 ARG   PSI     -85.0   195.0
   4 CYSS  PHI    -315.0   -45.0
   4 CYSS  PHI    -185.0    75.0
   4 CYSS  CHI1   -335.0   -25.0
   4 CYSS  CHI1   -185.0    75.0
   4 CYSS  PSI      55.0   165.0
   4 CYSS  PSI    -215.0    85.0
   5 PRO   PSI      65.0   195.0
   6 LYS   PHI      45.0    75.0
   6 LYS   CHI1   -205.0   -25.0
   6 LYS   CHI2   -325.0   -35.0
   7 SER   PHI      45.0   195.0
   7 SER   PHI    -185.0    75.0
   7 SER   CHI1   -155.0    55.0
   7 SER   CHI1    -45.0   285.0
   7 SER   PSI       5.0   125.0
   7 SER   PSI    -275.0    35.0
   8 TRP   PHI    -125.0   -45.0
   8 TRP   CHI1   -125.0   -35.0
   8 TRP   CHI2    -45.0    55.0
   8 TRP   PSI      35.0   195.0
   9 LYS   PHI    -315.0   -45.0
   9 LYS   PHI    -185.0    75.0
   9 LYS   CHI1   -335.0   -25.0
   9 LYS   CHI1   -205.0    95.0
   9 LYS   CHI2   -325.0   -35.0
   9 LYS   PSI     -85.0   195.0
  10 CYSS  PHI      45.0    75.0
  10 CYSS  CHI1   -195.0   -25.0
  10 CYSS  PSI      15.0   135.0
  11 LYS   CHI1   -335.0   -25.0
  11 LYS   CHI1   -205.0    95.0
  11 LYS   CHI2   -325.0   -35.0
  11 LYS   PSI     -15.0   195.0
  12 ALA   PHI    -315.0   -45.0
  12 ALA   PHI    -185.0    75.0
  12 ALA   PSI     -85.0    95.0
  13 PHE   PHI    -125.0   -45.0
  13 PHE   CHI1   -195.0  -135.0
  13 PHE   CHI2   -335.0   -25.0
  13 PHE   CHI2   -155.0   155.0
  13 PHE   PSI     -85.0   -35.0
  14 LYS   PHI    -135.0   -45.0
  14 LYS   CHI1   -205.0  -135.0
  14 LYS   CHI2     35.0   315.0
  14 LYS   PSI     -85.0   195.0
  15 GLN   PHI    -315.0   -45.0
  15 GLN   PHI    -165.0    65.0
  15 GLN   CHI1   -335.0   -25.0
  15 GLN   CHI1   -145.0    95.0
  15 GLN   CHI2   -345.0   -15.0
  15 GLN   PSI     -85.0    75.0
  16 ARG   PHI    -315.0   -45.0
  16 ARG   PHI    -185.0    75.0
  16 ARG   CHI1   -335.0   -25.0
  16 ARG   CHI1   -205.0    95.0
  16 ARG   CHI2   -325.0   -35.0
  16 ARG   PSI     -85.0    75.0
  17 VAL   PHI    -155.0   -45.0
  17 VAL   CHI1   -195.0  -155.0
  17 VAL   PSI     -85.0   -25.0
  18 LEU   PHI    -315.0   -45.0
  18 LEU   PHI    -185.0    75.0
  18 LEU   CHI1   -345.0    -5.0
  18 LEU   CHI1   -215.0   105.0
  18 LEU   CHI2   -325.0   -35.0
  18 LEU   CHI2    -95.0   205.0
  18 LEU   PSI    -295.0    45.0
  18 LEU   PSI     -85.0    95.0
  19 LYS   PHI    -315.0   -45.0
  19 LYS   PHI    -185.0    75.0
  19 LYS   CHI1   -335.0   -25.0
  19 LYS   CHI1   -205.0    95.0
  19 LYS   CHI2   -325.0   -35.0
  19 LYS   PSI     -85.0    85.0
  20 ARG   PHI    -315.0   -45.0
  20 ARG   PHI    -185.0    75.0
  20 ARG   CHI1   -335.0   -25.0
  20 ARG   CHI1   -205.0    95.0
  20 ARG   CHI2   -325.0   -35.0
  20 ARG   PSI     -85.0    85.0
  21 LEU   PHI    -315.0   -45.0
  21 LEU   PHI    -185.0    75.0
  21 LEU   CHI1   -355.0    -5.0
  21 LEU   CHI1   -215.0   105.0
  21 LEU   CHI2   -325.0   -35.0
  21 LEU   CHI2    -95.0   205.0
  21 LEU   PSI     -85.0   205.0
  22 LEU   PHI    -185.0   -45.0
  22 LEU   CHI1   -145.0   -45.0
  22 LEU   CHI2   -325.0   -35.0
  22 LEU   CHI2    -95.0   205.0
  22 LEU   PSI     -85.0   -35.0
  23 ALA   PHI    -315.0   -45.0
  23 ALA   PHI    -185.0    75.0
  23 ALA   PSI     -85.0    85.0
  24 MET   PHI    -145.0   -45.0
  24 MET   CHI1   -205.0  -145.0
  24 MET   CHI2     45.0   305.0
  24 MET   PSI     -85.0   185.0
  25 LEU   PHI    -315.0   -45.0
  25 LEU   PHI    -185.0    75.0
  25 LEU   CHI1   -345.0   -15.0
  25 LEU   CHI1   -215.0   105.0
  25 LEU   CHI2   -325.0   -35.0
  25 LEU   CHI2    -95.0   205.0
  25 LEU   PSI     -85.0   205.0
  26 ARG   PHI    -315.0   -45.0
  26 ARG   PHI    -185.0    75.0
  26 ARG   CHI1   -335.0   -25.0
  26 ARG   CHI1   -205.0    95.0
  26 ARG   CHI2   -325.0   -35.0
  26 ARG   PSI     -85.0    95.0
  27 GLN   PHI      45.0   295.0
  27 GLN   PHI    -185.0    75.0
  27 GLN   CHI1   -335.0   -25.0
  27 GLN   CHI1   -195.0    95.0
  27 GLN   CHI2   -345.0   -15.0
  27 GLN   PSI     -15.0    85.0
  28 HIS   PHI    -165.0   -45.0
  28 HIS   CHI1   -195.0   -85.0
  28 HIS   PSI     125.0   195.0
  29 ALA   PHI    -315.0   -45.0
  29 ALA   PHI    -185.0    75.0
  29 ALA   PSI      35.0   195.0
  30 PHE   PHI    -315.0   -45.0
  30 PHE   PHI    -175.0    65.0
  30 PHE   CHI1   -205.0   -25.0
  30 PHE   CHI2   -335.0   -25.0
  30 PHE   CHI2   -155.0   155.0

   3 ARG   PHI    -180.0   -50.0
   4 CYSS  PHI    -120.0   -80.0
   4 CYSS  PSI     140.0   180.0
   5 PRO   PSI      60.0    80.0
   6 LYS   PHI      40.0    80.0
   6 LYS   PSI      60.0   115.0
   6 LYS   CHI1    -80.0   -40.0
   7 SER   PHI    -180.0   -50.0
   7 SER   CHI1     40.0    80.0
   8 TRP   CHI1    -80.0   -40.0
   9 LYS   PHI    -180.0  -120.0
   9 LYS   PSI     -80.0   -40.0
   9 LYS   CHI1    -80.0   -40.0
  10 CYSS  PHI      40.0    80.0
  10 CYSS  PSI      60.0   100.0
  11 LYS   PHI    -150.0   -40.0
  11 LYS   PSI      60.0   180.0
  12 ALA   PHI     -80.0   -40.0
  12 ALA   PSI     -80.0   -40.0
  13 PHE   PHI     -80.0   -40.0
  13 PHE   PSI     -80.0   -40.0
  13 PHE   CHI1   -200.0  -160.0
  15 GLN   CHI1    -80.0   -40.0
  17 VAL   CHI1   -200.0  -160.0
  18 LEU   CHI1   -200.0  -160.0
  22 LEU   CHI1    -80.0   -40.0
  23 ALA   PHI     -80.0   -40.0
  23 ALA   PSI     -80.0   -40.0
  24 MET   PHI     -80.0   -40.0
  24 MET   PSI     -80.0   -40.0
  24 MET   CHI1   -200.0  -160.0
  25 LEU   PHI    -100.0   -40.0
  25 LEU   PSI     -80.0   -40.0
  25 LEU   CHI1   -200.0  -160.0
  26 ARG   PHI    -180.0   -40.0
  27 GLN   PHI     -180.0   -40.0
  28 HIS   PHI     -180.0   -50.0
  28 HIS   CHI1    -200.0  -160.0
  29 ALA   PHI     -180.0   -50.0
  30 PHE   PHI     -180.0   -50.0
  30 PHE   CHI1    -200.0  -160.0


  4 CYSS SG     10 CYSS SG      2.10
  4 CYSS SG     10 CYSS CB      3.10
  4 CYSS CB     10 CYSS SG      3.10

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY   1           H        GLY   1  -8.381   2.046   1.348
    2    HA2  GLY   1           2HA      GLY   1 -10.119   2.326   3.017
    3    HA3  GLY   1           3HA      GLY   1  -8.955   3.198   4.002
    4    H    ILE   2           H        ILE   2  -8.296   5.324   3.315
    5    HA   ILE   2           HA       ILE   2 -10.502   6.767   2.104
    6    HB   ILE   2           HB       ILE   2  -7.942   7.998   3.092
    7   HG12  ILE   2          2HG1      ILE   2  -8.743   6.556   4.883
    8   HG13  ILE   2          3HG1      ILE   2  -9.043   8.241   5.297
    9   HG21  ILE   2          1HG2      ILE   2 -10.688   8.937   2.448
   10   HG22  ILE   2          2HG2      ILE   2  -9.802   9.755   3.734
   11   HG23  ILE   2          3HG2      ILE   2  -9.127   9.684   2.106
   12   HD11  ILE   2          3HD1      ILE   2 -10.944   6.945   5.921
   13   HD12  ILE   2          1HD1      ILE   2 -11.385   7.944   4.537
   14   HD13  ILE   2          2HD1      ILE   2 -11.046   6.228   4.313
   15    H    ARG   3           H        ARG   3 -10.136   8.409   0.454
   16    HA   ARG   3           HA       ARG   3  -7.897   7.757  -1.344
   17    HB2  ARG   3           2HB      ARG   3 -10.074   6.808  -2.133
   18    HB3  ARG   3           3HB      ARG   3 -10.703   8.447  -2.225
   19    HG2  ARG   3           2HG      ARG   3 -10.080   8.049  -4.401
   20    HG3  ARG   3           3HG      ARG   3  -8.656   8.872  -3.761
   21    HD2  ARG   3           2HD      ARG   3  -8.072   6.288  -3.177
   22    HD3  ARG   3           3HD      ARG   3  -8.996   6.095  -4.667
   23    HE   ARG   3           HE       ARG   3  -6.358   7.164  -4.405
   24   HH11  ARG   3          1HH1      ARG   3  -9.276   7.288  -6.299
   25   HH12  ARG   3          2HH1      ARG   3  -8.473   7.815  -7.741
   26   HH21  ARG   3          1HH2      ARG   3  -5.289   7.858  -6.297
   27   HH22  ARG   3          2HH2      ARG   3  -6.205   8.138  -7.739
   28    H    CYS   4           H        CYS   4 -10.504  10.167  -0.966
   29    HA   CYS   4           HA       CYS   4  -8.805  12.260  -1.999
   30    HB2  CYS   4           2HB      CYS   4 -11.659  12.018  -1.187
   31    HB3  CYS   4           3HB      CYS   4 -10.938  13.624  -1.149
   32    HA   PRO   5           HA       PRO   5  -7.248  13.930   1.746
   33    HB2  PRO   5           2HB      PRO   5  -7.427  16.605   1.317
   34    HB3  PRO   5           3HB      PRO   5  -6.252  15.575   0.490
   35    HG2  PRO   5           2HG      PRO   5  -8.886  16.606  -0.489
   36    HG3  PRO   5           3HG      PRO   5  -7.336  16.507  -1.344
   37    HD2  PRO   5           2HD      PRO   5  -9.319  14.698  -1.706
   38    HD3  PRO   5           3HD      PRO   5  -7.601  14.267  -1.822
   39    H    LYS   6           H        LYS   6  -9.203  13.062   2.887
   40    HA   LYS   6           HA       LYS   6 -10.959  13.270   4.325
   41    HB2  LYS   6           2HB      LYS   6  -9.839  16.051   4.716
   42    HB3  LYS   6           3HB      LYS   6 -10.874  15.175   5.837
   43    HG2  LYS   6           2HG      LYS   6  -9.010  13.420   5.887
   44    HG3  LYS   6           3HG      LYS   6  -8.005  14.666   5.143
   45    HD2  LYS   6           2HD      LYS   6  -8.512  16.172   7.019
   46    HD3  LYS   6           3HD      LYS   6  -9.483  14.901   7.766
   47    HE2  LYS   6           2HE      LYS   6  -6.542  14.688   7.128
   48    HE3  LYS   6           3HE      LYS   6  -7.205  15.071   8.716
   49    HZ1  LYS   6           3HZ      LYS   6  -6.997  12.529   7.377
   50    HZ2  LYS   6           1HZ      LYS   6  -8.518  12.810   8.062
   51    HZ3  LYS   6           2HZ      LYS   6  -7.131  12.875   9.027
   52    H    SER   7           H        SER   7 -12.212  13.294   2.193
   53    HA   SER   7           HA       SER   7 -14.393  15.018   2.421
   54    HB2  SER   7           2HB      SER   7 -13.970  16.241   0.159
   55    HB3  SER   7           3HB      SER   7 -13.215  16.870   1.623
   56    HG   SER   7           HG       SER   7 -11.848  16.579  -0.333
   57    H    TRP   8           H        TRP   8 -15.959  13.747   1.714
   58    HA   TRP   8           HA       TRP   8 -15.427  11.671  -0.224
   59    HB2  TRP   8           2HB      TRP   8 -17.770  12.408   1.501
   60    HB3  TRP   8           3HB      TRP   8 -17.976  11.274   0.169
   61    HD1  TRP   8           HD1      TRP   8 -14.744  11.214   2.195
   62    HE1  TRP   8           HE1      TRP   8 -14.649   9.022   3.540
   63    HE3  TRP   8           HE3      TRP   8 -19.468   9.490   1.272
   64    HZ2  TRP   8           HZ2      TRP   8 -16.351   6.849   4.131
   65    HZ3  TRP   8           HZ3      TRP   8 -20.156   7.346   2.264
   66    HH2  TRP   8           HH2      TRP   8 -18.628   6.054   3.663
   67    H    LYS   9           H        LYS   9 -14.906  13.543  -1.791
   68    HA   LYS   9           HA       LYS   9 -17.353  14.131  -3.321
   69    HB2  LYS   9           2HB      LYS   9 -14.997  15.930  -2.768
   70    HB3  LYS   9           3HB      LYS   9 -16.117  16.226  -4.092
   71    HG2  LYS   9           2HG      LYS   9 -17.966  16.316  -2.447
   72    HG3  LYS   9           3HG      LYS   9 -16.774  16.154  -1.155
   73    HD2  LYS   9           2HD      LYS   9 -17.286  18.479  -1.402
   74    HD3  LYS   9           3HD      LYS   9 -15.658  18.211  -2.029
   75    HE2  LYS   9           2HE      LYS   9 -16.332  18.464  -4.237
   76    HE3  LYS   9           3HE      LYS   9 -18.020  18.119  -3.865
   77    HZ1  LYS   9           3HZ      LYS   9 -17.309  20.384  -2.421
   78    HZ2  LYS   9           1HZ      LYS   9 -18.364  20.287  -3.740
   79    HZ3  LYS   9           2HZ      LYS   9 -16.724  20.614  -3.991
   80    H    CYS  10           H        CYS  10 -13.886  14.640  -3.925
   81    HA   CYS  10           HA       CYS  10 -12.574  14.091  -5.706
   82    HB2  CYS  10           2HB      CYS  10 -14.149  11.515  -5.747
   83    HB3  CYS  10           3HB      CYS  10 -12.487  11.766  -6.271
   84    H    LYS  11           H        LYS  11 -13.872  15.784  -6.862
   85    HA   LYS  11           HA       LYS  11 -15.991  15.301  -8.559
   86    HB2  LYS  11           2HB      LYS  11 -14.589  17.483  -8.006
   87    HB3  LYS  11           3HB      LYS  11 -13.792  17.077  -9.520
   88    HG2  LYS  11           2HG      LYS  11 -15.414  18.275 -10.471
   89    HG3  LYS  11           3HG      LYS  11 -16.425  16.854 -10.196
   90    HD2  LYS  11           2HD      LYS  11 -16.115  19.000  -8.117
   91    HD3  LYS  11           3HD      LYS  11 -17.315  19.123  -9.406
   92    HE2  LYS  11           2HE      LYS  11 -18.260  16.963  -8.697
   93    HE3  LYS  11           3HE      LYS  11 -17.086  16.895  -7.384
   94    HZ1  LYS  11           3HZ      LYS  11 -18.945  19.173  -7.670
   95    HZ2  LYS  11           1HZ      LYS  11 -18.089  18.676  -6.298
   96    HZ3  LYS  11           2HZ      LYS  11 -19.400  17.764  -6.853
   97    H    ALA  12           H        ALA  12 -16.153  13.673  -9.958
   98    HA   ALA  12           HA       ALA  12 -14.122  12.215 -11.122
   99    HB1  ALA  12           1HB      ALA  12 -15.735  11.182 -12.411
  100    HB2  ALA  12           2HB      ALA  12 -16.690  11.824 -11.075
  101    HB3  ALA  12           3HB      ALA  12 -16.665  12.665 -12.625
  102    H    PHE  13           H        PHE  13 -15.700  15.141 -12.318
  103    HA   PHE  13           HA       PHE  13 -14.585  15.208 -14.877
  104    HB2  PHE  13           2HB      PHE  13 -16.417  16.702 -13.861
  105    HB3  PHE  13           3HB      PHE  13 -15.094  17.685 -13.243
  106    HD1  PHE  13           HD2      PHE  13 -16.867  16.570 -16.243
  107    HD2  PHE  13           HD1      PHE  13 -13.744  19.024 -14.714
  108    HE1  PHE  13           HE2      PHE  13 -16.744  17.750 -18.399
  109    HE2  PHE  13           HE1      PHE  13 -13.617  20.209 -16.867
  110    HZ   PHE  13           HZ       PHE  13 -15.117  19.571 -18.713
  111    H    LYS  14           H        LYS  14 -13.519  17.166 -12.092
  112    HA   LYS  14           HA       LYS  14 -11.108  18.007 -13.211
  113    HB2  LYS  14           2HB      LYS  14 -12.204  18.961 -11.171
  114    HB3  LYS  14           3HB      LYS  14 -11.649  17.556 -10.271
  115    HG2  LYS  14           2HG      LYS  14  -9.464  18.781 -11.687
  116    HG3  LYS  14           3HG      LYS  14 -10.295  19.958 -10.668
  117    HD2  LYS  14           2HD      LYS  14  -9.811  17.343  -9.413
  118    HD3  LYS  14           3HD      LYS  14  -8.357  18.267  -9.799
  119    HE2  LYS  14           2HE      LYS  14  -9.144  18.749  -7.537
  120    HE3  LYS  14           3HE      LYS  14  -9.232  20.178  -8.564
  121    HZ1  LYS  14           3HZ      LYS  14 -11.467  20.221  -8.463
  122    HZ2  LYS  14           1HZ      LYS  14 -11.233  19.356  -7.028
  123    HZ3  LYS  14           2HZ      LYS  14 -11.627  18.537  -8.455
  124    H    GLN  15           H        GLN  15 -11.936  15.052 -11.535
  125    HA   GLN  15           HA       GLN  15  -9.358  14.133 -10.936
  126    HB2  GLN  15           2HB      GLN  15 -11.984  12.762 -11.419
  127    HB3  GLN  15           3HB      GLN  15 -10.521  11.819 -11.167
  128    HG2  GLN  15           2HG      GLN  15 -10.842  13.892  -9.168
  129    HG3  GLN  15           3HG      GLN  15 -12.215  12.787  -9.217
  130   HE21  GLN  15          1HE2      GLN  15 -11.811  10.532  -8.936
  131   HE22  GLN  15          2HE2      GLN  15 -10.431   9.998  -8.044
  132    H    ARG  16           H        ARG  16 -11.370  13.662 -13.820
  133    HA   ARG  16           HA       ARG  16  -9.424  12.061 -15.169
  134    HB2  ARG  16           2HB      ARG  16 -11.861  13.521 -16.202
  135    HB3  ARG  16           3HB      ARG  16 -10.891  12.405 -17.154
  136    HG2  ARG  16           2HG      ARG  16 -12.074  11.506 -14.566
  137    HG3  ARG  16           3HG      ARG  16 -13.073  11.584 -16.019
  138    HD2  ARG  16           2HD      ARG  16 -10.539  10.318 -16.568
  139    HD3  ARG  16           3HD      ARG  16 -11.371   9.511 -15.240
  140    HE   ARG  16           HE       ARG  16 -13.238   9.902 -17.257
  141   HH11  ARG  16          1HH1      ARG  16 -10.268   8.152 -16.773
  142   HH12  ARG  16          2HH1      ARG  16 -10.683   6.884 -17.879
  143   HH21  ARG  16          1HH2      ARG  16 -13.796   8.239 -18.715
  144   HH22  ARG  16          2HH2      ARG  16 -12.689   6.935 -18.983
  145    H    VAL  17           H        VAL  17 -10.464  15.446 -15.431
  146    HA   VAL  17           HA       VAL  17  -8.917  16.265 -17.563
  147    HB   VAL  17           HB       VAL  17  -9.439  17.905 -15.081
  148   HG11  VAL  17          1HG1      VAL  17  -9.225  19.819 -16.507
  149   HG12  VAL  17          2HG1      VAL  17  -7.791  18.811 -16.718
  150   HG13  VAL  17          3HG1      VAL  17  -9.068  18.798 -17.936
  151   HG21  VAL  17          3HG2      VAL  17 -11.268  18.496 -17.165
  152   HG22  VAL  17          1HG2      VAL  17 -11.285  16.751 -16.909
  153   HG23  VAL  17          2HG2      VAL  17 -11.606  17.843 -15.562
  154    H    LEU  18           H        LEU  18  -7.990  15.921 -14.171
  155    HA   LEU  18           HA       LEU  18  -5.504  17.123 -14.201
  156    HB2  LEU  18           2HB      LEU  18  -6.524  16.318 -12.167
  157    HB3  LEU  18           3HB      LEU  18  -6.398  14.651 -12.726
  158    HG   LEU  18           HG       LEU  18  -3.836  16.074 -12.566
  159   HD11  LEU  18          1HD1      LEU  18  -5.336  15.419 -10.034
  160   HD12  LEU  18          2HD1      LEU  18  -5.010  17.046 -10.631
  161   HD13  LEU  18          3HD1      LEU  18  -3.674  15.997 -10.157
  162   HD21  LEU  18          3HD2      LEU  18  -3.324  13.913 -11.301
  163   HD22  LEU  18          1HD2      LEU  18  -3.743  13.778 -13.009
  164   HD23  LEU  18          2HD2      LEU  18  -4.944  13.398 -11.774
  165    H    LYS  19           H        LYS  19  -6.379  13.832 -15.165
  166    HA   LYS  19           HA       LYS  19  -3.650  13.182 -15.871
  167    HB2  LYS  19           2HB      LYS  19  -6.263  11.723 -15.902
  168    HB3  LYS  19           3HB      LYS  19  -4.922  11.102 -16.856
  169    HG2  LYS  19           2HG      LYS  19  -4.191  11.775 -14.112
  170    HG3  LYS  19           3HG      LYS  19  -5.418  10.512 -14.237
  171    HD2  LYS  19           2HD      LYS  19  -3.926   9.343 -15.872
  172    HD3  LYS  19           3HD      LYS  19  -2.682  10.540 -15.506
  173    HE2  LYS  19           2HE      LYS  19  -3.464   9.692 -13.014
  174    HE3  LYS  19           3HE      LYS  19  -3.566   8.217 -13.973
  175    HZ1  LYS  19           3HZ      LYS  19  -1.182   9.982 -13.819
  176    HZ2  LYS  19           1HZ      LYS  19  -1.289   8.516 -14.658
  177    HZ3  LYS  19           2HZ      LYS  19  -1.372   8.531 -12.969
  178    H    ARG  20           H        ARG  20  -6.623  14.112 -17.488
  179    HA   ARG  20           HA       ARG  20  -6.026  13.483 -20.113
  180    HB2  ARG  20           2HB      ARG  20  -8.101  14.693 -18.930
  181    HB3  ARG  20           3HB      ARG  20  -7.316  16.112 -19.611
  182    HG2  ARG  20           2HG      ARG  20  -7.291  14.553 -21.773
  183    HG3  ARG  20           3HG      ARG  20  -8.703  13.877 -20.957
  184    HD2  ARG  20           2HD      ARG  20  -8.774  16.748 -20.861
  185    HD3  ARG  20           3HD      ARG  20  -8.572  16.200 -22.524
  186    HE   ARG  20           HE       ARG  20 -10.907  15.916 -20.882
  187   HH11  ARG  20          1HH1      ARG  20  -9.138  14.596 -23.574
  188   HH12  ARG  20          2HH1      ARG  20 -10.530  13.857 -24.294
  189   HH21  ARG  20          1HH2      ARG  20 -12.747  14.948 -21.819
  190   HH22  ARG  20          2HH2      ARG  20 -12.582  14.059 -23.295
  191    H    LEU  21           H        LEU  21  -5.131  16.381 -18.276
  192    HA   LEU  21           HA       LEU  21  -3.941  17.855 -20.296
  193    HB2  LEU  21           2HB      LEU  21  -4.033  17.899 -17.451
  194    HB3  LEU  21           3HB      LEU  21  -2.365  18.159 -17.958
  195    HG   LEU  21           HG       LEU  21  -3.674  20.247 -17.582
  196   HD11  LEU  21          1HD1      LEU  21  -3.122  21.126 -20.006
  197   HD12  LEU  21          2HD1      LEU  21  -2.323  19.560 -20.139
  198   HD13  LEU  21          3HD1      LEU  21  -1.845  20.689 -18.872
  199   HD21  LEU  21          3HD2      LEU  21  -5.370  20.911 -19.133
  200   HD22  LEU  21          1HD2      LEU  21  -5.818  19.338 -18.474
  201   HD23  LEU  21          2HD2      LEU  21  -5.135  19.451 -20.096
  202    H    LEU  22           H        LEU  22  -2.701  15.117 -18.496
  203    HA   LEU  22           HA       LEU  22  -0.012  15.385 -19.466
  204    HB2  LEU  22           2HB      LEU  22  -1.513  13.304 -17.929
  205    HB3  LEU  22           3HB      LEU  22   0.079  12.941 -18.592
  206    HG   LEU  22           HG       LEU  22  -0.353  15.310 -16.801
  207   HD11  LEU  22          1HD1      LEU  22   0.378  13.867 -14.926
  208   HD12  LEU  22          2HD1      LEU  22   0.177  12.462 -15.971
  209   HD13  LEU  22          3HD1      LEU  22  -1.219  13.452 -15.548
  210   HD21  LEU  22          3HD2      LEU  22   1.754  15.507 -17.648
  211   HD22  LEU  22          1HD2      LEU  22   1.943  13.770 -17.886
  212   HD23  LEU  22          2HD2      LEU  22   2.097  14.459 -16.270
  213    H    ALA  23           H        ALA  23  -2.582  12.978 -20.053
  214    HA   ALA  23           HA       ALA  23  -1.367  11.532 -22.058
  215    HB1  ALA  23           1HB      ALA  23  -4.015  11.594 -22.841
  216    HB2  ALA  23           2HB      ALA  23  -3.289  10.464 -21.697
  217    HB3  ALA  23           3HB      ALA  23  -4.082  11.927 -21.110
  218    H    MET  24           H        MET  24  -3.149  14.573 -22.313
  219    HA   MET  24           HA       MET  24  -2.998  14.664 -25.175
  220    HB2  MET  24           2HB      MET  24  -4.814  15.775 -23.954
  221    HB3  MET  24           3HB      MET  24  -3.648  16.841 -23.179
  222    HG2  MET  24           2HG      MET  24  -3.573  18.210 -24.930
  223    HG3  MET  24           3HG      MET  24  -3.454  16.878 -26.077
  224    HE1  MET  24           3HE      MET  24  -6.351  17.900 -27.982
  225    HE2  MET  24           1HE      MET  24  -5.404  19.245 -27.345
  226    HE3  MET  24           2HE      MET  24  -4.601  17.745 -27.812
  227    H    LEU  25           H        LEU  25  -1.240  16.176 -22.502
  228    HA   LEU  25           HA       LEU  25   0.339  17.964 -23.887
  229    HB2  LEU  25           2HB      LEU  25   0.431  18.006 -21.541
  230    HB3  LEU  25           3HB      LEU  25   0.869  16.302 -21.445
  231    HG   LEU  25           HG       LEU  25   2.856  17.885 -22.864
  232   HD11  LEU  25          1HD1      LEU  25   3.709  19.023 -20.845
  233   HD12  LEU  25          2HD1      LEU  25   2.226  18.582 -20.000
  234   HD13  LEU  25          3HD1      LEU  25   2.159  19.663 -21.392
  235   HD21  LEU  25          3HD2      LEU  25   2.949  16.118 -20.421
  236   HD22  LEU  25          1HD2      LEU  25   4.349  16.725 -21.305
  237   HD23  LEU  25          2HD2      LEU  25   3.228  15.610 -22.087
  238    H    ARG  26           H        ARG  26   1.076  14.554 -23.167
  239    HA   ARG  26           HA       ARG  26   3.537  14.439 -24.483
  240    HB2  ARG  26           2HB      ARG  26   1.676  12.575 -23.304
  241    HB3  ARG  26           3HB      ARG  26   2.335  11.918 -24.797
  242    HG2  ARG  26           2HG      ARG  26   3.898  11.170 -23.328
  243    HG3  ARG  26           3HG      ARG  26   4.611  12.731 -23.739
  244    HD2  ARG  26           2HD      ARG  26   4.601  13.225 -21.572
  245    HD3  ARG  26           3HD      ARG  26   2.839  13.257 -21.647
  246    HE   ARG  26           HE       ARG  26   2.806  11.301 -20.474
  247   HH11  ARG  26          1HH1      ARG  26   5.964  11.705 -21.883
  248   HH12  ARG  26          2HH1      ARG  26   6.640  10.324 -21.084
  249   HH21  ARG  26          1HH2      ARG  26   3.685   9.481 -19.416
  250   HH22  ARG  26          2HH2      ARG  26   5.343   9.059 -19.682
  251    H    GLN  27           H        GLN  27   0.254  13.970 -25.687
  252    HA   GLN  27           HA       GLN  27   1.267  13.454 -28.378
  253    HB2  GLN  27           2HB      GLN  27  -0.788  12.314 -27.085
  254    HB3  GLN  27           3HB      GLN  27  -1.650  13.640 -27.855
  255    HG2  GLN  27           2HG      GLN  27  -1.431  12.767 -29.920
  256    HG3  GLN  27           3HG      GLN  27   0.165  12.098 -29.588
  257   HE21  GLN  27          1HE2      GLN  27   0.000  10.337 -27.760
  258   HE22  GLN  27          2HE2      GLN  27  -1.195   9.125 -28.056
  259    H    HIS  28           H        HIS  28   1.733  16.037 -27.321
  260    HA   HIS  28           HA       HIS  28  -0.098  18.006 -27.939
  261    HB2  HIS  28           2HB      HIS  28   2.186  18.266 -26.845
  262    HB3  HIS  28           3HB      HIS  28   2.859  18.281 -28.473
  263    HD1  HIS  28           HD1      HIS  28  -0.069  20.124 -26.868
  264    HD2  HIS  28           HD2      HIS  28   3.325  20.844 -29.153
  265    HE1  HIS  28           HE1      HIS  28  -0.070  22.600 -27.311
  266    H    ALA  29           H        ALA  29  -0.627  19.183 -29.756
  267    HA   ALA  29           HA       ALA  29   0.087  17.917 -32.308
  268    HB1  ALA  29           1HB      ALA  29  -2.001  18.315 -33.034
  269    HB2  ALA  29           2HB      ALA  29  -2.372  18.492 -31.318
  270    HB3  ALA  29           3HB      ALA  29  -2.059  19.920 -32.305
  271    H    PHE  30           H        PHE  30   1.994  18.907 -32.853
  272    HA   PHE  30           HA       PHE  30   2.671  21.577 -32.516
  273    HB2  PHE  30           2HB      PHE  30   4.165  19.643 -33.252
  274    HB3  PHE  30           3HB      PHE  30   3.555  19.925 -34.879
  275    HD1  PHE  30           HD1      PHE  30   4.124  21.964 -36.085
  276    HD2  PHE  30           HD2      PHE  30   5.703  21.160 -32.215
  277    HE1  PHE  30           HE1      PHE  30   5.830  23.704 -36.423
  278    HE2  PHE  30           HE2      PHE  30   7.412  22.899 -32.547
  279    HZ   PHE  30           HZ       PHE  30   7.476  24.175 -34.653
  Start of MODEL    2
    1    H1   GLY   1           H        GLY   1  -0.021  10.781  -2.063
    2    HA2  GLY   1           2HA      GLY   1  -0.902  10.180   0.678
    3    HA3  GLY   1           3HA      GLY   1  -1.197  11.684  -0.182
    4    H    ILE   2           H        ILE   2  -3.402  11.708   0.074
    5    HA   ILE   2           HA       ILE   2  -4.978   9.406  -0.723
    6    HB   ILE   2           HB       ILE   2  -6.078  12.111   0.000
    7   HG12  ILE   2          2HG1      ILE   2  -6.236  10.615   2.304
    8   HG13  ILE   2          3HG1      ILE   2  -4.640  10.193   1.692
    9   HG21  ILE   2          1HG2      ILE   2  -7.821  10.800  -0.752
   10   HG22  ILE   2          2HG2      ILE   2  -7.118   9.314  -0.113
   11   HG23  ILE   2          3HG2      ILE   2  -7.856  10.483   0.982
   12   HD11  ILE   2          3HD1      ILE   2  -4.378  12.776   1.444
   13   HD12  ILE   2          1HD1      ILE   2  -5.678  12.816   2.635
   14   HD13  ILE   2          2HD1      ILE   2  -4.161  11.998   3.012
   15    H    ARG   3           H        ARG   3  -6.734   9.601  -2.283
   16    HA   ARG   3           HA       ARG   3  -5.867  10.536  -4.774
   17    HB2  ARG   3           2HB      ARG   3  -7.834   8.861  -3.948
   18    HB3  ARG   3           3HB      ARG   3  -8.785  10.268  -4.405
   19    HG2  ARG   3           2HG      ARG   3  -8.758   9.200  -6.400
   20    HG3  ARG   3           3HG      ARG   3  -7.261  10.118  -6.571
   21    HD2  ARG   3           2HD      ARG   3  -6.350   8.123  -7.047
   22    HD3  ARG   3           3HD      ARG   3  -6.376   7.887  -5.300
   23    HE   ARG   3           HE       ARG   3  -8.013   6.310  -5.571
   24   HH11  ARG   3          1HH1      ARG   3  -7.719   8.170  -8.499
   25   HH12  ARG   3          2HH1      ARG   3  -8.780   7.147  -9.410
   26   HH21  ARG   3          1HH2      ARG   3  -9.412   4.956  -6.759
   27   HH22  ARG   3          2HH2      ARG   3  -9.743   5.320  -8.419
   28    H    CYS   4           H        CYS   4  -8.490  11.811  -2.717
   29    HA   CYS   4           HA       CYS   4  -8.295  14.356  -4.174
   30    HB2  CYS   4           2HB      CYS   4 -10.511  12.933  -2.787
   31    HB3  CYS   4           3HB      CYS   4 -10.530  14.693  -2.752
   32    HA   PRO   5           HA       PRO   5  -6.723  16.549  -0.715
   33    HB2  PRO   5           2HB      PRO   5  -8.085  18.894  -0.837
   34    HB3  PRO   5           3HB      PRO   5  -6.824  18.454  -1.995
   35    HG2  PRO   5           2HG      PRO   5  -9.799  18.267  -2.271
   36    HG3  PRO   5           3HG      PRO   5  -8.599  18.829  -3.450
   37    HD2  PRO   5           2HD      PRO   5  -9.683  16.349  -3.543
   38    HD3  PRO   5           3HD      PRO   5  -8.022  16.686  -4.071
   39    H    LYS   6           H        LYS   6  -7.812  14.940   0.735
   40    HA   LYS   6           HA       LYS   6  -9.100  14.393   2.534
   41    HB2  LYS   6           2HB      LYS   6  -9.212  17.383   2.960
   42    HB3  LYS   6           3HB      LYS   6  -9.413  16.134   4.181
   43    HG2  LYS   6           2HG      LYS   6  -7.084  15.447   3.851
   44    HG3  LYS   6           3HG      LYS   6  -6.888  16.724   2.649
   45    HD2  LYS   6           2HD      LYS   6  -7.190  18.424   4.276
   46    HD3  LYS   6           3HD      LYS   6  -7.755  17.265   5.481
   47    HE2  LYS   6           2HE      LYS   6  -5.449  16.186   5.262
   48    HE3  LYS   6           3HE      LYS   6  -4.973  17.659   4.418
   49    HZ1  LYS   6           3HZ      LYS   6  -6.325  18.007   6.971
   50    HZ2  LYS   6           1HZ      LYS   6  -5.029  18.867   6.305
   51    HZ3  LYS   6           2HZ      LYS   6  -4.761  17.366   7.037
   52    H    SER   7           H        SER   7 -10.720  13.873   0.739
   53    HA   SER   7           HA       SER   7 -13.294  14.514   1.603
   54    HB2  SER   7           2HB      SER   7 -13.965  15.788  -0.570
   55    HB3  SER   7           3HB      SER   7 -13.211  16.686   0.748
   56    HG   SER   7           HG       SER   7 -11.557  15.552  -1.201
   57    H    TRP   8           H        TRP   8 -14.316  12.695   1.136
   58    HA   TRP   8           HA       TRP   8 -13.454  11.029  -1.062
   59    HB2  TRP   8           2HB      TRP   8 -15.407  10.714   1.195
   60    HB3  TRP   8           3HB      TRP   8 -15.438   9.592  -0.162
   61    HD1  TRP   8           HD1      TRP   8 -12.088  10.916   1.093
   62    HE1  TRP   8           HE1      TRP   8 -10.781   8.978   2.169
   63    HE3  TRP   8           HE3      TRP   8 -15.753   7.351   1.064
   64    HZ2  TRP   8           HZ2      TRP   8 -11.242   6.292   2.907
   65    HZ3  TRP   8           HZ3      TRP   8 -15.238   5.124   1.973
   66    HH2  TRP   8           HH2      TRP   8 -13.028   4.607   2.874
   67    H    LYS   9           H        LYS   9 -14.140  12.937  -2.518
   68    HA   LYS   9           HA       LYS   9 -16.899  12.425  -3.414
   69    HB2  LYS   9           2HB      LYS   9 -15.437  15.062  -3.269
   70    HB3  LYS   9           3HB      LYS   9 -16.906  14.829  -4.208
   71    HG2  LYS   9           2HG      LYS   9 -17.781  13.901  -1.877
   72    HG3  LYS   9           3HG      LYS   9 -16.527  14.988  -1.277
   73    HD2  LYS   9           2HD      LYS   9 -17.699  16.824  -1.823
   74    HD3  LYS   9           3HD      LYS   9 -18.204  16.152  -3.375
   75    HE2  LYS   9           2HE      LYS   9 -19.680  14.625  -1.757
   76    HE3  LYS   9           3HE      LYS   9 -19.532  16.048  -0.727
   77    HZ1  LYS   9           3HZ      LYS   9 -21.333  15.700  -2.749
   78    HZ2  LYS   9           1HZ      LYS   9 -20.174  16.731  -3.425
   79    HZ3  LYS   9           2HZ      LYS   9 -20.958  17.165  -1.991
   80    H    CYS  10           H        CYS  10 -14.204  14.352  -4.707
   81    HA   CYS  10           HA       CYS  10 -13.247  14.401  -6.775
   82    HB2  CYS  10           2HB      CYS  10 -13.581  11.400  -6.720
   83    HB3  CYS  10           3HB      CYS  10 -12.347  12.329  -7.566
   84    H    LYS  11           H        LYS  11 -15.259  15.413  -7.552
   85    HA   LYS  11           HA       LYS  11 -17.394  14.122  -8.726
   86    HB2  LYS  11           2HB      LYS  11 -16.313  16.765  -8.711
   87    HB3  LYS  11           3HB      LYS  11 -16.753  16.358 -10.364
   88    HG2  LYS  11           2HG      LYS  11 -19.011  15.771  -9.605
   89    HG3  LYS  11           3HG      LYS  11 -18.563  16.229  -7.960
   90    HD2  LYS  11           2HD      LYS  11 -17.895  18.341  -9.789
   91    HD3  LYS  11           3HD      LYS  11 -19.588  17.882  -9.987
   92    HE2  LYS  11           2HE      LYS  11 -19.616  17.969  -7.378
   93    HE3  LYS  11           3HE      LYS  11 -18.181  18.972  -7.586
   94    HZ1  LYS  11           3HZ      LYS  11 -19.767  20.570  -7.660
   95    HZ2  LYS  11           1HZ      LYS  11 -20.962  19.540  -8.271
   96    HZ3  LYS  11           2HZ      LYS  11 -19.773  20.161  -9.301
   97    H    ALA  12           H        ALA  12 -17.912  13.644 -10.932
   98    HA   ALA  12           HA       ALA  12 -16.124  12.008 -12.248
   99    HB1  ALA  12           1HB      ALA  12 -17.625  12.091 -14.150
  100    HB2  ALA  12           2HB      ALA  12 -18.549  12.020 -12.649
  101    HB3  ALA  12           3HB      ALA  12 -18.387  13.549 -13.512
  102    H    PHE  13           H        PHE  13 -16.769  15.447 -12.793
  103    HA   PHE  13           HA       PHE  13 -15.234  15.821 -15.083
  104    HB2  PHE  13           2HB      PHE  13 -16.801  17.470 -13.874
  105    HB3  PHE  13           3HB      PHE  13 -15.398  17.878 -12.892
  106    HD1  PHE  13           HD1      PHE  13 -16.668  17.787 -16.366
  107    HD2  PHE  13           HD2      PHE  13 -13.760  19.352 -13.682
  108    HE1  PHE  13           HE1      PHE  13 -15.921  19.363 -18.101
  109    HE2  PHE  13           HE2      PHE  13 -13.008  20.932 -15.413
  110    HZ   PHE  13           HZ       PHE  13 -14.089  20.939 -17.625
  111    H    LYS  14           H        LYS  14 -14.226  16.631 -11.757
  112    HA   LYS  14           HA       LYS  14 -11.547  17.091 -12.304
  113    HB2  LYS  14           2HB      LYS  14 -12.603  17.681 -10.174
  114    HB3  LYS  14           3HB      LYS  14 -12.772  15.977  -9.773
  115    HG2  LYS  14           2HG      LYS  14 -10.652  15.804  -9.084
  116    HG3  LYS  14           3HG      LYS  14 -10.035  16.789 -10.412
  117    HD2  LYS  14           2HD      LYS  14  -9.583  18.103  -8.554
  118    HD3  LYS  14           3HD      LYS  14 -11.118  18.762  -9.125
  119    HE2  LYS  14           2HE      LYS  14 -11.377  16.540  -7.229
  120    HE3  LYS  14           3HE      LYS  14 -10.602  17.977  -6.565
  121    HZ1  LYS  14           3HZ      LYS  14 -13.276  17.584  -6.790
  122    HZ2  LYS  14           1HZ      LYS  14 -12.937  18.577  -8.118
  123    HZ3  LYS  14           2HZ      LYS  14 -12.521  19.080  -6.558
  124    H    GLN  15           H        GLN  15 -13.197  14.064 -11.542
  125    HA   GLN  15           HA       GLN  15 -10.989  12.410 -11.204
  126    HB2  GLN  15           2HB      GLN  15 -13.781  11.926 -12.188
  127    HB3  GLN  15           3HB      GLN  15 -12.604  10.619 -12.182
  128    HG2  GLN  15           2HG      GLN  15 -12.308  10.844  -9.798
  129    HG3  GLN  15           3HG      GLN  15 -13.390  12.235  -9.769
  130   HE21  GLN  15          1HE2      GLN  15 -13.510   9.589  -8.433
  131   HE22  GLN  15          2HE2      GLN  15 -15.054   8.940  -8.856
  132    H    ARG  16           H        ARG  16 -12.671  13.352 -14.175
  133    HA   ARG  16           HA       ARG  16 -11.029  11.740 -15.873
  134    HB2  ARG  16           2HB      ARG  16 -13.095  13.861 -16.301
  135    HB3  ARG  16           3HB      ARG  16 -12.062  13.386 -17.642
  136    HG2  ARG  16           2HG      ARG  16 -12.909  11.219 -17.689
  137    HG3  ARG  16           3HG      ARG  16 -13.566  11.342 -16.056
  138    HD2  ARG  16           2HD      ARG  16 -15.517  12.012 -16.875
  139    HD3  ARG  16           3HD      ARG  16 -14.733  13.387 -17.651
  140    HE   ARG  16           HE       ARG  16 -14.875  12.289 -19.651
  141   HH11  ARG  16          1HH1      ARG  16 -15.362  10.007 -17.068
  142   HH12  ARG  16          2HH1      ARG  16 -15.802   8.706 -18.124
  143   HH21  ARG  16          1HH2      ARG  16 -15.454  10.585 -21.053
  144   HH22  ARG  16          2HH2      ARG  16 -15.854   9.036 -20.391
  145    H    VAL  17           H        VAL  17 -11.137  15.193 -15.063
  146    HA   VAL  17           HA       VAL  17  -9.191  16.157 -16.763
  147    HB   VAL  17           HB       VAL  17  -9.680  17.012 -13.906
  148   HG11  VAL  17          1HG1      VAL  17  -7.692  18.056 -14.407
  149   HG12  VAL  17          2HG1      VAL  17  -8.060  18.169 -16.130
  150   HG13  VAL  17          3HG1      VAL  17  -8.857  19.248 -14.984
  151   HG21  VAL  17          3HG2      VAL  17 -11.282  17.223 -16.268
  152   HG22  VAL  17          1HG2      VAL  17 -11.632  17.783 -14.632
  153   HG23  VAL  17          2HG2      VAL  17 -10.772  18.833 -15.759
  154    H    LEU  18           H        LEU  18  -8.788  14.560 -13.635
  155    HA   LEU  18           HA       LEU  18  -6.094  14.963 -13.200
  156    HB2  LEU  18           2HB      LEU  18  -7.673  13.844 -11.650
  157    HB3  LEU  18           3HB      LEU  18  -7.611  12.412 -12.674
  158    HG   LEU  18           HG       LEU  18  -5.090  12.415 -12.197
  159   HD11  LEU  18          1HD1      LEU  18  -4.784  14.574 -11.270
  160   HD12  LEU  18          2HD1      LEU  18  -4.566  13.422  -9.953
  161   HD13  LEU  18          3HD1      LEU  18  -6.073  14.327 -10.092
  162   HD21  LEU  18          3HD2      LEU  18  -6.449  11.879  -9.647
  163   HD22  LEU  18          1HD2      LEU  18  -5.485  10.813 -10.670
  164   HD23  LEU  18          2HD2      LEU  18  -7.178  11.118 -11.062
  165    H    LYS  19           H        LYS  19  -7.656  12.501 -15.207
  166    HA   LYS  19           HA       LYS  19  -5.118  11.366 -16.007
  167    HB2  LYS  19           2HB      LYS  19  -7.986  10.738 -16.453
  168    HB3  LYS  19           3HB      LYS  19  -6.857  10.214 -17.695
  169    HG2  LYS  19           2HG      LYS  19  -6.811   8.371 -16.382
  170    HG3  LYS  19           3HG      LYS  19  -5.544   9.301 -15.577
  171    HD2  LYS  19           2HD      LYS  19  -7.035  10.006 -13.864
  172    HD3  LYS  19           3HD      LYS  19  -8.438   9.394 -14.744
  173    HE2  LYS  19           2HE      LYS  19  -7.321   7.099 -14.550
  174    HE3  LYS  19           3HE      LYS  19  -6.278   7.847 -13.342
  175    HZ1  LYS  19           3HZ      LYS  19  -8.361   6.680 -12.524
  176    HZ2  LYS  19           1HZ      LYS  19  -9.224   7.995 -13.148
  177    HZ3  LYS  19           2HZ      LYS  19  -8.075   8.238 -11.930
  178    H    ARG  20           H        ARG  20  -7.540  13.542 -17.314
  179    HA   ARG  20           HA       ARG  20  -6.823  13.604 -19.984
  180    HB2  ARG  20           2HB      ARG  20  -8.673  14.892 -18.605
  181    HB3  ARG  20           3HB      ARG  20  -7.469  16.174 -18.605
  182    HG2  ARG  20           2HG      ARG  20  -8.827  16.627 -20.448
  183    HG3  ARG  20           3HG      ARG  20  -7.386  15.872 -21.132
  184    HD2  ARG  20           2HD      ARG  20  -9.569  14.036 -20.392
  185    HD3  ARG  20           3HD      ARG  20  -9.914  15.133 -21.729
  186    HE   ARG  20           HE       ARG  20  -8.081  12.913 -21.730
  187   HH11  ARG  20          1HH1      ARG  20  -8.935  15.939 -23.226
  188   HH12  ARG  20          2HH1      ARG  20  -8.161  15.563 -24.730
  189   HH21  ARG  20          1HH2      ARG  20  -7.059  12.407 -23.706
  190   HH22  ARG  20          2HH2      ARG  20  -7.095  13.554 -25.002
  191    H    LEU  21           H        LEU  21  -5.430  15.425 -17.278
  192    HA   LEU  21           HA       LEU  21  -3.672  17.046 -18.674
  193    HB2  LEU  21           2HB      LEU  21  -3.941  16.061 -15.948
  194    HB3  LEU  21           3HB      LEU  21  -2.265  16.359 -16.404
  195    HG   LEU  21           HG       LEU  21  -3.295  18.277 -15.262
  196   HD11  LEU  21          1HD1      LEU  21  -2.729  19.980 -17.006
  197   HD12  LEU  21          2HD1      LEU  21  -2.535  18.654 -18.151
  198   HD13  LEU  21          3HD1      LEU  21  -1.488  18.757 -16.735
  199   HD21  LEU  21          3HD2      LEU  21  -5.102  18.406 -17.674
  200   HD22  LEU  21          1HD2      LEU  21  -5.032  19.573 -16.354
  201   HD23  LEU  21          2HD2      LEU  21  -5.596  17.929 -16.049
  202    H    LEU  22           H        LEU  22  -3.401  13.657 -17.832
  203    HA   LEU  22           HA       LEU  22  -0.641  13.437 -18.590
  204    HB2  LEU  22           2HB      LEU  22  -2.797  11.499 -17.857
  205    HB3  LEU  22           3HB      LEU  22  -1.287  10.922 -18.559
  206    HG   LEU  22           HG       LEU  22  -0.759  12.700 -16.354
  207   HD11  LEU  22          1HD1      LEU  22  -2.519  12.181 -15.058
  208   HD12  LEU  22          2HD1      LEU  22  -1.643  10.674 -14.793
  209   HD13  LEU  22          3HD1      LEU  22  -2.926  10.747 -16.001
  210   HD21  LEU  22          3HD2      LEU  22   0.862  11.146 -17.223
  211   HD22  LEU  22          1HD2      LEU  22  -0.206   9.784 -16.885
  212   HD23  LEU  22          2HD2      LEU  22   0.485  10.712 -15.554
  213    H    ALA  23           H        ALA  23  -3.658  12.153 -19.998
  214    HA   ALA  23           HA       ALA  23  -2.634  11.109 -22.332
  215    HB1  ALA  23           1HB      ALA  23  -5.295  12.467 -21.926
  216    HB2  ALA  23           2HB      ALA  23  -4.878  11.437 -23.296
  217    HB3  ALA  23           3HB      ALA  23  -4.933  10.760 -21.669
  218    H    MET  24           H        MET  24  -3.527  14.455 -21.629
  219    HA   MET  24           HA       MET  24  -3.027  15.370 -24.300
  220    HB2  MET  24           2HB      MET  24  -4.616  16.483 -22.734
  221    HB3  MET  24           3HB      MET  24  -3.245  16.987 -21.755
  222    HG2  MET  24           2HG      MET  24  -2.365  18.211 -23.732
  223    HG3  MET  24           3HG      MET  24  -3.854  17.807 -24.583
  224    HE1  MET  24           3HE      MET  24  -2.704  21.259 -22.655
  225    HE2  MET  24           1HE      MET  24  -2.394  20.336 -24.126
  226    HE3  MET  24           2HE      MET  24  -3.753  21.459 -24.060
  227    H    LEU  25           H        LEU  25  -1.260  15.431 -21.234
  228    HA   LEU  25           HA       LEU  25   0.877  17.035 -21.918
  229    HB2  LEU  25           2HB      LEU  25   0.687  16.319 -19.683
  230    HB3  LEU  25           3HB      LEU  25   0.689  14.618 -20.146
  231    HG   LEU  25           HG       LEU  25   3.081  14.887 -20.821
  232   HD11  LEU  25          1HD1      LEU  25   3.827  17.094 -19.290
  233   HD12  LEU  25          2HD1      LEU  25   2.463  17.644 -20.263
  234   HD13  LEU  25          3HD1      LEU  25   3.880  16.945 -21.047
  235   HD21  LEU  25          3HD2      LEU  25   2.516  15.578 -17.942
  236   HD22  LEU  25          1HD2      LEU  25   3.936  14.751 -18.582
  237   HD23  LEU  25          2HD2      LEU  25   2.360  13.962 -18.633
  238    H    ARG  26           H        ARG  26   0.644  13.500 -22.303
  239    HA   ARG  26           HA       ARG  26   3.128  13.200 -23.606
  240    HB2  ARG  26           2HB      ARG  26   0.649  11.482 -23.559
  241    HB3  ARG  26           3HB      ARG  26   2.124  11.003 -24.387
  242    HG2  ARG  26           2HG      ARG  26   3.198  11.523 -22.034
  243    HG3  ARG  26           3HG      ARG  26   1.553  11.200 -21.483
  244    HD2  ARG  26           2HD      ARG  26   1.839   9.105 -23.087
  245    HD3  ARG  26           3HD      ARG  26   3.542   9.377 -22.723
  246    HE   ARG  26           HE       ARG  26   1.532   8.357 -20.945
  247   HH11  ARG  26          1HH1      ARG  26   4.584  10.019 -21.154
  248   HH12  ARG  26          2HH1      ARG  26   5.096   9.550 -19.567
  249   HH21  ARG  26          1HH2      ARG  26   2.195   7.733 -18.853
  250   HH22  ARG  26          2HH2      ARG  26   3.737   8.250 -18.259
  251    H    GLN  27           H        GLN  27  -0.014  14.150 -24.726
  252    HA   GLN  27           HA       GLN  27   0.769  13.842 -27.524
  253    HB2  GLN  27           2HB      GLN  27  -1.846  14.616 -26.229
  254    HB3  GLN  27           3HB      GLN  27  -1.590  14.593 -27.969
  255    HG2  GLN  27           2HG      GLN  27  -1.080  12.201 -27.854
  256    HG3  GLN  27           3HG      GLN  27  -1.368  12.232 -26.115
  257   HE21  GLN  27          1HE2      GLN  27  -3.074  10.837 -26.115
  258   HE22  GLN  27          2HE2      GLN  27  -4.606  11.204 -26.823
  259    H    HIS  28           H        HIS  28   1.957  15.847 -25.672
  260    HA   HIS  28           HA       HIS  28   1.047  18.423 -26.056
  261    HB2  HIS  28           2HB      HIS  28   2.922  17.808 -24.565
  262    HB3  HIS  28           3HB      HIS  28   3.938  17.532 -25.977
  263    HD1  HIS  28           HD1      HIS  28   5.356  19.454 -26.592
  264    HD2  HIS  28           HD2      HIS  28   1.939  20.652 -24.554
  265    HE1  HIS  28           HE1      HIS  28   5.574  21.945 -26.320
  266    H    ALA  29           H        ALA  29   1.568  20.080 -27.536
  267    HA   ALA  29           HA       ALA  29   2.572  19.146 -30.144
  268    HB1  ALA  29           1HB      ALA  29   0.763  21.285 -30.565
  269    HB2  ALA  29           2HB      ALA  29   0.621  19.607 -31.090
  270    HB3  ALA  29           3HB      ALA  29  -0.033  20.100 -29.529
  271    H    PHE  30           H        PHE  30   3.482  20.827 -31.506
  272    HA   PHE  30           HA       PHE  30   5.340  22.431 -30.194
  273    HB2  PHE  30           2HB      PHE  30   5.349  21.630 -32.626
  274    HB3  PHE  30           3HB      PHE  30   4.314  23.012 -32.968
  275    HD1  PHE  30           HD2      PHE  30   7.665  21.960 -31.894
  276    HD2  PHE  30           HD1      PHE  30   5.186  25.232 -33.018
  277    HE1  PHE  30           HE2      PHE  30   9.655  23.390 -32.110
  278    HE2  PHE  30           HE1      PHE  30   7.173  26.667 -33.237
  279    HZ   PHE  30           HZ       PHE  30   9.411  25.746 -32.781
  Start of MODEL    3
    1    H1   GLY   1           H        GLY   1  -9.226   5.119  -5.732
    2    HA2  GLY   1           2HA      GLY   1  -7.019   4.217  -5.465
    3    HA3  GLY   1           3HA      GLY   1  -6.672   4.676  -7.126
    4    H    ILE   2           H        ILE   2  -7.920   7.340  -6.731
    5    HA   ILE   2           HA       ILE   2  -5.565   8.637  -5.639
    6    HB   ILE   2           HB       ILE   2  -7.988  10.046  -6.730
    7   HG12  ILE   2          2HG1      ILE   2  -7.353   8.382  -8.393
    8   HG13  ILE   2          3HG1      ILE   2  -6.887   9.987  -8.946
    9   HG21  ILE   2          1HG2      ILE   2  -5.167  10.742  -6.131
   10   HG22  ILE   2          2HG2      ILE   2  -5.930  11.519  -7.517
   11   HG23  ILE   2          3HG2      ILE   2  -6.639  11.688  -5.911
   12   HD11  ILE   2          3HD1      ILE   2  -5.166   7.740  -8.003
   13   HD12  ILE   2          1HD1      ILE   2  -5.053   8.696  -9.480
   14   HD13  ILE   2          2HD1      ILE   2  -4.586   9.404  -7.933
   15    H    ARG   3           H        ARG   3  -5.744  10.439  -4.131
   16    HA   ARG   3           HA       ARG   3  -7.927  10.028  -2.194
   17    HB2  ARG   3           2HB      ARG   3  -5.075  10.015  -1.862
   18    HB3  ARG   3           3HB      ARG   3  -5.764  11.337  -0.929
   19    HG2  ARG   3           2HG      ARG   3  -6.946   9.933   0.450
   20    HG3  ARG   3           3HG      ARG   3  -6.997   8.633  -0.742
   21    HD2  ARG   3           2HD      ARG   3  -5.494   7.901   0.912
   22    HD3  ARG   3           3HD      ARG   3  -4.484   8.449  -0.425
   23    HE   ARG   3           HE       ARG   3  -4.889  10.560   1.401
   24   HH11  ARG   3          1HH1      ARG   3  -3.181   7.545   1.065
   25   HH12  ARG   3          2HH1      ARG   3  -1.895   8.003   2.131
   26   HH21  ARG   3          1HH2      ARG   3  -3.201  11.176   2.808
   27   HH22  ARG   3          2HH2      ARG   3  -1.908  10.069   3.123
   28    H    CYS   4           H        CYS   4  -9.256  11.685  -1.901
   29    HA   CYS   4           HA       CYS   4  -8.666  14.245  -3.110
   30    HB2  CYS   4           2HB      CYS   4 -11.066  12.930  -1.938
   31    HB3  CYS   4           3HB      CYS   4 -11.028  14.690  -1.947
   32    HA   PRO   5           HA       PRO   5  -7.401  16.480   0.447
   33    HB2  PRO   5           2HB      PRO   5  -8.662  18.862   0.124
   34    HB3  PRO   5           3HB      PRO   5  -7.300  18.353  -0.881
   35    HG2  PRO   5           2HG      PRO   5 -10.232  18.251  -1.474
   36    HG3  PRO   5           3HG      PRO   5  -8.894  18.743  -2.528
   37    HD2  PRO   5           2HD      PRO   5 -10.045  16.297  -2.680
   38    HD3  PRO   5           3HD      PRO   5  -8.326  16.567  -3.033
   39    H    LYS   6           H        LYS   6  -8.694  14.946   1.808
   40    HA   LYS   6           HA       LYS   6 -10.186  14.488   3.469
   41    HB2  LYS   6           2HB      LYS   6  -9.802  17.460   3.714
   42    HB3  LYS   6           3HB      LYS   6 -10.863  16.591   4.814
   43    HG2  LYS   6           2HG      LYS   6  -9.093  16.159   6.069
   44    HG3  LYS   6           3HG      LYS   6  -8.485  15.127   4.772
   45    HD2  LYS   6           2HD      LYS   6  -7.656  17.430   3.792
   46    HD3  LYS   6           3HD      LYS   6  -7.752  17.927   5.483
   47    HE2  LYS   6           2HE      LYS   6  -6.488  15.393   5.400
   48    HE3  LYS   6           3HE      LYS   6  -5.727  16.407   4.175
   49    HZ1  LYS   6           3HZ      LYS   6  -5.047  16.423   6.754
   50    HZ2  LYS   6           1HZ      LYS   6  -6.176  17.683   6.737
   51    HZ3  LYS   6           2HZ      LYS   6  -4.827  17.742   5.719
   52    H    SER   7           H        SER   7 -11.620  13.970   1.522
   53    HA   SER   7           HA       SER   7 -14.248  14.713   2.086
   54    HB2  SER   7           2HB      SER   7 -14.638  15.949  -0.176
   55    HB3  SER   7           3HB      SER   7 -14.001  16.858   1.194
   56    HG   SER   7           HG       SER   7 -12.577  17.374  -0.312
   57    H    TRP   8           H        TRP   8 -15.275  12.915   1.553
   58    HA   TRP   8           HA       TRP   8 -14.238  11.164  -0.498
   59    HB2  TRP   8           2HB      TRP   8 -16.432  10.971   1.540
   60    HB3  TRP   8           3HB      TRP   8 -16.354   9.815   0.214
   61    HD1  TRP   8           HD1      TRP   8 -13.238  11.148   2.039
   62    HE1  TRP   8           HE1      TRP   8 -12.073   9.169   3.199
   63    HE3  TRP   8           HE3      TRP   8 -16.705   7.507   1.111
   64    HZ2  TRP   8           HZ2      TRP   8 -12.558   6.426   3.660
   65    HZ3  TRP   8           HZ3      TRP   8 -16.279   5.232   1.946
   66    HH2  TRP   8           HH2      TRP   8 -14.247   4.705   3.193
   67    H    LYS   9           H        LYS   9 -14.699  13.053  -2.064
   68    HA   LYS   9           HA       LYS   9 -17.361  12.603  -3.242
   69    HB2  LYS   9           2HB      LYS   9 -15.856  15.184  -2.883
   70    HB3  LYS   9           3HB      LYS   9 -17.090  15.010  -4.124
   71    HG2  LYS   9           2HG      LYS   9 -18.675  14.321  -2.296
   72    HG3  LYS   9           3HG      LYS   9 -17.431  14.815  -1.145
   73    HD2  LYS   9           2HD      LYS   9 -18.128  16.762  -3.260
   74    HD3  LYS   9           3HD      LYS   9 -19.356  16.462  -2.028
   75    HE2  LYS   9           2HE      LYS   9 -18.269  17.913  -0.737
   76    HE3  LYS   9           3HE      LYS   9 -16.986  16.712  -0.601
   77    HZ1  LYS   9           3HZ      LYS   9 -16.895  18.328  -2.999
   78    HZ2  LYS   9           1HZ      LYS   9 -15.648  17.872  -1.951
   79    HZ3  LYS   9           2HZ      LYS   9 -16.641  19.185  -1.563
   80    H    CYS  10           H        CYS  10 -14.480  14.411  -4.280
   81    HA   CYS  10           HA       CYS  10 -13.306  14.374  -6.233
   82    HB2  CYS  10           2HB      CYS  10 -13.743  11.388  -6.144
   83    HB3  CYS  10           3HB      CYS  10 -12.396  12.255  -6.874
   84    H    LYS  11           H        LYS  11 -15.119  15.437  -7.299
   85    HA   LYS  11           HA       LYS  11 -17.197  14.217  -8.638
   86    HB2  LYS  11           2HB      LYS  11 -15.601  16.691  -9.260
   87    HB3  LYS  11           3HB      LYS  11 -16.943  16.187 -10.280
   88    HG2  LYS  11           2HG      LYS  11 -18.497  16.437  -8.499
   89    HG3  LYS  11           3HG      LYS  11 -17.201  16.661  -7.321
   90    HD2  LYS  11           2HD      LYS  11 -16.861  18.585  -9.384
   91    HD3  LYS  11           3HD      LYS  11 -18.551  18.624  -8.874
   92    HE2  LYS  11           2HE      LYS  11 -18.041  19.331  -6.768
   93    HE3  LYS  11           3HE      LYS  11 -16.479  18.515  -6.753
   94    HZ1  LYS  11           3HZ      LYS  11 -16.734  20.697  -8.646
   95    HZ2  LYS  11           1HZ      LYS  11 -15.446  20.290  -7.627
   96    HZ3  LYS  11           2HZ      LYS  11 -16.770  21.147  -7.016
   97    H    ALA  12           H        ALA  12 -17.432  13.062 -10.466
   98    HA   ALA  12           HA       ALA  12 -15.358  11.646 -11.605
   99    HB1  ALA  12           1HB      ALA  12 -16.947  10.669 -12.854
  100    HB2  ALA  12           2HB      ALA  12 -18.059  11.613 -11.861
  101    HB3  ALA  12           3HB      ALA  12 -17.571  12.208 -13.448
  102    H    PHE  13           H        PHE  13 -16.828  14.668 -12.740
  103    HA   PHE  13           HA       PHE  13 -15.462  14.946 -15.141
  104    HB2  PHE  13           2HB      PHE  13 -17.354  16.391 -14.156
  105    HB3  PHE  13           3HB      PHE  13 -16.071  17.291 -13.354
  106    HD1  PHE  13           HD2      PHE  13 -14.420  18.542 -14.686
  107    HD2  PHE  13           HD1      PHE  13 -17.770  16.628 -16.482
  108    HE1  PHE  13           HE2      PHE  13 -14.096  19.891 -16.718
  109    HE2  PHE  13           HE1      PHE  13 -17.452  17.973 -18.518
  110    HZ   PHE  13           HZ       PHE  13 -15.613  19.608 -18.637
  111    H    LYS  14           H        LYS  14 -14.608  16.560 -12.074
  112    HA   LYS  14           HA       LYS  14 -12.124  17.515 -12.877
  113    HB2  LYS  14           2HB      LYS  14 -13.300  18.219 -10.818
  114    HB3  LYS  14           3HB      LYS  14 -12.946  16.655 -10.096
  115    HG2  LYS  14           2HG      LYS  14 -10.467  17.331 -10.676
  116    HG3  LYS  14           3HG      LYS  14 -11.147  18.958 -10.618
  117    HD2  LYS  14           2HD      LYS  14 -11.762  17.061  -8.402
  118    HD3  LYS  14           3HD      LYS  14 -10.168  17.818  -8.457
  119    HE2  LYS  14           2HE      LYS  14 -11.049  19.621  -7.503
  120    HE3  LYS  14           3HE      LYS  14 -12.021  19.866  -8.953
  121    HZ1  LYS  14           3HZ      LYS  14 -13.405  19.783  -6.985
  122    HZ2  LYS  14           1HZ      LYS  14 -12.808  18.251  -6.588
  123    HZ3  LYS  14           2HZ      LYS  14 -13.739  18.460  -7.984
  124    H    GLN  15           H        GLN  15 -12.958  14.444 -11.312
  125    HA   GLN  15           HA       GLN  15 -10.414  13.440 -10.887
  126    HB2  GLN  15           2HB      GLN  15 -13.050  12.131 -11.470
  127    HB3  GLN  15           3HB      GLN  15 -11.594  11.158 -11.308
  128    HG2  GLN  15           2HG      GLN  15 -11.988  13.092  -9.151
  129    HG3  GLN  15           3HG      GLN  15 -13.247  11.864  -9.269
  130   HE21  GLN  15          1HE2      GLN  15 -12.142   9.610  -9.837
  131   HE22  GLN  15          2HE2      GLN  15 -10.887   9.167  -8.736
  132    H    ARG  16           H        ARG  16 -12.337  13.492 -13.833
  133    HA   ARG  16           HA       ARG  16 -10.554  11.832 -15.330
  134    HB2  ARG  16           2HB      ARG  16 -13.072  13.209 -15.774
  135    HB3  ARG  16           3HB      ARG  16 -11.995  13.370 -17.155
  136    HG2  ARG  16           2HG      ARG  16 -12.200  11.213 -17.728
  137    HG3  ARG  16           3HG      ARG  16 -12.182  10.659 -16.053
  138    HD2  ARG  16           2HD      ARG  16 -14.394  10.457 -16.053
  139    HD3  ARG  16           3HD      ARG  16 -14.580  12.141 -16.544
  140    HE   ARG  16           HE       ARG  16 -13.890  10.574 -18.780
  141   HH11  ARG  16          1HH1      ARG  16 -16.542  11.165 -16.604
  142   HH12  ARG  16          2HH1      ARG  16 -17.758  10.751 -17.766
  143   HH21  ARG  16          1HH2      ARG  16 -15.482  10.025 -20.319
  144   HH22  ARG  16          2HH2      ARG  16 -17.154  10.101 -19.879
  145    H    VAL  17           H        VAL  17 -11.171  15.333 -15.223
  146    HA   VAL  17           HA       VAL  17  -9.397  16.184 -17.156
  147    HB   VAL  17           HB       VAL  17  -9.899  17.597 -14.534
  148   HG11  VAL  17          1HG1      VAL  17  -9.719  19.442 -16.598
  149   HG12  VAL  17          2HG1      VAL  17  -8.490  19.102 -15.378
  150   HG13  VAL  17          3HG1      VAL  17  -8.438  18.279 -16.938
  151   HG21  VAL  17          3HG2      VAL  17 -11.578  18.775 -16.289
  152   HG22  VAL  17          1HG2      VAL  17 -11.622  17.111 -16.872
  153   HG23  VAL  17          2HG2      VAL  17 -12.051  17.471 -15.199
  154    H    LEU  18           H        LEU  18  -8.751  15.374 -13.776
  155    HA   LEU  18           HA       LEU  18  -6.142  16.258 -13.542
  156    HB2  LEU  18           2HB      LEU  18  -7.405  15.389 -11.668
  157    HB3  LEU  18           3HB      LEU  18  -7.406  13.779 -12.385
  158    HG   LEU  18           HG       LEU  18  -4.716  14.406 -12.164
  159   HD11  LEU  18          1HD1      LEU  18  -5.041  16.295 -10.780
  160   HD12  LEU  18          2HD1      LEU  18  -4.556  14.977  -9.713
  161   HD13  LEU  18          3HD1      LEU  18  -6.249  15.462  -9.801
  162   HD21  LEU  18          3HD2      LEU  18  -5.366  12.229 -11.725
  163   HD22  LEU  18          1HD2      LEU  18  -6.638  12.723 -10.607
  164   HD23  LEU  18          2HD2      LEU  18  -4.946  12.826 -10.119
  165    H    LYS  19           H        LYS  19  -7.350  13.242 -14.932
  166    HA   LYS  19           HA       LYS  19  -4.677  12.300 -15.527
  167    HB2  LYS  19           2HB      LYS  19  -6.915  10.953 -14.983
  168    HB3  LYS  19           3HB      LYS  19  -7.082  11.024 -16.733
  169    HG2  LYS  19           2HG      LYS  19  -5.501   9.487 -17.056
  170    HG3  LYS  19           3HG      LYS  19  -4.419  10.219 -15.869
  171    HD2  LYS  19           2HD      LYS  19  -5.359   9.030 -14.099
  172    HD3  LYS  19           3HD      LYS  19  -6.840   8.682 -14.995
  173    HE2  LYS  19           2HE      LYS  19  -5.326   7.332 -16.570
  174    HE3  LYS  19           3HE      LYS  19  -4.126   7.432 -15.283
  175    HZ1  LYS  19           3HZ      LYS  19  -5.540   6.268 -13.814
  176    HZ2  LYS  19           1HZ      LYS  19  -5.562   5.399 -15.266
  177    HZ3  LYS  19           2HZ      LYS  19  -6.868   6.392 -14.854
  178    H    ARG  20           H        ARG  20  -7.385  13.764 -17.220
  179    HA   ARG  20           HA       ARG  20  -6.652  13.346 -19.853
  180    HB2  ARG  20           2HB      ARG  20  -8.024  15.674 -18.520
  181    HB3  ARG  20           3HB      ARG  20  -7.784  15.604 -20.261
  182    HG2  ARG  20           2HG      ARG  20  -9.011  13.220 -19.047
  183    HG3  ARG  20           3HG      ARG  20  -9.979  14.694 -19.006
  184    HD2  ARG  20           2HD      ARG  20  -8.639  13.795 -21.531
  185    HD3  ARG  20           3HD      ARG  20 -10.193  13.120 -21.040
  186    HE   ARG  20           HE       ARG  20  -9.710  15.723 -22.126
  187   HH11  ARG  20          1HH1      ARG  20 -11.797  13.867 -20.048
  188   HH12  ARG  20          2HH1      ARG  20 -13.162  14.910 -20.270
  189   HH21  ARG  20          1HH2      ARG  20 -11.500  17.104 -22.426
  190   HH22  ARG  20          2HH2      ARG  20 -12.993  16.750 -21.623
  191    H    LEU  21           H        LEU  21  -5.586  15.903 -17.639
  192    HA   LEU  21           HA       LEU  21  -4.077  17.426 -19.394
  193    HB2  LEU  21           2HB      LEU  21  -4.218  17.027 -16.509
  194    HB3  LEU  21           3HB      LEU  21  -2.612  17.494 -17.066
  195    HG   LEU  21           HG       LEU  21  -4.767  19.145 -18.160
  196   HD11  LEU  21          1HD1      LEU  21  -4.980  20.411 -15.985
  197   HD12  LEU  21          2HD1      LEU  21  -4.318  18.982 -15.192
  198   HD13  LEU  21          3HD1      LEU  21  -5.841  18.874 -16.076
  199   HD21  LEU  21          3HD2      LEU  21  -2.362  19.966 -16.558
  200   HD22  LEU  21          1HD2      LEU  21  -3.233  20.885 -17.785
  201   HD23  LEU  21          2HD2      LEU  21  -2.249  19.498 -18.255
  202    H    LEU  22           H        LEU  22  -3.307  14.386 -17.835
  203    HA   LEU  22           HA       LEU  22  -0.534  14.426 -18.576
  204    HB2  LEU  22           2HB      LEU  22  -2.383  12.392 -17.397
  205    HB3  LEU  22           3HB      LEU  22  -0.792  11.911 -17.984
  206    HG   LEU  22           HG       LEU  22  -0.916  14.180 -16.073
  207   HD11  LEU  22          1HD1      LEU  22  -2.499  12.538 -15.137
  208   HD12  LEU  22          2HD1      LEU  22  -1.046  12.719 -14.155
  209   HD13  LEU  22          3HD1      LEU  22  -1.233  11.311 -15.201
  210   HD21  LEU  22          3HD2      LEU  22   1.101  12.846 -17.254
  211   HD22  LEU  22          1HD2      LEU  22   0.938  11.908 -15.770
  212   HD23  LEU  22          2HD2      LEU  22   1.241  13.643 -15.686
  213    H    ALA  23           H        ALA  23  -3.301  12.425 -19.614
  214    HA   ALA  23           HA       ALA  23  -2.095  11.061 -21.681
  215    HB1  ALA  23           1HB      ALA  23  -4.464  11.113 -22.717
  216    HB2  ALA  23           2HB      ALA  23  -4.232  10.336 -21.151
  217    HB3  ALA  23           3HB      ALA  23  -4.914  11.960 -21.237
  218    H    MET  24           H        MET  24  -3.494  14.305 -21.712
  219    HA   MET  24           HA       MET  24  -3.096  14.678 -24.527
  220    HB2  MET  24           2HB      MET  24  -4.854  15.850 -23.179
  221    HB3  MET  24           3HB      MET  24  -3.575  16.784 -22.414
  222    HG2  MET  24           2HG      MET  24  -3.129  17.062 -25.146
  223    HG3  MET  24           3HG      MET  24  -4.877  17.176 -24.951
  224    HE1  MET  24           3HE      MET  24  -5.807  19.384 -22.752
  225    HE2  MET  24           1HE      MET  24  -5.558  20.506 -24.090
  226    HE3  MET  24           2HE      MET  24  -6.063  18.848 -24.413
  227    H    LEU  25           H        LEU  25  -1.408  15.675 -21.581
  228    HA   LEU  25           HA       LEU  25   0.474  17.394 -22.637
  229    HB2  LEU  25           2HB      LEU  25   0.382  17.185 -20.303
  230    HB3  LEU  25           3HB      LEU  25   0.596  15.437 -20.368
  231    HG   LEU  25           HG       LEU  25   2.848  17.038 -21.398
  232   HD11  LEU  25          1HD1      LEU  25   2.668  18.472 -19.637
  233   HD12  LEU  25          2HD1      LEU  25   3.563  17.167 -18.859
  234   HD13  LEU  25          3HD1      LEU  25   1.821  17.303 -18.624
  235   HD21  LEU  25          3HD2      LEU  25   3.954  15.152 -20.971
  236   HD22  LEU  25          1HD2      LEU  25   2.384  14.418 -20.648
  237   HD23  LEU  25          2HD2      LEU  25   3.340  15.075 -19.319
  238    H    ARG  26           H        ARG  26   0.775  13.865 -22.244
  239    HA   ARG  26           HA       ARG  26   3.301  13.649 -23.466
  240    HB2  ARG  26           2HB      ARG  26   1.084  11.731 -22.864
  241    HB3  ARG  26           3HB      ARG  26   2.417  11.210 -23.886
  242    HG2  ARG  26           2HG      ARG  26   3.907  12.106 -21.961
  243    HG3  ARG  26           3HG      ARG  26   2.432  11.971 -21.001
  244    HD2  ARG  26           2HD      ARG  26   2.724   9.780 -20.797
  245    HD3  ARG  26           3HD      ARG  26   2.766   9.595 -22.550
  246    HE   ARG  26           HE       ARG  26   5.256  10.480 -21.942
  247   HH11  ARG  26          1HH1      ARG  26   3.282   7.852 -20.796
  248   HH12  ARG  26          2HH1      ARG  26   4.629   6.824 -20.436
  249   HH21  ARG  26          1HH2      ARG  26   7.039   9.136 -21.472
  250   HH22  ARG  26          2HH2      ARG  26   6.766   7.556 -20.820
  251    H    GLN  27           H        GLN  27   0.096  13.911 -24.766
  252    HA   GLN  27           HA       GLN  27   1.001  13.162 -27.441
  253    HB2  GLN  27           2HB      GLN  27  -1.690  13.635 -26.201
  254    HB3  GLN  27           3HB      GLN  27  -1.502  13.660 -27.949
  255    HG2  GLN  27           2HG      GLN  27  -0.204  11.345 -27.165
  256    HG3  GLN  27           3HG      GLN  27  -1.630  11.418 -26.130
  257   HE21  GLN  27          1HE2      GLN  27  -0.659   9.925 -28.697
  258   HE22  GLN  27          2HE2      GLN  27  -2.078   9.925 -29.682
  259    H    HIS  28           H        HIS  28   1.853  15.639 -26.036
  260    HA   HIS  28           HA       HIS  28   0.612  17.936 -26.930
  261    HB2  HIS  28           2HB      HIS  28   2.509  17.905 -25.348
  262    HB3  HIS  28           3HB      HIS  28   3.593  17.481 -26.670
  263    HD1  HIS  28           HD1      HIS  28   4.648  19.385 -27.867
  264    HD2  HIS  28           HD2      HIS  28   1.280  20.554 -25.735
  265    HE1  HIS  28           HE1      HIS  28   4.560  21.890 -28.071
  266    H    ALA  29           H        ALA  29   0.982  19.338 -28.706
  267    HA   ALA  29           HA       ALA  29   2.216  18.081 -31.063
  268    HB1  ALA  29           1HB      ALA  29   0.036  17.724 -31.653
  269    HB2  ALA  29           2HB      ALA  29  -0.552  19.130 -30.766
  270    HB3  ALA  29           3HB      ALA  29   0.270  19.343 -32.312
  271    H    PHE  30           H        PHE  30   3.983  19.341 -31.272
  272    HA   PHE  30           HA       PHE  30   4.132  22.078 -30.657
  273    HB2  PHE  30           2HB      PHE  30   6.097  20.571 -30.860
  274    HB3  PHE  30           3HB      PHE  30   5.853  20.526 -32.603
  275    HD1  PHE  30           HD2      PHE  30   5.937  23.224 -30.021
  276    HD2  PHE  30           HD1      PHE  30   7.413  21.755 -33.733
  277    HE1  PHE  30           HE2      PHE  30   7.326  25.240 -30.262
  278    HE2  PHE  30           HE1      PHE  30   8.806  23.769 -33.980
  279    HZ   PHE  30           HZ       PHE  30   8.763  25.515 -32.244
  Start of MODEL    4
    1    H1   GLY   1           H        GLY   1 -10.808   2.819  -0.659
    2    HA2  GLY   1           2HA      GLY   1 -10.431   2.362  -2.877
    3    HA3  GLY   1           3HA      GLY   1 -11.839   3.352  -3.230
    4    H    ILE   2           H        ILE   2 -11.502   5.712  -3.290
    5    HA   ILE   2           HA       ILE   2  -9.048   6.302  -4.720
    6    HB   ILE   2           HB       ILE   2 -11.251   8.267  -4.147
    7   HG12  ILE   2          2HG1      ILE   2 -11.750   7.330  -6.684
    8   HG13  ILE   2          3HG1      ILE   2 -11.318   5.857  -5.822
    9   HG21  ILE   2          1HG2      ILE   2 -10.415   8.868  -6.592
   10   HG22  ILE   2          2HG2      ILE   2  -9.603   9.474  -5.149
   11   HG23  ILE   2          3HG2      ILE   2  -8.949   8.080  -6.008
   12   HD11  ILE   2          3HD1      ILE   2 -13.211   5.854  -4.627
   13   HD12  ILE   2          1HD1      ILE   2 -13.211   7.605  -4.422
   14   HD13  ILE   2          2HD1      ILE   2 -13.803   6.893  -5.923
   15    H    ARG   3           H        ARG   3  -7.797   8.246  -4.263
   16    HA   ARG   3           HA       ARG   3  -7.715   8.842  -1.378
   17    HB2  ARG   3           2HB      ARG   3  -5.540   8.393  -3.385
   18    HB3  ARG   3           3HB      ARG   3  -5.238   9.445  -2.008
   19    HG2  ARG   3           2HG      ARG   3  -4.908   7.706  -0.679
   20    HG3  ARG   3           3HG      ARG   3  -6.461   7.002  -1.132
   21    HD2  ARG   3           2HD      ARG   3  -5.279   6.229  -3.265
   22    HD3  ARG   3           3HD      ARG   3  -3.779   6.620  -2.426
   23    HE   ARG   3           HE       ARG   3  -5.161   5.013  -0.693
   24   HH11  ARG   3          1HH1      ARG   3  -4.016   4.736  -3.969
   25   HH12  ARG   3          2HH1      ARG   3  -3.796   3.019  -3.885
   26   HH21  ARG   3          1HH2      ARG   3  -4.876   2.753  -0.570
   27   HH22  ARG   3          2HH2      ARG   3  -4.287   1.892  -1.952
   28    H    CYS   4           H        CYS   4  -8.835  10.723  -1.259
   29    HA   CYS   4           HA       CYS   4  -8.043  12.910  -3.060
   30    HB2  CYS   4           2HB      CYS   4 -10.586  12.137  -1.769
   31    HB3  CYS   4           3HB      CYS   4 -10.243  13.864  -1.788
   32    HA   PRO   5           HA       PRO   5  -6.219  15.251   0.170
   33    HB2  PRO   5           2HB      PRO   5  -7.040  17.775  -0.397
   34    HB3  PRO   5           3HB      PRO   5  -5.845  16.913  -1.372
   35    HG2  PRO   5           2HG      PRO   5  -8.773  17.294  -1.865
   36    HG3  PRO   5           3HG      PRO   5  -7.422  17.408  -3.008
   37    HD2  PRO   5           2HD      PRO   5  -9.004  15.217  -2.836
   38    HD3  PRO   5           3HD      PRO   5  -7.285  15.121  -3.268
   39    H    LYS   6           H        LYS   6  -7.699  14.145   1.739
   40    HA   LYS   6           HA       LYS   6  -9.164  14.160   3.485
   41    HB2  LYS   6           2HB      LYS   6  -8.216  17.008   3.364
   42    HB3  LYS   6           3HB      LYS   6  -9.386  16.503   4.576
   43    HG2  LYS   6           2HG      LYS   6  -7.454  14.588   4.817
   44    HG3  LYS   6           3HG      LYS   6  -6.510  16.027   4.425
   45    HD2  LYS   6           2HD      LYS   6  -7.396  17.216   6.285
   46    HD3  LYS   6           3HD      LYS   6  -8.615  15.973   6.580
   47    HE2  LYS   6           2HE      LYS   6  -6.295  14.537   6.708
   48    HE3  LYS   6           3HE      LYS   6  -5.800  16.088   7.385
   49    HZ1  LYS   6           3HZ      LYS   6  -7.066  15.797   9.203
   50    HZ2  LYS   6           1HZ      LYS   6  -6.949  14.156   8.807
   51    HZ3  LYS   6           2HZ      LYS   6  -8.322  15.038   8.362
   52    H    SER   7           H        SER   7 -10.750  13.719   1.623
   53    HA   SER   7           HA       SER   7 -13.178  14.974   2.180
   54    HB2  SER   7           2HB      SER   7 -13.444  16.039  -0.184
   55    HB3  SER   7           3HB      SER   7 -12.595  16.944   1.069
   56    HG   SER   7           HG       SER   7 -11.660  16.485  -1.243
   57    H    TRP   8           H        TRP   8 -14.529  13.349   1.860
   58    HA   TRP   8           HA       TRP   8 -13.912  11.254  -0.032
   59    HB2  TRP   8           2HB      TRP   8 -16.009  11.651   2.077
   60    HB3  TRP   8           3HB      TRP   8 -16.198  10.379   0.872
   61    HD1  TRP   8           HD1      TRP   8 -12.720  11.173   2.223
   62    HE1  TRP   8           HE1      TRP   8 -11.906   9.182   3.637
   63    HE3  TRP   8           HE3      TRP   8 -17.039   8.440   2.341
   64    HZ2  TRP   8           HZ2      TRP   8 -12.956   6.772   4.666
   65    HZ3  TRP   8           HZ3      TRP   8 -17.050   6.303   3.561
   66    HH2  TRP   8           HH2      TRP   8 -15.049   5.488   4.698
   67    H    LYS   9           H        LYS   9 -14.105  13.041  -1.766
   68    HA   LYS   9           HA       LYS   9 -16.851  12.954  -2.824
   69    HB2  LYS   9           2HB      LYS   9 -14.939  15.267  -2.696
   70    HB3  LYS   9           3HB      LYS   9 -16.176  15.198  -3.944
   71    HG2  LYS   9           2HG      LYS   9 -17.287  16.397  -2.365
   72    HG3  LYS   9           3HG      LYS   9 -17.753  14.766  -1.875
   73    HD2  LYS   9           2HD      LYS   9 -15.503  14.994  -0.457
   74    HD3  LYS   9           3HD      LYS   9 -15.932  16.704  -0.562
   75    HE2  LYS   9           2HE      LYS   9 -17.922  14.622   0.288
   76    HE3  LYS   9           3HE      LYS   9 -16.812  15.365   1.438
   77    HZ1  LYS   9           3HZ      LYS   9 -18.859  16.740  -0.213
   78    HZ2  LYS   9           1HZ      LYS   9 -17.694  17.549   0.709
   79    HZ3  LYS   9           2HZ      LYS   9 -18.846  16.573   1.470
   80    H    CYS  10           H        CYS  10 -13.755  14.155  -4.097
   81    HA   CYS  10           HA       CYS  10 -12.682  13.754  -6.066
   82    HB2  CYS  10           2HB      CYS  10 -13.603  10.902  -5.696
   83    HB3  CYS  10           3HB      CYS  10 -12.160  11.465  -6.531
   84    H    LYS  11           H        LYS  11 -14.805  14.967  -6.791
   85    HA   LYS  11           HA       LYS  11 -16.850  13.736  -8.171
   86    HB2  LYS  11           2HB      LYS  11 -15.810  16.372  -7.924
   87    HB3  LYS  11           3HB      LYS  11 -16.075  16.064  -9.635
   88    HG2  LYS  11           2HG      LYS  11 -18.259  15.265  -7.825
   89    HG3  LYS  11           3HG      LYS  11 -17.964  16.999  -7.980
   90    HD2  LYS  11           2HD      LYS  11 -19.052  16.996  -9.917
   91    HD3  LYS  11           3HD      LYS  11 -17.855  15.881 -10.579
   92    HE2  LYS  11           2HE      LYS  11 -19.995  14.874 -10.854
   93    HE3  LYS  11           3HE      LYS  11 -19.169  14.008  -9.560
   94    HZ1  LYS  11           3HZ      LYS  11 -20.770  14.544  -8.143
   95    HZ2  LYS  11           1HZ      LYS  11 -21.665  15.148  -9.445
   96    HZ3  LYS  11           2HZ      LYS  11 -20.684  16.186  -8.539
   97    H    ALA  12           H        ALA  12 -17.123  12.851 -10.157
   98    HA   ALA  12           HA       ALA  12 -15.036  11.638 -11.492
   99    HB1  ALA  12           1HB      ALA  12 -17.436  12.454 -13.057
  100    HB2  ALA  12           2HB      ALA  12 -16.582  10.911 -13.021
  101    HB3  ALA  12           3HB      ALA  12 -17.639  11.365 -11.684
  102    H    PHE  13           H        PHE  13 -16.507  14.792 -12.103
  103    HA   PHE  13           HA       PHE  13 -15.209  15.385 -14.510
  104    HB2  PHE  13           2HB      PHE  13 -17.125  16.648 -13.369
  105    HB3  PHE  13           3HB      PHE  13 -15.879  17.449 -12.419
  106    HD1  PHE  13           HD2      PHE  13 -17.286  17.022 -15.780
  107    HD2  PHE  13           HD1      PHE  13 -14.459  19.112 -13.381
  108    HE1  PHE  13           HE2      PHE  13 -16.965  18.658 -17.590
  109    HE2  PHE  13           HE1      PHE  13 -14.134  20.752 -15.187
  110    HZ   PHE  13           HZ       PHE  13 -15.387  20.525 -17.295
  111    H    LYS  14           H        LYS  14 -14.382  16.740 -11.316
  112    HA   LYS  14           HA       LYS  14 -11.912  17.783 -12.016
  113    HB2  LYS  14           2HB      LYS  14 -13.283  18.052  -9.839
  114    HB3  LYS  14           3HB      LYS  14 -12.426  16.618  -9.292
  115    HG2  LYS  14           2HG      LYS  14 -10.289  17.890  -9.879
  116    HG3  LYS  14           3HG      LYS  14 -11.318  19.323  -9.952
  117    HD2  LYS  14           2HD      LYS  14 -12.006  18.988  -7.656
  118    HD3  LYS  14           3HD      LYS  14 -11.097  17.478  -7.573
  119    HE2  LYS  14           2HE      LYS  14  -9.384  18.677  -6.807
  120    HE3  LYS  14           3HE      LYS  14  -9.239  19.354  -8.429
  121    HZ1  LYS  14           3HZ      LYS  14 -11.072  20.962  -7.536
  122    HZ2  LYS  14           1HZ      LYS  14  -9.440  21.240  -7.185
  123    HZ3  LYS  14           2HZ      LYS  14 -10.445  20.526  -6.027
  124    H    GLN  15           H        GLN  15 -12.759  14.530 -10.970
  125    HA   GLN  15           HA       GLN  15 -10.202  13.516 -10.522
  126    HB2  GLN  15           2HB      GLN  15 -12.792  12.265 -11.374
  127    HB3  GLN  15           3HB      GLN  15 -11.327  11.296 -11.284
  128    HG2  GLN  15           2HG      GLN  15 -12.083  12.963  -8.941
  129    HG3  GLN  15           3HG      GLN  15 -12.975  11.474  -9.253
  130   HE21  GLN  15          1HE2      GLN  15 -11.387   9.604  -9.863
  131   HE22  GLN  15          2HE2      GLN  15 -10.072   9.397  -8.762
  132    H    ARG  16           H        ARG  16 -12.100  13.652 -13.516
  133    HA   ARG  16           HA       ARG  16 -10.108  12.365 -15.102
  134    HB2  ARG  16           2HB      ARG  16 -12.780  13.157 -15.442
  135    HB3  ARG  16           3HB      ARG  16 -11.865  14.064 -16.640
  136    HG2  ARG  16           2HG      ARG  16 -11.404  12.237 -17.864
  137    HG3  ARG  16           3HG      ARG  16 -11.197  11.208 -16.445
  138    HD2  ARG  16           2HD      ARG  16 -13.361  10.567 -16.433
  139    HD3  ARG  16           3HD      ARG  16 -13.941  12.154 -16.936
  140    HE   ARG  16           HE       ARG  16 -13.354   9.915 -18.625
  141   HH11  ARG  16          1HH1      ARG  16 -13.530  13.389 -18.473
  142   HH12  ARG  16          2HH1      ARG  16 -13.799  13.580 -20.174
  143   HH21  ARG  16          1HH2      ARG  16 -13.707  10.154 -20.866
  144   HH22  ARG  16          2HH2      ARG  16 -13.901  11.739 -21.534
  145    H    VAL  17           H        VAL  17 -11.080  15.743 -14.619
  146    HA   VAL  17           HA       VAL  17  -9.458  16.991 -16.469
  147    HB   VAL  17           HB       VAL  17 -10.120  17.975 -13.690
  148   HG11  VAL  17          1HG1      VAL  17  -9.907  20.224 -15.032
  149   HG12  VAL  17          2HG1      VAL  17  -8.483  19.447 -14.338
  150   HG13  VAL  17          3HG1      VAL  17  -8.842  19.260 -16.055
  151   HG21  VAL  17          3HG2      VAL  17 -11.613  19.196 -15.815
  152   HG22  VAL  17          1HG2      VAL  17 -11.800  17.443 -15.872
  153   HG23  VAL  17          2HG2      VAL  17 -12.198  18.325 -14.398
  154    H    LEU  18           H        LEU  18  -8.633  15.857 -13.225
  155    HA   LEU  18           HA       LEU  18  -6.126  16.967 -12.917
  156    HB2  LEU  18           2HB      LEU  18  -7.477  15.518 -11.306
  157    HB3  LEU  18           3HB      LEU  18  -6.751  14.137 -12.126
  158    HG   LEU  18           HG       LEU  18  -4.500  15.133 -11.502
  159   HD11  LEU  18          1HD1      LEU  18  -6.330  17.055 -10.226
  160   HD12  LEU  18          2HD1      LEU  18  -4.674  17.263 -10.795
  161   HD13  LEU  18          3HD1      LEU  18  -4.981  16.502  -9.234
  162   HD21  LEU  18          3HD2      LEU  18  -4.449  13.835  -9.639
  163   HD22  LEU  18          1HD2      LEU  18  -6.005  13.306 -10.280
  164   HD23  LEU  18          2HD2      LEU  18  -5.945  14.508  -8.991
  165    H    LYS  19           H        LYS  19  -7.029  14.010 -14.642
  166    HA   LYS  19           HA       LYS  19  -4.292  13.487 -15.423
  167    HB2  LYS  19           2HB      LYS  19  -6.766  12.019 -15.356
  168    HB3  LYS  19           3HB      LYS  19  -6.052  11.904 -16.959
  169    HG2  LYS  19           2HG      LYS  19  -4.115  10.882 -16.153
  170    HG3  LYS  19           3HG      LYS  19  -4.437  11.380 -14.490
  171    HD2  LYS  19           2HD      LYS  19  -6.642   9.913 -14.975
  172    HD3  LYS  19           3HD      LYS  19  -5.490   9.089 -16.030
  173    HE2  LYS  19           2HE      LYS  19  -5.194   7.938 -14.062
  174    HE3  LYS  19           3HE      LYS  19  -3.949   9.178 -13.921
  175    HZ1  LYS  19           3HZ      LYS  19  -6.643   9.622 -12.806
  176    HZ2  LYS  19           1HZ      LYS  19  -5.179  10.354 -12.374
  177    HZ3  LYS  19           2HZ      LYS  19  -5.486   8.750 -11.933
  178    H    ARG  20           H        ARG  20  -7.207  14.835 -16.834
  179    HA   ARG  20           HA       ARG  20  -6.565  14.814 -19.523
  180    HB2  ARG  20           2HB      ARG  20  -8.715  15.611 -18.412
  181    HB3  ARG  20           3HB      ARG  20  -7.898  17.147 -18.157
  182    HG2  ARG  20           2HG      ARG  20  -7.714  17.539 -20.485
  183    HG3  ARG  20           3HG      ARG  20  -8.208  15.888 -20.867
  184    HD2  ARG  20           2HD      ARG  20 -10.398  16.457 -19.686
  185    HD3  ARG  20           3HD      ARG  20  -9.874  18.138 -19.778
  186    HE   ARG  20           HE       ARG  20 -10.470  18.136 -21.975
  187   HH11  ARG  20          1HH1      ARG  20  -9.957  14.843 -20.967
  188   HH12  ARG  20          2HH1      ARG  20 -10.472  14.164 -22.475
  189   HH21  ARG  20          1HH2      ARG  20 -11.151  17.253 -23.965
  190   HH22  ARG  20          2HH2      ARG  20 -11.151  15.535 -24.180
  191    H    LEU  21           H        LEU  21  -5.650  17.186 -17.050
  192    HA   LEU  21           HA       LEU  21  -4.385  19.055 -18.655
  193    HB2  LEU  21           2HB      LEU  21  -4.304  18.277 -15.836
  194    HB3  LEU  21           3HB      LEU  21  -2.818  19.029 -16.411
  195    HG   LEU  21           HG       LEU  21  -4.365  20.632 -15.359
  196   HD11  LEU  21          1HD1      LEU  21  -4.150  21.188 -18.305
  197   HD12  LEU  21          2HD1      LEU  21  -2.761  21.227 -17.219
  198   HD13  LEU  21          3HD1      LEU  21  -4.108  22.338 -16.968
  199   HD21  LEU  21          3HD2      LEU  21  -6.411  21.269 -16.617
  200   HD22  LEU  21          1HD2      LEU  21  -6.486  19.654 -15.913
  201   HD23  LEU  21          2HD2      LEU  21  -6.177  19.850 -17.639
  202    H    LEU  22           H        LEU  22  -3.243  15.945 -17.516
  203    HA   LEU  22           HA       LEU  22  -0.529  16.360 -18.354
  204    HB2  LEU  22           2HB      LEU  22  -2.107  14.020 -17.365
  205    HB3  LEU  22           3HB      LEU  22  -0.508  13.779 -18.067
  206    HG   LEU  22           HG       LEU  22  -0.734  15.788 -15.900
  207   HD11  LEU  22          1HD1      LEU  22  -0.312  13.641 -14.381
  208   HD12  LEU  22          2HD1      LEU  22  -1.389  12.920 -15.577
  209   HD13  LEU  22          3HD1      LEU  22  -1.918  14.320 -14.644
  210   HD21  LEU  22          3HD2      LEU  22   1.378  15.215 -17.097
  211   HD22  LEU  22          1HD2      LEU  22   1.264  13.592 -16.415
  212   HD23  LEU  22          2HD2      LEU  22   1.451  14.985 -15.349
  213    H    ALA  23           H        ALA  23  -3.135  14.220 -19.523
  214    HA   ALA  23           HA       ALA  23  -1.908  13.245 -21.788
  215    HB1  ALA  23           1HB      ALA  23  -3.997  12.338 -21.084
  216    HB2  ALA  23           2HB      ALA  23  -4.813  13.884 -21.317
  217    HB3  ALA  23           3HB      ALA  23  -4.218  12.982 -22.711
  218    H    MET  24           H        MET  24  -3.618  16.307 -21.363
  219    HA   MET  24           HA       MET  24  -3.404  17.052 -24.123
  220    HB2  MET  24           2HB      MET  24  -5.197  17.868 -22.577
  221    HB3  MET  24           3HB      MET  24  -3.979  18.827 -21.747
  222    HG2  MET  24           2HG      MET  24  -4.922  20.361 -23.174
  223    HG3  MET  24           3HG      MET  24  -3.516  19.820 -24.087
  224    HE1  MET  24           3HE      MET  24  -4.173  20.521 -26.330
  225    HE2  MET  24           1HE      MET  24  -3.690  18.836 -26.530
  226    HE3  MET  24           2HE      MET  24  -5.117  19.449 -27.365
  227    H    LEU  25           H        LEU  25  -1.673  17.862 -21.145
  228    HA   LEU  25           HA       LEU  25  -0.025  19.879 -22.054
  229    HB2  LEU  25           2HB      LEU  25  -0.001  19.362 -19.756
  230    HB3  LEU  25           3HB      LEU  25   0.436  17.682 -20.060
  231    HG   LEU  25           HG       LEU  25   2.677  18.380 -20.735
  232   HD11  LEU  25          1HD1      LEU  25   1.512  21.103 -20.363
  233   HD12  LEU  25          2HD1      LEU  25   2.528  20.483 -21.663
  234   HD13  LEU  25          3HD1      LEU  25   3.234  20.837 -20.087
  235   HD21  LEU  25          3HD2      LEU  25   3.186  18.093 -18.596
  236   HD22  LEU  25          1HD2      LEU  25   1.556  18.575 -18.123
  237   HD23  LEU  25          2HD2      LEU  25   2.822  19.792 -18.290
  238    H    ARG  26           H        ARG  26   0.564  16.373 -22.185
  239    HA   ARG  26           HA       ARG  26   2.758  16.882 -24.077
  240    HB2  ARG  26           2HB      ARG  26   2.171  14.532 -22.277
  241    HB3  ARG  26           3HB      ARG  26   3.386  14.482 -23.548
  242    HG2  ARG  26           2HG      ARG  26   4.735  16.069 -22.476
  243    HG3  ARG  26           3HG      ARG  26   3.429  16.579 -21.405
  244    HD2  ARG  26           2HD      ARG  26   3.717  14.821 -19.992
  245    HD3  ARG  26           3HD      ARG  26   4.244  13.735 -21.278
  246    HE   ARG  26           HE       ARG  26   6.409  14.340 -20.850
  247   HH11  ARG  26          1HH1      ARG  26   4.266  16.645 -19.361
  248   HH12  ARG  26          2HH1      ARG  26   5.532  17.469 -18.512
  249   HH21  ARG  26          1HH2      ARG  26   8.084  15.416 -19.737
  250   HH22  ARG  26          2HH2      ARG  26   7.703  16.769 -18.726
  251    H    GLN  27           H        GLN  27   0.300  17.158 -25.171
  252    HA   GLN  27           HA       GLN  27  -0.401  14.618 -26.433
  253    HB2  GLN  27           2HB      GLN  27  -1.979  16.626 -25.513
  254    HB3  GLN  27           3HB      GLN  27  -1.853  17.067 -27.211
  255    HG2  GLN  27           2HG      GLN  27  -2.391  14.423 -27.409
  256    HG3  GLN  27           3HG      GLN  27  -3.265  14.837 -25.936
  257   HE21  GLN  27          1HE2      GLN  27  -5.292  15.358 -26.270
  258   HE22  GLN  27          2HE2      GLN  27  -5.933  16.136 -27.673
  259    H    HIS  28           H        HIS  28   2.091  16.134 -27.020
  260    HA   HIS  28           HA       HIS  28   2.045  17.509 -29.412
  261    HB2  HIS  28           2HB      HIS  28   4.032  17.077 -27.878
  262    HB3  HIS  28           3HB      HIS  28   4.204  15.526 -28.694
  263    HD1  HIS  28           HD1      HIS  28   4.167  19.225 -29.563
  264    HD2  HIS  28           HD2      HIS  28   5.719  15.627 -30.943
  265    HE1  HIS  28           HE1      HIS  28   5.672  19.835 -31.483
  266    H    ALA  29           H        ALA  29   2.789  16.760 -31.568
  267    HA   ALA  29           HA       ALA  29   2.223  13.992 -32.233
  268    HB1  ALA  29           1HB      ALA  29   0.007  14.844 -32.366
  269    HB2  ALA  29           2HB      ALA  29   0.541  16.266 -33.263
  270    HB3  ALA  29           3HB      ALA  29   0.597  14.674 -34.020
  271    H    PHE  30           H        PHE  30   3.521  13.309 -33.819
  272    HA   PHE  30           HA       PHE  30   5.579  14.867 -34.850
  273    HB2  PHE  30           2HB      PHE  30   5.408  12.320 -34.756
  274    HB3  PHE  30           3HB      PHE  30   4.477  12.432 -36.246
  275    HD1  PHE  30           HD1      PHE  30   7.774  12.802 -34.721
  276    HD2  PHE  30           HD2      PHE  30   5.529  13.068 -38.327
  277    HE1  PHE  30           HE1      PHE  30   9.866  12.840 -36.016
  278    HE2  PHE  30           HE2      PHE  30   7.617  13.106 -39.628
  279    HZ   PHE  30           HZ       PHE  30   9.789  12.991 -38.473
  Start of MODEL    5
    1    H1   GLY   1           H        GLY   1  -5.966   1.914  -9.174
    2    HA2  GLY   1           2HA      GLY   1  -6.901   4.252  -9.194
    3    HA3  GLY   1           3HA      GLY   1  -7.738   3.174  -8.088
    4    H    ILE   2           H        ILE   2  -6.639   6.181  -8.302
    5    HA   ILE   2           HA       ILE   2  -5.378   6.396  -5.698
    6    HB   ILE   2           HB       ILE   2  -6.251   8.708  -7.411
    7   HG12  ILE   2          2HG1      ILE   2  -3.588   8.369  -7.976
    8   HG13  ILE   2          3HG1      ILE   2  -4.162   6.706  -7.929
    9   HG21  ILE   2          1HG2      ILE   2  -4.358   8.283  -5.151
   10   HG22  ILE   2          2HG2      ILE   2  -4.016   9.549  -6.329
   11   HG23  ILE   2          3HG2      ILE   2  -5.525   9.578  -5.416
   12   HD11  ILE   2          3HD1      ILE   2  -5.891   8.499  -9.444
   13   HD12  ILE   2          1HD1      ILE   2  -4.258   8.354 -10.094
   14   HD13  ILE   2          2HD1      ILE   2  -5.247   6.912  -9.863
   15    H    ARG   3           H        ARG   3  -6.194   7.878  -4.057
   16    HA   ARG   3           HA       ARG   3  -9.140   7.934  -4.003
   17    HB2  ARG   3           2HB      ARG   3  -7.252   7.765  -1.647
   18    HB3  ARG   3           3HB      ARG   3  -9.009   7.731  -1.579
   19    HG2  ARG   3           2HG      ARG   3  -8.533   5.669  -3.261
   20    HG3  ARG   3           3HG      ARG   3  -7.101   5.602  -2.233
   21    HD2  ARG   3           2HD      ARG   3  -9.124   5.993  -0.422
   22    HD3  ARG   3           3HD      ARG   3  -9.883   4.954  -1.628
   23    HE   ARG   3           HE       ARG   3  -7.364   3.904  -0.986
   24   HH11  ARG   3          1HH1      ARG   3 -10.501   4.390   0.445
   25   HH12  ARG   3          2HH1      ARG   3 -10.371   3.028   1.508
   26   HH21  ARG   3          1HH2      ARG   3  -7.182   2.108   0.409
   27   HH22  ARG   3          2HH2      ARG   3  -8.482   1.731   1.487
   28    H    CYS   4           H        CYS   4  -9.962   9.631  -2.376
   29    HA   CYS   4           HA       CYS   4  -8.654  12.162  -3.052
   30    HB2  CYS   4           2HB      CYS   4 -11.434  11.322  -2.476
   31    HB3  CYS   4           3HB      CYS   4 -10.975  12.918  -1.892
   32    HA   PRO   5           HA       PRO   5  -7.306  13.064   1.023
   33    HB2  PRO   5           2HB      PRO   5  -7.855  15.713   1.252
   34    HB3  PRO   5           3HB      PRO   5  -6.557  15.086   0.228
   35    HG2  PRO   5           2HG      PRO   5  -9.318  15.957  -0.534
   36    HG3  PRO   5           3HG      PRO   5  -7.777  16.280  -1.351
   37    HD2  PRO   5           2HD      PRO   5  -9.496  14.363  -2.189
   38    HD3  PRO   5           3HD      PRO   5  -7.736  14.210  -2.364
   39    H    LYS   6           H        LYS   6  -9.111  11.687   1.872
   40    HA   LYS   6           HA       LYS   6 -10.864  11.298   3.275
   41    HB2  LYS   6           2HB      LYS   6  -9.839  13.942   4.300
   42    HB3  LYS   6           3HB      LYS   6 -11.124  13.053   5.107
   43    HG2  LYS   6           2HG      LYS   6  -8.905  11.311   4.595
   44    HG3  LYS   6           3HG      LYS   6  -8.361  12.761   5.443
   45    HD2  LYS   6           2HD      LYS   6  -8.953  11.391   7.202
   46    HD3  LYS   6           3HD      LYS   6 -10.441  12.309   6.956
   47    HE2  LYS   6           2HE      LYS   6 -11.343  10.472   5.611
   48    HE3  LYS   6           3HE      LYS   6  -9.857   9.558   5.862
   49    HZ1  LYS   6           3HZ      LYS   6 -11.430  10.506   8.167
   50    HZ2  LYS   6           1HZ      LYS   6 -10.343   9.212   8.079
   51    HZ3  LYS   6           2HZ      LYS   6 -11.870   9.086   7.361
   52    H    SER   7           H        SER   7 -12.117  11.683   1.168
   53    HA   SER   7           HA       SER   7 -14.520  12.970   1.755
   54    HB2  SER   7           2HB      SER   7 -14.290  14.772  -0.114
   55    HB3  SER   7           3HB      SER   7 -13.624  15.110   1.483
   56    HG   SER   7           HG       SER   7 -11.674  15.083   0.676
   57    H    TRP   8           H        TRP   8 -15.893  11.713   0.704
   58    HA   TRP   8           HA       TRP   8 -15.080  10.291  -1.677
   59    HB2  TRP   8           2HB      TRP   8 -17.492  10.227   0.108
   60    HB3  TRP   8           3HB      TRP   8 -17.542   9.451  -1.472
   61    HD1  TRP   8           HD1      TRP   8 -14.369   9.360   0.671
   62    HE1  TRP   8           HE1      TRP   8 -13.929   6.926   1.382
   63    HE3  TRP   8           HE3      TRP   8 -18.684   7.221  -1.044
   64    HZ2  TRP   8           HZ2      TRP   8 -15.238   4.429   1.235
   65    HZ3  TRP   8           HZ3      TRP   8 -19.012   4.804  -0.720
   66    HH2  TRP   8           HH2      TRP   8 -17.323   3.439   0.396
   67    H    LYS   9           H        LYS   9 -14.847  12.556  -2.704
   68    HA   LYS   9           HA       LYS   9 -17.360  13.150  -4.119
   69    HB2  LYS   9           2HB      LYS   9 -15.341  15.056  -2.962
   70    HB3  LYS   9           3HB      LYS   9 -16.387  15.537  -4.292
   71    HG2  LYS   9           2HG      LYS   9 -18.245  14.577  -2.641
   72    HG3  LYS   9           3HG      LYS   9 -17.031  15.046  -1.448
   73    HD2  LYS   9           2HD      LYS   9 -17.537  17.201  -1.688
   74    HD3  LYS   9           3HD      LYS   9 -17.350  17.104  -3.441
   75    HE2  LYS   9           2HE      LYS   9 -19.588  16.624  -3.782
   76    HE3  LYS   9           3HE      LYS   9 -19.814  16.020  -2.141
   77    HZ1  LYS   9           3HZ      LYS   9 -20.883  18.116  -2.296
   78    HZ2  LYS   9           1HZ      LYS   9 -19.524  18.847  -2.989
   79    HZ3  LYS   9           2HZ      LYS   9 -19.485  18.350  -1.372
   80    H    CYS  10           H        CYS  10 -14.015  14.316  -4.438
   81    HA   CYS  10           HA       CYS  10 -12.636  14.450  -6.247
   82    HB2  CYS  10           2HB      CYS  10 -13.792  11.766  -7.009
   83    HB3  CYS  10           3HB      CYS  10 -12.190  12.391  -7.384
   84    H    LYS  11           H        LYS  11 -13.916  16.192  -7.133
   85    HA   LYS  11           HA       LYS  11 -16.059  15.980  -8.854
   86    HB2  LYS  11           2HB      LYS  11 -14.189  17.993  -8.110
   87    HB3  LYS  11           3HB      LYS  11 -14.327  18.012  -9.863
   88    HG2  LYS  11           2HG      LYS  11 -16.822  17.922  -8.250
   89    HG3  LYS  11           3HG      LYS  11 -15.925  19.439  -8.342
   90    HD2  LYS  11           2HD      LYS  11 -16.091  19.465 -10.734
   91    HD3  LYS  11           3HD      LYS  11 -16.782  17.841 -10.751
   92    HE2  LYS  11           2HE      LYS  11 -18.830  18.562  -9.970
   93    HE3  LYS  11           3HE      LYS  11 -18.151  20.003  -9.215
   94    HZ1  LYS  11           3HZ      LYS  11 -18.898  21.073 -11.001
   95    HZ2  LYS  11           1HZ      LYS  11 -19.173  19.645 -11.867
   96    HZ3  LYS  11           2HZ      LYS  11 -17.635  20.350 -11.863
   97    H    ALA  12           H        ALA  12 -16.301  14.868 -10.667
   98    HA   ALA  12           HA       ALA  12 -14.337  13.532 -12.068
   99    HB1  ALA  12           1HB      ALA  12 -16.904  13.342 -12.209
  100    HB2  ALA  12           2HB      ALA  12 -16.772  14.568 -13.470
  101    HB3  ALA  12           3HB      ALA  12 -15.952  13.018 -13.658
  102    H    PHE  13           H        PHE  13 -15.592  16.793 -12.597
  103    HA   PHE  13           HA       PHE  13 -14.336  17.344 -15.027
  104    HB2  PHE  13           2HB      PHE  13 -16.085  18.733 -13.759
  105    HB3  PHE  13           3HB      PHE  13 -14.725  19.405 -12.866
  106    HD1  PHE  13           HD1      PHE  13 -16.304  19.134 -16.174
  107    HD2  PHE  13           HD2      PHE  13 -13.260  20.997 -13.856
  108    HE1  PHE  13           HE1      PHE  13 -15.943  20.774 -17.973
  109    HE2  PHE  13           HE2      PHE  13 -12.894  22.640 -15.650
  110    HZ   PHE  13           HZ       PHE  13 -14.237  22.531 -17.711
  111    H    LYS  14           H        LYS  14 -13.258  18.490 -11.825
  112    HA   LYS  14           HA       LYS  14 -10.721  19.318 -12.644
  113    HB2  LYS  14           2HB      LYS  14 -11.888  19.868 -10.470
  114    HB3  LYS  14           3HB      LYS  14 -11.409  18.277  -9.894
  115    HG2  LYS  14           2HG      LYS  14  -9.541  19.218  -9.164
  116    HG3  LYS  14           3HG      LYS  14  -9.058  19.391 -10.853
  117    HD2  LYS  14           2HD      LYS  14  -9.749  21.611 -10.952
  118    HD3  LYS  14           3HD      LYS  14 -10.809  21.444  -9.550
  119    HE2  LYS  14           2HE      LYS  14  -9.169  21.977  -8.132
  120    HE3  LYS  14           3HE      LYS  14  -8.034  20.874  -8.910
  121    HZ1  LYS  14           3HZ      LYS  14  -8.711  23.477 -10.131
  122    HZ2  LYS  14           1HZ      LYS  14  -7.353  22.503 -10.398
  123    HZ3  LYS  14           2HZ      LYS  14  -7.510  23.356  -8.946
  124    H    GLN  15           H        GLN  15 -11.928  16.163 -11.807
  125    HA   GLN  15           HA       GLN  15  -9.480  14.874 -11.293
  126    HB2  GLN  15           2HB      GLN  15 -12.185  13.927 -12.182
  127    HB3  GLN  15           3HB      GLN  15 -10.834  12.805 -12.104
  128    HG2  GLN  15           2HG      GLN  15 -11.542  14.506  -9.750
  129    HG3  GLN  15           3HG      GLN  15 -12.416  13.012 -10.084
  130   HE21  GLN  15          1HE2      GLN  15 -10.312  14.055  -8.053
  131   HE22  GLN  15          2HE2      GLN  15  -9.208  12.731  -7.938
  132    H    ARG  16           H        ARG  16 -11.325  15.316 -14.287
  133    HA   ARG  16           HA       ARG  16  -9.425  13.873 -15.882
  134    HB2  ARG  16           2HB      ARG  16 -12.035  15.048 -16.244
  135    HB3  ARG  16           3HB      ARG  16 -10.969  15.514 -17.563
  136    HG2  ARG  16           2HG      ARG  16 -12.031  13.551 -18.277
  137    HG3  ARG  16           3HG      ARG  16 -10.409  13.053 -17.791
  138    HD2  ARG  16           2HD      ARG  16 -11.283  12.310 -15.632
  139    HD3  ARG  16           3HD      ARG  16 -12.903  12.817 -16.111
  140    HE   ARG  16           HE       ARG  16 -11.586  10.395 -16.831
  141   HH11  ARG  16          1HH1      ARG  16 -13.866  12.778 -17.945
  142   HH12  ARG  16          2HH1      ARG  16 -14.694  11.683 -19.001
  143   HH21  ARG  16          1HH2      ARG  16 -12.667   8.943 -18.219
  144   HH22  ARG  16          2HH2      ARG  16 -14.012   9.501 -19.156
  145    H    VAL  17           H        VAL  17 -10.271  17.302 -15.475
  146    HA   VAL  17           HA       VAL  17  -8.537  18.437 -17.295
  147    HB   VAL  17           HB       VAL  17  -9.260  19.521 -14.569
  148   HG11  VAL  17          1HG1      VAL  17  -8.929  21.703 -16.083
  149   HG12  VAL  17          2HG1      VAL  17  -7.626  20.987 -15.132
  150   HG13  VAL  17          3HG1      VAL  17  -7.756  20.638 -16.856
  151   HG21  VAL  17          3HG2      VAL  17 -10.941  18.933 -16.667
  152   HG22  VAL  17          1HG2      VAL  17 -11.268  20.084 -15.372
  153   HG23  VAL  17          2HG2      VAL  17 -10.595  20.646 -16.901
  154    H    LEU  18           H        LEU  18  -7.873  17.367 -13.992
  155    HA   LEU  18           HA       LEU  18  -5.330  18.390 -13.639
  156    HB2  LEU  18           2HB      LEU  18  -6.660  17.205 -11.924
  157    HB3  LEU  18           3HB      LEU  18  -6.314  15.684 -12.744
  158    HG   LEU  18           HG       LEU  18  -3.849  16.220 -12.315
  159   HD11  LEU  18          1HD1      LEU  18  -5.041  18.564 -11.239
  160   HD12  LEU  18          2HD1      LEU  18  -3.333  18.138 -11.336
  161   HD13  LEU  18          3HD1      LEU  18  -4.279  17.671  -9.923
  162   HD21  LEU  18          3HD2      LEU  18  -3.900  15.000 -10.358
  163   HD22  LEU  18          1HD2      LEU  18  -5.471  14.616 -11.060
  164   HD23  LEU  18          2HD2      LEU  18  -5.352  15.808  -9.766
  165    H    LYS  19           H        LYS  19  -6.320  15.425 -15.294
  166    HA   LYS  19           HA       LYS  19  -3.590  14.715 -15.933
  167    HB2  LYS  19           2HB      LYS  19  -6.155  13.407 -15.951
  168    HB3  LYS  19           3HB      LYS  19  -5.368  13.197 -17.510
  169    HG2  LYS  19           2HG      LYS  19  -3.400  12.281 -16.410
  170    HG3  LYS  19           3HG      LYS  19  -4.158  12.523 -14.835
  171    HD2  LYS  19           2HD      LYS  19  -5.767  10.867 -15.228
  172    HD3  LYS  19           3HD      LYS  19  -5.477  10.873 -16.969
  173    HE2  LYS  19           2HE      LYS  19  -3.058  10.139 -16.216
  174    HE3  LYS  19           3HE      LYS  19  -3.919   9.590 -14.779
  175    HZ1  LYS  19           3HZ      LYS  19  -5.051   8.009 -15.947
  176    HZ2  LYS  19           1HZ      LYS  19  -3.610   8.031 -16.833
  177    HZ3  LYS  19           2HZ      LYS  19  -4.972   8.849 -17.413
  178    H    ARG  20           H        ARG  20  -6.369  16.144 -17.545
  179    HA   ARG  20           HA       ARG  20  -5.573  16.021 -20.188
  180    HB2  ARG  20           2HB      ARG  20  -7.099  18.141 -18.683
  181    HB3  ARG  20           3HB      ARG  20  -6.848  18.219 -20.422
  182    HG2  ARG  20           2HG      ARG  20  -8.100  16.240 -20.782
  183    HG3  ARG  20           3HG      ARG  20  -8.135  15.872 -19.057
  184    HD2  ARG  20           2HD      ARG  20  -9.753  17.425 -18.618
  185    HD3  ARG  20           3HD      ARG  20  -9.266  18.468 -19.953
  186    HE   ARG  20           HE       ARG  20 -11.229  16.401 -20.023
  187   HH11  ARG  20          1HH1      ARG  20  -8.839  18.064 -21.932
  188   HH12  ARG  20          2HH1      ARG  20  -9.633  17.746 -23.439
  189   HH21  ARG  20          1HH2      ARG  20 -12.283  15.976 -22.001
  190   HH22  ARG  20          2HH2      ARG  20 -11.592  16.559 -23.477
  191    H    LEU  21           H        LEU  21  -4.703  18.428 -17.733
  192    HA   LEU  21           HA       LEU  21  -3.271  20.195 -19.314
  193    HB2  LEU  21           2HB      LEU  21  -3.828  20.617 -16.979
  194    HB3  LEU  21           3HB      LEU  21  -2.709  19.353 -16.474
  195    HG   LEU  21           HG       LEU  21  -1.322  21.298 -18.066
  196   HD11  LEU  21          1HD1      LEU  21  -3.251  22.345 -16.095
  197   HD12  LEU  21          2HD1      LEU  21  -2.538  23.116 -17.512
  198   HD13  LEU  21          3HD1      LEU  21  -1.615  22.999 -16.014
  199   HD21  LEU  21          3HD2      LEU  21  -0.242  19.785 -16.523
  200   HD22  LEU  21          1HD2      LEU  21  -1.146  20.469 -15.172
  201   HD23  LEU  21          2HD2      LEU  21   0.049  21.451 -16.019
  202    H    LEU  22           H        LEU  22  -2.316  17.089 -17.996
  203    HA   LEU  22           HA       LEU  22   0.453  17.366 -18.685
  204    HB2  LEU  22           2HB      LEU  22  -1.279  15.121 -17.735
  205    HB3  LEU  22           3HB      LEU  22   0.347  14.795 -18.331
  206    HG   LEU  22           HG       LEU  22  -0.015  16.838 -16.190
  207   HD11  LEU  22          1HD1      LEU  22  -1.330  14.700 -15.646
  208   HD12  LEU  22          2HD1      LEU  22  -0.165  15.289 -14.461
  209   HD13  LEU  22          3HD1      LEU  22   0.252  13.933 -15.508
  210   HD21  LEU  22          3HD2      LEU  22   2.199  16.733 -16.197
  211   HD22  LEU  22          1HD2      LEU  22   2.134  15.547 -17.501
  212   HD23  LEU  22          2HD2      LEU  22   2.136  15.010 -15.820
  213    H    ALA  23           H        ALA  23  -2.169  15.311 -19.964
  214    HA   ALA  23           HA       ALA  23  -0.849  14.214 -22.118
  215    HB1  ALA  23           1HB      ALA  23  -2.984  13.756 -23.075
  216    HB2  ALA  23           2HB      ALA  23  -3.149  13.637 -21.323
  217    HB3  ALA  23           3HB      ALA  23  -3.736  15.069 -22.169
  218    H    MET  24           H        MET  24  -2.436  17.363 -21.886
  219    HA   MET  24           HA       MET  24  -2.021  18.019 -24.643
  220    HB2  MET  24           2HB      MET  24  -3.825  18.963 -23.114
  221    HB3  MET  24           3HB      MET  24  -2.565  19.964 -22.404
  222    HG2  MET  24           2HG      MET  24  -2.901  21.462 -23.987
  223    HG3  MET  24           3HG      MET  24  -2.362  20.287 -25.185
  224    HE1  MET  24           3HE      MET  24  -3.562  20.406 -27.169
  225    HE2  MET  24           1HE      MET  24  -4.134  18.799 -26.719
  226    HE3  MET  24           2HE      MET  24  -5.263  19.985 -27.376
  227    H    LEU  25           H        LEU  25  -0.404  18.807 -21.597
  228    HA   LEU  25           HA       LEU  25   1.447  20.651 -22.630
  229    HB2  LEU  25           2HB      LEU  25   1.053  20.470 -20.263
  230    HB3  LEU  25           3HB      LEU  25   1.622  18.802 -20.257
  231    HG   LEU  25           HG       LEU  25   3.888  19.663 -20.889
  232   HD11  LEU  25          1HD1      LEU  25   3.208  22.353 -19.912
  233   HD12  LEU  25          2HD1      LEU  25   2.630  21.961 -21.532
  234   HD13  LEU  25          3HD1      LEU  25   4.350  21.848 -21.158
  235   HD21  LEU  25          3HD2      LEU  25   4.229  20.759 -18.562
  236   HD22  LEU  25          1HD2      LEU  25   3.720  19.073 -18.660
  237   HD23  LEU  25          2HD2      LEU  25   2.536  20.332 -18.306
  238    H    ARG  26           H        ARG  26   2.346  17.417 -21.455
  239    HA   ARG  26           HA       ARG  26   3.778  16.867 -23.926
  240    HB2  ARG  26           2HB      ARG  26   5.090  17.518 -21.340
  241    HB3  ARG  26           3HB      ARG  26   5.767  16.188 -22.269
  242    HG2  ARG  26           2HG      ARG  26   5.877  17.762 -24.230
  243    HG3  ARG  26           3HG      ARG  26   5.473  19.058 -23.103
  244    HD2  ARG  26           2HD      ARG  26   7.844  17.209 -22.867
  245    HD3  ARG  26           3HD      ARG  26   7.897  18.861 -23.480
  246    HE   ARG  26           HE       ARG  26   6.776  19.103 -21.011
  247   HH11  ARG  26          1HH1      ARG  26   9.716  17.694 -22.232
  248   HH12  ARG  26          2HH1      ARG  26  10.617  17.997 -20.784
  249   HH21  ARG  26          1HH2      ARG  26   7.952  19.507 -19.098
  250   HH22  ARG  26          2HH2      ARG  26   9.612  19.027 -19.001
  251    H    GLN  27           H        GLN  27   1.871  15.350 -23.737
  252    HA   GLN  27           HA       GLN  27   2.756  12.762 -23.176
  253    HB2  GLN  27           2HB      GLN  27   2.037  14.051 -20.838
  254    HB3  GLN  27           3HB      GLN  27   0.592  13.138 -21.252
  255    HG2  GLN  27           2HG      GLN  27   1.661  11.101 -21.058
  256    HG3  GLN  27           3HG      GLN  27   3.262  11.805 -21.281
  257   HE21  GLN  27          1HE2      GLN  27   0.725  11.101 -19.047
  258   HE22  GLN  27          2HE2      GLN  27   1.586  11.519 -17.608
  259    H    HIS  28           H        HIS  28   1.357  14.248 -25.195
  260    HA   HIS  28           HA       HIS  28  -1.371  13.859 -25.338
  261    HB2  HIS  28           2HB      HIS  28   0.104  15.079 -26.997
  262    HB3  HIS  28           3HB      HIS  28   0.498  13.506 -27.684
  263    HD1  HIS  28           HD1      HIS  28  -0.709  13.467 -29.851
  264    HD2  HIS  28           HD2      HIS  28  -3.104  14.866 -26.758
  265    HE1  HIS  28           HE1      HIS  28  -2.998  13.758 -30.852
  266    H    ALA  29           H        ALA  29  -2.676  12.252 -26.350
  267    HA   ALA  29           HA       ALA  29  -1.442   9.581 -26.485
  268    HB1  ALA  29           1HB      ALA  29  -3.036  10.308 -24.439
  269    HB2  ALA  29           2HB      ALA  29  -4.240   9.693 -25.572
  270    HB3  ALA  29           3HB      ALA  29  -2.912   8.657 -25.048
  271    H    PHE  30           H        PHE  30  -2.631   8.027 -27.792
  272    HA   PHE  30           HA       PHE  30  -3.291   8.986 -30.316
  273    HB2  PHE  30           2HB      PHE  30  -2.607   6.669 -29.909
  274    HB3  PHE  30           3HB      PHE  30  -4.106   6.368 -29.036
  275    HD1  PHE  30           HD2      PHE  30  -6.238   6.247 -30.234
  276    HD2  PHE  30           HD1      PHE  30  -2.543   6.719 -32.294
  277    HE1  PHE  30           HE2      PHE  30  -7.329   5.585 -32.337
  278    HE2  PHE  30           HE1      PHE  30  -3.629   6.059 -34.401
  279    HZ   PHE  30           HZ       PHE  30  -6.025   5.490 -34.424
  Start of MODEL    6
    1    H1   GLY   1           H        GLY   1  -8.003   2.073  -4.634
    2    HA2  GLY   1           2HA      GLY   1  -5.333   2.345  -5.865
    3    HA3  GLY   1           3HA      GLY   1  -6.842   2.302  -6.764
    4    H    ILE   2           H        ILE   2  -8.436   4.094  -5.672
    5    HA   ILE   2           HA       ILE   2  -7.087   6.597  -6.249
    6    HB   ILE   2           HB       ILE   2  -9.986   6.307  -5.503
    7   HG12  ILE   2          2HG1      ILE   2  -9.551   4.682  -7.272
    8   HG13  ILE   2          3HG1      ILE   2 -10.472   6.038  -7.910
    9   HG21  ILE   2          1HG2      ILE   2  -9.577   8.551  -5.631
   10   HG22  ILE   2          2HG2      ILE   2  -8.284   8.360  -6.814
   11   HG23  ILE   2          3HG2      ILE   2  -9.967   8.221  -7.319
   12   HD11  ILE   2          3HD1      ILE   2  -7.508   5.629  -8.220
   13   HD12  ILE   2          1HD1      ILE   2  -8.732   5.322  -9.452
   14   HD13  ILE   2          2HD1      ILE   2  -8.447   6.967  -8.882
   15    H    ARG   3           H        ARG   3  -7.384   8.495  -4.884
   16    HA   ARG   3           HA       ARG   3  -8.256   8.295  -2.196
   17    HB2  ARG   3           2HB      ARG   3  -6.100   6.960  -2.153
   18    HB3  ARG   3           3HB      ARG   3  -5.260   8.464  -2.505
   19    HG2  ARG   3           2HG      ARG   3  -5.088   8.537  -0.260
   20    HG3  ARG   3           3HG      ARG   3  -6.693   9.257  -0.392
   21    HD2  ARG   3           2HD      ARG   3  -7.014   7.629   1.219
   22    HD3  ARG   3           3HD      ARG   3  -7.527   6.807  -0.253
   23    HE   ARG   3           HE       ARG   3  -4.810   6.290   0.125
   24   HH11  ARG   3          1HH1      ARG   3  -7.864   5.598   1.646
   25   HH12  ARG   3          2HH1      ARG   3  -7.335   4.092   2.321
   26   HH21  ARG   3          1HH2      ARG   3  -4.101   4.310   1.007
   27   HH22  ARG   3          2HH2      ARG   3  -5.194   3.361   1.957
   28    H    CYS   4           H        CYS   4  -9.179  10.249  -2.200
   29    HA   CYS   4           HA       CYS   4  -7.863  12.523  -3.425
   30    HB2  CYS   4           2HB      CYS   4 -10.572  11.953  -2.331
   31    HB3  CYS   4           3HB      CYS   4 -10.036  13.630  -2.337
   32    HA   PRO   5           HA       PRO   5  -6.123  14.342   0.167
   33    HB2  PRO   5           2HB      PRO   5  -6.646  16.981  -0.198
   34    HB3  PRO   5           3HB      PRO   5  -5.455  16.096  -1.158
   35    HG2  PRO   5           2HG      PRO   5  -8.276  16.824  -1.843
   36    HG3  PRO   5           3HG      PRO   5  -6.822  16.906  -2.855
   37    HD2  PRO   5           2HD      PRO   5  -8.615  14.885  -3.041
   38    HD3  PRO   5           3HD      PRO   5  -6.881  14.653  -3.340
   39    H    LYS   6           H        LYS   6  -7.839  13.251   1.488
   40    HA   LYS   6           HA       LYS   6  -9.448  13.251   3.102
   41    HB2  LYS   6           2HB      LYS   6  -8.582  16.132   3.412
   42    HB3  LYS   6           3HB      LYS   6  -9.437  15.174   4.614
   43    HG2  LYS   6           2HG      LYS   6  -6.767  14.316   3.563
   44    HG3  LYS   6           3HG      LYS   6  -6.908  15.489   4.875
   45    HD2  LYS   6           2HD      LYS   6  -8.508  13.678   5.900
   46    HD3  LYS   6           3HD      LYS   6  -7.625  12.592   4.825
   47    HE2  LYS   6           2HE      LYS   6  -5.871  12.567   6.194
   48    HE3  LYS   6           3HE      LYS   6  -5.807  14.329   6.226
   49    HZ1  LYS   6           3HZ      LYS   6  -6.143  13.334   8.433
   50    HZ2  LYS   6           1HZ      LYS   6  -7.612  12.678   7.909
   51    HZ3  LYS   6           2HZ      LYS   6  -7.416  14.356   7.989
   52    H    SER   7           H        SER   7 -10.910  13.143   1.109
   53    HA   SER   7           HA       SER   7 -13.236  14.605   1.589
   54    HB2  SER   7           2HB      SER   7 -13.191  15.880  -0.684
   55    HB3  SER   7           3HB      SER   7 -12.364  16.584   0.706
   56    HG   SER   7           HG       SER   7 -11.304  16.147  -1.590
   57    H    TRP   8           H        TRP   8 -14.713  13.167   1.025
   58    HA   TRP   8           HA       TRP   8 -14.154  11.176  -0.993
   59    HB2  TRP   8           2HB      TRP   8 -16.373  11.630   0.975
   60    HB3  TRP   8           3HB      TRP   8 -16.586  10.487  -0.348
   61    HD1  TRP   8           HD1      TRP   8 -13.185  10.799   1.358
   62    HE1  TRP   8           HE1      TRP   8 -12.699   8.620   2.639
   63    HE3  TRP   8           HE3      TRP   8 -17.732   8.522   0.838
   64    HZ2  TRP   8           HZ2      TRP   8 -14.064   6.249   3.336
   65    HZ3  TRP   8           HZ3      TRP   8 -18.059   6.299   1.841
   66    HH2  TRP   8           HH2      TRP   8 -16.262   5.187   3.063
   67    H    LYS   9           H        LYS   9 -14.013  13.104  -2.573
   68    HA   LYS   9           HA       LYS   9 -16.656  13.416  -3.834
   69    HB2  LYS   9           2HB      LYS   9 -14.459  15.475  -3.590
   70    HB3  LYS   9           3HB      LYS   9 -15.844  15.648  -4.659
   71    HG2  LYS   9           2HG      LYS   9 -17.304  15.410  -2.622
   72    HG3  LYS   9           3HG      LYS   9 -15.833  15.550  -1.656
   73    HD2  LYS   9           2HD      LYS   9 -15.822  17.646  -3.569
   74    HD3  LYS   9           3HD      LYS   9 -17.413  17.620  -2.805
   75    HE2  LYS   9           2HE      LYS   9 -15.033  17.361  -1.049
   76    HE3  LYS   9           3HE      LYS   9 -15.351  18.941  -1.765
   77    HZ1  LYS   9           3HZ      LYS   9 -16.957  19.285  -0.300
   78    HZ2  LYS   9           1HZ      LYS   9 -16.549  17.836   0.472
   79    HZ3  LYS   9           2HZ      LYS   9 -17.741  17.848  -0.727
   80    H    CYS  10           H        CYS  10 -13.350  14.322  -4.781
   81    HA   CYS  10           HA       CYS  10 -12.176  13.936  -6.695
   82    HB2  CYS  10           2HB      CYS  10 -13.446  11.198  -6.621
   83    HB3  CYS  10           3HB      CYS  10 -11.886  11.640  -7.307
   84    H    LYS  11           H        LYS  11 -13.960  15.466  -7.550
   85    HA   LYS  11           HA       LYS  11 -16.081  14.652  -9.112
   86    HB2  LYS  11           2HB      LYS  11 -14.509  17.052  -8.790
   87    HB3  LYS  11           3HB      LYS  11 -14.943  16.827 -10.480
   88    HG2  LYS  11           2HG      LYS  11 -17.278  16.747  -9.927
   89    HG3  LYS  11           3HG      LYS  11 -16.910  16.785  -8.201
   90    HD2  LYS  11           2HD      LYS  11 -17.388  18.995  -8.548
   91    HD3  LYS  11           3HD      LYS  11 -15.654  19.009  -8.876
   92    HE2  LYS  11           2HE      LYS  11 -16.816  18.344 -11.309
   93    HE3  LYS  11           3HE      LYS  11 -17.882  19.579 -10.639
   94    HZ1  LYS  11           3HZ      LYS  11 -15.329  19.888 -11.804
   95    HZ2  LYS  11           1HZ      LYS  11 -15.285  20.446 -10.207
   96    HZ3  LYS  11           2HZ      LYS  11 -16.415  21.082 -11.294
   97    H    ALA  12           H        ALA  12 -16.183  13.337 -10.799
   98    HA   ALA  12           HA       ALA  12 -14.054  12.218 -12.148
   99    HB1  ALA  12           1HB      ALA  12 -16.955  12.455 -12.663
  100    HB2  ALA  12           2HB      ALA  12 -15.941  12.009 -14.036
  101    HB3  ALA  12           3HB      ALA  12 -15.929  11.023 -12.574
  102    H    PHE  13           H        PHE  13 -15.887  15.130 -12.952
  103    HA   PHE  13           HA       PHE  13 -14.787  15.613 -15.480
  104    HB2  PHE  13           2HB      PHE  13 -16.767  16.776 -14.303
  105    HB3  PHE  13           3HB      PHE  13 -15.547  17.817 -13.578
  106    HD1  PHE  13           HD2      PHE  13 -16.172  16.438 -16.993
  107    HD2  PHE  13           HD1      PHE  13 -15.411  19.864 -14.584
  108    HE1  PHE  13           HE2      PHE  13 -16.191  17.853 -19.005
  109    HE2  PHE  13           HE1      PHE  13 -15.430  21.285 -16.593
  110    HZ   PHE  13           HZ       PHE  13 -15.819  20.279 -18.807
  111    H    LYS  14           H        LYS  14 -13.958  17.366 -12.487
  112    HA   LYS  14           HA       LYS  14 -11.656  18.587 -13.427
  113    HB2  LYS  14           2HB      LYS  14 -12.827  19.099 -11.277
  114    HB3  LYS  14           3HB      LYS  14 -12.118  17.641 -10.593
  115    HG2  LYS  14           2HG      LYS  14  -9.910  18.893 -11.544
  116    HG3  LYS  14           3HG      LYS  14 -10.921  20.269 -11.096
  117    HD2  LYS  14           2HD      LYS  14 -10.369  19.961  -8.966
  118    HD3  LYS  14           3HD      LYS  14 -11.116  18.363  -9.014
  119    HE2  LYS  14           2HE      LYS  14  -8.817  17.745 -10.185
  120    HE3  LYS  14           3HE      LYS  14  -8.261  19.144  -9.267
  121    HZ1  LYS  14           3HZ      LYS  14  -8.248  16.741  -8.245
  122    HZ2  LYS  14           1HZ      LYS  14  -9.850  17.128  -7.863
  123    HZ3  LYS  14           2HZ      LYS  14  -8.587  18.097  -7.292
  124    H    GLN  15           H        GLN  15 -12.102  15.361 -12.115
  125    HA   GLN  15           HA       GLN  15  -9.415  14.679 -11.718
  126    HB2  GLN  15           2HB      GLN  15 -11.873  13.052 -12.313
  127    HB3  GLN  15           3HB      GLN  15 -10.298  12.292 -12.135
  128    HG2  GLN  15           2HG      GLN  15 -10.855  14.110  -9.958
  129    HG3  GLN  15           3HG      GLN  15 -12.104  12.877 -10.121
  130   HE21  GLN  15          1HE2      GLN  15  -9.629  13.485  -8.322
  131   HE22  GLN  15          2HE2      GLN  15  -8.909  11.925  -8.140
  132    H    ARG  16           H        ARG  16 -11.487  14.362 -14.575
  133    HA   ARG  16           HA       ARG  16  -9.437  13.147 -16.166
  134    HB2  ARG  16           2HB      ARG  16 -11.705  12.636 -16.721
  135    HB3  ARG  16           3HB      ARG  16 -12.124  14.340 -16.843
  136    HG2  ARG  16           2HG      ARG  16 -10.003  13.335 -18.648
  137    HG3  ARG  16           3HG      ARG  16 -11.660  12.820 -18.969
  138    HD2  ARG  16           2HD      ARG  16 -12.194  15.362 -18.684
  139    HD3  ARG  16           3HD      ARG  16 -10.476  15.561 -19.026
  140    HE   ARG  16           HE       ARG  16 -10.931  15.128 -21.214
  141   HH11  ARG  16          1HH1      ARG  16 -13.499  13.805 -19.272
  142   HH12  ARG  16          2HH1      ARG  16 -14.453  13.316 -20.633
  143   HH21  ARG  16          1HH2      ARG  16 -12.177  14.489 -23.014
  144   HH22  ARG  16          2HH2      ARG  16 -13.700  13.705 -22.761
  145    H    VAL  17           H        VAL  17 -10.874  16.388 -15.974
  146    HA   VAL  17           HA       VAL  17  -9.550  17.629 -18.053
  147    HB   VAL  17           HB       VAL  17 -10.121  18.895 -15.370
  148   HG11  VAL  17          1HG1      VAL  17 -10.489  20.910 -16.924
  149   HG12  VAL  17          2HG1      VAL  17  -8.830  20.415 -16.581
  150   HG13  VAL  17          3HG1      VAL  17  -9.583  19.976 -18.115
  151   HG21  VAL  17          3HG2      VAL  17 -12.124  19.512 -17.266
  152   HG22  VAL  17          1HG2      VAL  17 -11.917  17.760 -17.274
  153   HG23  VAL  17          2HG2      VAL  17 -12.287  18.597 -15.766
  154    H    LEU  18           H        LEU  18  -8.406  17.006 -14.768
  155    HA   LEU  18           HA       LEU  18  -6.081  18.496 -14.750
  156    HB2  LEU  18           2HB      LEU  18  -6.921  17.313 -12.801
  157    HB3  LEU  18           3HB      LEU  18  -6.562  15.765 -13.565
  158    HG   LEU  18           HG       LEU  18  -4.123  17.077 -13.549
  159   HD11  LEU  18          1HD1      LEU  18  -5.679  17.700 -11.056
  160   HD12  LEU  18          2HD1      LEU  18  -4.776  18.806 -12.090
  161   HD13  LEU  18          3HD1      LEU  18  -3.916  17.637 -11.088
  162   HD21  LEU  18          3HD2      LEU  18  -4.243  14.772 -13.137
  163   HD22  LEU  18          1HD2      LEU  18  -5.362  14.982 -11.790
  164   HD23  LEU  18          2HD2      LEU  18  -3.676  15.470 -11.619
  165    H    LYS  19           H        LYS  19  -6.625  15.264 -16.083
  166    HA   LYS  19           HA       LYS  19  -3.880  15.038 -16.972
  167    HB2  LYS  19           2HB      LYS  19  -6.280  13.264 -17.461
  168    HB3  LYS  19           3HB      LYS  19  -4.632  12.884 -17.943
  169    HG2  LYS  19           2HG      LYS  19  -4.775  13.551 -15.138
  170    HG3  LYS  19           3HG      LYS  19  -5.868  12.227 -15.548
  171    HD2  LYS  19           2HD      LYS  19  -3.034  12.230 -16.522
  172    HD3  LYS  19           3HD      LYS  19  -3.425  11.681 -14.890
  173    HE2  LYS  19           2HE      LYS  19  -5.205  10.530 -16.861
  174    HE3  LYS  19           3HE      LYS  19  -3.517  10.180 -17.231
  175    HZ1  LYS  19           3HZ      LYS  19  -4.986   9.548 -14.735
  176    HZ2  LYS  19           1HZ      LYS  19  -3.304   9.429 -14.871
  177    HZ3  LYS  19           2HZ      LYS  19  -4.301   8.460 -15.834
  178    H    ARG  20           H        ARG  20  -7.027  15.777 -18.339
  179    HA   ARG  20           HA       ARG  20  -6.508  15.537 -21.044
  180    HB2  ARG  20           2HB      ARG  20  -8.732  16.019 -20.238
  181    HB3  ARG  20           3HB      ARG  20  -8.208  17.568 -19.591
  182    HG2  ARG  20           2HG      ARG  20  -9.444  17.881 -21.645
  183    HG3  ARG  20           3HG      ARG  20  -7.760  18.359 -21.865
  184    HD2  ARG  20           2HD      ARG  20  -7.277  16.254 -22.965
  185    HD3  ARG  20           3HD      ARG  20  -8.924  15.696 -22.671
  186    HE   ARG  20           HE       ARG  20  -9.105  18.076 -24.091
  187   HH11  ARG  20          1HH1      ARG  20  -7.848  14.863 -24.560
  188   HH12  ARG  20          2HH1      ARG  20  -8.096  14.876 -26.275
  189   HH21  ARG  20          1HH2      ARG  20  -9.437  18.104 -26.347
  190   HH22  ARG  20          2HH2      ARG  20  -8.999  16.720 -27.290
  191    H    LEU  21           H        LEU  21  -5.853  18.287 -18.902
  192    HA   LEU  21           HA       LEU  21  -4.959  20.121 -20.775
  193    HB2  LEU  21           2HB      LEU  21  -5.325  20.404 -18.264
  194    HB3  LEU  21           3HB      LEU  21  -3.686  19.785 -18.076
  195    HG   LEU  21           HG       LEU  21  -3.993  22.066 -19.923
  196   HD11  LEU  21          1HD1      LEU  21  -4.028  23.674 -18.031
  197   HD12  LEU  21          2HD1      LEU  21  -4.426  22.337 -16.953
  198   HD13  LEU  21          3HD1      LEU  21  -5.541  22.792 -18.242
  199   HD21  LEU  21          3HD2      LEU  21  -1.790  21.645 -19.626
  200   HD22  LEU  21          1HD2      LEU  21  -2.026  20.941 -18.026
  201   HD23  LEU  21          2HD2      LEU  21  -2.016  22.694 -18.226
  202    H    LEU  22           H        LEU  22  -3.309  17.368 -19.371
  203    HA   LEU  22           HA       LEU  22  -0.728  18.074 -20.408
  204    HB2  LEU  22           2HB      LEU  22  -1.890  15.658 -19.082
  205    HB3  LEU  22           3HB      LEU  22  -0.305  15.574 -19.847
  206    HG   LEU  22           HG       LEU  22   0.241  17.619 -18.333
  207   HD11  LEU  22          1HD1      LEU  22  -2.411  17.162 -17.571
  208   HD12  LEU  22          2HD1      LEU  22  -1.244  18.242 -16.809
  209   HD13  LEU  22          3HD1      LEU  22  -1.421  16.586 -16.230
  210   HD21  LEU  22          3HD2      LEU  22   1.162  15.280 -18.210
  211   HD22  LEU  22          1HD2      LEU  22  -0.094  14.930 -17.023
  212   HD23  LEU  22          2HD2      LEU  22   1.122  16.160 -16.681
  213    H    ALA  23           H        ALA  23  -3.034  15.464 -21.189
  214    HA   ALA  23           HA       ALA  23  -1.776  14.404 -23.393
  215    HB1  ALA  23           1HB      ALA  23  -4.481  14.414 -22.331
  216    HB2  ALA  23           2HB      ALA  23  -4.440  14.271 -24.088
  217    HB3  ALA  23           3HB      ALA  23  -3.566  13.110 -23.089
  218    H    MET  24           H        MET  24  -3.862  17.252 -23.228
  219    HA   MET  24           HA       MET  24  -3.814  17.691 -26.066
  220    HB2  MET  24           2HB      MET  24  -5.730  18.430 -24.770
  221    HB3  MET  24           3HB      MET  24  -4.703  19.462 -23.784
  222    HG2  MET  24           2HG      MET  24  -5.027  21.126 -25.194
  223    HG3  MET  24           3HG      MET  24  -4.274  20.183 -26.478
  224    HE1  MET  24           3HE      MET  24  -5.555  19.920 -28.698
  225    HE2  MET  24           1HE      MET  24  -5.611  18.368 -27.863
  226    HE3  MET  24           2HE      MET  24  -7.054  18.991 -28.663
  227    H    LEU  25           H        LEU  25  -2.138  19.010 -23.253
  228    HA   LEU  25           HA       LEU  25  -0.838  21.161 -24.399
  229    HB2  LEU  25           2HB      LEU  25  -0.642  20.904 -22.082
  230    HB3  LEU  25           3HB      LEU  25  -0.048  19.250 -22.228
  231    HG   LEU  25           HG       LEU  25   2.073  20.154 -23.159
  232   HD11  LEU  25          1HD1      LEU  25   0.568  22.674 -22.879
  233   HD12  LEU  25          2HD1      LEU  25   1.836  22.226 -24.018
  234   HD13  LEU  25          3HD1      LEU  25   2.258  22.716 -22.378
  235   HD21  LEU  25          3HD2      LEU  25   2.133  21.585 -20.685
  236   HD22  LEU  25          1HD2      LEU  25   2.818  20.007 -21.075
  237   HD23  LEU  25          2HD2      LEU  25   1.156  20.128 -20.496
  238    H    ARG  26           H        ARG  26   0.407  17.830 -24.116
  239    HA   ARG  26           HA       ARG  26   2.092  18.370 -26.471
  240    HB2  ARG  26           2HB      ARG  26   2.795  17.116 -23.852
  241    HB3  ARG  26           3HB      ARG  26   3.593  16.533 -25.306
  242    HG2  ARG  26           2HG      ARG  26   4.017  19.100 -25.702
  243    HG3  ARG  26           3HG      ARG  26   3.802  19.167 -23.951
  244    HD2  ARG  26           2HD      ARG  26   5.686  17.244 -25.294
  245    HD3  ARG  26           3HD      ARG  26   6.174  18.861 -24.787
  246    HE   ARG  26           HE       ARG  26   4.964  17.524 -22.626
  247   HH11  ARG  26          1HH1      ARG  26   7.870  17.484 -24.543
  248   HH12  ARG  26          2HH1      ARG  26   8.856  16.843 -23.271
  249   HH21  ARG  26          1HH2      ARG  26   6.252  16.680 -20.943
  250   HH22  ARG  26          2HH2      ARG  26   7.934  16.385 -21.224
  251    H    GLN  27           H        GLN  27   1.503  15.445 -24.546
  252    HA   GLN  27           HA       GLN  27  -0.330  14.213 -26.248
  253    HB2  GLN  27           2HB      GLN  27   1.261  12.534 -27.310
  254    HB3  GLN  27           3HB      GLN  27   1.254  14.153 -27.997
  255    HG2  GLN  27           2HG      GLN  27   3.390  14.508 -27.476
  256    HG3  GLN  27           3HG      GLN  27   3.208  13.818 -25.864
  257   HE21  GLN  27          1HE2      GLN  27   5.204  12.771 -26.060
  258   HE22  GLN  27          2HE2      GLN  27   5.393  11.355 -27.031
  259    H    HIS  28           H        HIS  28   0.305  14.451 -23.461
  260    HA   HIS  28           HA       HIS  28   1.493  12.259 -22.278
  261    HB2  HIS  28           2HB      HIS  28   0.620  14.274 -21.085
  262    HB3  HIS  28           3HB      HIS  28  -1.010  13.637 -21.285
  263    HD1  HIS  28           HD1      HIS  28  -1.833  12.338 -19.357
  264    HD2  HIS  28           HD2      HIS  28   2.315  12.292 -19.586
  265    HE1  HIS  28           HE1      HIS  28  -1.062  11.061 -17.332
  266    H    ALA  29           H        ALA  29   0.750  10.259 -21.527
  267    HA   ALA  29           HA       ALA  29  -1.703   9.279 -22.836
  268    HB1  ALA  29           1HB      ALA  29  -0.487   7.734 -23.859
  269    HB2  ALA  29           2HB      ALA  29   0.975   8.344 -23.081
  270    HB3  ALA  29           3HB      ALA  29   0.010   7.096 -22.291
  271    H    PHE  30           H        PHE  30  -2.715   7.408 -21.748
  272    HA   PHE  30           HA       PHE  30  -3.270   7.954 -19.062
  273    HB2  PHE  30           2HB      PHE  30  -4.826   6.744 -20.518
  274    HB3  PHE  30           3HB      PHE  30  -3.707   5.386 -20.602
  275    HD1  PHE  30           HD1      PHE  30  -3.321   3.975 -18.627
  276    HD2  PHE  30           HD2      PHE  30  -6.239   7.074 -18.633
  277    HE1  PHE  30           HE1      PHE  30  -4.370   2.987 -16.633
  278    HE2  PHE  30           HE2      PHE  30  -7.293   6.091 -16.639
  279    HZ   PHE  30           HZ       PHE  30  -6.358   4.045 -15.636
  Start of MODEL    7
    1    H1   GLY   1           H        GLY   1  -9.677   2.358  -4.523
    2    HA2  GLY   1           2HA      GLY   1  -8.022   2.656  -6.132
    3    HA3  GLY   1           3HA      GLY   1  -9.427   3.171  -7.055
    4    H    ILE   2           H        ILE   2 -10.009   5.583  -5.826
    5    HA   ILE   2           HA       ILE   2  -7.872   7.225  -6.901
    6    HB   ILE   2           HB       ILE   2 -10.411   8.255  -5.661
    7   HG12  ILE   2          2HG1      ILE   2 -11.062   6.546  -7.278
    8   HG13  ILE   2          3HG1      ILE   2 -11.432   8.147  -7.907
    9   HG21  ILE   2          1HG2      ILE   2  -8.373   9.304  -7.586
   10   HG22  ILE   2          2HG2      ILE   2 -10.005   9.970  -7.546
   11   HG23  ILE   2          3HG2      ILE   2  -8.990  10.037  -6.106
   12   HD11  ILE   2          3HD1      ILE   2  -8.893   7.658  -8.854
   13   HD12  ILE   2          1HD1      ILE   2  -9.691   6.089  -8.963
   14   HD13  ILE   2          2HD1      ILE   2 -10.399   7.495  -9.758
   15    H    ARG   3           H        ARG   3  -7.062   9.105  -5.733
   16    HA   ARG   3           HA       ARG   3  -7.072   8.762  -2.811
   17    HB2  ARG   3           2HB      ARG   3  -4.635   9.488  -4.443
   18    HB3  ARG   3           3HB      ARG   3  -4.702   9.203  -2.709
   19    HG2  ARG   3           2HG      ARG   3  -5.553   6.845  -3.404
   20    HG3  ARG   3           3HG      ARG   3  -4.812   7.246  -4.955
   21    HD2  ARG   3           2HD      ARG   3  -3.225   7.706  -2.485
   22    HD3  ARG   3           3HD      ARG   3  -3.461   6.042  -3.017
   23    HE   ARG   3           HE       ARG   3  -2.634   7.534  -5.222
   24   HH11  ARG   3          1HH1      ARG   3  -1.391   6.485  -2.144
   25   HH12  ARG   3          2HH1      ARG   3   0.258   6.448  -2.676
   26   HH21  ARG   3          1HH2      ARG   3  -0.468   7.490  -5.934
   27   HH22  ARG   3          2HH2      ARG   3   0.782   7.021  -4.831
   28    H    CYS   4           H        CYS   4  -8.589  10.465  -2.679
   29    HA   CYS   4           HA       CYS   4  -7.779  13.090  -3.654
   30    HB2  CYS   4           2HB      CYS   4 -10.307  11.886  -2.644
   31    HB3  CYS   4           3HB      CYS   4 -10.084  13.617  -2.410
   32    HA   PRO   5           HA       PRO   5  -6.291  14.674   0.156
   33    HB2  PRO   5           2HB      PRO   5  -7.292  17.198   0.175
   34    HB3  PRO   5           3HB      PRO   5  -5.989  16.689  -0.907
   35    HG2  PRO   5           2HG      PRO   5  -8.915  16.978  -1.470
   36    HG3  PRO   5           3HG      PRO   5  -7.530  17.465  -2.465
   37    HD2  PRO   5           2HD      PRO   5  -8.934  15.197  -2.932
   38    HD3  PRO   5           3HD      PRO   5  -7.196  15.331  -3.268
   39    H    LYS   6           H        LYS   6  -7.742  13.114   1.312
   40    HA   LYS   6           HA       LYS   6  -9.277  12.593   2.915
   41    HB2  LYS   6           2HB      LYS   6  -8.769  15.495   3.588
   42    HB3  LYS   6           3HB      LYS   6  -9.657  14.389   4.627
   43    HG2  LYS   6           2HG      LYS   6  -7.779  13.594   5.488
   44    HG3  LYS   6           3HG      LYS   6  -7.131  13.241   3.884
   45    HD2  LYS   6           2HD      LYS   6  -7.136  16.054   4.894
   46    HD3  LYS   6           3HD      LYS   6  -5.900  14.926   5.455
   47    HE2  LYS   6           2HE      LYS   6  -5.842  14.480   2.779
   48    HE3  LYS   6           3HE      LYS   6  -6.262  16.192   2.826
   49    HZ1  LYS   6           3HZ      LYS   6  -4.328  16.543   4.285
   50    HZ2  LYS   6           1HZ      LYS   6  -3.893  15.954   2.759
   51    HZ3  LYS   6           2HZ      LYS   6  -3.901  14.917   4.095
   52    H    SER   7           H        SER   7 -10.754  12.502   0.932
   53    HA   SER   7           HA       SER   7 -13.290  13.433   1.626
   54    HB2  SER   7           2HB      SER   7 -13.542  15.001  -0.441
   55    HB3  SER   7           3HB      SER   7 -12.814  15.641   1.033
   56    HG   SER   7           HG       SER   7 -11.267  14.527  -1.056
   57    H    TRP   8           H        TRP   8 -14.500  11.843   0.866
   58    HA   TRP   8           HA       TRP   8 -13.651  10.291  -1.419
   59    HB2  TRP   8           2HB      TRP   8 -15.858  10.053   0.602
   60    HB3  TRP   8           3HB      TRP   8 -15.900   9.087  -0.871
   61    HD1  TRP   8           HD1      TRP   8 -12.584   9.785   0.906
   62    HE1  TRP   8           HE1      TRP   8 -11.669   7.567   1.838
   63    HE3  TRP   8           HE3      TRP   8 -16.607   6.779  -0.053
   64    HZ2  TRP   8           HZ2      TRP   8 -12.537   4.897   2.128
   65    HZ3  TRP   8           HZ3      TRP   8 -16.484   4.405   0.582
   66    HH2  TRP   8           HH2      TRP   8 -14.490   3.485   1.649
   67    H    LYS   9           H        LYS   9 -13.905  12.415  -2.706
   68    HA   LYS   9           HA       LYS   9 -16.598  12.414  -3.901
   69    HB2  LYS   9           2HB      LYS   9 -14.834  14.741  -3.186
   70    HB3  LYS   9           3HB      LYS   9 -16.043  14.881  -4.456
   71    HG2  LYS   9           2HG      LYS   9 -17.597  13.882  -2.547
   72    HG3  LYS   9           3HG      LYS   9 -16.382  14.653  -1.525
   73    HD2  LYS   9           2HD      LYS   9 -16.863  16.596  -3.377
   74    HD3  LYS   9           3HD      LYS   9 -18.454  15.845  -3.226
   75    HE2  LYS   9           2HE      LYS   9 -18.006  16.038  -0.673
   76    HE3  LYS   9           3HE      LYS   9 -16.805  17.237  -1.152
   77    HZ1  LYS   9           3HZ      LYS   9 -19.447  17.519  -2.334
   78    HZ2  LYS   9           1HZ      LYS   9 -18.382  18.704  -1.764
   79    HZ3  LYS   9           2HZ      LYS   9 -19.341  17.834  -0.675
   80    H    CYS  10           H        CYS  10 -13.538  14.031  -4.719
   81    HA   CYS  10           HA       CYS  10 -12.370  14.139  -6.673
   82    HB2  CYS  10           2HB      CYS  10 -13.124  11.232  -6.988
   83    HB3  CYS  10           3HB      CYS  10 -11.690  12.043  -7.608
   84    H    LYS  11           H        LYS  11 -14.148  15.509  -7.493
   85    HA   LYS  11           HA       LYS  11 -16.294  14.665  -9.005
   86    HB2  LYS  11           2HB      LYS  11 -15.074  17.100  -8.440
   87    HB3  LYS  11           3HB      LYS  11 -14.997  16.984 -10.194
   88    HG2  LYS  11           2HG      LYS  11 -17.261  17.088 -10.442
   89    HG3  LYS  11           3HG      LYS  11 -17.579  16.364  -8.864
   90    HD2  LYS  11           2HD      LYS  11 -17.033  18.405  -7.743
   91    HD3  LYS  11           3HD      LYS  11 -16.443  19.132  -9.239
   92    HE2  LYS  11           2HE      LYS  11 -18.609  20.025  -8.821
   93    HE3  LYS  11           3HE      LYS  11 -18.759  18.891 -10.162
   94    HZ1  LYS  11           3HZ      LYS  11 -19.816  18.713  -7.452
   95    HZ2  LYS  11           1HZ      LYS  11 -19.283  17.268  -8.153
   96    HZ3  LYS  11           2HZ      LYS  11 -20.486  18.184  -8.912
   97    H    ALA  12           H        ALA  12 -16.501  13.587 -10.849
   98    HA   ALA  12           HA       ALA  12 -14.425  12.467 -12.279
   99    HB1  ALA  12           1HB      ALA  12 -17.164  13.155 -13.340
  100    HB2  ALA  12           2HB      ALA  12 -16.052  11.962 -14.013
  101    HB3  ALA  12           3HB      ALA  12 -16.754  11.710 -12.415
  102    H    PHE  13           H        PHE  13 -16.098  15.527 -12.853
  103    HA   PHE  13           HA       PHE  13 -14.992  16.165 -15.332
  104    HB2  PHE  13           2HB      PHE  13 -16.858  17.365 -14.052
  105    HB3  PHE  13           3HB      PHE  13 -15.573  18.211 -13.197
  106    HD1  PHE  13           HD2      PHE  13 -13.958  19.612 -14.517
  107    HD2  PHE  13           HD1      PHE  13 -17.540  18.035 -16.191
  108    HE1  PHE  13           HE2      PHE  13 -13.825  21.256 -16.342
  109    HE2  PHE  13           HE1      PHE  13 -17.412  19.676 -18.019
  110    HZ   PHE  13           HZ       PHE  13 -15.554  21.291 -18.096
  111    H    LYS  14           H        LYS  14 -13.959  17.509 -12.192
  112    HA   LYS  14           HA       LYS  14 -11.574  18.627 -13.112
  113    HB2  LYS  14           2HB      LYS  14 -12.731  19.061 -10.902
  114    HB3  LYS  14           3HB      LYS  14 -12.024  17.557 -10.325
  115    HG2  LYS  14           2HG      LYS  14  -9.922  18.424 -10.211
  116    HG3  LYS  14           3HG      LYS  14 -10.206  19.578 -11.515
  117    HD2  LYS  14           2HD      LYS  14 -11.782  20.765  -9.904
  118    HD3  LYS  14           3HD      LYS  14 -11.077  19.753  -8.641
  119    HE2  LYS  14           2HE      LYS  14  -9.211  20.979  -8.563
  120    HE3  LYS  14           3HE      LYS  14  -9.067  21.018 -10.320
  121    HZ1  LYS  14           3HZ      LYS  14  -9.663  23.135 -10.214
  122    HZ2  LYS  14           1HZ      LYS  14 -10.011  23.031  -8.562
  123    HZ3  LYS  14           2HZ      LYS  14 -11.201  22.650  -9.701
  124    H    GLN  15           H        GLN  15 -12.330  15.371 -12.093
  125    HA   GLN  15           HA       GLN  15  -9.736  14.403 -11.678
  126    HB2  GLN  15           2HB      GLN  15 -12.319  13.102 -12.482
  127    HB3  GLN  15           3HB      GLN  15 -10.833  12.165 -12.400
  128    HG2  GLN  15           2HG      GLN  15 -11.714  13.826 -10.077
  129    HG3  GLN  15           3HG      GLN  15 -12.402  12.228 -10.357
  130   HE21  GLN  15          1HE2      GLN  15  -9.787  13.989  -9.118
  131   HE22  GLN  15          2HE2      GLN  15  -8.768  12.655  -8.710
  132    H    ARG  16           H        ARG  16 -11.722  14.481 -14.620
  133    HA   ARG  16           HA       ARG  16  -9.727  13.258 -16.255
  134    HB2  ARG  16           2HB      ARG  16 -12.187  14.856 -16.985
  135    HB3  ARG  16           3HB      ARG  16 -11.186  13.984 -18.138
  136    HG2  ARG  16           2HG      ARG  16 -12.604  12.687 -15.823
  137    HG3  ARG  16           3HG      ARG  16 -13.258  12.791 -17.459
  138    HD2  ARG  16           2HD      ARG  16 -10.876  11.749 -18.039
  139    HD3  ARG  16           3HD      ARG  16 -11.039  11.138 -16.393
  140    HE   ARG  16           HE       ARG  16 -12.622   9.674 -17.144
  141   HH11  ARG  16          1HH1      ARG  16 -12.237  12.213 -19.493
  142   HH12  ARG  16          2HH1      ARG  16 -13.267  11.462 -20.667
  143   HH21  ARG  16          1HH2      ARG  16 -13.979   8.674 -18.680
  144   HH22  ARG  16          2HH2      ARG  16 -14.258   9.449 -20.203
  145    H    VAL  17           H        VAL  17 -10.830  16.600 -15.787
  146    HA   VAL  17           HA       VAL  17  -9.294  17.887 -17.683
  147    HB   VAL  17           HB       VAL  17  -9.854  18.943 -14.909
  148   HG11  VAL  17          1HG1      VAL  17  -8.399  20.463 -15.864
  149   HG12  VAL  17          2HG1      VAL  17  -9.019  20.193 -17.493
  150   HG13  VAL  17          3HG1      VAL  17  -9.969  21.116 -16.329
  151   HG21  VAL  17          3HG2      VAL  17 -11.690  19.938 -16.824
  152   HG22  VAL  17          1HG2      VAL  17 -11.672  18.179 -16.959
  153   HG23  VAL  17          2HG2      VAL  17 -12.019  18.941 -15.406
  154    H    LEU  18           H        LEU  18  -8.371  16.838 -14.437
  155    HA   LEU  18           HA       LEU  18  -5.909  18.062 -14.189
  156    HB2  LEU  18           2HB      LEU  18  -7.047  16.726 -12.443
  157    HB3  LEU  18           3HB      LEU  18  -6.604  15.261 -13.316
  158    HG   LEU  18           HG       LEU  18  -4.176  16.049 -12.993
  159   HD11  LEU  18          1HD1      LEU  18  -4.296  18.227 -12.246
  160   HD12  LEU  18          2HD1      LEU  18  -4.069  17.340 -10.739
  161   HD13  LEU  18          3HD1      LEU  18  -5.676  17.905 -11.196
  162   HD21  LEU  18          3HD2      LEU  18  -4.957  15.417 -10.312
  163   HD22  LEU  18          1HD2      LEU  18  -4.166  14.396 -11.514
  164   HD23  LEU  18          2HD2      LEU  18  -5.927  14.480 -11.450
  165    H    LYS  19           H        LYS  19  -6.721  15.045 -15.852
  166    HA   LYS  19           HA       LYS  19  -3.976  14.608 -16.659
  167    HB2  LYS  19           2HB      LYS  19  -5.910  12.863 -16.163
  168    HB3  LYS  19           3HB      LYS  19  -6.252  13.106 -17.871
  169    HG2  LYS  19           2HG      LYS  19  -3.830  12.561 -18.312
  170    HG3  LYS  19           3HG      LYS  19  -3.728  12.057 -16.623
  171    HD2  LYS  19           2HD      LYS  19  -5.838  10.959 -18.453
  172    HD3  LYS  19           3HD      LYS  19  -4.215  10.265 -18.406
  173    HE2  LYS  19           2HE      LYS  19  -4.726   9.126 -16.570
  174    HE3  LYS  19           3HE      LYS  19  -5.155  10.617 -15.734
  175    HZ1  LYS  19           3HZ      LYS  19  -6.900   8.716 -16.119
  176    HZ2  LYS  19           1HZ      LYS  19  -7.094   9.487 -17.612
  177    HZ3  LYS  19           2HZ      LYS  19  -7.355  10.344 -16.178
  178    H    ARG  20           H        ARG  20  -6.961  15.811 -18.061
  179    HA   ARG  20           HA       ARG  20  -6.340  15.777 -20.755
  180    HB2  ARG  20           2HB      ARG  20  -8.466  16.614 -19.421
  181    HB3  ARG  20           3HB      ARG  20  -7.700  18.184 -19.628
  182    HG2  ARG  20           2HG      ARG  20  -7.575  17.064 -22.147
  183    HG3  ARG  20           3HG      ARG  20  -9.151  16.557 -21.535
  184    HD2  ARG  20           2HD      ARG  20  -9.062  19.178 -20.776
  185    HD3  ARG  20           3HD      ARG  20  -8.189  19.214 -22.307
  186    HE   ARG  20           HE       ARG  20 -10.629  17.750 -22.497
  187   HH11  ARG  20          1HH1      ARG  20  -9.277  20.957 -22.470
  188   HH12  ARG  20          2HH1      ARG  20 -10.572  21.653 -23.386
  189   HH21  ARG  20          1HH2      ARG  20 -12.341  18.653 -23.704
  190   HH22  ARG  20          2HH2      ARG  20 -12.316  20.341 -24.086
  191    H    LEU  21           H        LEU  21  -5.507  18.223 -18.325
  192    HA   LEU  21           HA       LEU  21  -4.338  20.120 -19.970
  193    HB2  LEU  21           2HB      LEU  21  -4.621  19.736 -17.253
  194    HB3  LEU  21           3HB      LEU  21  -2.874  19.723 -17.486
  195    HG   LEU  21           HG       LEU  21  -4.773  21.947 -18.230
  196   HD11  LEU  21          1HD1      LEU  21  -3.851  23.165 -16.456
  197   HD12  LEU  21          2HD1      LEU  21  -2.514  22.033 -16.256
  198   HD13  LEU  21          3HD1      LEU  21  -4.147  21.559 -15.789
  199   HD21  LEU  21          3HD2      LEU  21  -1.793  21.693 -18.612
  200   HD22  LEU  21          1HD2      LEU  21  -2.707  23.189 -18.797
  201   HD23  LEU  21          2HD2      LEU  21  -3.018  21.828 -19.874
  202    H    LEU  22           H        LEU  22  -3.052  17.084 -18.788
  203    HA   LEU  22           HA       LEU  22  -0.365  17.602 -19.652
  204    HB2  LEU  22           2HB      LEU  22  -1.834  15.211 -18.619
  205    HB3  LEU  22           3HB      LEU  22  -0.231  15.029 -19.328
  206    HG   LEU  22           HG       LEU  22  -0.264  17.120 -17.329
  207   HD11  LEU  22          1HD1      LEU  22  -1.915  16.057 -16.107
  208   HD12  LEU  22          2HD1      LEU  22  -0.440  15.353 -15.446
  209   HD13  LEU  22          3HD1      LEU  22  -1.401  14.448 -16.614
  210   HD21  LEU  22          3HD2      LEU  22   1.584  15.729 -16.426
  211   HD22  LEU  22          1HD2      LEU  22   1.768  16.125 -18.135
  212   HD23  LEU  22          2HD2      LEU  22   1.223  14.517 -17.656
  213    H    ALA  23           H        ALA  23  -2.889  15.344 -20.776
  214    HA   ALA  23           HA       ALA  23  -1.644  14.370 -23.026
  215    HB1  ALA  23           1HB      ALA  23  -4.559  14.938 -22.537
  216    HB2  ALA  23           2HB      ALA  23  -3.963  14.068 -23.951
  217    HB3  ALA  23           3HB      ALA  23  -3.702  13.410 -22.335
  218    H    MET  24           H        MET  24  -3.429  17.397 -22.655
  219    HA   MET  24           HA       MET  24  -3.200  18.098 -25.432
  220    HB2  MET  24           2HB      MET  24  -5.060  18.865 -23.940
  221    HB3  MET  24           3HB      MET  24  -3.901  19.886 -23.100
  222    HG2  MET  24           2HG      MET  24  -3.920  20.246 -25.999
  223    HG3  MET  24           3HG      MET  24  -5.442  20.650 -25.208
  224    HE1  MET  24           3HE      MET  24  -4.738  24.240 -24.734
  225    HE2  MET  24           1HE      MET  24  -5.281  23.127 -25.990
  226    HE3  MET  24           2HE      MET  24  -5.897  22.968 -24.346
  227    H    LEU  25           H        LEU  25  -1.532  18.953 -22.440
  228    HA   LEU  25           HA       LEU  25   0.038  21.051 -23.315
  229    HB2  LEU  25           2HB      LEU  25   0.072  20.527 -21.023
  230    HB3  LEU  25           3HB      LEU  25   0.552  18.859 -21.330
  231    HG   LEU  25           HG       LEU  25   2.783  19.553 -21.907
  232   HD11  LEU  25          1HD1      LEU  25   2.539  21.580 -23.038
  233   HD12  LEU  25          2HD1      LEU  25   3.361  22.019 -21.541
  234   HD13  LEU  25          3HD1      LEU  25   1.631  22.316 -21.716
  235   HD21  LEU  25          3HD2      LEU  25   3.307  20.868 -19.706
  236   HD22  LEU  25          1HD2      LEU  25   2.730  19.203 -19.636
  237   HD23  LEU  25          2HD2      LEU  25   1.613  20.536 -19.345
  238    H    ARG  26           H        ARG  26   0.917  17.594 -23.318
  239    HA   ARG  26           HA       ARG  26   2.760  18.170 -25.542
  240    HB2  ARG  26           2HB      ARG  26   3.221  16.702 -23.003
  241    HB3  ARG  26           3HB      ARG  26   3.937  16.018 -24.456
  242    HG2  ARG  26           2HG      ARG  26   4.796  18.466 -24.815
  243    HG3  ARG  26           3HG      ARG  26   4.533  18.584 -23.074
  244    HD2  ARG  26           2HD      ARG  26   5.853  16.132 -23.568
  245    HD3  ARG  26           3HD      ARG  26   6.698  17.377 -24.486
  246    HE   ARG  26           HE       ARG  26   6.727  17.030 -21.667
  247   HH11  ARG  26          1HH1      ARG  26   6.781  19.458 -24.161
  248   HH12  ARG  26          2HH1      ARG  26   7.626  20.620 -23.192
  249   HH21  ARG  26          1HH2      ARG  26   7.839  18.551 -20.382
  250   HH22  ARG  26          2HH2      ARG  26   8.228  20.102 -21.044
  251    H    GLN  27           H        GLN  27   1.778  15.156 -23.944
  252    HA   GLN  27           HA       GLN  27  -0.089  14.298 -25.830
  253    HB2  GLN  27           2HB      GLN  27   2.421  14.318 -26.962
  254    HB3  GLN  27           3HB      GLN  27   2.258  12.653 -26.422
  255    HG2  GLN  27           2HG      GLN  27  -0.141  13.030 -27.604
  256    HG3  GLN  27           3HG      GLN  27   0.879  14.087 -28.578
  257   HE21  GLN  27          1HE2      GLN  27  -0.479  11.411 -29.015
  258   HE22  GLN  27          2HE2      GLN  27   0.768  10.415 -29.677
  259    H    HIS  28           H        HIS  28   0.432  14.197 -23.011
  260    HA   HIS  28           HA       HIS  28   1.327  11.788 -22.009
  261    HB2  HIS  28           2HB      HIS  28   0.610  13.762 -20.655
  262    HB3  HIS  28           3HB      HIS  28  -1.065  13.325 -20.978
  263    HD1  HIS  28           HD1      HIS  28   2.011  11.946 -19.253
  264    HD2  HIS  28           HD2      HIS  28  -2.117  11.476 -19.266
  265    HE1  HIS  28           HE1      HIS  28   1.504  10.408 -17.330
  266    H    ALA  29           H        ALA  29   0.380   9.803 -21.544
  267    HA   ALA  29           HA       ALA  29  -2.303   9.257 -22.542
  268    HB1  ALA  29           1HB      ALA  29  -0.213   8.806 -24.227
  269    HB2  ALA  29           2HB      ALA  29  -0.380   7.237 -23.438
  270    HB3  ALA  29           3HB      ALA  29  -1.755   7.952 -24.280
  271    H    PHE  30           H        PHE  30  -3.033   7.048 -21.959
  272    HA   PHE  30           HA       PHE  30  -2.644   6.518 -19.252
  273    HB2  PHE  30           2HB      PHE  30  -4.646   5.772 -20.374
  274    HB3  PHE  30           3HB      PHE  30  -3.712   4.735 -21.448
  275    HD1  PHE  30           HD2      PHE  30  -3.523   5.195 -17.759
  276    HD2  PHE  30           HD1      PHE  30  -4.369   2.569 -21.000
  277    HE1  PHE  30           HE2      PHE  30  -3.782   3.330 -16.176
  278    HE2  PHE  30           HE1      PHE  30  -4.631   0.700 -19.422
  279    HZ   PHE  30           HZ       PHE  30  -4.336   1.079 -17.006
  Start of MODEL    8
    1    H1   GLY   1           H        GLY   1  -4.167   2.264  -1.682
    2    HA2  GLY   1           2HA      GLY   1  -6.214   2.609  -0.051
    3    HA3  GLY   1           3HA      GLY   1  -4.743   3.538   0.199
    4    H    ILE   2           H        ILE   2  -4.817   5.704   0.026
    5    HA   ILE   2           HA       ILE   2  -7.415   6.917  -0.422
    6    HB   ILE   2           HB       ILE   2  -4.880   8.404   0.218
    7   HG12  ILE   2          2HG1      ILE   2  -6.121   8.091   2.634
    8   HG13  ILE   2          3HG1      ILE   2  -6.404   6.520   1.893
    9   HG21  ILE   2          1HG2      ILE   2  -6.614   9.822   1.462
   10   HG22  ILE   2          2HG2      ILE   2  -6.596   9.901  -0.299
   11   HG23  ILE   2          3HG2      ILE   2  -7.816   8.932   0.528
   12   HD11  ILE   2          3HD1      ILE   2  -3.779   6.857   1.365
   13   HD12  ILE   2          1HD1      ILE   2  -3.926   7.719   2.896
   14   HD13  ILE   2          2HD1      ILE   2  -4.413   6.027   2.785
   15    H    ARG   3           H        ARG   3  -7.662   8.820  -1.790
   16    HA   ARG   3           HA       ARG   3  -5.749   9.019  -3.998
   17    HB2  ARG   3           2HB      ARG   3  -7.620   8.999  -5.638
   18    HB3  ARG   3           3HB      ARG   3  -7.390   7.458  -4.822
   19    HG2  ARG   3           2HG      ARG   3  -9.221   8.387  -3.200
   20    HG3  ARG   3           3HG      ARG   3  -9.610   9.424  -4.574
   21    HD2  ARG   3           2HD      ARG   3 -10.240   7.646  -5.906
   22    HD3  ARG   3           3HD      ARG   3  -9.277   6.487  -4.991
   23    HE   ARG   3           HE       ARG   3 -11.986   7.248  -4.490
   24   HH11  ARG   3          1HH1      ARG   3  -9.047   6.132  -2.994
   25   HH12  ARG   3          2HH1      ARG   3  -9.857   5.395  -1.651
   26   HH21  ARG   3          1HH2      ARG   3 -13.063   6.281  -2.727
   27   HH22  ARG   3          2HH2      ARG   3 -12.141   5.480  -1.501
   28    H    CYS   4           H        CYS   4  -8.657  10.315  -2.447
   29    HA   CYS   4           HA       CYS   4  -7.960  12.983  -3.472
   30    HB2  CYS   4           2HB      CYS   4 -10.527  11.653  -2.776
   31    HB3  CYS   4           3HB      CYS   4 -10.404  13.378  -2.443
   32    HA   PRO   5           HA       PRO   5  -6.932  14.520   0.505
   33    HB2  PRO   5           2HB      PRO   5  -8.027  17.004   0.477
   34    HB3  PRO   5           3HB      PRO   5  -6.602  16.571  -0.476
   35    HG2  PRO   5           2HG      PRO   5  -9.464  16.769  -1.331
   36    HG3  PRO   5           3HG      PRO   5  -8.005  17.332  -2.167
   37    HD2  PRO   5           2HD      PRO   5  -9.264  15.027  -2.827
   38    HD3  PRO   5           3HD      PRO   5  -7.507  15.232  -2.978
   39    H    LYS   6           H        LYS   6  -8.432  12.878   1.471
   40    HA   LYS   6           HA       LYS   6 -10.101  12.260   2.895
   41    HB2  LYS   6           2HB      LYS   6  -9.977  15.167   3.716
   42    HB3  LYS   6           3HB      LYS   6 -10.618  13.840   4.675
   43    HG2  LYS   6           2HG      LYS   6  -8.090  12.970   4.139
   44    HG3  LYS   6           3HG      LYS   6  -7.859  14.715   4.277
   45    HD2  LYS   6           2HD      LYS   6  -9.436  14.303   6.409
   46    HD3  LYS   6           3HD      LYS   6  -8.640  12.729   6.326
   47    HE2  LYS   6           2HE      LYS   6  -6.902  15.103   6.046
   48    HE3  LYS   6           3HE      LYS   6  -7.620  14.843   7.634
   49    HZ1  LYS   6           3HZ      LYS   6  -5.986  13.405   7.991
   50    HZ2  LYS   6           1HZ      LYS   6  -5.481  13.449   6.377
   51    HZ3  LYS   6           2HZ      LYS   6  -6.701  12.379   6.852
   52    H    SER   7           H        SER   7 -11.359  12.173   0.763
   53    HA   SER   7           HA       SER   7 -13.989  12.987   1.213
   54    HB2  SER   7           2HB      SER   7 -14.090  14.607  -0.826
   55    HB3  SER   7           3HB      SER   7 -13.545  15.228   0.731
   56    HG   SER   7           HG       SER   7 -12.253  15.626  -1.330
   57    H    TRP   8           H        TRP   8 -15.049  11.377   0.288
   58    HA   TRP   8           HA       TRP   8 -13.907   9.928  -1.936
   59    HB2  TRP   8           2HB      TRP   8 -16.298   9.545  -0.163
   60    HB3  TRP   8           3HB      TRP   8 -16.150   8.624  -1.657
   61    HD1  TRP   8           HD1      TRP   8 -13.066   9.392   0.475
   62    HE1  TRP   8           HE1      TRP   8 -12.162   7.182   1.437
   63    HE3  TRP   8           HE3      TRP   8 -16.842   6.267  -0.981
   64    HZ2  TRP   8           HZ2      TRP   8 -12.945   4.473   1.562
   65    HZ3  TRP   8           HZ3      TRP   8 -16.687   3.881  -0.401
   66    HH2  TRP   8           HH2      TRP   8 -14.778   3.005   0.844
   67    H    LYS   9           H        LYS   9 -14.114  12.080  -3.185
   68    HA   LYS   9           HA       LYS   9 -16.666  12.013  -4.654
   69    HB2  LYS   9           2HB      LYS   9 -15.098  14.374  -3.663
   70    HB3  LYS   9           3HB      LYS   9 -16.126  14.523  -5.083
   71    HG2  LYS   9           2HG      LYS   9 -17.924  13.453  -3.495
   72    HG3  LYS   9           3HG      LYS   9 -16.869  14.100  -2.235
   73    HD2  LYS   9           2HD      LYS   9 -17.903  15.753  -4.532
   74    HD3  LYS   9           3HD      LYS   9 -18.742  15.618  -2.985
   75    HE2  LYS   9           2HE      LYS   9 -16.718  16.461  -1.852
   76    HE3  LYS   9           3HE      LYS   9 -15.943  16.657  -3.424
   77    HZ1  LYS   9           3HZ      LYS   9 -16.784  18.754  -2.883
   78    HZ2  LYS   9           1HZ      LYS   9 -18.258  18.136  -2.328
   79    HZ3  LYS   9           2HZ      LYS   9 -17.909  18.131  -3.983
   80    H    CYS  10           H        CYS  10 -13.608  13.773  -5.102
   81    HA   CYS  10           HA       CYS  10 -12.249  13.988  -6.918
   82    HB2  CYS  10           2HB      CYS  10 -12.845  11.066  -7.392
   83    HB3  CYS  10           3HB      CYS  10 -11.389  11.951  -7.835
   84    H    LYS  11           H        LYS  11 -13.878  15.337  -7.948
   85    HA   LYS  11           HA       LYS  11 -15.880  14.509  -9.653
   86    HB2  LYS  11           2HB      LYS  11 -14.069  16.918  -9.832
   87    HB3  LYS  11           3HB      LYS  11 -15.477  16.690 -10.861
   88    HG2  LYS  11           2HG      LYS  11 -16.911  16.641  -8.876
   89    HG3  LYS  11           3HG      LYS  11 -15.493  16.898  -7.856
   90    HD2  LYS  11           2HD      LYS  11 -15.080  19.027  -9.086
   91    HD3  LYS  11           3HD      LYS  11 -16.606  18.779  -9.936
   92    HE2  LYS  11           2HE      LYS  11 -17.780  18.769  -7.770
   93    HE3  LYS  11           3HE      LYS  11 -16.248  19.079  -6.955
   94    HZ1  LYS  11           3HZ      LYS  11 -17.980  20.968  -7.858
   95    HZ2  LYS  11           1HZ      LYS  11 -16.787  20.949  -9.058
   96    HZ3  LYS  11           2HZ      LYS  11 -16.360  21.233  -7.446
   97    H    ALA  12           H        ALA  12 -15.805  13.177 -11.328
   98    HA   ALA  12           HA       ALA  12 -13.553  12.227 -12.606
   99    HB1  ALA  12           1HB      ALA  12 -15.780  11.193 -12.753
  100    HB2  ALA  12           2HB      ALA  12 -16.300  12.498 -13.820
  101    HB3  ALA  12           3HB      ALA  12 -15.028  11.391 -14.336
  102    H    PHE  13           H        PHE  13 -15.556  15.013 -13.450
  103    HA   PHE  13           HA       PHE  13 -14.419  15.608 -15.932
  104    HB2  PHE  13           2HB      PHE  13 -16.492  16.635 -14.822
  105    HB3  PHE  13           3HB      PHE  13 -15.370  17.710 -13.994
  106    HD1  PHE  13           HD2      PHE  13 -13.919  19.234 -15.347
  107    HD2  PHE  13           HD1      PHE  13 -17.127  17.015 -17.051
  108    HE1  PHE  13           HE2      PHE  13 -13.918  20.735 -17.296
  109    HE2  PHE  13           HE1      PHE  13 -17.130  18.512 -19.004
  110    HZ   PHE  13           HZ       PHE  13 -15.525  20.376 -19.128
  111    H    LYS  14           H        LYS  14 -13.750  17.326 -12.877
  112    HA   LYS  14           HA       LYS  14 -11.505  18.703 -13.748
  113    HB2  LYS  14           2HB      LYS  14 -12.769  19.083 -11.609
  114    HB3  LYS  14           3HB      LYS  14 -11.945  17.682 -10.939
  115    HG2  LYS  14           2HG      LYS  14 -10.510  19.236 -10.182
  116    HG3  LYS  14           3HG      LYS  14  -9.826  19.089 -11.803
  117    HD2  LYS  14           2HD      LYS  14 -11.299  20.968 -12.521
  118    HD3  LYS  14           3HD      LYS  14 -11.797  21.160 -10.838
  119    HE2  LYS  14           2HE      LYS  14  -9.588  21.740 -10.169
  120    HE3  LYS  14           3HE      LYS  14  -8.924  21.273 -11.734
  121    HZ1  LYS  14           3HZ      LYS  14  -9.463  23.233 -12.629
  122    HZ2  LYS  14           1HZ      LYS  14  -9.595  23.783 -11.034
  123    HZ3  LYS  14           2HZ      LYS  14 -10.977  23.293 -11.876
  124    H    GLN  15           H        GLN  15 -11.725  15.510 -12.228
  125    HA   GLN  15           HA       GLN  15  -9.042  14.960 -11.871
  126    HB2  GLN  15           2HB      GLN  15 -11.397  13.210 -12.505
  127    HB3  GLN  15           3HB      GLN  15  -9.786  12.522 -12.354
  128    HG2  GLN  15           2HG      GLN  15 -10.390  14.261 -10.134
  129    HG3  GLN  15           3HG      GLN  15 -11.607  12.999 -10.315
  130   HE21  GLN  15          1HE2      GLN  15  -8.311  13.719  -9.572
  131   HE22  GLN  15          2HE2      GLN  15  -7.868  12.142  -9.026
  132    H    ARG  16           H        ARG  16 -11.020  14.436 -14.773
  133    HA   ARG  16           HA       ARG  16  -8.886  13.357 -16.318
  134    HB2  ARG  16           2HB      ARG  16 -11.670  14.265 -16.847
  135    HB3  ARG  16           3HB      ARG  16 -10.578  14.157 -18.221
  136    HG2  ARG  16           2HG      ARG  16 -10.610  11.920 -18.229
  137    HG3  ARG  16           3HG      ARG  16 -10.547  11.812 -16.469
  138    HD2  ARG  16           2HD      ARG  16 -12.663  11.066 -16.717
  139    HD3  ARG  16           3HD      ARG  16 -13.031  12.789 -16.784
  140    HE   ARG  16           HE       ARG  16 -12.494  12.043 -19.376
  141   HH11  ARG  16          1HH1      ARG  16 -14.767  11.122 -16.906
  142   HH12  ARG  16          2HH1      ARG  16 -16.011  10.685 -18.030
  143   HH21  ARG  16          1HH2      ARG  16 -14.123  11.471 -20.867
  144   HH22  ARG  16          2HH2      ARG  16 -15.643  10.883 -20.283
  145    H    VAL  17           H        VAL  17 -10.360  16.571 -16.076
  146    HA   VAL  17           HA       VAL  17  -9.039  17.880 -18.114
  147    HB   VAL  17           HB       VAL  17  -9.725  18.998 -15.392
  148   HG11  VAL  17          1HG1      VAL  17  -8.758  20.240 -17.919
  149   HG12  VAL  17          2HG1      VAL  17  -9.931  21.120 -16.936
  150   HG13  VAL  17          3HG1      VAL  17  -8.379  20.644 -16.245
  151   HG21  VAL  17          3HG2      VAL  17 -11.399  18.015 -17.414
  152   HG22  VAL  17          1HG2      VAL  17 -11.861  18.973 -16.007
  153   HG23  VAL  17          2HG2      VAL  17 -11.481  19.773 -17.532
  154    H    LEU  18           H        LEU  18  -7.899  17.161 -14.850
  155    HA   LEU  18           HA       LEU  18  -5.592  18.672 -14.765
  156    HB2  LEU  18           2HB      LEU  18  -6.456  17.367 -12.884
  157    HB3  LEU  18           3HB      LEU  18  -5.994  15.877 -13.706
  158    HG   LEU  18           HG       LEU  18  -3.742  17.677 -13.378
  159   HD11  LEU  18          1HD1      LEU  18  -5.272  18.183 -11.357
  160   HD12  LEU  18          2HD1      LEU  18  -3.571  17.814 -11.073
  161   HD13  LEU  18          3HD1      LEU  18  -4.798  16.576 -10.805
  162   HD21  LEU  18          3HD2      LEU  18  -2.726  15.657 -12.454
  163   HD22  LEU  18          1HD2      LEU  18  -3.567  15.314 -13.966
  164   HD23  LEU  18          2HD2      LEU  18  -4.305  14.869 -12.427
  165    H    LYS  19           H        LYS  19  -6.074  15.470 -16.201
  166    HA   LYS  19           HA       LYS  19  -3.330  15.337 -17.110
  167    HB2  LYS  19           2HB      LYS  19  -5.638  13.516 -16.987
  168    HB3  LYS  19           3HB      LYS  19  -4.624  13.308 -18.409
  169    HG2  LYS  19           2HG      LYS  19  -2.662  13.060 -16.933
  170    HG3  LYS  19           3HG      LYS  19  -3.734  13.172 -15.536
  171    HD2  LYS  19           2HD      LYS  19  -3.893  11.077 -17.703
  172    HD3  LYS  19           3HD      LYS  19  -3.191  10.842 -16.101
  173    HE2  LYS  19           2HE      LYS  19  -5.415  11.463 -15.134
  174    HE3  LYS  19           3HE      LYS  19  -6.065  11.450 -16.773
  175    HZ1  LYS  19           3HZ      LYS  19  -6.066   9.328 -15.169
  176    HZ2  LYS  19           1HZ      LYS  19  -4.603   9.073 -15.980
  177    HZ3  LYS  19           2HZ      LYS  19  -6.041   9.218 -16.857
  178    H    ARG  20           H        ARG  20  -6.495  16.064 -18.432
  179    HA   ARG  20           HA       ARG  20  -5.999  15.907 -21.147
  180    HB2  ARG  20           2HB      ARG  20  -8.164  16.530 -19.830
  181    HB3  ARG  20           3HB      ARG  20  -7.596  18.183 -20.024
  182    HG2  ARG  20           2HG      ARG  20  -7.406  17.535 -22.537
  183    HG3  ARG  20           3HG      ARG  20  -8.527  16.247 -22.091
  184    HD2  ARG  20           2HD      ARG  20  -9.603  18.499 -20.903
  185    HD3  ARG  20           3HD      ARG  20  -9.000  19.091 -22.450
  186    HE   ARG  20           HE       ARG  20 -10.664  17.927 -23.500
  187   HH11  ARG  20          1HH1      ARG  20 -10.314  16.725 -20.251
  188   HH12  ARG  20          2HH1      ARG  20 -11.715  15.709 -20.337
  189   HH21  ARG  20          1HH2      ARG  20 -12.511  16.593 -23.625
  190   HH22  ARG  20          2HH2      ARG  20 -12.963  15.634 -22.256
  191    H    LEU  21           H        LEU  21  -5.356  18.605 -18.936
  192    HA   LEU  21           HA       LEU  21  -4.500  20.501 -20.764
  193    HB2  LEU  21           2HB      LEU  21  -4.809  20.596 -18.179
  194    HB3  LEU  21           3HB      LEU  21  -3.098  20.173 -18.144
  195    HG   LEU  21           HG       LEU  21  -3.087  22.287 -19.856
  196   HD11  LEU  21          1HD1      LEU  21  -5.626  22.418 -18.991
  197   HD12  LEU  21          2HD1      LEU  21  -4.672  23.834 -19.432
  198   HD13  LEU  21          3HD1      LEU  21  -4.829  23.370 -17.738
  199   HD21  LEU  21          3HD2      LEU  21  -2.802  22.230 -16.858
  200   HD22  LEU  21          1HD2      LEU  21  -2.331  23.599 -17.865
  201   HD23  LEU  21          2HD2      LEU  21  -1.531  22.040 -18.066
  202    H    LEU  22           H        LEU  22  -2.803  17.729 -19.454
  203    HA   LEU  22           HA       LEU  22  -0.242  18.493 -20.500
  204    HB2  LEU  22           2HB      LEU  22  -1.363  16.028 -19.228
  205    HB3  LEU  22           3HB      LEU  22   0.215  15.983 -20.012
  206    HG   LEU  22           HG       LEU  22  -0.394  17.987 -17.863
  207   HD11  LEU  22          1HD1      LEU  22   0.212  16.522 -16.168
  208   HD12  LEU  22          2HD1      LEU  22   0.900  15.349 -17.290
  209   HD13  LEU  22          3HD1      LEU  22  -0.849  15.544 -17.181
  210   HD21  LEU  22          3HD2      LEU  22   1.842  18.380 -17.839
  211   HD22  LEU  22          1HD2      LEU  22   1.691  17.850 -19.514
  212   HD23  LEU  22          2HD2      LEU  22   2.252  16.722 -18.280
  213    H    ALA  23           H        ALA  23  -2.526  15.878 -21.327
  214    HA   ALA  23           HA       ALA  23  -1.281  14.894 -23.573
  215    HB1  ALA  23           1HB      ALA  23  -3.087  13.605 -23.652
  216    HB2  ALA  23           2HB      ALA  23  -3.769  14.569 -22.341
  217    HB3  ALA  23           3HB      ALA  23  -4.121  14.986 -24.018
  218    H    MET  24           H        MET  24  -3.398  17.711 -23.306
  219    HA   MET  24           HA       MET  24  -3.388  18.228 -26.132
  220    HB2  MET  24           2HB      MET  24  -5.198  18.884 -24.427
  221    HB3  MET  24           3HB      MET  24  -4.133  20.216 -23.999
  222    HG2  MET  24           2HG      MET  24  -5.657  21.095 -25.544
  223    HG3  MET  24           3HG      MET  24  -4.160  20.853 -26.441
  224    HE1  MET  24           3HE      MET  24  -7.942  20.131 -27.998
  225    HE2  MET  24           1HE      MET  24  -8.130  19.372 -26.416
  226    HE3  MET  24           2HE      MET  24  -7.463  21.000 -26.539
  227    H    LEU  25           H        LEU  25  -1.695  19.490 -23.303
  228    HA   LEU  25           HA       LEU  25  -0.432  21.687 -24.403
  229    HB2  LEU  25           2HB      LEU  25  -0.230  21.334 -22.086
  230    HB3  LEU  25           3HB      LEU  25   0.443  19.721 -22.310
  231    HG   LEU  25           HG       LEU  25   2.120  21.776 -23.490
  232   HD11  LEU  25          1HD1      LEU  25   1.539  21.931 -20.537
  233   HD12  LEU  25          2HD1      LEU  25   1.257  23.190 -21.739
  234   HD13  LEU  25          3HD1      LEU  25   2.905  22.704 -21.342
  235   HD21  LEU  25          3HD2      LEU  25   3.000  20.115 -21.210
  236   HD22  LEU  25          1HD2      LEU  25   3.778  20.418 -22.764
  237   HD23  LEU  25          2HD2      LEU  25   2.456  19.256 -22.651
  238    H    ARG  26           H        ARG  26   0.854  18.364 -24.225
  239    HA   ARG  26           HA       ARG  26   2.506  18.987 -26.582
  240    HB2  ARG  26           2HB      ARG  26   3.982  18.888 -24.681
  241    HB3  ARG  26           3HB      ARG  26   3.263  17.376 -24.143
  242    HG2  ARG  26           2HG      ARG  26   4.214  17.065 -26.818
  243    HG3  ARG  26           3HG      ARG  26   5.495  17.740 -25.809
  244    HD2  ARG  26           2HD      ARG  26   5.632  15.882 -24.500
  245    HD3  ARG  26           3HD      ARG  26   3.923  15.491 -24.690
  246    HE   ARG  26           HE       ARG  26   5.366  15.150 -27.123
  247   HH11  ARG  26          1HH1      ARG  26   4.676  13.668 -24.049
  248   HH12  ARG  26          2HH1      ARG  26   4.946  12.055 -24.619
  249   HH21  ARG  26          1HH2      ARG  26   5.724  13.030 -27.886
  250   HH22  ARG  26          2HH2      ARG  26   5.543  11.693 -26.801
  251    H    GLN  27           H        GLN  27   1.972  16.004 -24.732
  252    HA   GLN  27           HA       GLN  27   0.135  14.798 -26.447
  253    HB2  GLN  27           2HB      GLN  27   2.569  15.027 -27.717
  254    HB3  GLN  27           3HB      GLN  27   2.630  13.397 -27.060
  255    HG2  GLN  27           2HG      GLN  27   0.778  12.701 -28.290
  256    HG3  GLN  27           3HG      GLN  27   0.261  14.354 -28.618
  257   HE21  GLN  27          1HE2      GLN  27   0.163  13.883 -30.836
  258   HE22  GLN  27          2HE2      GLN  27   1.593  13.773 -31.798
  259    H    HIS  28           H        HIS  28   0.799  14.967 -23.662
  260    HA   HIS  28           HA       HIS  28   2.025  12.758 -22.553
  261    HB2  HIS  28           2HB      HIS  28   1.140  14.730 -21.297
  262    HB3  HIS  28           3HB      HIS  28  -0.483  14.076 -21.494
  263    HD1  HIS  28           HD1      HIS  28  -1.117  12.024 -20.062
  264    HD2  HIS  28           HD2      HIS  28   2.736  13.428 -19.398
  265    HE1  HIS  28           HE1      HIS  28  -0.338  10.881 -17.962
  266    H    ALA  29           H        ALA  29   1.281  10.743 -21.798
  267    HA   ALA  29           HA       ALA  29  -1.345   9.805 -22.570
  268    HB1  ALA  29           1HB      ALA  29  -0.757   8.244 -24.162
  269    HB2  ALA  29           2HB      ALA  29   0.310   9.589 -24.568
  270    HB3  ALA  29           3HB      ALA  29   0.934   8.212 -23.660
  271    H    PHE  30           H        PHE  30  -2.022   8.072 -21.374
  272    HA   PHE  30           HA       PHE  30  -0.737   7.539 -18.940
  273    HB2  PHE  30           2HB      PHE  30  -3.195   7.259 -19.447
  274    HB3  PHE  30           3HB      PHE  30  -2.782   5.761 -20.274
  275    HD1  PHE  30           HD1      PHE  30  -2.404   7.464 -16.987
  276    HD2  PHE  30           HD2      PHE  30  -2.738   3.779 -19.092
  277    HE1  PHE  30           HE1      PHE  30  -2.522   6.256 -14.847
  278    HE2  PHE  30           HE2      PHE  30  -2.857   2.566 -16.955
  279    HZ   PHE  30           HZ       PHE  30  -2.750   3.804 -14.829
  Start of MODEL    9
    1    H1   GLY   1           H        GLY   1  -4.248   4.317  -6.917
    2    HA2  GLY   1           2HA      GLY   1  -5.160   5.539  -9.228
    3    HA3  GLY   1           3HA      GLY   1  -6.116   5.348  -7.766
    4    H    ILE   2           H        ILE   2  -7.162   7.310  -7.915
    5    HA   ILE   2           HA       ILE   2  -5.615   9.754  -8.143
    6    HB   ILE   2           HB       ILE   2  -8.563   9.599  -7.564
    7   HG12  ILE   2          2HG1      ILE   2  -8.439   9.966 -10.260
    8   HG13  ILE   2          3HG1      ILE   2  -7.099   8.851 -10.015
    9   HG21  ILE   2          1HG2      ILE   2  -8.459  11.713  -9.001
   10   HG22  ILE   2          2HG2      ILE   2  -7.796  11.800  -7.370
   11   HG23  ILE   2          3HG2      ILE   2  -6.715  11.642  -8.754
   12   HD11  ILE   2          3HD1      ILE   2  -9.563   8.103  -8.629
   13   HD12  ILE   2          1HD1      ILE   2  -9.681   8.123 -10.388
   14   HD13  ILE   2          2HD1      ILE   2  -8.458   7.128  -9.597
   15    H    ARG   3           H        ARG   3  -5.852  11.507  -6.585
   16    HA   ARG   3           HA       ARG   3  -6.402  10.584  -3.847
   17    HB2  ARG   3           2HB      ARG   3  -3.916  10.689  -4.467
   18    HB3  ARG   3           3HB      ARG   3  -4.120  12.435  -4.507
   19    HG2  ARG   3           2HG      ARG   3  -4.060  12.595  -2.288
   20    HG3  ARG   3           3HG      ARG   3  -5.173  11.242  -2.076
   21    HD2  ARG   3           2HD      ARG   3  -3.421   9.659  -2.205
   22    HD3  ARG   3           3HD      ARG   3  -2.282  10.861  -2.809
   23    HE   ARG   3           HE       ARG   3  -3.015  10.385  -0.064
   24   HH11  ARG   3          1HH1      ARG   3  -1.687  12.660  -2.341
   25   HH12  ARG   3          2HH1      ARG   3  -0.829  13.563  -1.137
   26   HH21  ARG   3          1HH2      ARG   3  -1.889  11.566   1.530
   27   HH22  ARG   3          2HH2      ARG   3  -0.944  12.939   1.065
   28    H    CYS   4           H        CYS   4  -8.250  11.679  -3.464
   29    HA   CYS   4           HA       CYS   4  -8.479  14.477  -4.236
   30    HB2  CYS   4           2HB      CYS   4 -10.343  12.325  -3.468
   31    HB3  CYS   4           3HB      CYS   4 -10.778  13.927  -2.882
   32    HA   PRO   5           HA       PRO   5  -7.622  16.247  -0.315
   33    HB2  PRO   5           2HB      PRO   5  -9.487  18.212  -0.136
   34    HB3  PRO   5           3HB      PRO   5  -8.106  18.295  -1.237
   35    HG2  PRO   5           2HG      PRO   5 -10.940  17.514  -1.807
   36    HG3  PRO   5           3HG      PRO   5  -9.851  18.544  -2.754
   37    HD2  PRO   5           2HD      PRO   5 -10.321  15.953  -3.385
   38    HD3  PRO   5           3HD      PRO   5  -8.762  16.744  -3.695
   39    H    LYS   6           H        LYS   6  -8.372  14.187   0.721
   40    HA   LYS   6           HA       LYS   6  -9.577  13.031   2.271
   41    HB2  LYS   6           2HB      LYS   6  -9.971  15.891   3.108
   42    HB3  LYS   6           3HB      LYS   6 -10.699  14.575   4.019
   43    HG2  LYS   6           2HG      LYS   6  -8.805  14.383   5.143
   44    HG3  LYS   6           3HG      LYS   6  -8.023  13.848   3.654
   45    HD2  LYS   6           2HD      LYS   6  -8.039  16.532   3.286
   46    HD3  LYS   6           3HD      LYS   6  -7.888  16.440   5.042
   47    HE2  LYS   6           2HE      LYS   6  -6.100  15.095   3.019
   48    HE3  LYS   6           3HE      LYS   6  -5.695  16.510   3.988
   49    HZ1  LYS   6           3HZ      LYS   6  -5.568  13.750   4.686
   50    HZ2  LYS   6           1HZ      LYS   6  -6.492  14.622   5.803
   51    HZ3  LYS   6           2HZ      LYS   6  -4.899  15.088   5.475
   52    H    SER   7           H        SER   7 -10.937  12.597   0.214
   53    HA   SER   7           HA       SER   7 -13.620  12.407   0.950
   54    HB2  SER   7           2HB      SER   7 -14.498  13.976  -0.937
   55    HB3  SER   7           3HB      SER   7 -14.038  14.680   0.612
   56    HG   SER   7           HG       SER   7 -13.095  15.289  -1.765
   57    H    TRP   8           H        TRP   8 -14.148  10.569  -0.006
   58    HA   TRP   8           HA       TRP   8 -12.824   9.724  -2.433
   59    HB2  TRP   8           2HB      TRP   8 -14.708   8.430  -0.488
   60    HB3  TRP   8           3HB      TRP   8 -14.416   7.691  -2.060
   61    HD1  TRP   8           HD1      TRP   8 -11.555   9.421  -0.216
   62    HE1  TRP   8           HE1      TRP   8  -9.837   7.643   0.498
   63    HE3  TRP   8           HE3      TRP   8 -14.185   5.212  -1.443
   64    HZ2  TRP   8           HZ2      TRP   8  -9.624   4.828   0.535
   65    HZ3  TRP   8           HZ3      TRP   8 -13.153   3.016  -1.037
   66    HH2  TRP   8           HH2      TRP   8 -10.919   2.830  -0.069
   67    H    LYS   9           H        LYS   9 -13.921  11.716  -3.471
   68    HA   LYS   9           HA       LYS   9 -16.412  10.786  -4.734
   69    HB2  LYS   9           2HB      LYS   9 -15.754  13.502  -3.633
   70    HB3  LYS   9           3HB      LYS   9 -16.917  13.325  -4.940
   71    HG2  LYS   9           2HG      LYS   9 -18.397  12.089  -3.604
   72    HG3  LYS   9           3HG      LYS   9 -17.166  11.791  -2.374
   73    HD2  LYS   9           2HD      LYS   9 -17.571  14.624  -2.815
   74    HD3  LYS   9           3HD      LYS   9 -19.075  13.814  -2.371
   75    HE2  LYS   9           2HE      LYS   9 -18.230  13.103  -0.324
   76    HE3  LYS   9           3HE      LYS   9 -16.555  13.299  -0.837
   77    HZ1  LYS   9           3HZ      LYS   9 -16.551  15.340  -0.016
   78    HZ2  LYS   9           1HZ      LYS   9 -18.122  15.110   0.567
   79    HZ3  LYS   9           2HZ      LYS   9 -17.879  15.784  -0.965
   80    H    CYS  10           H        CYS  10 -14.308  13.613  -5.216
   81    HA   CYS  10           HA       CYS  10 -13.256  14.423  -7.063
   82    HB2  CYS  10           2HB      CYS  10 -12.968  11.539  -7.909
   83    HB3  CYS  10           3HB      CYS  10 -11.924  12.892  -8.331
   84    H    LYS  11           H        LYS  11 -15.045  15.431  -7.987
   85    HA   LYS  11           HA       LYS  11 -17.081  14.296  -9.460
   86    HB2  LYS  11           2HB      LYS  11 -15.814  16.965  -9.339
   87    HB3  LYS  11           3HB      LYS  11 -16.745  16.630 -10.793
   88    HG2  LYS  11           2HG      LYS  11 -18.719  16.648  -9.700
   89    HG3  LYS  11           3HG      LYS  11 -18.038  15.949  -8.229
   90    HD2  LYS  11           2HD      LYS  11 -18.233  18.009  -7.373
   91    HD3  LYS  11           3HD      LYS  11 -16.810  18.397  -8.342
   92    HE2  LYS  11           2HE      LYS  11 -18.117  19.326 -10.070
   93    HE3  LYS  11           3HE      LYS  11 -19.602  18.622  -9.432
   94    HZ1  LYS  11           3HZ      LYS  11 -18.782  20.136  -7.376
   95    HZ2  LYS  11           1HZ      LYS  11 -19.885  20.645  -8.553
   96    HZ3  LYS  11           2HZ      LYS  11 -18.252  21.064  -8.688
   97    H    ALA  12           H        ALA  12 -17.425  13.870 -11.646
   98    HA   ALA  12           HA       ALA  12 -15.430  12.589 -13.055
   99    HB1  ALA  12           1HB      ALA  12 -17.034  12.147 -14.558
  100    HB2  ALA  12           2HB      ALA  12 -18.106  12.940 -13.402
  101    HB3  ALA  12           3HB      ALA  12 -17.450  13.849 -14.763
  102    H    PHE  13           H        PHE  13 -16.448  15.967 -13.253
  103    HA   PHE  13           HA       PHE  13 -14.971  16.736 -15.489
  104    HB2  PHE  13           2HB      PHE  13 -16.720  18.074 -14.169
  105    HB3  PHE  13           3HB      PHE  13 -15.395  18.523 -13.101
  106    HD1  PHE  13           HD1      PHE  13 -15.891  18.292 -16.796
  107    HD2  PHE  13           HD2      PHE  13 -14.589  20.626 -13.484
  108    HE1  PHE  13           HE1      PHE  13 -15.284  20.119 -18.327
  109    HE2  PHE  13           HE2      PHE  13 -13.981  22.458 -15.009
  110    HZ   PHE  13           HZ       PHE  13 -14.329  22.207 -17.435
  111    H    LYS  14           H        LYS  14 -14.072  17.335 -12.088
  112    HA   LYS  14           HA       LYS  14 -11.459  18.141 -12.556
  113    HB2  LYS  14           2HB      LYS  14 -12.537  18.438 -10.398
  114    HB3  LYS  14           3HB      LYS  14 -12.603  16.697 -10.159
  115    HG2  LYS  14           2HG      LYS  14 -10.269  16.545  -9.877
  116    HG3  LYS  14           3HG      LYS  14 -10.013  18.179 -10.492
  117    HD2  LYS  14           2HD      LYS  14 -11.765  17.907  -8.122
  118    HD3  LYS  14           3HD      LYS  14 -10.046  17.587  -7.879
  119    HE2  LYS  14           2HE      LYS  14 -10.929  20.042  -9.343
  120    HE3  LYS  14           3HE      LYS  14 -10.968  20.002  -7.581
  121    HZ1  LYS  14           3HZ      LYS  14  -8.888  20.880  -8.154
  122    HZ2  LYS  14           1HZ      LYS  14  -8.619  19.724  -9.359
  123    HZ3  LYS  14           2HZ      LYS  14  -8.570  19.274  -7.729
  124    H    GLN  15           H        GLN  15 -12.770  14.894 -12.127
  125    HA   GLN  15           HA       GLN  15 -10.399  13.463 -11.889
  126    HB2  GLN  15           2HB      GLN  15 -13.022  12.694 -13.171
  127    HB3  GLN  15           3HB      GLN  15 -11.708  11.558 -12.893
  128    HG2  GLN  15           2HG      GLN  15 -12.457  13.082 -10.521
  129    HG3  GLN  15           3HG      GLN  15 -13.757  12.081 -11.166
  130   HE21  GLN  15          1HE2      GLN  15 -10.286  11.891 -10.453
  131   HE22  GLN  15          2HE2      GLN  15 -10.332  10.289  -9.808
  132    H    ARG  16           H        ARG  16 -12.178  14.374 -14.827
  133    HA   ARG  16           HA       ARG  16 -10.294  13.181 -16.602
  134    HB2  ARG  16           2HB      ARG  16 -12.751  14.775 -16.823
  135    HB3  ARG  16           3HB      ARG  16 -11.593  15.060 -18.115
  136    HG2  ARG  16           2HG      ARG  16 -12.135  13.156 -19.108
  137    HG3  ARG  16           3HG      ARG  16 -11.872  12.242 -17.621
  138    HD2  ARG  16           2HD      ARG  16 -14.067  12.227 -17.088
  139    HD3  ARG  16           3HD      ARG  16 -14.336  13.853 -17.713
  140    HE   ARG  16           HE       ARG  16 -13.881  11.880 -19.756
  141   HH11  ARG  16          1HH1      ARG  16 -16.256  13.409 -17.721
  142   HH12  ARG  16          2HH1      ARG  16 -17.582  13.053 -18.778
  143   HH21  ARG  16          1HH2      ARG  16 -15.618  11.405 -21.156
  144   HH22  ARG  16          2HH2      ARG  16 -17.217  11.912 -20.731
  145    H    VAL  17           H        VAL  17 -10.859  16.488 -15.462
  146    HA   VAL  17           HA       VAL  17  -9.074  17.875 -17.044
  147    HB   VAL  17           HB       VAL  17  -9.647  18.354 -14.116
  148   HG11  VAL  17          1HG1      VAL  17  -9.147  20.785 -14.994
  149   HG12  VAL  17          2HG1      VAL  17  -7.842  19.721 -14.465
  150   HG13  VAL  17          3HG1      VAL  17  -8.182  19.914 -16.185
  151   HG21  VAL  17          3HG2      VAL  17 -11.282  18.599 -16.453
  152   HG22  VAL  17          1HG2      VAL  17 -11.691  18.925 -14.768
  153   HG23  VAL  17          2HG2      VAL  17 -10.988  20.197 -15.768
  154    H    LEU  18           H        LEU  18  -8.436  15.997 -14.122
  155    HA   LEU  18           HA       LEU  18  -5.821  16.712 -13.608
  156    HB2  LEU  18           2HB      LEU  18  -7.241  15.197 -12.237
  157    HB3  LEU  18           3HB      LEU  18  -6.946  13.923 -13.418
  158    HG   LEU  18           HG       LEU  18  -4.510  14.098 -12.883
  159   HD11  LEU  18          1HD1      LEU  18  -4.143  16.179 -11.963
  160   HD12  LEU  18          2HD1      LEU  18  -4.154  15.150 -10.531
  161   HD13  LEU  18          3HD1      LEU  18  -5.581  16.101 -10.944
  162   HD21  LEU  18          3HD2      LEU  18  -4.832  12.415 -11.464
  163   HD22  LEU  18          1HD2      LEU  18  -6.555  12.785 -11.542
  164   HD23  LEU  18          2HD2      LEU  18  -5.561  13.477 -10.259
  165    H    LYS  19           H        LYS  19  -7.028  14.287 -15.893
  166    HA   LYS  19           HA       LYS  19  -4.359  13.650 -16.807
  167    HB2  LYS  19           2HB      LYS  19  -6.545  12.144 -16.690
  168    HB3  LYS  19           3HB      LYS  19  -6.788  12.790 -18.308
  169    HG2  LYS  19           2HG      LYS  19  -4.452  11.998 -18.842
  170    HG3  LYS  19           3HG      LYS  19  -4.491  11.136 -17.302
  171    HD2  LYS  19           2HD      LYS  19  -6.880  10.650 -18.868
  172    HD3  LYS  19           3HD      LYS  19  -5.417  10.210 -19.753
  173    HE2  LYS  19           2HE      LYS  19  -5.876   8.259 -18.614
  174    HE3  LYS  19           3HE      LYS  19  -4.747   9.053 -17.516
  175    HZ1  LYS  19           3HZ      LYS  19  -7.264   9.954 -16.819
  176    HZ2  LYS  19           1HZ      LYS  19  -6.290   8.873 -15.957
  177    HZ3  LYS  19           2HZ      LYS  19  -7.432   8.288 -17.058
  178    H    ARG  20           H        ARG  20  -7.098  15.568 -17.864
  179    HA   ARG  20           HA       ARG  20  -6.450  16.027 -20.512
  180    HB2  ARG  20           2HB      ARG  20  -8.310  17.021 -18.717
  181    HB3  ARG  20           3HB      ARG  20  -7.371  18.442 -19.159
  182    HG2  ARG  20           2HG      ARG  20  -7.797  17.321 -21.592
  183    HG3  ARG  20           3HG      ARG  20  -9.273  16.870 -20.737
  184    HD2  ARG  20           2HD      ARG  20  -8.185  19.677 -20.819
  185    HD3  ARG  20           3HD      ARG  20  -9.368  19.057 -21.971
  186    HE   ARG  20           HE       ARG  20 -10.132  18.735 -19.214
  187   HH11  ARG  20          1HH1      ARG  20 -10.168  20.847 -21.981
  188   HH12  ARG  20          2HH1      ARG  20 -11.549  21.744 -21.442
  189   HH21  ARG  20          1HH2      ARG  20 -11.950  19.908 -18.493
  190   HH22  ARG  20          2HH2      ARG  20 -12.561  21.210 -19.457
  191    H    LEU  21           H        LEU  21  -5.282  17.724 -17.625
  192    HA   LEU  21           HA       LEU  21  -3.807  19.730 -18.838
  193    HB2  LEU  21           2HB      LEU  21  -4.116  18.685 -16.251
  194    HB3  LEU  21           3HB      LEU  21  -2.383  18.686 -16.570
  195    HG   LEU  21           HG       LEU  21  -4.236  21.066 -16.648
  196   HD11  LEU  21          1HD1      LEU  21  -3.492  21.616 -14.599
  197   HD12  LEU  21          2HD1      LEU  21  -1.866  21.008 -14.908
  198   HD13  LEU  21          3HD1      LEU  21  -3.157  19.889 -14.469
  199   HD21  LEU  21          3HD2      LEU  21  -2.769  21.850 -18.154
  200   HD22  LEU  21          1HD2      LEU  21  -1.565  20.618 -17.774
  201   HD23  LEU  21          2HD2      LEU  21  -1.706  22.055 -16.761
  202    H    LEU  22           H        LEU  22  -3.026  16.345 -18.374
  203    HA   LEU  22           HA       LEU  22  -0.280  16.617 -19.161
  204    HB2  LEU  22           2HB      LEU  22  -2.118  14.315 -18.642
  205    HB3  LEU  22           3HB      LEU  22  -0.554  14.046 -19.410
  206    HG   LEU  22           HG       LEU  22  -0.413  13.593 -17.039
  207   HD11  LEU  22          1HD1      LEU  22   1.290  15.206 -18.468
  208   HD12  LEU  22          2HD1      LEU  22   1.635  14.465 -16.906
  209   HD13  LEU  22          3HD1      LEU  22   1.031  16.120 -16.981
  210   HD21  LEU  22          3HD2      LEU  22  -0.803  16.384 -16.205
  211   HD22  LEU  22          1HD2      LEU  22  -1.267  14.882 -15.407
  212   HD23  LEU  22          2HD2      LEU  22  -2.267  15.535 -16.705
  213    H    ALA  23           H        ALA  23  -3.110  15.078 -20.697
  214    HA   ALA  23           HA       ALA  23  -2.002  14.438 -23.131
  215    HB1  ALA  23           1HB      ALA  23  -4.234  14.439 -24.036
  216    HB2  ALA  23           2HB      ALA  23  -4.279  13.816 -22.386
  217    HB3  ALA  23           3HB      ALA  23  -4.807  15.465 -22.721
  218    H    MET  24           H        MET  24  -3.298  17.551 -22.071
  219    HA   MET  24           HA       MET  24  -2.925  18.797 -24.633
  220    HB2  MET  24           2HB      MET  24  -4.679  19.564 -23.107
  221    HB3  MET  24           3HB      MET  24  -3.464  20.006 -21.915
  222    HG2  MET  24           2HG      MET  24  -2.920  21.256 -24.452
  223    HG3  MET  24           3HG      MET  24  -4.552  21.621 -23.898
  224    HE1  MET  24           3HE      MET  24  -2.876  24.020 -24.298
  225    HE2  MET  24           1HE      MET  24  -1.756  24.531 -23.034
  226    HE3  MET  24           2HE      MET  24  -1.330  23.193 -24.101
  227    H    LEU  25           H        LEU  25  -1.185  18.709 -21.562
  228    HA   LEU  25           HA       LEU  25   0.704  20.678 -21.992
  229    HB2  LEU  25           2HB      LEU  25   0.632  19.672 -19.871
  230    HB3  LEU  25           3HB      LEU  25   0.837  18.055 -20.541
  231    HG   LEU  25           HG       LEU  25   3.175  18.669 -21.141
  232   HD11  LEU  25          1HD1      LEU  25   2.638  21.164 -21.099
  233   HD12  LEU  25          2HD1      LEU  25   4.176  20.651 -20.408
  234   HD13  LEU  25          3HD1      LEU  25   2.823  21.050 -19.349
  235   HD21  LEU  25          3HD2      LEU  25   3.842  18.915 -18.591
  236   HD22  LEU  25          1HD2      LEU  25   3.182  17.413 -19.240
  237   HD23  LEU  25          2HD2      LEU  25   2.135  18.530 -18.362
  238    H    ARG  26           H        ARG  26   1.032  17.211 -22.770
  239    HA   ARG  26           HA       ARG  26   2.972  17.968 -24.853
  240    HB2  ARG  26           2HB      ARG  26   3.186  15.971 -22.680
  241    HB3  ARG  26           3HB      ARG  26   3.747  15.446 -24.262
  242    HG2  ARG  26           2HG      ARG  26   4.824  18.003 -23.876
  243    HG3  ARG  26           3HG      ARG  26   5.032  17.144 -22.348
  244    HD2  ARG  26           2HD      ARG  26   6.866  16.285 -23.308
  245    HD3  ARG  26           3HD      ARG  26   5.738  15.237 -24.166
  246    HE   ARG  26           HE       ARG  26   6.033  17.641 -25.590
  247   HH11  ARG  26          1HH1      ARG  26   7.817  14.769 -24.763
  248   HH12  ARG  26          2HH1      ARG  26   8.801  14.812 -26.188
  249   HH21  ARG  26          1HH2      ARG  26   7.322  17.709 -27.470
  250   HH22  ARG  26          2HH2      ARG  26   8.519  16.485 -27.727
  251    H    GLN  27           H        GLN  27   1.511  14.866 -23.929
  252    HA   GLN  27           HA       GLN  27  -0.441  14.741 -25.916
  253    HB2  GLN  27           2HB      GLN  27   0.753  13.091 -27.452
  254    HB3  GLN  27           3HB      GLN  27   1.188  14.787 -27.615
  255    HG2  GLN  27           2HG      GLN  27   3.170  14.370 -26.196
  256    HG3  GLN  27           3HG      GLN  27   2.753  12.657 -26.177
  257   HE21  GLN  27          1HE2      GLN  27   5.161  13.170 -27.060
  258   HE22  GLN  27          2HE2      GLN  27   5.269  13.047 -28.780
  259    H    HIS  28           H        HIS  28   0.021  13.947 -23.198
  260    HA   HIS  28           HA       HIS  28   0.517  11.268 -22.765
  261    HB2  HIS  28           2HB      HIS  28   0.117  12.954 -20.984
  262    HB3  HIS  28           3HB      HIS  28  -1.600  12.927 -21.378
  263    HD1  HIS  28           HD1      HIS  28   1.027  11.066 -19.549
  264    HD2  HIS  28           HD2      HIS  28  -2.952  10.541 -20.623
  265    HE1  HIS  28           HE1      HIS  28   0.200   9.148 -18.148
  266    H    ALA  29           H        ALA  29  -0.799   9.416 -22.615
  267    HA   ALA  29           HA       ALA  29  -3.533   9.379 -23.368
  268    HB1  ALA  29           1HB      ALA  29  -1.840   8.098 -25.467
  269    HB2  ALA  29           2HB      ALA  29  -3.512   8.653 -25.554
  270    HB3  ALA  29           3HB      ALA  29  -2.192   9.824 -25.559
  271    H    PHE  30           H        PHE  30  -3.492   8.136 -21.427
  272    HA   PHE  30           HA       PHE  30  -1.990   5.782 -21.087
  273    HB2  PHE  30           2HB      PHE  30  -3.177   7.056 -19.273
  274    HB3  PHE  30           3HB      PHE  30  -4.689   6.378 -19.866
  275    HD1  PHE  30           HD2      PHE  30  -5.130   3.970 -19.667
  276    HD2  PHE  30           HD1      PHE  30  -1.654   5.758 -17.985
  277    HE1  PHE  30           HE2      PHE  30  -4.788   1.977 -18.265
  278    HE2  PHE  30           HE1      PHE  30  -1.305   3.768 -16.581
  279    HZ   PHE  30           HZ       PHE  30  -2.874   1.875 -16.718
  Start of MODEL   10
    1    H1   GLY   1           H        GLY   1  -3.597   2.941  -5.731
    2    HA2  GLY   1           2HA      GLY   1  -5.310   3.269  -8.109
    3    HA3  GLY   1           3HA      GLY   1  -5.893   2.918  -6.488
    4    H    ILE   2           H        ILE   2  -7.258   4.836  -7.422
    5    HA   ILE   2           HA       ILE   2  -5.985   7.420  -7.074
    6    HB   ILE   2           HB       ILE   2  -8.929   6.965  -7.493
    7   HG12  ILE   2          2HG1      ILE   2  -7.944   7.507  -9.990
    8   HG13  ILE   2          3HG1      ILE   2  -6.692   6.456  -9.336
    9   HG21  ILE   2          1HG2      ILE   2  -8.384   9.161  -8.868
   10   HG22  ILE   2          2HG2      ILE   2  -8.692   9.202  -7.133
   11   HG23  ILE   2          3HG2      ILE   2  -7.035   9.238  -7.735
   12   HD11  ILE   2          3HD1      ILE   2  -8.911   5.592 -10.599
   13   HD12  ILE   2          1HD1      ILE   2  -7.999   4.641  -9.427
   14   HD13  ILE   2          2HD1      ILE   2  -9.440   5.522  -8.918
   15    H    ARG   3           H        ARG   3  -6.894   9.053  -5.637
   16    HA   ARG   3           HA       ARG   3  -8.627   8.334  -3.498
   17    HB2  ARG   3           2HB      ARG   3  -5.892   7.651  -3.170
   18    HB3  ARG   3           3HB      ARG   3  -6.216   9.024  -2.121
   19    HG2  ARG   3           2HG      ARG   3  -8.382   7.352  -1.715
   20    HG3  ARG   3           3HG      ARG   3  -7.006   6.255  -1.849
   21    HD2  ARG   3           2HD      ARG   3  -6.039   7.019   0.055
   22    HD3  ARG   3           3HD      ARG   3  -6.616   8.667  -0.186
   23    HE   ARG   3           HE       ARG   3  -8.692   6.788   0.474
   24   HH11  ARG   3          1HH1      ARG   3  -6.273   8.955   1.730
   25   HH12  ARG   3          2HH1      ARG   3  -7.069   9.168   3.254
   26   HH21  ARG   3          1HH2      ARG   3  -9.749   7.061   2.477
   27   HH22  ARG   3          2HH2      ARG   3  -9.045   8.090   3.678
   28    H    CYS   4           H        CYS   4  -9.138  10.104  -2.140
   29    HA   CYS   4           HA       CYS   4  -8.145  12.693  -3.140
   30    HB2  CYS   4           2HB      CYS   4 -10.880  11.736  -2.455
   31    HB3  CYS   4           3HB      CYS   4 -10.488  13.410  -2.076
   32    HA   PRO   5           HA       PRO   5  -6.874  13.844   0.898
   33    HB2  PRO   5           2HB      PRO   5  -7.583  16.462   1.014
   34    HB3  PRO   5           3HB      PRO   5  -6.245  15.872   0.021
   35    HG2  PRO   5           2HG      PRO   5  -9.050  16.541  -0.784
   36    HG3  PRO   5           3HG      PRO   5  -7.528  16.923  -1.610
   37    HD2  PRO   5           2HD      PRO   5  -9.123  14.872  -2.371
   38    HD3  PRO   5           3HD      PRO   5  -7.356  14.820  -2.536
   39    H    LYS   6           H        LYS   6  -8.599  12.395   1.797
   40    HA   LYS   6           HA       LYS   6 -10.333  11.960   3.210
   41    HB2  LYS   6           2HB      LYS   6  -9.373  14.657   4.124
   42    HB3  LYS   6           3HB      LYS   6 -10.723  13.863   4.924
   43    HG2  LYS   6           2HG      LYS   6  -9.194  11.876   5.246
   44    HG3  LYS   6           3HG      LYS   6  -7.876  12.931   4.729
   45    HD2  LYS   6           2HD      LYS   6  -8.058  14.288   6.601
   46    HD3  LYS   6           3HD      LYS   6  -9.724  13.797   6.918
   47    HE2  LYS   6           2HE      LYS   6  -8.920  12.371   8.426
   48    HE3  LYS   6           3HE      LYS   6  -8.242  11.446   7.087
   49    HZ1  LYS   6           3HZ      LYS   6  -6.171  12.416   7.359
   50    HZ2  LYS   6           1HZ      LYS   6  -6.689  12.200   8.956
   51    HZ3  LYS   6           2HZ      LYS   6  -6.773  13.730   8.239
   52    H    SER   7           H        SER   7 -11.609  12.169   1.101
   53    HA   SER   7           HA       SER   7 -14.079  13.351   1.629
   54    HB2  SER   7           2HB      SER   7 -13.949  15.065  -0.330
   55    HB3  SER   7           3HB      SER   7 -13.302  15.520   1.246
   56    HG   SER   7           HG       SER   7 -11.912  14.758  -1.087
   57    H    TRP   8           H        TRP   8 -15.381  11.968   0.647
   58    HA   TRP   8           HA       TRP   8 -14.491  10.472  -1.660
   59    HB2  TRP   8           2HB      TRP   8 -16.899  10.372   0.129
   60    HB3  TRP   8           3HB      TRP   8 -16.904   9.513  -1.409
   61    HD1  TRP   8           HD1      TRP   8 -13.752   9.710   0.766
   62    HE1  TRP   8           HE1      TRP   8 -13.178   7.340   1.588
   63    HE3  TRP   8           HE3      TRP   8 -17.904   7.242  -0.910
   64    HZ2  TRP   8           HZ2      TRP   8 -14.332   4.764   1.534
   65    HZ3  TRP   8           HZ3      TRP   8 -18.091   4.825  -0.484
   66    HH2  TRP   8           HH2      TRP   8 -16.341   3.614   0.712
   67    H    LYS   9           H        LYS   9 -14.376  12.688  -2.805
   68    HA   LYS   9           HA       LYS   9 -16.919  13.083  -4.235
   69    HB2  LYS   9           2HB      LYS   9 -14.981  15.137  -3.203
   70    HB3  LYS   9           3HB      LYS   9 -16.049  15.496  -4.552
   71    HG2  LYS   9           2HG      LYS   9 -17.920  15.515  -3.251
   72    HG3  LYS   9           3HG      LYS   9 -17.253  14.373  -2.082
   73    HD2  LYS   9           2HD      LYS   9 -16.829  16.116  -0.761
   74    HD3  LYS   9           3HD      LYS   9 -15.597  16.609  -1.925
   75    HE2  LYS   9           2HE      LYS   9 -17.277  17.920  -3.134
   76    HE3  LYS   9           3HE      LYS   9 -18.501  17.430  -1.964
   77    HZ1  LYS   9           3HZ      LYS   9 -16.094  19.083  -1.429
   78    HZ2  LYS   9           1HZ      LYS   9 -17.138  18.508  -0.228
   79    HZ3  LYS   9           2HZ      LYS   9 -17.706  19.594  -1.394
   80    H    CYS  10           H        CYS  10 -13.631  14.373  -4.650
   81    HA   CYS  10           HA       CYS  10 -12.271  14.464  -6.476
   82    HB2  CYS  10           2HB      CYS  10 -13.312  11.693  -7.072
   83    HB3  CYS  10           3HB      CYS  10 -11.742  12.365  -7.498
   84    H    LYS  11           H        LYS  11 -13.574  16.095  -7.484
   85    HA   LYS  11           HA       LYS  11 -15.742  15.722  -9.146
   86    HB2  LYS  11           2HB      LYS  11 -13.801  17.797  -8.663
   87    HB3  LYS  11           3HB      LYS  11 -14.173  17.708 -10.380
   88    HG2  LYS  11           2HG      LYS  11 -16.649  17.552  -9.173
   89    HG3  LYS  11           3HG      LYS  11 -15.768  18.716  -8.180
   90    HD2  LYS  11           2HD      LYS  11 -15.172  19.957 -10.238
   91    HD3  LYS  11           3HD      LYS  11 -16.156  18.827 -11.172
   92    HE2  LYS  11           2HE      LYS  11 -18.111  19.483  -9.774
   93    HE3  LYS  11           3HE      LYS  11 -17.099  20.708  -9.011
   94    HZ1  LYS  11           3HZ      LYS  11 -16.843  21.823 -11.085
   95    HZ2  LYS  11           1HZ      LYS  11 -18.497  21.546 -10.861
   96    HZ3  LYS  11           2HZ      LYS  11 -17.615  20.577 -11.930
   97    H    ALA  12           H        ALA  12 -15.938  14.327 -10.767
   98    HA   ALA  12           HA       ALA  12 -13.926  13.035 -12.141
   99    HB1  ALA  12           1HB      ALA  12 -16.176  12.225 -12.234
  100    HB2  ALA  12           2HB      ALA  12 -16.723  13.691 -13.049
  101    HB3  ALA  12           3HB      ALA  12 -15.646  12.569 -13.881
  102    H    PHE  13           H        PHE  13 -15.520  16.090 -12.922
  103    HA   PHE  13           HA       PHE  13 -14.419  16.479 -15.467
  104    HB2  PHE  13           2HB      PHE  13 -16.282  17.802 -14.291
  105    HB3  PHE  13           3HB      PHE  13 -14.984  18.725 -13.542
  106    HD1  PHE  13           HD1      PHE  13 -15.977  17.537 -16.939
  107    HD2  PHE  13           HD2      PHE  13 -14.387  20.687 -14.558
  108    HE1  PHE  13           HE1      PHE  13 -15.862  18.979 -18.929
  109    HE2  PHE  13           HE2      PHE  13 -14.271  22.134 -16.544
  110    HZ   PHE  13           HZ       PHE  13 -15.009  21.282 -18.733
  111    H    LYS  14           H        LYS  14 -13.406  18.160 -12.489
  112    HA   LYS  14           HA       LYS  14 -11.019  19.174 -13.469
  113    HB2  LYS  14           2HB      LYS  14 -12.164  19.764 -11.294
  114    HB3  LYS  14           3HB      LYS  14 -11.467  18.300 -10.614
  115    HG2  LYS  14           2HG      LYS  14  -9.976  19.932  -9.952
  116    HG3  LYS  14           3HG      LYS  14  -9.213  19.281 -11.404
  117    HD2  LYS  14           2HD      LYS  14  -9.225  21.304 -12.323
  118    HD3  LYS  14           3HD      LYS  14 -10.984  21.363 -12.188
  119    HE2  LYS  14           2HE      LYS  14 -10.914  22.481 -10.154
  120    HE3  LYS  14           3HE      LYS  14  -9.263  21.966  -9.815
  121    HZ1  LYS  14           3HZ      LYS  14  -8.437  23.468 -11.453
  122    HZ2  LYS  14           1HZ      LYS  14  -9.475  24.337 -10.438
  123    HZ3  LYS  14           2HZ      LYS  14  -9.996  23.863 -11.976
  124    H    GLN  15           H        GLN  15 -11.749  16.002 -12.182
  125    HA   GLN  15           HA       GLN  15  -9.135  15.086 -11.750
  126    HB2  GLN  15           2HB      GLN  15 -11.739  13.719 -12.343
  127    HB3  GLN  15           3HB      GLN  15 -10.250  12.788 -12.253
  128    HG2  GLN  15           2HG      GLN  15 -10.626  14.599 -10.000
  129    HG3  GLN  15           3HG      GLN  15 -11.894  13.384 -10.153
  130   HE21  GLN  15          1HE2      GLN  15  -8.427  13.865  -9.869
  131   HE22  GLN  15          2HE2      GLN  15  -8.078  12.312  -9.196
  132    H    ARG  16           H        ARG  16 -11.223  14.801 -14.615
  133    HA   ARG  16           HA       ARG  16  -9.233  13.495 -16.187
  134    HB2  ARG  16           2HB      ARG  16 -11.984  14.417 -16.536
  135    HB3  ARG  16           3HB      ARG  16 -11.005  14.623 -17.983
  136    HG2  ARG  16           2HG      ARG  16 -12.040  12.507 -18.150
  137    HG3  ARG  16           3HG      ARG  16 -10.346  12.211 -17.757
  138    HD2  ARG  16           2HD      ARG  16 -11.671  12.452 -15.301
  139    HD3  ARG  16           3HD      ARG  16 -12.719  11.460 -16.314
  140    HE   ARG  16           HE       ARG  16 -10.139  10.474 -16.595
  141   HH11  ARG  16          1HH1      ARG  16 -12.514  10.842 -14.077
  142   HH12  ARG  16          2HH1      ARG  16 -11.972   9.461 -13.183
  143   HH21  ARG  16          1HH2      ARG  16  -9.415   8.653 -15.428
  144   HH22  ARG  16          2HH2      ARG  16 -10.208   8.217 -13.952
  145    H    VAL  17           H        VAL  17 -10.449  16.825 -16.018
  146    HA   VAL  17           HA       VAL  17  -9.041  17.967 -18.096
  147    HB   VAL  17           HB       VAL  17  -9.626  19.216 -15.407
  148   HG11  VAL  17          1HG1      VAL  17  -8.836  20.416 -18.052
  149   HG12  VAL  17          2HG1      VAL  17  -9.572  21.348 -16.747
  150   HG13  VAL  17          3HG1      VAL  17  -8.010  20.567 -16.502
  151   HG21  VAL  17          3HG2      VAL  17 -11.399  18.275 -17.326
  152   HG22  VAL  17          1HG2      VAL  17 -11.757  19.412 -16.026
  153   HG23  VAL  17          2HG2      VAL  17 -11.311  20.011 -17.624
  154    H    LEU  18           H        LEU  18  -7.946  17.283 -14.806
  155    HA   LEU  18           HA       LEU  18  -5.525  18.607 -14.788
  156    HB2  LEU  18           2HB      LEU  18  -6.483  17.457 -12.852
  157    HB3  LEU  18           3HB      LEU  18  -6.145  15.902 -13.609
  158    HG   LEU  18           HG       LEU  18  -3.667  17.040 -13.561
  159   HD11  LEU  18          1HD1      LEU  18  -5.000  18.807 -12.056
  160   HD12  LEU  18          2HD1      LEU  18  -3.311  18.382 -11.779
  161   HD13  LEU  18          3HD1      LEU  18  -4.579  17.627 -10.814
  162   HD21  LEU  18          3HD2      LEU  18  -3.721  15.680 -11.203
  163   HD22  LEU  18          1HD2      LEU  18  -3.566  14.935 -12.794
  164   HD23  LEU  18          2HD2      LEU  18  -5.147  15.035 -12.019
  165    H    LYS  19           H        LYS  19  -6.280  15.409 -16.105
  166    HA   LYS  19           HA       LYS  19  -3.557  14.999 -16.994
  167    HB2  LYS  19           2HB      LYS  19  -6.007  13.363 -17.663
  168    HB3  LYS  19           3HB      LYS  19  -4.326  12.867 -17.812
  169    HG2  LYS  19           2HG      LYS  19  -4.109  13.061 -15.346
  170    HG3  LYS  19           3HG      LYS  19  -5.841  13.392 -15.265
  171    HD2  LYS  19           2HD      LYS  19  -6.198  11.197 -15.196
  172    HD3  LYS  19           3HD      LYS  19  -5.569  11.086 -16.841
  173    HE2  LYS  19           2HE      LYS  19  -3.249  11.100 -15.620
  174    HE3  LYS  19           3HE      LYS  19  -4.204  10.561 -14.239
  175    HZ1  LYS  19           3HZ      LYS  19  -5.076   8.976 -16.256
  176    HZ2  LYS  19           1HZ      LYS  19  -3.930   8.536 -15.092
  177    HZ3  LYS  19           2HZ      LYS  19  -3.425   9.120 -16.597
  178    H    ARG  20           H        ARG  20  -6.644  15.951 -18.364
  179    HA   ARG  20           HA       ARG  20  -6.144  15.667 -21.068
  180    HB2  ARG  20           2HB      ARG  20  -7.715  17.778 -19.590
  181    HB3  ARG  20           3HB      ARG  20  -7.710  17.636 -21.343
  182    HG2  ARG  20           2HG      ARG  20  -8.409  15.263 -19.678
  183    HG3  ARG  20           3HG      ARG  20  -9.603  16.535 -19.941
  184    HD2  ARG  20           2HD      ARG  20  -8.109  15.208 -22.189
  185    HD3  ARG  20           3HD      ARG  20  -9.640  14.593 -21.569
  186    HE   ARG  20           HE       ARG  20 -10.076  17.251 -22.133
  187   HH11  ARG  20          1HH1      ARG  20  -9.078  14.423 -23.901
  188   HH12  ARG  20          2HH1      ARG  20  -9.762  14.959 -25.400
  189   HH21  ARG  20          1HH2      ARG  20 -10.981  17.967 -24.101
  190   HH22  ARG  20          2HH2      ARG  20 -10.843  16.975 -25.513
  191    H    LEU  21           H        LEU  21  -5.296  18.370 -18.936
  192    HA   LEU  21           HA       LEU  21  -4.275  20.130 -20.816
  193    HB2  LEU  21           2HB      LEU  21  -4.180  19.800 -17.969
  194    HB3  LEU  21           3HB      LEU  21  -2.597  20.297 -18.563
  195    HG   LEU  21           HG       LEU  21  -4.823  21.873 -19.634
  196   HD11  LEU  21          1HD1      LEU  21  -4.146  22.202 -16.723
  197   HD12  LEU  21          2HD1      LEU  21  -5.572  21.334 -17.289
  198   HD13  LEU  21          3HD1      LEU  21  -5.379  23.047 -17.659
  199   HD21  LEU  21          3HD2      LEU  21  -2.145  22.143 -19.507
  200   HD22  LEU  21          1HD2      LEU  21  -2.622  23.085 -18.094
  201   HD23  LEU  21          2HD2      LEU  21  -3.261  23.498 -19.686
  202    H    LEU  22           H        LEU  22  -2.823  17.272 -19.403
  203    HA   LEU  22           HA       LEU  22  -0.199  17.789 -20.445
  204    HB2  LEU  22           2HB      LEU  22  -1.528  15.467 -19.109
  205    HB3  LEU  22           3HB      LEU  22   0.046  15.268 -19.875
  206    HG   LEU  22           HG       LEU  22  -0.345  17.431 -17.851
  207   HD11  LEU  22          1HD1      LEU  22   0.726  15.053 -16.658
  208   HD12  LEU  22          2HD1      LEU  22  -0.892  14.743 -17.287
  209   HD13  LEU  22          3HD1      LEU  22  -0.629  16.054 -16.137
  210   HD21  LEU  22          3HD2      LEU  22   1.728  17.144 -19.279
  211   HD22  LEU  22          1HD2      LEU  22   2.028  15.660 -18.374
  212   HD23  LEU  22          2HD2      LEU  22   1.982  17.211 -17.534
  213    H    ALA  23           H        ALA  23  -2.685  15.347 -21.215
  214    HA   ALA  23           HA       ALA  23  -1.509  14.191 -23.414
  215    HB1  ALA  23           1HB      ALA  23  -4.108  14.249 -22.253
  216    HB2  ALA  23           2HB      ALA  23  -4.265  14.402 -24.004
  217    HB3  ALA  23           3HB      ALA  23  -3.396  13.032 -23.313
  218    H    MET  24           H        MET  24  -3.382  17.184 -23.261
  219    HA   MET  24           HA       MET  24  -3.298  17.607 -26.102
  220    HB2  MET  24           2HB      MET  24  -5.134  18.464 -24.665
  221    HB3  MET  24           3HB      MET  24  -3.990  19.558 -23.899
  222    HG2  MET  24           2HG      MET  24  -4.564  21.049 -25.430
  223    HG3  MET  24           3HG      MET  24  -3.677  20.066 -26.593
  224    HE1  MET  24           3HE      MET  24  -6.852  20.874 -24.856
  225    HE2  MET  24           1HE      MET  24  -8.147  20.501 -25.994
  226    HE3  MET  24           2HE      MET  24  -7.473  19.227 -24.977
  227    H    LEU  25           H        LEU  25  -1.537  18.813 -23.290
  228    HA   LEU  25           HA       LEU  25  -0.085  20.863 -24.438
  229    HB2  LEU  25           2HB      LEU  25   0.061  20.560 -22.108
  230    HB3  LEU  25           3HB      LEU  25   0.607  18.893 -22.280
  231    HG   LEU  25           HG       LEU  25   2.763  19.699 -23.136
  232   HD11  LEU  25          1HD1      LEU  25   2.161  21.757 -24.168
  233   HD12  LEU  25          2HD1      LEU  25   3.278  22.131 -22.856
  234   HD13  LEU  25          3HD1      LEU  25   1.549  22.410 -22.648
  235   HD21  LEU  25          3HD2      LEU  25   1.716  20.160 -20.465
  236   HD22  LEU  25          1HD2      LEU  25   3.095  21.193 -20.842
  237   HD23  LEU  25          2HD2      LEU  25   3.244  19.440 -20.975
  238    H    ARG  26           H        ARG  26   0.921  17.453 -24.146
  239    HA   ARG  26           HA       ARG  26   2.642  17.866 -26.501
  240    HB2  ARG  26           2HB      ARG  26   4.059  17.702 -24.539
  241    HB3  ARG  26           3HB      ARG  26   3.241  16.230 -24.031
  242    HG2  ARG  26           2HG      ARG  26   4.567  14.969 -25.282
  243    HG3  ARG  26           3HG      ARG  26   4.286  15.970 -26.708
  244    HD2  ARG  26           2HD      ARG  26   6.032  17.461 -26.113
  245    HD3  ARG  26           3HD      ARG  26   6.172  16.760 -24.501
  246    HE   ARG  26           HE       ARG  26   7.395  15.808 -26.904
  247   HH11  ARG  26          1HH1      ARG  26   6.148  14.850 -23.798
  248   HH12  ARG  26          2HH1      ARG  26   7.143  13.436 -23.689
  249   HH21  ARG  26          1HH2      ARG  26   8.710  13.949 -26.772
  250   HH22  ARG  26          2HH2      ARG  26   8.601  12.925 -25.380
  251    H    GLN  27           H        GLN  27   1.845  14.994 -24.572
  252    HA   GLN  27           HA       GLN  27  -0.068  13.894 -26.279
  253    HB2  GLN  27           2HB      GLN  27   1.368  12.118 -27.359
  254    HB3  GLN  27           3HB      GLN  27   1.554  13.742 -28.007
  255    HG2  GLN  27           2HG      GLN  27   3.439  13.452 -25.927
  256    HG3  GLN  27           3HG      GLN  27   3.530  12.005 -26.931
  257   HE21  GLN  27          1HE2      GLN  27   5.581  12.605 -27.668
  258   HE22  GLN  27          2HE2      GLN  27   5.795  13.862 -28.834
  259    H    HIS  28           H        HIS  28   0.575  14.094 -23.489
  260    HA   HIS  28           HA       HIS  28   1.592  11.825 -22.295
  261    HB2  HIS  28           2HB      HIS  28   0.870  13.900 -21.108
  262    HB3  HIS  28           3HB      HIS  28  -0.803  13.391 -21.317
  263    HD1  HIS  28           HD1      HIS  28  -1.727  12.216 -19.358
  264    HD2  HIS  28           HD2      HIS  28   2.391  11.743 -19.630
  265    HE1  HIS  28           HE1      HIS  28  -1.070  10.875 -17.335
  266    H    ALA  29           H        ALA  29   0.554   9.975 -21.336
  267    HA   ALA  29           HA       ALA  29  -1.802   9.080 -22.866
  268    HB1  ALA  29           1HB      ALA  29  -0.590   6.785 -21.933
  269    HB2  ALA  29           2HB      ALA  29  -0.473   7.434 -23.569
  270    HB3  ALA  29           3HB      ALA  29   0.769   7.819 -22.377
  271    H    PHE  30           H        PHE  30  -3.272   7.637 -21.775
  272    HA   PHE  30           HA       PHE  30  -4.109   8.517 -19.286
  273    HB2  PHE  30           2HB      PHE  30  -5.398   7.143 -21.019
  274    HB3  PHE  30           3HB      PHE  30  -4.639   5.728 -20.298
  275    HD1  PHE  30           HD2      PHE  30  -6.165   8.820 -18.871
  276    HD2  PHE  30           HD1      PHE  30  -6.160   4.567 -19.037
  277    HE1  PHE  30           HE2      PHE  30  -7.929   8.754 -17.157
  278    HE2  PHE  30           HE1      PHE  30  -7.924   4.494 -17.324
  279    HZ   PHE  30           HZ       PHE  30  -8.811   6.589 -16.381
  Start of MODEL   11
    1    H1   GLY   1           H        GLY   1  -2.388   5.778   1.285
    2    HA2  GLY   1           2HA      GLY   1  -2.674   7.086   3.499
    3    HA3  GLY   1           3HA      GLY   1  -2.463   8.479   2.448
    4    H    ILE   2           H        ILE   2  -4.298   9.426   1.898
    5    HA   ILE   2           HA       ILE   2  -6.805   7.984   2.131
    6    HB   ILE   2           HB       ILE   2  -6.508  10.835   1.222
    7   HG12  ILE   2          2HG1      ILE   2  -5.209  10.615   3.277
    8   HG13  ILE   2          3HG1      ILE   2  -6.696  11.503   3.592
    9   HG21  ILE   2          1HG2      ILE   2  -8.713  10.821   2.687
   10   HG22  ILE   2          2HG2      ILE   2  -8.719  10.338   0.992
   11   HG23  ILE   2          3HG2      ILE   2  -8.690   9.111   2.257
   12   HD11  ILE   2          3HD1      ILE   2  -6.363  10.007   5.394
   13   HD12  ILE   2          1HD1      ILE   2  -7.686   9.361   4.423
   14   HD13  ILE   2          2HD1      ILE   2  -6.075   8.653   4.301
   15    H    ARG   3           H        ARG   3  -8.438   8.079   0.434
   16    HA   ARG   3           HA       ARG   3  -7.344   7.319  -2.099
   17    HB2  ARG   3           2HB      ARG   3  -9.535   6.532  -0.853
   18    HB3  ARG   3           3HB      ARG   3 -10.256   7.874  -1.731
   19    HG2  ARG   3           2HG      ARG   3  -9.596   6.912  -3.838
   20    HG3  ARG   3           3HG      ARG   3  -8.725   5.620  -3.010
   21    HD2  ARG   3           2HD      ARG   3 -10.821   4.736  -3.728
   22    HD3  ARG   3           3HD      ARG   3 -10.894   4.931  -1.977
   23    HE   ARG   3           HE       ARG   3 -11.920   7.224  -3.291
   24   HH11  ARG   3          1HH1      ARG   3 -12.701   3.928  -2.485
   25   HH12  ARG   3          2HH1      ARG   3 -14.413   4.199  -2.476
   26   HH21  ARG   3          1HH2      ARG   3 -14.171   7.593  -3.282
   27   HH22  ARG   3          2HH2      ARG   3 -15.248   6.283  -2.931
   28    H    CYS   4           H        CYS   4  -9.332  10.037  -0.963
   29    HA   CYS   4           HA       CYS   4  -8.718  11.441  -3.478
   30    HB2  CYS   4           2HB      CYS   4 -11.088  11.491  -1.653
   31    HB3  CYS   4           3HB      CYS   4 -10.703  12.929  -2.592
   32    HA   PRO   5           HA       PRO   5  -6.428  14.538  -1.380
   33    HB2  PRO   5           2HB      PRO   5  -7.175  16.797  -2.688
   34    HB3  PRO   5           3HB      PRO   5  -6.138  15.565  -3.415
   35    HG2  PRO   5           2HG      PRO   5  -9.078  16.008  -3.758
   36    HG3  PRO   5           3HG      PRO   5  -7.854  15.627  -4.983
   37    HD2  PRO   5           2HD      PRO   5  -9.519  13.755  -3.955
   38    HD3  PRO   5           3HD      PRO   5  -7.863  13.379  -4.473
   39    H    LYS   6           H        LYS   6  -7.846  14.100   0.565
   40    HA   LYS   6           HA       LYS   6  -9.136  14.804   2.309
   41    HB2  LYS   6           2HB      LYS   6  -8.184  17.484   1.283
   42    HB3  LYS   6           3HB      LYS   6  -8.940  17.225   2.850
   43    HG2  LYS   6           2HG      LYS   6  -6.986  15.447   3.075
   44    HG3  LYS   6           3HG      LYS   6  -6.216  16.532   1.915
   45    HD2  LYS   6           2HD      LYS   6  -7.427  17.415   4.533
   46    HD3  LYS   6           3HD      LYS   6  -5.711  17.075   4.291
   47    HE2  LYS   6           2HE      LYS   6  -6.790  18.887   2.289
   48    HE3  LYS   6           3HE      LYS   6  -6.970  19.509   3.929
   49    HZ1  LYS   6           3HZ      LYS   6  -4.411  18.502   2.815
   50    HZ2  LYS   6           1HZ      LYS   6  -4.639  19.302   4.288
   51    HZ3  LYS   6           2HZ      LYS   6  -4.855  20.134   2.832
   52    H    SER   7           H        SER   7 -10.868  14.036   0.609
   53    HA   SER   7           HA       SER   7 -13.155  15.587   0.989
   54    HB2  SER   7           2HB      SER   7 -13.503  16.124  -1.538
   55    HB3  SER   7           3HB      SER   7 -12.509  17.207  -0.563
   56    HG   SER   7           HG       SER   7 -11.719  15.311  -2.486
   57    H    TRP   8           H        TRP   8 -14.627  14.042   1.125
   58    HA   TRP   8           HA       TRP   8 -14.300  11.552  -0.314
   59    HB2  TRP   8           2HB      TRP   8 -16.163  12.532   1.825
   60    HB3  TRP   8           3HB      TRP   8 -16.537  11.059   0.935
   61    HD1  TRP   8           HD1      TRP   8 -12.975  12.029   2.030
   62    HE1  TRP   8           HE1      TRP   8 -12.122  10.243   3.675
   63    HE3  TRP   8           HE3      TRP   8 -17.254   9.276   2.530
   64    HZ2  TRP   8           HZ2      TRP   8 -13.129   7.967   5.008
   65    HZ3  TRP   8           HZ3      TRP   8 -17.225   7.309   4.009
   66    HH2  TRP   8           HH2      TRP   8 -15.204   6.670   5.221
   67    H    LYS   9           H        LYS   9 -14.553  12.985  -2.356
   68    HA   LYS   9           HA       LYS   9 -17.248  12.532  -3.338
   69    HB2  LYS   9           2HB      LYS   9 -15.985  15.254  -3.153
   70    HB3  LYS   9           3HB      LYS   9 -17.179  14.893  -4.393
   71    HG2  LYS   9           2HG      LYS   9 -18.558  14.034  -2.308
   72    HG3  LYS   9           3HG      LYS   9 -17.510  15.172  -1.458
   73    HD2  LYS   9           2HD      LYS   9 -18.845  16.826  -2.109
   74    HD3  LYS   9           3HD      LYS   9 -18.403  16.486  -3.784
   75    HE2  LYS   9           2HE      LYS   9 -20.244  14.538  -3.286
   76    HE3  LYS   9           3HE      LYS   9 -20.865  15.871  -2.314
   77    HZ1  LYS   9           3HZ      LYS   9 -21.800  16.491  -4.238
   78    HZ2  LYS   9           1HZ      LYS   9 -20.732  15.587  -5.189
   79    HZ3  LYS   9           2HZ      LYS   9 -20.270  17.109  -4.612
   80    H    CYS  10           H        CYS  10 -14.545  14.513  -4.529
   81    HA   CYS  10           HA       CYS  10 -13.281  14.387  -6.415
   82    HB2  CYS  10           2HB      CYS  10 -13.670  11.526  -5.662
   83    HB3  CYS  10           3HB      CYS  10 -12.970  11.881  -7.238
   84    H    LYS  11           H        LYS  11 -15.081  15.490  -7.480
   85    HA   LYS  11           HA       LYS  11 -17.164  14.307  -8.846
   86    HB2  LYS  11           2HB      LYS  11 -15.611  16.817  -9.171
   87    HB3  LYS  11           3HB      LYS  11 -16.603  16.318 -10.535
   88    HG2  LYS  11           2HG      LYS  11 -18.242  16.036  -8.295
   89    HG3  LYS  11           3HG      LYS  11 -17.379  17.557  -8.059
   90    HD2  LYS  11           2HD      LYS  11 -18.499  17.026 -10.755
   91    HD3  LYS  11           3HD      LYS  11 -19.640  17.395  -9.461
   92    HE2  LYS  11           2HE      LYS  11 -18.944  19.543  -9.280
   93    HE3  LYS  11           3HE      LYS  11 -17.267  19.142  -9.649
   94    HZ1  LYS  11           3HZ      LYS  11 -17.569  19.616 -11.789
   95    HZ2  LYS  11           1HZ      LYS  11 -19.022  20.354 -11.334
   96    HZ3  LYS  11           2HZ      LYS  11 -19.021  18.753 -11.882
   97    H    ALA  12           H        ALA  12 -17.449  13.382 -10.840
   98    HA   ALA  12           HA       ALA  12 -15.471  11.795 -11.923
   99    HB1  ALA  12           1HB      ALA  12 -17.332  11.027 -12.869
  100    HB2  ALA  12           2HB      ALA  12 -18.166  12.565 -12.641
  101    HB3  ALA  12           3HB      ALA  12 -17.156  12.312 -14.064
  102    H    PHE  13           H        PHE  13 -16.411  15.077 -12.836
  103    HA   PHE  13           HA       PHE  13 -14.919  15.341 -15.168
  104    HB2  PHE  13           2HB      PHE  13 -16.614  16.971 -14.117
  105    HB3  PHE  13           3HB      PHE  13 -15.249  17.588 -13.192
  106    HD1  PHE  13           HD2      PHE  13 -15.686  16.544 -16.749
  107    HD2  PHE  13           HD1      PHE  13 -14.560  19.609 -14.019
  108    HE1  PHE  13           HE2      PHE  13 -15.069  17.994 -18.638
  109    HE2  PHE  13           HE1      PHE  13 -13.943  21.065 -15.904
  110    HZ   PHE  13           HZ       PHE  13 -14.196  20.258 -18.217
  111    H    LYS  14           H        LYS  14 -13.973  16.565 -11.952
  112    HA   LYS  14           HA       LYS  14 -11.334  17.166 -12.588
  113    HB2  LYS  14           2HB      LYS  14 -12.686  17.741 -10.474
  114    HB3  LYS  14           3HB      LYS  14 -12.167  16.172  -9.871
  115    HG2  LYS  14           2HG      LYS  14 -10.624  17.672  -8.985
  116    HG3  LYS  14           3HG      LYS  14  -9.791  16.964 -10.371
  117    HD2  LYS  14           2HD      LYS  14 -10.613  18.960 -11.704
  118    HD3  LYS  14           3HD      LYS  14 -11.077  19.677 -10.159
  119    HE2  LYS  14           2HE      LYS  14  -8.590  19.045  -9.527
  120    HE3  LYS  14           3HE      LYS  14  -8.372  19.133 -11.274
  121    HZ1  LYS  14           3HZ      LYS  14  -7.906  21.255 -10.248
  122    HZ2  LYS  14           1HZ      LYS  14  -9.442  21.294  -9.540
  123    HZ3  LYS  14           2HZ      LYS  14  -9.284  21.383 -11.221
  124    H    GLN  15           H        GLN  15 -12.755  14.146 -11.431
  125    HA   GLN  15           HA       GLN  15 -10.447  12.705 -10.902
  126    HB2  GLN  15           2HB      GLN  15 -13.179  11.908 -11.852
  127    HB3  GLN  15           3HB      GLN  15 -11.912  10.700 -11.682
  128    HG2  GLN  15           2HG      GLN  15 -12.252  12.458  -9.361
  129    HG3  GLN  15           3HG      GLN  15 -13.635  11.426  -9.724
  130   HE21  GLN  15          1HE2      GLN  15 -10.160  11.398  -9.147
  131   HE22  GLN  15          2HE2      GLN  15 -10.097   9.799  -8.494
  132    H    ARG  16           H        ARG  16 -12.157  13.125 -13.980
  133    HA   ARG  16           HA       ARG  16 -10.358  11.470 -15.456
  134    HB2  ARG  16           2HB      ARG  16 -12.732  13.091 -16.006
  135    HB3  ARG  16           3HB      ARG  16 -11.556  13.118 -17.313
  136    HG2  ARG  16           2HG      ARG  16 -12.747  11.304 -17.954
  137    HG3  ARG  16           3HG      ARG  16 -11.595  10.499 -16.887
  138    HD2  ARG  16           2HD      ARG  16 -13.541   9.628 -16.074
  139    HD3  ARG  16           3HD      ARG  16 -13.421  11.071 -15.068
  140    HE   ARG  16           HE       ARG  16 -14.857  11.915 -17.203
  141   HH11  ARG  16          1HH1      ARG  16 -15.177   9.238 -15.000
  142   HH12  ARG  16          2HH1      ARG  16 -16.905   9.182 -15.114
  143   HH21  ARG  16          1HH2      ARG  16 -17.131  11.851 -17.361
  144   HH22  ARG  16          2HH2      ARG  16 -18.015  10.668 -16.458
  145    H    VAL  17           H        VAL  17 -10.723  14.967 -15.013
  146    HA   VAL  17           HA       VAL  17  -8.860  15.900 -16.821
  147    HB   VAL  17           HB       VAL  17  -9.397  16.989 -14.054
  148   HG11  VAL  17          1HG1      VAL  17  -8.009  18.154 -16.452
  149   HG12  VAL  17          2HG1      VAL  17  -8.692  19.160 -15.173
  150   HG13  VAL  17          3HG1      VAL  17  -7.410  18.007 -14.800
  151   HG21  VAL  17          3HG2      VAL  17 -11.360  17.710 -14.809
  152   HG22  VAL  17          1HG2      VAL  17 -10.594  18.457 -16.211
  153   HG23  VAL  17          2HG2      VAL  17 -11.097  16.768 -16.276
  154    H    LEU  18           H        LEU  18  -8.331  14.607 -13.578
  155    HA   LEU  18           HA       LEU  18  -5.678  15.256 -13.187
  156    HB2  LEU  18           2HB      LEU  18  -7.223  14.103 -11.582
  157    HB3  LEU  18           3HB      LEU  18  -6.919  12.608 -12.465
  158    HG   LEU  18           HG       LEU  18  -4.386  13.378 -11.876
  159   HD11  LEU  18          1HD1      LEU  18  -4.991  15.275 -10.559
  160   HD12  LEU  18          2HD1      LEU  18  -4.429  14.013  -9.464
  161   HD13  LEU  18          3HD1      LEU  18  -6.156  14.330  -9.632
  162   HD21  LEU  18          3HD2      LEU  18  -4.340  11.531 -10.505
  163   HD22  LEU  18          1HD2      LEU  18  -5.788  11.213 -11.461
  164   HD23  LEU  18          2HD2      LEU  18  -5.935  11.859  -9.826
  165    H    LYS  19           H        LYS  19  -7.028  12.499 -14.958
  166    HA   LYS  19           HA       LYS  19  -4.400  11.544 -15.702
  167    HB2  LYS  19           2HB      LYS  19  -6.462  10.091 -15.251
  168    HB3  LYS  19           3HB      LYS  19  -7.027  10.599 -16.837
  169    HG2  LYS  19           2HG      LYS  19  -4.779   9.741 -17.707
  170    HG3  LYS  19           3HG      LYS  19  -4.635   8.933 -16.144
  171    HD2  LYS  19           2HD      LYS  19  -6.705   7.735 -16.539
  172    HD3  LYS  19           3HD      LYS  19  -6.946   8.603 -18.057
  173    HE2  LYS  19           2HE      LYS  19  -4.491   6.951 -17.551
  174    HE3  LYS  19           3HE      LYS  19  -5.977   6.232 -18.167
  175    HZ1  LYS  19           3HZ      LYS  19  -5.729   8.258 -19.841
  176    HZ2  LYS  19           1HZ      LYS  19  -5.014   6.751 -20.126
  177    HZ3  LYS  19           2HZ      LYS  19  -4.092   8.017 -19.486
  178    H    ARG  20           H        ARG  20  -7.026  13.368 -17.138
  179    HA   ARG  20           HA       ARG  20  -6.369  13.249 -19.821
  180    HB2  ARG  20           2HB      ARG  20  -8.394  14.334 -19.070
  181    HB3  ARG  20           3HB      ARG  20  -7.467  15.567 -18.225
  182    HG2  ARG  20           2HG      ARG  20  -7.298  16.812 -20.054
  183    HG3  ARG  20           3HG      ARG  20  -6.758  15.440 -21.023
  184    HD2  ARG  20           2HD      ARG  20  -8.861  14.949 -21.750
  185    HD3  ARG  20           3HD      ARG  20  -9.625  15.546 -20.277
  186    HE   ARG  20           HE       ARG  20  -8.495  17.698 -21.703
  187   HH11  ARG  20          1HH1      ARG  20 -11.142  15.442 -21.847
  188   HH12  ARG  20          2HH1      ARG  20 -12.174  16.509 -22.740
  189   HH21  ARG  20          1HH2      ARG  20  -9.844  19.112 -22.879
  190   HH22  ARG  20          2HH2      ARG  20 -11.434  18.596 -23.328
  191    H    LEU  21           H        LEU  21  -5.086  15.420 -17.327
  192    HA   LEU  21           HA       LEU  21  -3.501  17.050 -18.906
  193    HB2  LEU  21           2HB      LEU  21  -3.832  16.526 -16.154
  194    HB3  LEU  21           3HB      LEU  21  -2.105  16.427 -16.488
  195    HG   LEU  21           HG       LEU  21  -2.329  18.712 -17.571
  196   HD11  LEU  21          1HD1      LEU  21  -4.734  18.734 -17.871
  197   HD12  LEU  21          2HD1      LEU  21  -4.236  20.066 -16.828
  198   HD13  LEU  21          3HD1      LEU  21  -4.974  18.626 -16.127
  199   HD21  LEU  21          3HD2      LEU  21  -2.248  19.873 -15.414
  200   HD22  LEU  21          1HD2      LEU  21  -1.302  18.385 -15.390
  201   HD23  LEU  21          2HD2      LEU  21  -2.887  18.433 -14.619
  202    H    LEU  22           H        LEU  22  -2.922  13.784 -17.778
  203    HA   LEU  22           HA       LEU  22  -0.169  13.730 -18.591
  204    HB2  LEU  22           2HB      LEU  22  -2.134  11.692 -17.628
  205    HB3  LEU  22           3HB      LEU  22  -0.596  11.183 -18.320
  206    HG   LEU  22           HG       LEU  22  -0.461  11.206 -15.906
  207   HD11  LEU  22          1HD1      LEU  22   1.077  13.627 -16.741
  208   HD12  LEU  22          2HD1      LEU  22   1.434  12.058 -17.461
  209   HD13  LEU  22          3HD1      LEU  22   1.573  12.279 -15.717
  210   HD21  LEU  22          3HD2      LEU  22  -1.019  12.979 -14.548
  211   HD22  LEU  22          1HD2      LEU  22  -2.246  13.108 -15.808
  212   HD23  LEU  22          2HD2      LEU  22  -0.836  14.167 -15.839
  213    H    ALA  23           H        ALA  23  -3.093  12.074 -19.794
  214    HA   ALA  23           HA       ALA  23  -2.032  10.913 -22.055
  215    HB1  ALA  23           1HB      ALA  23  -4.478  11.449 -22.967
  216    HB2  ALA  23           2HB      ALA  23  -4.168  10.213 -21.747
  217    HB3  ALA  23           3HB      ALA  23  -4.740  11.810 -21.261
  218    H    MET  24           H        MET  24  -3.195  14.222 -21.625
  219    HA   MET  24           HA       MET  24  -2.831  14.931 -24.379
  220    HB2  MET  24           2HB      MET  24  -4.474  16.039 -22.859
  221    HB3  MET  24           3HB      MET  24  -3.124  16.757 -21.990
  222    HG2  MET  24           2HG      MET  24  -2.799  17.310 -24.756
  223    HG3  MET  24           3HG      MET  24  -4.452  17.711 -24.295
  224    HE1  MET  24           3HE      MET  24  -3.984  20.892 -24.259
  225    HE2  MET  24           1HE      MET  24  -5.097  19.589 -23.838
  226    HE3  MET  24           2HE      MET  24  -4.522  20.694 -22.590
  227    H    LEU  25           H        LEU  25  -1.013  15.418 -21.382
  228    HA   LEU  25           HA       LEU  25   0.964  17.127 -22.267
  229    HB2  LEU  25           2HB      LEU  25   0.886  16.609 -19.973
  230    HB3  LEU  25           3HB      LEU  25   1.015  14.878 -20.278
  231    HG   LEU  25           HG       LEU  25   3.354  15.187 -20.964
  232   HD11  LEU  25          1HD1      LEU  25   4.477  17.295 -20.663
  233   HD12  LEU  25          2HD1      LEU  25   2.991  18.047 -20.085
  234   HD13  LEU  25          3HD1      LEU  25   3.115  17.514 -21.762
  235   HD21  LEU  25          3HD2      LEU  25   3.568  14.618 -18.813
  236   HD22  LEU  25          1HD2      LEU  25   2.291  15.721 -18.299
  237   HD23  LEU  25          2HD2      LEU  25   3.932  16.322 -18.539
  238    H    ARG  26           H        ARG  26   1.116  13.561 -22.243
  239    HA   ARG  26           HA       ARG  26   3.560  13.321 -23.569
  240    HB2  ARG  26           2HB      ARG  26   1.183  11.462 -23.468
  241    HB3  ARG  26           3HB      ARG  26   2.726  11.021 -24.185
  242    HG2  ARG  26           2HG      ARG  26   2.463  11.943 -21.339
  243    HG3  ARG  26           3HG      ARG  26   2.328  10.250 -21.819
  244    HD2  ARG  26           2HD      ARG  26   4.580  10.449 -22.875
  245    HD3  ARG  26           3HD      ARG  26   4.704  12.067 -22.187
  246    HE   ARG  26           HE       ARG  26   4.999   9.562 -20.801
  247   HH11  ARG  26          1HH1      ARG  26   4.265  12.951 -20.489
  248   HH12  ARG  26          2HH1      ARG  26   4.718  13.028 -18.818
  249   HH21  ARG  26          1HH2      ARG  26   5.598   9.651 -18.602
  250   HH22  ARG  26          2HH2      ARG  26   5.477  11.151 -17.746
  251    H    GLN  27           H        GLN  27   0.374  13.988 -24.778
  252    HA   GLN  27           HA       GLN  27   1.209  13.547 -27.542
  253    HB2  GLN  27           2HB      GLN  27  -1.159  13.058 -26.328
  254    HB3  GLN  27           3HB      GLN  27  -1.470  14.663 -26.978
  255    HG2  GLN  27           2HG      GLN  27  -0.247  13.170 -29.030
  256    HG3  GLN  27           3HG      GLN  27  -1.488  12.145 -28.311
  257   HE21  GLN  27          1HE2      GLN  27  -0.863  15.205 -29.888
  258   HE22  GLN  27          2HE2      GLN  27  -2.486  15.487 -30.410
  259    H    HIS  28           H        HIS  28   2.513  15.630 -26.141
  260    HA   HIS  28           HA       HIS  28   1.489  18.177 -26.420
  261    HB2  HIS  28           2HB      HIS  28   3.706  17.453 -25.375
  262    HB3  HIS  28           3HB      HIS  28   4.371  17.511 -27.004
  263    HD1  HIS  28           HD1      HIS  28   4.535  19.874 -28.126
  264    HD2  HIS  28           HD2      HIS  28   3.347  19.908 -24.145
  265    HE1  HIS  28           HE1      HIS  28   4.785  22.259 -27.371
  266    H    ALA  29           H        ALA  29   1.754  19.811 -28.020
  267    HA   ALA  29           HA       ALA  29   2.384  18.874 -30.726
  268    HB1  ALA  29           1HB      ALA  29  -0.238  19.812 -29.750
  269    HB2  ALA  29           2HB      ALA  29   0.293  20.455 -31.304
  270    HB3  ALA  29           3HB      ALA  29   0.158  18.712 -31.071
  271    H    PHE  30           H        PHE  30   2.893  20.566 -32.222
  272    HA   PHE  30           HA       PHE  30   4.533  22.567 -31.198
  273    HB2  PHE  30           2HB      PHE  30   4.737  21.745 -33.491
  274    HB3  PHE  30           3HB      PHE  30   3.172  22.443 -33.897
  275    HD1  PHE  30           HD2      PHE  30   6.678  23.179 -33.104
  276    HD2  PHE  30           HD1      PHE  30   2.930  24.781 -34.329
  277    HE1  PHE  30           HE2      PHE  30   7.788  25.280 -33.740
  278    HE2  PHE  30           HE1      PHE  30   4.034  26.884 -34.968
  279    HZ   PHE  30           HZ       PHE  30   6.466  27.137 -34.673
  Start of MODEL   12
    1    H1   GLY   1           H        GLY   1 -11.899   2.293   6.273
    2    HA2  GLY   1           2HA      GLY   1  -9.992   1.541   4.235
    3    HA3  GLY   1           3HA      GLY   1 -11.739   1.614   4.058
    4    H    ILE   2           H        ILE   2  -8.750   3.290   3.666
    5    HA   ILE   2           HA       ILE   2 -10.018   5.806   2.973
    6    HB   ILE   2           HB       ILE   2  -7.118   5.135   2.544
    7   HG12  ILE   2          2HG1      ILE   2  -7.145   6.455   4.926
    8   HG13  ILE   2          3HG1      ILE   2  -8.601   5.476   5.072
    9   HG21  ILE   2          1HG2      ILE   2  -6.998   7.636   3.168
   10   HG22  ILE   2          2HG2      ILE   2  -7.589   7.188   1.568
   11   HG23  ILE   2          3HG2      ILE   2  -8.730   7.641   2.835
   12   HD11  ILE   2          3HD1      ILE   2  -7.161   3.966   5.893
   13   HD12  ILE   2          1HD1      ILE   2  -6.874   3.619   4.188
   14   HD13  ILE   2          2HD1      ILE   2  -5.774   4.679   5.070
   15    H    ARG   3           H        ARG   3  -9.627   6.847   0.896
   16    HA   ARG   3           HA       ARG   3  -8.808   5.263  -1.353
   17    HB2  ARG   3           2HB      ARG   3 -10.993   5.380  -2.529
   18    HB3  ARG   3           3HB      ARG   3 -11.026   4.343  -1.109
   19    HG2  ARG   3           2HG      ARG   3 -11.913   6.458   0.102
   20    HG3  ARG   3           3HG      ARG   3 -12.293   7.012  -1.531
   21    HD2  ARG   3           2HD      ARG   3 -13.251   4.468  -0.224
   22    HD3  ARG   3           3HD      ARG   3 -14.216   5.907  -0.548
   23    HE   ARG   3           HE       ARG   3 -13.470   3.856  -2.424
   24   HH11  ARG   3          1HH1      ARG   3 -14.481   7.164  -2.032
   25   HH12  ARG   3          2HH1      ARG   3 -15.135   7.290  -3.632
   26   HH21  ARG   3          1HH2      ARG   3 -14.327   4.010  -4.532
   27   HH22  ARG   3          2HH2      ARG   3 -15.048   5.495  -5.053
   28    H    CYS   4           H        CYS   4 -10.512   8.142  -0.205
   29    HA   CYS   4           HA       CYS   4  -9.291   9.664  -2.414
   30    HB2  CYS   4           2HB      CYS   4 -11.921   9.920  -1.009
   31    HB3  CYS   4           3HB      CYS   4 -11.169  11.362  -1.682
   32    HA   PRO   5           HA       PRO   5  -6.997  12.117   0.407
   33    HB2  PRO   5           2HB      PRO   5  -7.161  14.587  -0.706
   34    HB3  PRO   5           3HB      PRO   5  -6.198  13.281  -1.406
   35    HG2  PRO   5           2HG      PRO   5  -8.932  14.233  -2.165
   36    HG3  PRO   5           3HG      PRO   5  -7.574  13.781  -3.212
   37    HD2  PRO   5           2HD      PRO   5  -9.650  12.114  -2.716
   38    HD3  PRO   5           3HD      PRO   5  -8.000  11.525  -3.001
   39    H    LYS   6           H        LYS   6  -8.792  11.726   2.024
   40    HA   LYS   6           HA       LYS   6 -10.261  12.453   3.608
   41    HB2  LYS   6           2HB      LYS   6  -8.637  14.941   3.091
   42    HB3  LYS   6           3HB      LYS   6  -9.844  14.849   4.367
   43    HG2  LYS   6           2HG      LYS   6  -8.589  13.439   5.648
   44    HG3  LYS   6           3HG      LYS   6  -7.753  12.741   4.258
   45    HD2  LYS   6           2HD      LYS   6  -6.047  14.135   4.556
   46    HD3  LYS   6           3HD      LYS   6  -7.129  15.522   4.413
   47    HE2  LYS   6           2HE      LYS   6  -7.730  15.025   6.869
   48    HE3  LYS   6           3HE      LYS   6  -6.261  14.049   6.877
   49    HZ1  LYS   6           3HZ      LYS   6  -6.567  16.924   6.849
   50    HZ2  LYS   6           1HZ      LYS   6  -5.389  16.334   5.787
   51    HZ3  LYS   6           2HZ      LYS   6  -5.296  15.975   7.437
   52    H    SER   7           H        SER   7 -11.749  12.154   1.564
   53    HA   SER   7           HA       SER   7 -13.819  14.013   1.760
   54    HB2  SER   7           2HB      SER   7 -13.622  14.851  -0.700
   55    HB3  SER   7           3HB      SER   7 -12.675  15.653   0.553
   56    HG   SER   7           HG       SER   7 -11.812  13.764  -1.367
   57    H    TRP   8           H        TRP   8 -15.498  12.724   1.457
   58    HA   TRP   8           HA       TRP   8 -15.278  10.372  -0.214
   59    HB2  TRP   8           2HB      TRP   8 -17.337  11.424   1.700
   60    HB3  TRP   8           3HB      TRP   8 -17.752  10.129   0.580
   61    HD1  TRP   8           HD1      TRP   8 -14.276  10.247   2.161
   62    HE1  TRP   8           HE1      TRP   8 -14.027   8.244   3.758
   63    HE3  TRP   8           HE3      TRP   8 -19.090   8.531   2.067
   64    HZ2  TRP   8           HZ2      TRP   8 -15.656   6.206   4.835
   65    HZ3  TRP   8           HZ3      TRP   8 -19.662   6.549   3.408
   66    HH2  TRP   8           HH2      TRP   8 -17.979   5.411   4.762
   67    H    LYS   9           H        LYS   9 -14.950  12.025  -2.071
   68    HA   LYS   9           HA       LYS   9 -17.459  12.120  -3.529
   69    HB2  LYS   9           2HB      LYS   9 -15.876  14.564  -2.786
   70    HB3  LYS   9           3HB      LYS   9 -16.850  14.533  -4.249
   71    HG2  LYS   9           2HG      LYS   9 -18.841  14.056  -2.920
   72    HG3  LYS   9           3HG      LYS   9 -17.865  14.079  -1.450
   73    HD2  LYS   9           2HD      LYS   9 -17.205  16.469  -2.560
   74    HD3  LYS   9           3HD      LYS   9 -18.882  16.301  -3.083
   75    HE2  LYS   9           2HE      LYS   9 -18.792  15.522  -0.377
   76    HE3  LYS   9           3HE      LYS   9 -17.848  17.005  -0.506
   77    HZ1  LYS   9           3HZ      LYS   9 -20.692  16.574  -1.173
   78    HZ2  LYS   9           1HZ      LYS   9 -19.833  17.883  -1.815
   79    HZ3  LYS   9           2HZ      LYS   9 -20.011  17.728  -0.140
   80    H    CYS  10           H        CYS  10 -14.329  13.741  -4.002
   81    HA   CYS  10           HA       CYS  10 -12.777  13.600  -5.658
   82    HB2  CYS  10           2HB      CYS  10 -13.702  10.780  -5.347
   83    HB3  CYS  10           3HB      CYS  10 -12.684  11.172  -6.729
   84    H    LYS  11           H        LYS  11 -14.221  15.080  -6.832
   85    HA   LYS  11           HA       LYS  11 -16.149  14.375  -8.672
   86    HB2  LYS  11           2HB      LYS  11 -14.134  16.617  -8.695
   87    HB3  LYS  11           3HB      LYS  11 -15.386  16.467  -9.921
   88    HG2  LYS  11           2HG      LYS  11 -17.102  16.861  -8.389
   89    HG3  LYS  11           3HG      LYS  11 -16.061  16.525  -7.003
   90    HD2  LYS  11           2HD      LYS  11 -14.924  18.570  -7.226
   91    HD3  LYS  11           3HD      LYS  11 -15.531  18.825  -8.864
   92    HE2  LYS  11           2HE      LYS  11 -17.351  19.859  -8.105
   93    HE3  LYS  11           3HE      LYS  11 -17.700  18.548  -6.978
   94    HZ1  LYS  11           3HZ      LYS  11 -17.218  20.030  -5.406
   95    HZ2  LYS  11           1HZ      LYS  11 -16.484  21.101  -6.490
   96    HZ3  LYS  11           2HZ      LYS  11 -15.595  19.820  -5.834
   97    H    ALA  12           H        ALA  12 -15.965  12.806 -10.139
   98    HA   ALA  12           HA       ALA  12 -13.666  11.782 -11.267
   99    HB1  ALA  12           1HB      ALA  12 -15.052  10.417 -12.377
  100    HB2  ALA  12           2HB      ALA  12 -16.327  11.210 -11.450
  101    HB3  ALA  12           3HB      ALA  12 -15.957  11.755 -13.087
  102    H    PHE  13           H        PHE  13 -15.679  14.454 -12.405
  103    HA   PHE  13           HA       PHE  13 -14.445  14.839 -14.893
  104    HB2  PHE  13           2HB      PHE  13 -16.610  15.880 -14.030
  105    HB3  PHE  13           3HB      PHE  13 -15.595  17.054 -13.200
  106    HD1  PHE  13           HD1      PHE  13 -16.640  15.788 -16.492
  107    HD2  PHE  13           HD2      PHE  13 -14.540  18.827 -14.377
  108    HE1  PHE  13           HE1      PHE  13 -16.543  17.144 -18.543
  109    HE2  PHE  13           HE2      PHE  13 -14.441  20.188 -16.424
  110    HZ   PHE  13           HZ       PHE  13 -15.444  19.348 -18.510
  111    H    LYS  14           H        LYS  14 -14.019  16.903 -12.016
  112    HA   LYS  14           HA       LYS  14 -11.788  18.280 -12.882
  113    HB2  LYS  14           2HB      LYS  14 -12.989  18.980 -10.912
  114    HB3  LYS  14           3HB      LYS  14 -12.584  17.485 -10.079
  115    HG2  LYS  14           2HG      LYS  14 -10.361  18.113  -9.775
  116    HG3  LYS  14           3HG      LYS  14 -10.448  19.362 -11.019
  117    HD2  LYS  14           2HD      LYS  14 -12.273  19.634  -8.698
  118    HD3  LYS  14           3HD      LYS  14 -10.554  19.914  -8.409
  119    HE2  LYS  14           2HE      LYS  14 -10.870  21.346 -10.655
  120    HE3  LYS  14           3HE      LYS  14 -12.501  21.476  -9.997
  121    HZ1  LYS  14           3HZ      LYS  14 -11.029  23.283  -9.271
  122    HZ2  LYS  14           1HZ      LYS  14 -10.021  22.156  -8.512
  123    HZ3  LYS  14           2HZ      LYS  14 -11.608  22.371  -7.969
  124    H    GLN  15           H        GLN  15 -11.945  15.194 -11.157
  125    HA   GLN  15           HA       GLN  15  -9.240  14.817 -10.659
  126    HB2  GLN  15           2HB      GLN  15 -11.462  12.863 -11.220
  127    HB3  GLN  15           3HB      GLN  15  -9.830  12.331 -10.836
  128    HG2  GLN  15           2HG      GLN  15 -10.883  14.296  -8.958
  129    HG3  GLN  15           3HG      GLN  15 -11.826  12.809  -9.031
  130   HE21  GLN  15          1HE2      GLN  15 -10.820  10.838  -8.506
  131   HE22  GLN  15          2HE2      GLN  15  -9.380  10.791  -7.554
  132    H    ARG  16           H        ARG  16 -11.125  13.985 -13.545
  133    HA   ARG  16           HA       ARG  16  -8.927  12.821 -14.934
  134    HB2  ARG  16           2HB      ARG  16 -11.737  13.488 -15.522
  135    HB3  ARG  16           3HB      ARG  16 -10.661  13.520 -16.913
  136    HG2  ARG  16           2HG      ARG  16 -11.644  11.349 -16.755
  137    HG3  ARG  16           3HG      ARG  16  -9.934  11.219 -16.335
  138    HD2  ARG  16           2HD      ARG  16 -10.748  11.500 -13.901
  139    HD3  ARG  16           3HD      ARG  16 -12.335  11.084 -14.547
  140    HE   ARG  16           HE       ARG  16 -10.127   9.310 -14.120
  141   HH11  ARG  16          1HH1      ARG  16 -12.991   9.873 -16.018
  142   HH12  ARG  16          2HH1      ARG  16 -13.226   8.199 -16.397
  143   HH21  ARG  16          1HH2      ARG  16 -10.426   7.103 -14.613
  144   HH22  ARG  16          2HH2      ARG  16 -11.768   6.625 -15.597
  145    H    VAL  17           H        VAL  17 -10.502  15.997 -15.044
  146    HA   VAL  17           HA       VAL  17  -9.135  17.144 -17.152
  147    HB   VAL  17           HB       VAL  17  -9.891  18.573 -14.601
  148   HG11  VAL  17          1HG1      VAL  17  -8.809  20.217 -15.713
  149   HG12  VAL  17          2HG1      VAL  17  -9.002  19.432 -17.282
  150   HG13  VAL  17          3HG1      VAL  17 -10.343  20.334 -16.576
  151   HG21  VAL  17          3HG2      VAL  17 -12.012  18.102 -15.067
  152   HG22  VAL  17          1HG2      VAL  17 -11.837  18.976 -16.589
  153   HG23  VAL  17          2HG2      VAL  17 -11.539  17.239 -16.530
  154    H    LEU  18           H        LEU  18  -8.109  16.730 -13.806
  155    HA   LEU  18           HA       LEU  18  -5.867  18.351 -13.756
  156    HB2  LEU  18           2HB      LEU  18  -6.649  17.299 -11.761
  157    HB3  LEU  18           3HB      LEU  18  -6.382  15.694 -12.438
  158    HG   LEU  18           HG       LEU  18  -3.921  17.197 -12.372
  159   HD11  LEU  18          1HD1      LEU  18  -3.876  16.930  -9.758
  160   HD12  LEU  18          2HD1      LEU  18  -5.611  17.193  -9.924
  161   HD13  LEU  18          3HD1      LEU  18  -4.476  18.407 -10.513
  162   HD21  LEU  18          3HD2      LEU  18  -3.496  15.143 -10.748
  163   HD22  LEU  18          1HD2      LEU  18  -3.589  14.950 -12.499
  164   HD23  LEU  18          2HD2      LEU  18  -4.989  14.571 -11.495
  165    H    LYS  19           H        LYS  19  -6.185  15.029 -14.935
  166    HA   LYS  19           HA       LYS  19  -3.395  14.926 -15.714
  167    HB2  LYS  19           2HB      LYS  19  -5.054  12.992 -14.904
  168    HB3  LYS  19           3HB      LYS  19  -5.332  12.865 -16.636
  169    HG2  LYS  19           2HG      LYS  19  -2.602  12.966 -16.490
  170    HG3  LYS  19           3HG      LYS  19  -3.031  12.056 -15.040
  171    HD2  LYS  19           2HD      LYS  19  -4.156  11.401 -17.753
  172    HD3  LYS  19           3HD      LYS  19  -2.643  10.710 -17.161
  173    HE2  LYS  19           2HE      LYS  19  -4.097  10.104 -15.068
  174    HE3  LYS  19           3HE      LYS  19  -5.436  10.281 -16.201
  175    HZ1  LYS  19           3HZ      LYS  19  -3.976   8.033 -15.844
  176    HZ2  LYS  19           1HZ      LYS  19  -3.268   8.699 -17.229
  177    HZ3  LYS  19           2HZ      LYS  19  -4.927   8.370 -17.201
  178    H    ARG  20           H        ARG  20  -6.538  15.362 -17.213
  179    HA   ARG  20           HA       ARG  20  -5.920  14.975 -19.880
  180    HB2  ARG  20           2HB      ARG  20  -8.189  15.466 -18.900
  181    HB3  ARG  20           3HB      ARG  20  -7.723  17.161 -18.836
  182    HG2  ARG  20           2HG      ARG  20  -7.950  17.451 -21.063
  183    HG3  ARG  20           3HG      ARG  20  -7.409  15.815 -21.443
  184    HD2  ARG  20           2HD      ARG  20  -9.652  15.081 -20.391
  185    HD3  ARG  20           3HD      ARG  20 -10.129  16.763 -20.618
  186    HE   ARG  20           HE       ARG  20  -9.799  14.758 -22.660
  187   HH11  ARG  20          1HH1      ARG  20  -9.894  18.167 -21.958
  188   HH12  ARG  20          2HH1      ARG  20 -10.323  18.621 -23.574
  189   HH21  ARG  20          1HH2      ARG  20 -10.363  15.343 -24.791
  190   HH22  ARG  20          2HH2      ARG  20 -10.591  17.013 -25.185
  191    H    LEU  21           H        LEU  21  -5.513  17.902 -17.918
  192    HA   LEU  21           HA       LEU  21  -4.678  19.661 -19.887
  193    HB2  LEU  21           2HB      LEU  21  -5.043  19.875 -17.260
  194    HB3  LEU  21           3HB      LEU  21  -3.285  19.750 -17.269
  195    HG   LEU  21           HG       LEU  21  -3.371  21.690 -18.964
  196   HD11  LEU  21          1HD1      LEU  21  -5.526  22.036 -19.598
  197   HD12  LEU  21          2HD1      LEU  21  -5.469  23.132 -18.218
  198   HD13  LEU  21          3HD1      LEU  21  -6.185  21.530 -18.042
  199   HD21  LEU  21          3HD2      LEU  21  -2.999  21.571 -16.271
  200   HD22  LEU  21          1HD2      LEU  21  -4.297  22.758 -16.397
  201   HD23  LEU  21          2HD2      LEU  21  -2.779  23.017 -17.257
  202    H    LEU  22           H        LEU  22  -2.900  17.120 -18.258
  203    HA   LEU  22           HA       LEU  22  -0.339  17.923 -19.275
  204    HB2  LEU  22           2HB      LEU  22  -1.383  15.532 -17.812
  205    HB3  LEU  22           3HB      LEU  22   0.226  15.500 -18.529
  206    HG   LEU  22           HG       LEU  22  -0.486  17.737 -16.689
  207   HD11  LEU  22          1HD1      LEU  22  -1.015  15.247 -15.826
  208   HD12  LEU  22          2HD1      LEU  22  -0.415  16.537 -14.784
  209   HD13  LEU  22          3HD1      LEU  22   0.705  15.346 -15.446
  210   HD21  LEU  22          3HD2      LEU  22   1.744  18.049 -16.576
  211   HD22  LEU  22          1HD2      LEU  22   1.738  17.155 -18.096
  212   HD23  LEU  22          2HD2      LEU  22   2.095  16.320 -16.584
  213    H    ALA  23           H        ALA  23  -2.441  15.113 -19.925
  214    HA   ALA  23           HA       ALA  23  -1.048  14.008 -22.028
  215    HB1  ALA  23           1HB      ALA  23  -3.242  13.267 -20.805
  216    HB2  ALA  23           2HB      ALA  23  -4.025  14.068 -22.169
  217    HB3  ALA  23           3HB      ALA  23  -2.909  12.733 -22.453
  218    H    MET  24           H        MET  24  -3.359  16.681 -22.089
  219    HA   MET  24           HA       MET  24  -3.317  16.929 -24.945
  220    HB2  MET  24           2HB      MET  24  -5.289  17.659 -23.809
  221    HB3  MET  24           3HB      MET  24  -4.363  18.711 -22.746
  222    HG2  MET  24           2HG      MET  24  -3.993  19.325 -25.566
  223    HG3  MET  24           3HG      MET  24  -5.667  19.467 -25.034
  224    HE1  MET  24           3HE      MET  24  -6.619  21.397 -23.956
  225    HE2  MET  24           1HE      MET  24  -6.040  20.771 -22.412
  226    HE3  MET  24           2HE      MET  24  -5.803  22.471 -22.819
  227    H    LEU  25           H        LEU  25  -1.782  18.618 -22.239
  228    HA   LEU  25           HA       LEU  25  -0.591  20.717 -23.583
  229    HB2  LEU  25           2HB      LEU  25  -0.465  20.691 -21.235
  230    HB3  LEU  25           3HB      LEU  25   0.294  19.100 -21.214
  231    HG   LEU  25           HG       LEU  25   2.342  20.112 -22.172
  232   HD11  LEU  25          1HD1      LEU  25   1.849  22.830 -21.500
  233   HD12  LEU  25          2HD1      LEU  25   0.609  22.299 -22.636
  234   HD13  LEU  25          3HD1      LEU  25   2.315  22.141 -23.056
  235   HD21  LEU  25          3HD2      LEU  25   2.064  19.790 -19.746
  236   HD22  LEU  25          1HD2      LEU  25   1.399  21.418 -19.622
  237   HD23  LEU  25          2HD2      LEU  25   3.072  21.187 -20.128
  238    H    ARG  26           H        ARG  26   0.507  17.375 -23.267
  239    HA   ARG  26           HA       ARG  26   2.571  17.946 -25.292
  240    HB2  ARG  26           2HB      ARG  26   2.654  16.189 -22.858
  241    HB3  ARG  26           3HB      ARG  26   3.694  15.853 -24.236
  242    HG2  ARG  26           2HG      ARG  26   4.915  17.801 -23.957
  243    HG3  ARG  26           3HG      ARG  26   3.644  18.578 -23.011
  244    HD2  ARG  26           2HD      ARG  26   4.863  18.005 -21.226
  245    HD3  ARG  26           3HD      ARG  26   4.244  16.377 -21.497
  246    HE   ARG  26           HE       ARG  26   6.534  16.753 -23.073
  247   HH11  ARG  26          1HH1      ARG  26   5.607  16.440 -19.732
  248   HH12  ARG  26          2HH1      ARG  26   7.122  15.758 -19.240
  249   HH21  ARG  26          1HH2      ARG  26   8.532  15.855 -22.438
  250   HH22  ARG  26          2HH2      ARG  26   8.785  15.427 -20.780
  251    H    GLN  27           H        GLN  27   0.245  17.416 -26.364
  252    HA   GLN  27           HA       GLN  27   0.000  14.537 -26.799
  253    HB2  GLN  27           2HB      GLN  27  -2.109  15.019 -27.853
  254    HB3  GLN  27           3HB      GLN  27  -2.031  15.902 -26.334
  255    HG2  GLN  27           2HG      GLN  27  -1.431  17.937 -27.556
  256    HG3  GLN  27           3HG      GLN  27  -1.544  17.047 -29.074
  257   HE21  GLN  27          1HE2      GLN  27  -3.052  19.105 -29.129
  258   HE22  GLN  27          2HE2      GLN  27  -4.714  18.762 -28.807
  259    H    HIS  28           H        HIS  28   2.245  16.154 -27.849
  260    HA   HIS  28           HA       HIS  28   2.065  16.759 -30.535
  261    HB2  HIS  28           2HB      HIS  28   4.055  17.044 -28.940
  262    HB3  HIS  28           3HB      HIS  28   4.476  15.386 -29.359
  263    HD1  HIS  28           HD1      HIS  28   6.056  15.199 -31.243
  264    HD2  HIS  28           HD2      HIS  28   3.823  18.696 -31.450
  265    HE1  HIS  28           HE1      HIS  28   6.933  16.439 -33.247
  266    H    ALA  29           H        ALA  29   2.986  15.530 -32.390
  267    HA   ALA  29           HA       ALA  29   3.015  12.667 -32.279
  268    HB1  ALA  29           1HB      ALA  29   0.980  13.267 -34.211
  269    HB2  ALA  29           2HB      ALA  29   0.925  12.166 -32.834
  270    HB3  ALA  29           3HB      ALA  29   0.503  13.865 -32.621
  271    H    PHE  30           H        PHE  30   4.237  11.878 -33.889
  272    HA   PHE  30           HA       PHE  30   5.726  13.517 -35.555
  273    HB2  PHE  30           2HB      PHE  30   6.259  11.143 -34.939
  274    HB3  PHE  30           3HB      PHE  30   5.048  10.623 -36.107
  275    HD1  PHE  30           HD1      PHE  30   8.101  12.747 -35.879
  276    HD2  PHE  30           HD2      PHE  30   5.708  10.155 -38.261
  277    HE1  PHE  30           HE1      PHE  30   9.795  12.827 -37.662
  278    HE2  PHE  30           HE2      PHE  30   7.399  10.230 -40.047
  279    HZ   PHE  30           HZ       PHE  30   9.446  11.566 -39.748
  Start of MODEL   13
    1    H1   GLY   1           H        GLY   1 -14.130   0.353  -1.891
    2    HA2  GLY   1           2HA      GLY   1 -12.296   1.382  -3.786
    3    HA3  GLY   1           3HA      GLY   1 -13.485   2.317  -2.892
    4    H    ILE   2           H        ILE   2 -10.963   3.316  -3.513
    5    HA   ILE   2           HA       ILE   2  -9.298   3.056  -1.151
    6    HB   ILE   2           HB       ILE   2  -8.868   5.025  -3.383
    7   HG12  ILE   2          2HG1      ILE   2  -7.250   2.914  -4.012
    8   HG13  ILE   2          3HG1      ILE   2  -8.693   2.085  -3.438
    9   HG21  ILE   2          1HG2      ILE   2  -7.277   5.519  -1.838
   10   HG22  ILE   2          2HG2      ILE   2  -7.269   3.891  -1.162
   11   HG23  ILE   2          3HG2      ILE   2  -6.433   4.219  -2.679
   12   HD11  ILE   2          3HD1      ILE   2  -9.461   4.197  -5.194
   13   HD12  ILE   2          1HD1      ILE   2  -8.225   3.204  -5.968
   14   HD13  ILE   2          2HD1      ILE   2  -9.705   2.459  -5.363
   15    H    ARG   3           H        ARG   3  -8.580   4.946   0.059
   16    HA   ARG   3           HA       ARG   3 -10.811   6.603   0.798
   17    HB2  ARG   3           2HB      ARG   3  -9.469   7.342   2.614
   18    HB3  ARG   3           3HB      ARG   3  -9.127   5.629   2.410
   19    HG2  ARG   3           2HG      ARG   3  -7.193   6.659   0.863
   20    HG3  ARG   3           3HG      ARG   3  -7.382   7.972   2.028
   21    HD2  ARG   3           2HD      ARG   3  -5.856   6.707   3.150
   22    HD3  ARG   3           3HD      ARG   3  -7.335   5.955   3.745
   23    HE   ARG   3           HE       ARG   3  -6.745   4.037   2.655
   24   HH11  ARG   3          1HH1      ARG   3  -4.906   6.687   1.346
   25   HH12  ARG   3          2HH1      ARG   3  -3.907   5.676   0.356
   26   HH21  ARG   3          1HH2      ARG   3  -5.435   2.695   1.357
   27   HH22  ARG   3          2HH2      ARG   3  -4.209   3.405   0.363
   28    H    CYS   4           H        CYS   4 -11.002   8.821   0.606
   29    HA   CYS   4           HA       CYS   4  -9.496   9.992  -1.591
   30    HB2  CYS   4           2HB      CYS   4 -12.028  10.677  -0.150
   31    HB3  CYS   4           3HB      CYS   4 -11.187  11.937  -1.046
   32    HA   PRO   5           HA       PRO   5  -6.875  12.592   0.778
   33    HB2  PRO   5           2HB      PRO   5  -6.878  14.890  -0.669
   34    HB3  PRO   5           3HB      PRO   5  -6.062  13.417  -1.207
   35    HG2  PRO   5           2HG      PRO   5  -8.737  14.499  -2.004
   36    HG3  PRO   5           3HG      PRO   5  -7.471  13.785  -3.020
   37    HD2  PRO   5           2HD      PRO   5  -9.658  12.399  -2.226
   38    HD3  PRO   5           3HD      PRO   5  -8.078  11.628  -2.477
   39    H    LYS   6           H        LYS   6  -8.623  12.593   2.491
   40    HA   LYS   6           HA       LYS   6  -9.952  13.663   4.003
   41    HB2  LYS   6           2HB      LYS   6  -8.253  15.989   3.086
   42    HB3  LYS   6           3HB      LYS   6  -9.280  16.010   4.514
   43    HG2  LYS   6           2HG      LYS   6  -7.925  14.535   5.672
   44    HG3  LYS   6           3HG      LYS   6  -7.180  13.907   4.200
   45    HD2  LYS   6           2HD      LYS   6  -6.586  16.635   4.215
   46    HD3  LYS   6           3HD      LYS   6  -6.360  16.104   5.883
   47    HE2  LYS   6           2HE      LYS   6  -5.155  14.746   3.475
   48    HE3  LYS   6           3HE      LYS   6  -4.314  15.926   4.479
   49    HZ1  LYS   6           3HZ      LYS   6  -5.385  13.313   5.398
   50    HZ2  LYS   6           1HZ      LYS   6  -4.606  14.450   6.378
   51    HZ3  LYS   6           2HZ      LYS   6  -3.755  13.680   5.136
   52    H    SER   7           H        SER   7 -11.551  13.222   2.071
   53    HA   SER   7           HA       SER   7 -13.443  15.270   2.069
   54    HB2  SER   7           2HB      SER   7 -13.286  15.738  -0.490
   55    HB3  SER   7           3HB      SER   7 -12.219  16.616   0.605
   56    HG   SER   7           HG       SER   7 -10.762  15.866  -0.741
   57    H    TRP   8           H        TRP   8 -15.238  14.110   2.005
   58    HA   TRP   8           HA       TRP   8 -15.296  11.539   0.679
   59    HB2  TRP   8           2HB      TRP   8 -17.169  13.030   2.489
   60    HB3  TRP   8           3HB      TRP   8 -17.743  11.635   1.578
   61    HD1  TRP   8           HD1      TRP   8 -14.228  11.758   3.118
   62    HE1  TRP   8           HE1      TRP   8 -14.071   9.940   4.934
   63    HE3  TRP   8           HE3      TRP   8 -19.111  10.243   3.175
   64    HZ2  TRP   8           HZ2      TRP   8 -15.790   8.107   6.220
   65    HZ3  TRP   8           HZ3      TRP   8 -19.772   8.452   4.727
   66    HH2  TRP   8           HH2      TRP   8 -18.144   7.407   6.216
   67    H    LYS   9           H        LYS   9 -14.909  12.882  -1.404
   68    HA   LYS   9           HA       LYS   9 -17.464  13.003  -2.779
   69    HB2  LYS   9           2HB      LYS   9 -15.579  15.363  -2.669
   70    HB3  LYS   9           3HB      LYS   9 -16.916  15.216  -3.802
   71    HG2  LYS   9           2HG      LYS   9 -18.429  15.003  -1.790
   72    HG3  LYS   9           3HG      LYS   9 -17.041  15.493  -0.815
   73    HD2  LYS   9           2HD      LYS   9 -18.246  17.475  -1.237
   74    HD3  LYS   9           3HD      LYS   9 -16.872  17.516  -2.344
   75    HE2  LYS   9           2HE      LYS   9 -18.624  16.294  -3.930
   76    HE3  LYS   9           3HE      LYS   9 -19.765  17.163  -2.905
   77    HZ1  LYS   9           3HZ      LYS   9 -17.527  18.399  -4.418
   78    HZ2  LYS   9           1HZ      LYS   9 -18.646  19.225  -3.454
   79    HZ3  LYS   9           2HZ      LYS   9 -19.158  18.446  -4.865
   80    H    CYS  10           H        CYS  10 -14.229  14.250  -3.575
   81    HA   CYS  10           HA       CYS  10 -12.770  13.739  -5.242
   82    HB2  CYS  10           2HB      CYS  10 -13.921  11.087  -4.508
   83    HB3  CYS  10           3HB      CYS  10 -12.937  11.188  -5.964
   84    H    LYS  11           H        LYS  11 -14.397  15.176  -6.424
   85    HA   LYS  11           HA       LYS  11 -16.328  14.259  -8.166
   86    HB2  LYS  11           2HB      LYS  11 -15.138  16.690  -7.645
   87    HB3  LYS  11           3HB      LYS  11 -14.676  16.387  -9.315
   88    HG2  LYS  11           2HG      LYS  11 -17.155  15.903  -9.719
   89    HG3  LYS  11           3HG      LYS  11 -17.423  16.671  -8.152
   90    HD2  LYS  11           2HD      LYS  11 -15.712  18.115 -10.096
   91    HD3  LYS  11           3HD      LYS  11 -17.440  18.034 -10.447
   92    HE2  LYS  11           2HE      LYS  11 -17.561  19.852  -9.134
   93    HE3  LYS  11           3HE      LYS  11 -17.469  18.688  -7.813
   94    HZ1  LYS  11           3HZ      LYS  11 -15.624  19.696  -7.163
   95    HZ2  LYS  11           1HZ      LYS  11 -15.636  20.717  -8.512
   96    HZ3  LYS  11           2HZ      LYS  11 -14.863  19.215  -8.596
   97    H    ALA  12           H        ALA  12 -16.039  12.528  -9.440
   98    HA   ALA  12           HA       ALA  12 -13.708  11.605 -10.587
   99    HB1  ALA  12           1HB      ALA  12 -15.629  10.203 -10.545
  100    HB2  ALA  12           2HB      ALA  12 -16.553  11.334 -11.534
  101    HB3  ALA  12           3HB      ALA  12 -15.199  10.448 -12.238
  102    H    PHE  13           H        PHE  13 -16.018  13.951 -11.872
  103    HA   PHE  13           HA       PHE  13 -15.013  14.197 -14.456
  104    HB2  PHE  13           2HB      PHE  13 -17.125  15.241 -13.423
  105    HB3  PHE  13           3HB      PHE  13 -16.066  16.542 -12.887
  106    HD1  PHE  13           HD2      PHE  13 -16.809  14.625 -16.002
  107    HD2  PHE  13           HD1      PHE  13 -15.911  18.389 -14.230
  108    HE1  PHE  13           HE2      PHE  13 -17.037  15.709 -18.199
  109    HE2  PHE  13           HE1      PHE  13 -16.138  19.480 -16.424
  110    HZ   PHE  13           HZ       PHE  13 -16.701  18.140 -18.412
  111    H    LYS  14           H        LYS  14 -14.359  16.432 -11.752
  112    HA   LYS  14           HA       LYS  14 -12.263  17.797 -12.998
  113    HB2  LYS  14           2HB      LYS  14 -13.440  18.636 -11.009
  114    HB3  LYS  14           3HB      LYS  14 -12.724  17.354 -10.041
  115    HG2  LYS  14           2HG      LYS  14 -11.304  19.052  -9.533
  116    HG3  LYS  14           3HG      LYS  14 -10.478  18.402 -10.951
  117    HD2  LYS  14           2HD      LYS  14 -11.966  20.104 -12.251
  118    HD3  LYS  14           3HD      LYS  14 -12.114  20.892 -10.679
  119    HE2  LYS  14           2HE      LYS  14  -9.749  21.187 -10.527
  120    HE3  LYS  14           3HE      LYS  14  -9.475  20.175 -11.945
  121    HZ1  LYS  14           3HZ      LYS  14  -9.405  22.715 -12.203
  122    HZ2  LYS  14           1HZ      LYS  14 -11.094  22.630 -12.153
  123    HZ3  LYS  14           2HZ      LYS  14 -10.242  21.812 -13.363
  124    H    GLN  15           H        GLN  15 -12.311  14.799 -11.205
  125    HA   GLN  15           HA       GLN  15  -9.582  14.546 -10.641
  126    HB2  GLN  15           2HB      GLN  15 -11.803  12.570 -11.043
  127    HB3  GLN  15           3HB      GLN  15 -10.152  12.012 -10.808
  128    HG2  GLN  15           2HG      GLN  15 -11.403  13.931  -8.888
  129    HG3  GLN  15           3HG      GLN  15 -11.714  12.200  -8.773
  130   HE21  GLN  15          1HE2      GLN  15 -10.580  13.326  -6.661
  131   HE22  GLN  15          2HE2      GLN  15  -8.905  12.921  -6.546
  132    H    ARG  16           H        ARG  16 -11.449  13.484 -13.469
  133    HA   ARG  16           HA       ARG  16  -9.188  12.385 -14.817
  134    HB2  ARG  16           2HB      ARG  16 -11.866  13.225 -15.942
  135    HB3  ARG  16           3HB      ARG  16 -10.684  12.200 -16.745
  136    HG2  ARG  16           2HG      ARG  16 -11.036  10.431 -15.228
  137    HG3  ARG  16           3HG      ARG  16 -11.928  11.468 -14.113
  138    HD2  ARG  16           2HD      ARG  16 -13.044  11.342 -16.822
  139    HD3  ARG  16           3HD      ARG  16 -13.060   9.808 -15.954
  140    HE   ARG  16           HE       ARG  16 -14.066  11.558 -14.150
  141   HH11  ARG  16          1HH1      ARG  16 -14.856  10.794 -17.453
  142   HH12  ARG  16          2HH1      ARG  16 -16.537  11.174 -17.276
  143   HH21  ARG  16          1HH2      ARG  16 -16.277  12.062 -13.904
  144   HH22  ARG  16          2HH2      ARG  16 -17.344  11.896 -15.257
  145    H    VAL  17           H        VAL  17 -11.025  15.407 -15.148
  146    HA   VAL  17           HA       VAL  17  -9.742  16.517 -17.322
  147    HB   VAL  17           HB       VAL  17 -10.628  18.050 -14.875
  148   HG11  VAL  17          1HG1      VAL  17  -9.456  19.540 -16.239
  149   HG12  VAL  17          2HG1      VAL  17 -10.074  18.812 -17.723
  150   HG13  VAL  17          3HG1      VAL  17 -11.141  19.776 -16.701
  151   HG21  VAL  17          3HG2      VAL  17 -12.563  18.119 -16.945
  152   HG22  VAL  17          1HG2      VAL  17 -12.151  16.430 -16.646
  153   HG23  VAL  17          2HG2      VAL  17 -12.718  17.448 -15.322
  154    H    LEU  18           H        LEU  18  -8.725  16.492 -13.939
  155    HA   LEU  18           HA       LEU  18  -6.611  18.267 -14.032
  156    HB2  LEU  18           2HB      LEU  18  -7.483  17.156 -11.999
  157    HB3  LEU  18           3HB      LEU  18  -6.694  15.666 -12.510
  158    HG   LEU  18           HG       LEU  18  -4.825  17.878 -12.372
  159   HD11  LEU  18          1HD1      LEU  18  -6.471  17.228  -9.945
  160   HD12  LEU  18          2HD1      LEU  18  -6.116  18.809 -10.639
  161   HD13  LEU  18          3HD1      LEU  18  -4.840  17.892  -9.839
  162   HD21  LEU  18          3HD2      LEU  18  -3.443  16.230 -11.748
  163   HD22  LEU  18          1HD2      LEU  18  -4.762  15.154 -12.210
  164   HD23  LEU  18          2HD2      LEU  18  -4.559  15.626 -10.522
  165    H    LYS  19           H        LYS  19  -6.680  14.854 -14.949
  166    HA   LYS  19           HA       LYS  19  -3.875  14.857 -15.660
  167    HB2  LYS  19           2HB      LYS  19  -6.044  12.847 -15.486
  168    HB3  LYS  19           3HB      LYS  19  -4.794  12.535 -16.684
  169    HG2  LYS  19           2HG      LYS  19  -3.103  12.452 -15.048
  170    HG3  LYS  19           3HG      LYS  19  -4.154  13.155 -13.817
  171    HD2  LYS  19           2HD      LYS  19  -5.011  11.163 -13.275
  172    HD3  LYS  19           3HD      LYS  19  -5.251  10.718 -14.966
  173    HE2  LYS  19           2HE      LYS  19  -3.349   9.532 -15.043
  174    HE3  LYS  19           3HE      LYS  19  -2.448  10.740 -14.128
  175    HZ1  LYS  19           3HZ      LYS  19  -2.615   9.487 -12.328
  176    HZ2  LYS  19           1HZ      LYS  19  -3.396   8.288 -13.230
  177    HZ3  LYS  19           2HZ      LYS  19  -4.303   9.471 -12.432
  178    H    ARG  20           H        ARG  20  -6.989  15.019 -17.277
  179    HA   ARG  20           HA       ARG  20  -6.253  14.535 -19.898
  180    HB2  ARG  20           2HB      ARG  20  -8.324  16.382 -18.725
  181    HB3  ARG  20           3HB      ARG  20  -8.139  16.171 -20.461
  182    HG2  ARG  20           2HG      ARG  20  -8.422  13.674 -20.009
  183    HG3  ARG  20           3HG      ARG  20  -8.998  14.161 -18.413
  184    HD2  ARG  20           2HD      ARG  20 -11.013  14.410 -19.322
  185    HD3  ARG  20           3HD      ARG  20 -10.367  15.805 -20.186
  186    HE   ARG  20           HE       ARG  20  -9.773  13.427 -21.591
  187   HH11  ARG  20          1HH1      ARG  20 -12.416  15.561 -20.830
  188   HH12  ARG  20          2HH1      ARG  20 -13.305  15.185 -22.269
  189   HH21  ARG  20          1HH2      ARG  20 -10.934  12.924 -23.489
  190   HH22  ARG  20          2HH2      ARG  20 -12.462  13.684 -23.780
  191    H    LEU  21           H        LEU  21  -6.102  17.579 -18.085
  192    HA   LEU  21           HA       LEU  21  -5.312  19.283 -20.121
  193    HB2  LEU  21           2HB      LEU  21  -5.692  19.508 -17.434
  194    HB3  LEU  21           3HB      LEU  21  -3.947  19.717 -17.561
  195    HG   LEU  21           HG       LEU  21  -4.850  21.417 -19.496
  196   HD11  LEU  21          1HD1      LEU  21  -7.180  21.046 -18.843
  197   HD12  LEU  21          2HD1      LEU  21  -6.674  22.708 -18.542
  198   HD13  LEU  21          3HD1      LEU  21  -6.800  21.568 -17.202
  199   HD21  LEU  21          3HD2      LEU  21  -4.298  23.189 -17.922
  200   HD22  LEU  21          1HD2      LEU  21  -3.140  21.864 -17.799
  201   HD23  LEU  21          2HD2      LEU  21  -4.402  22.049 -16.580
  202    H    LEU  22           H        LEU  22  -3.436  16.955 -18.296
  203    HA   LEU  22           HA       LEU  22  -0.896  17.871 -19.269
  204    HB2  LEU  22           2HB      LEU  22  -1.838  15.496 -17.715
  205    HB3  LEU  22           3HB      LEU  22  -0.205  15.533 -18.375
  206    HG   LEU  22           HG       LEU  22  -1.003  17.883 -16.777
  207   HD11  LEU  22          1HD1      LEU  22  -2.013  15.933 -15.568
  208   HD12  LEU  22          2HD1      LEU  22  -0.789  16.821 -14.662
  209   HD13  LEU  22          3HD1      LEU  22  -0.384  15.275 -15.407
  210   HD21  LEU  22          3HD2      LEU  22   1.362  17.013 -15.824
  211   HD22  LEU  22          1HD2      LEU  22   1.197  18.058 -17.236
  212   HD23  LEU  22          2HD2      LEU  22   1.403  16.319 -17.446
  213    H    ALA  23           H        ALA  23  -2.789  14.900 -19.836
  214    HA   ALA  23           HA       ALA  23  -1.251  13.782 -21.829
  215    HB1  ALA  23           1HB      ALA  23  -4.262  13.720 -21.666
  216    HB2  ALA  23           2HB      ALA  23  -3.234  12.572 -22.526
  217    HB3  ALA  23           3HB      ALA  23  -3.167  12.669 -20.766
  218    H    MET  24           H        MET  24  -3.727  16.287 -22.110
  219    HA   MET  24           HA       MET  24  -3.598  16.389 -24.973
  220    HB2  MET  24           2HB      MET  24  -5.592  17.050 -23.562
  221    HB3  MET  24           3HB      MET  24  -4.702  18.501 -23.121
  222    HG2  MET  24           2HG      MET  24  -4.943  19.446 -25.174
  223    HG3  MET  24           3HG      MET  24  -4.999  17.893 -26.005
  224    HE1  MET  24           3HE      MET  24  -6.913  20.667 -24.153
  225    HE2  MET  24           1HE      MET  24  -8.517  19.980 -23.892
  226    HE3  MET  24           2HE      MET  24  -7.139  19.374 -22.974
  227    H    LEU  25           H        LEU  25  -2.270  18.310 -22.314
  228    HA   LEU  25           HA       LEU  25  -1.171  20.413 -23.730
  229    HB2  LEU  25           2HB      LEU  25  -1.150  20.469 -21.361
  230    HB3  LEU  25           3HB      LEU  25  -0.214  18.979 -21.267
  231    HG   LEU  25           HG       LEU  25   1.697  20.247 -22.314
  232   HD11  LEU  25          1HD1      LEU  25   1.630  22.687 -22.153
  233   HD12  LEU  25          2HD1      LEU  25  -0.064  22.608 -21.668
  234   HD13  LEU  25          3HD1      LEU  25   0.417  22.077 -23.279
  235   HD21  LEU  25          3HD2      LEU  25   0.574  20.830 -19.605
  236   HD22  LEU  25          1HD2      LEU  25   2.065  21.610 -20.134
  237   HD23  LEU  25          2HD2      LEU  25   1.971  19.850 -20.054
  238    H    ARG  26           H        ARG  26   0.143  17.177 -23.184
  239    HA   ARG  26           HA       ARG  26   2.306  17.805 -25.082
  240    HB2  ARG  26           2HB      ARG  26   2.208  15.758 -22.861
  241    HB3  ARG  26           3HB      ARG  26   3.507  15.873 -24.041
  242    HG2  ARG  26           2HG      ARG  26   3.002  18.422 -22.782
  243    HG3  ARG  26           3HG      ARG  26   3.352  17.165 -21.593
  244    HD2  ARG  26           2HD      ARG  26   5.049  17.604 -24.036
  245    HD3  ARG  26           3HD      ARG  26   5.337  18.452 -22.518
  246    HE   ARG  26           HE       ARG  26   5.226  15.784 -21.864
  247   HH11  ARG  26          1HH1      ARG  26   7.149  17.785 -23.966
  248   HH12  ARG  26          2HH1      ARG  26   8.564  16.795 -23.829
  249   HH21  ARG  26          1HH2      ARG  26   7.082  14.472 -21.676
  250   HH22  ARG  26          2HH2      ARG  26   8.525  14.910 -22.527
  251    H    GLN  27           H        GLN  27  -0.005  17.273 -26.290
  252    HA   GLN  27           HA       GLN  27  -0.101  14.417 -26.901
  253    HB2  GLN  27           2HB      GLN  27  -2.200  14.821 -27.927
  254    HB3  GLN  27           3HB      GLN  27  -2.192  15.768 -26.446
  255    HG2  GLN  27           2HG      GLN  27  -1.388  17.698 -27.955
  256    HG3  GLN  27           3HG      GLN  27  -1.985  16.697 -29.278
  257   HE21  GLN  27          1HE2      GLN  27  -4.208  15.572 -28.136
  258   HE22  GLN  27          2HE2      GLN  27  -5.376  16.802 -27.807
  259    H    HIS  28           H        HIS  28   2.110  16.192 -27.756
  260    HA   HIS  28           HA       HIS  28   2.015  16.946 -30.409
  261    HB2  HIS  28           2HB      HIS  28   3.922  17.201 -28.693
  262    HB3  HIS  28           3HB      HIS  28   4.443  15.609 -29.235
  263    HD1  HIS  28           HD1      HIS  28   3.596  18.955 -30.849
  264    HD2  HIS  28           HD2      HIS  28   6.201  15.747 -31.277
  265    HE1  HIS  28           HE1      HIS  28   5.112  19.570 -32.759
  266    H    ALA  29           H        ALA  29   3.110  15.862 -32.276
  267    HA   ALA  29           HA       ALA  29   2.682  12.951 -32.267
  268    HB1  ALA  29           1HB      ALA  29   1.759  13.164 -34.580
  269    HB2  ALA  29           2HB      ALA  29   0.735  13.846 -33.316
  270    HB3  ALA  29           3HB      ALA  29   1.704  14.910 -34.335
  271    H    PHE  30           H        PHE  30   4.975  12.778 -32.054
  272    HA   PHE  30           HA       PHE  30   6.901  13.950 -33.645
  273    HB2  PHE  30           2HB      PHE  30   7.186  12.385 -31.625
  274    HB3  PHE  30           3HB      PHE  30   7.080  11.069 -32.789
  275    HD1  PHE  30           HD1      PHE  30   8.835  14.363 -32.661
  276    HD2  PHE  30           HD2      PHE  30   9.116  10.164 -33.300
  277    HE1  PHE  30           HE1      PHE  30  11.237  14.600 -33.141
  278    HE2  PHE  30           HE2      PHE  30  11.518  10.394 -33.779
  279    HZ   PHE  30           HZ       PHE  30  12.582  12.614 -33.699
  Start of MODEL   14
    1    H1   GLY   1           H        GLY   1  -7.348   1.796  -1.290
    2    HA2  GLY   1           2HA      GLY   1  -7.513   2.008  -4.228
    3    HA3  GLY   1           3HA      GLY   1  -8.843   2.326  -3.124
    4    H    ILE   2           H        ILE   2  -9.028   4.343  -4.339
    5    HA   ILE   2           HA       ILE   2  -6.928   6.308  -3.958
    6    HB   ILE   2           HB       ILE   2  -9.656   6.853  -5.103
    7   HG12  ILE   2          2HG1      ILE   2  -7.230   5.812  -6.582
    8   HG13  ILE   2          3HG1      ILE   2  -8.689   4.886  -6.245
    9   HG21  ILE   2          1HG2      ILE   2  -8.286   8.505  -6.443
   10   HG22  ILE   2          2HG2      ILE   2  -8.442   8.840  -4.720
   11   HG23  ILE   2          3HG2      ILE   2  -6.951   8.141  -5.350
   12   HD11  ILE   2          3HD1      ILE   2  -9.079   5.544  -8.393
   13   HD12  ILE   2          1HD1      ILE   2  -9.855   6.858  -7.510
   14   HD13  ILE   2          2HD1      ILE   2  -8.244   7.084  -8.191
   15    H    ARG   3           H        ARG   3  -7.369   8.414  -3.006
   16    HA   ARG   3           HA       ARG   3  -9.624   8.643  -1.207
   17    HB2  ARG   3           2HB      ARG   3  -7.437   7.407  -0.178
   18    HB3  ARG   3           3HB      ARG   3  -7.057   9.085   0.182
   19    HG2  ARG   3           2HG      ARG   3  -8.903   9.338   1.569
   20    HG3  ARG   3           3HG      ARG   3  -9.726   7.934   0.887
   21    HD2  ARG   3           2HD      ARG   3  -7.772   6.573   1.837
   22    HD3  ARG   3           3HD      ARG   3  -7.403   8.013   2.785
   23    HE   ARG   3           HE       ARG   3 -10.019   7.601   3.305
   24   HH11  ARG   3          1HH1      ARG   3  -7.217   5.538   3.424
   25   HH12  ARG   3          2HH1      ARG   3  -7.836   4.551   4.706
   26   HH21  ARG   3          1HH2      ARG   3 -10.846   6.308   4.993
   27   HH22  ARG   3          2HH2      ARG   3  -9.901   4.989   5.597
   28    H    CYS   4           H        CYS   4 -10.268  10.695  -1.135
   29    HA   CYS   4           HA       CYS   4  -8.670  12.733  -2.408
   30    HB2  CYS   4           2HB      CYS   4 -11.472  12.503  -1.427
   31    HB3  CYS   4           3HB      CYS   4 -10.785  14.120  -1.549
   32    HA   PRO   5           HA       PRO   5  -6.955  14.713   1.110
   33    HB2  PRO   5           2HB      PRO   5  -7.214  17.343   0.489
   34    HB3  PRO   5           3HB      PRO   5  -6.062  16.274  -0.320
   35    HG2  PRO   5           2HG      PRO   5  -8.766  17.180  -1.229
   36    HG3  PRO   5           3HG      PRO   5  -7.262  17.043  -2.158
   37    HD2  PRO   5           2HD      PRO   5  -9.221  15.177  -2.273
   38    HD3  PRO   5           3HD      PRO   5  -7.502  14.769  -2.449
   39    H    LYS   6           H        LYS   6  -8.828  13.900   2.417
   40    HA   LYS   6           HA       LYS   6 -10.509  14.188   3.929
   41    HB2  LYS   6           2HB      LYS   6  -9.357  16.982   4.032
   42    HB3  LYS   6           3HB      LYS   6 -10.413  16.267   5.243
   43    HG2  LYS   6           2HG      LYS   6  -8.643  14.479   5.531
   44    HG3  LYS   6           3HG      LYS   6  -7.587  15.514   4.567
   45    HD2  LYS   6           2HD      LYS   6  -7.519  17.170   6.186
   46    HD3  LYS   6           3HD      LYS   6  -9.022  16.635   6.941
   47    HE2  LYS   6           2HE      LYS   6  -7.713  14.494   7.519
   48    HE3  LYS   6           3HE      LYS   6  -6.276  15.445   7.150
   49    HZ1  LYS   6           3HZ      LYS   6  -7.698  15.389   9.529
   50    HZ2  LYS   6           1HZ      LYS   6  -7.984  16.913   8.851
   51    HZ3  LYS   6           2HZ      LYS   6  -6.398  16.396   9.131
   52    H    SER   7           H        SER   7 -11.873  14.026   1.871
   53    HA   SER   7           HA       SER   7 -14.075  15.724   2.087
   54    HB2  SER   7           2HB      SER   7 -13.799  16.776  -0.281
   55    HB3  SER   7           3HB      SER   7 -12.981  17.529   1.088
   56    HG   SER   7           HG       SER   7 -11.166  17.148   0.125
   57    H    TRP   8           H        TRP   8 -15.649  14.375   1.564
   58    HA   TRP   8           HA       TRP   8 -15.175  12.166  -0.238
   59    HB2  TRP   8           2HB      TRP   8 -17.439  12.991   1.551
   60    HB3  TRP   8           3HB      TRP   8 -17.690  11.755   0.321
   61    HD1  TRP   8           HD1      TRP   8 -14.355  11.907   2.166
   62    HE1  TRP   8           HE1      TRP   8 -14.142   9.826   3.666
   63    HE3  TRP   8           HE3      TRP   8 -19.083  10.036   1.637
   64    HZ2  TRP   8           HZ2      TRP   8 -15.763   7.676   4.513
   65    HZ3  TRP   8           HZ3      TRP   8 -19.671   7.963   2.825
   66    HH2  TRP   8           HH2      TRP   8 -18.044   6.809   4.232
   67    H    LYS   9           H        LYS   9 -14.778  13.922  -1.968
   68    HA   LYS   9           HA       LYS   9 -17.314  14.347  -3.403
   69    HB2  LYS   9           2HB      LYS   9 -14.948  16.219  -3.230
   70    HB3  LYS   9           3HB      LYS   9 -16.278  16.418  -4.363
   71    HG2  LYS   9           2HG      LYS   9 -17.678  16.251  -2.095
   72    HG3  LYS   9           3HG      LYS   9 -16.171  16.909  -1.453
   73    HD2  LYS   9           2HD      LYS   9 -17.676  18.089  -3.785
   74    HD3  LYS   9           3HD      LYS   9 -17.850  18.636  -2.116
   75    HE2  LYS   9           2HE      LYS   9 -15.557  19.310  -2.028
   76    HE3  LYS   9           3HE      LYS   9 -15.221  18.558  -3.587
   77    HZ1  LYS   9           3HZ      LYS   9 -16.075  20.293  -4.703
   78    HZ2  LYS   9           1HZ      LYS   9 -15.770  21.146  -3.274
   79    HZ3  LYS   9           2HZ      LYS   9 -17.323  20.555  -3.591
   80    H    CYS  10           H        CYS  10 -13.895  14.871  -4.231
   81    HA   CYS  10           HA       CYS  10 -12.667  14.211  -6.033
   82    HB2  CYS  10           2HB      CYS  10 -14.186  11.612  -5.796
   83    HB3  CYS  10           3HB      CYS  10 -12.559  11.852  -6.425
   84    H    LYS  11           H        LYS  11 -14.197  15.803  -7.156
   85    HA   LYS  11           HA       LYS  11 -16.330  15.073  -8.742
   86    HB2  LYS  11           2HB      LYS  11 -14.928  17.372  -8.353
   87    HB3  LYS  11           3HB      LYS  11 -14.455  16.972  -9.999
   88    HG2  LYS  11           2HG      LYS  11 -16.539  17.321 -10.835
   89    HG3  LYS  11           3HG      LYS  11 -17.342  16.855  -9.334
   90    HD2  LYS  11           2HD      LYS  11 -16.670  18.963  -8.307
   91    HD3  LYS  11           3HD      LYS  11 -15.825  19.426  -9.787
   92    HE2  LYS  11           2HE      LYS  11 -18.454  18.714 -10.524
   93    HE3  LYS  11           3HE      LYS  11 -18.584  19.751  -9.103
   94    HZ1  LYS  11           3HZ      LYS  11 -18.054  20.498 -11.745
   95    HZ2  LYS  11           1HZ      LYS  11 -16.677  20.854 -10.829
   96    HZ3  LYS  11           2HZ      LYS  11 -18.179  21.492 -10.382
   97    H    ALA  12           H        ALA  12 -16.497  13.551 -10.240
   98    HA   ALA  12           HA       ALA  12 -14.445  12.089 -11.361
   99    HB1  ALA  12           1HB      ALA  12 -16.692  11.279 -11.454
  100    HB2  ALA  12           2HB      ALA  12 -17.199  12.647 -12.447
  101    HB3  ALA  12           3HB      ALA  12 -16.102  11.435 -13.109
  102    H    PHE  13           H        PHE  13 -16.013  15.002 -12.621
  103    HA   PHE  13           HA       PHE  13 -14.819  15.090 -15.132
  104    HB2  PHE  13           2HB      PHE  13 -16.663  16.592 -14.133
  105    HB3  PHE  13           3HB      PHE  13 -15.339  17.570 -13.509
  106    HD1  PHE  13           HD1      PHE  13 -17.015  16.374 -16.552
  107    HD2  PHE  13           HD2      PHE  13 -14.046  18.965 -14.943
  108    HE1  PHE  13           HE1      PHE  13 -16.865  17.540 -18.714
  109    HE2  PHE  13           HE2      PHE  13 -13.893  20.136 -17.102
  110    HZ   PHE  13           HZ       PHE  13 -15.304  19.424 -18.990
  111    H    LYS  14           H        LYS  14 -13.793  16.945 -12.261
  112    HA   LYS  14           HA       LYS  14 -11.357  17.813 -13.326
  113    HB2  LYS  14           2HB      LYS  14 -12.469  18.759 -11.307
  114    HB3  LYS  14           3HB      LYS  14 -11.998  17.319 -10.413
  115    HG2  LYS  14           2HG      LYS  14  -9.610  17.888 -10.990
  116    HG3  LYS  14           3HG      LYS  14 -10.214  19.441 -11.573
  117    HD2  LYS  14           2HD      LYS  14  -9.553  19.852  -9.360
  118    HD3  LYS  14           3HD      LYS  14 -11.308  19.679  -9.276
  119    HE2  LYS  14           2HE      LYS  14 -10.363  18.451  -7.459
  120    HE3  LYS  14           3HE      LYS  14 -10.963  17.289  -8.642
  121    HZ1  LYS  14           3HZ      LYS  14  -8.290  17.719  -7.707
  122    HZ2  LYS  14           1HZ      LYS  14  -8.386  17.708  -9.396
  123    HZ3  LYS  14           2HZ      LYS  14  -8.950  16.383  -8.508
  124    H    GLN  15           H        GLN  15 -12.244  14.833 -11.729
  125    HA   GLN  15           HA       GLN  15  -9.693  13.880 -11.080
  126    HB2  GLN  15           2HB      GLN  15 -12.314  12.545 -11.670
  127    HB3  GLN  15           3HB      GLN  15 -10.866  11.580 -11.410
  128    HG2  GLN  15           2HG      GLN  15 -11.070  13.526  -9.336
  129    HG3  GLN  15           3HG      GLN  15 -12.606  12.674  -9.488
  130   HE21  GLN  15          1HE2      GLN  15 -12.773  10.643  -8.746
  131   HE22  GLN  15          2HE2      GLN  15 -11.473   9.738  -8.056
  132    H    ARG  16           H        ARG  16 -11.607  13.532 -14.043
  133    HA   ARG  16           HA       ARG  16  -9.652  11.926 -15.373
  134    HB2  ARG  16           2HB      ARG  16 -12.315  12.829 -15.877
  135    HB3  ARG  16           3HB      ARG  16 -11.317  13.235 -17.267
  136    HG2  ARG  16           2HG      ARG  16 -12.179  11.115 -17.737
  137    HG3  ARG  16           3HG      ARG  16 -10.522  10.821 -17.204
  138    HD2  ARG  16           2HD      ARG  16 -11.189   9.920 -15.189
  139    HD3  ARG  16           3HD      ARG  16 -12.734  10.768 -15.203
  140    HE   ARG  16           HE       ARG  16 -13.645   9.019 -16.367
  141   HH11  ARG  16          1HH1      ARG  16 -10.173   8.786 -16.481
  142   HH12  ARG  16          2HH1      ARG  16 -10.172   7.215 -17.213
  143   HH21  ARG  16          1HH2      ARG  16 -13.657   6.951 -17.330
  144   HH22  ARG  16          2HH2      ARG  16 -12.154   6.173 -17.696
  145    H    VAL  17           H        VAL  17 -10.596  15.344 -15.560
  146    HA   VAL  17           HA       VAL  17  -8.949  16.189 -17.605
  147    HB   VAL  17           HB       VAL  17  -9.524  17.763 -15.092
  148   HG11  VAL  17          1HG1      VAL  17  -7.912  18.936 -16.326
  149   HG12  VAL  17          2HG1      VAL  17  -8.664  18.521 -17.868
  150   HG13  VAL  17          3HG1      VAL  17  -9.448  19.671 -16.784
  151   HG21  VAL  17          3HG2      VAL  17 -11.673  17.737 -15.652
  152   HG22  VAL  17          1HG2      VAL  17 -11.263  18.487 -17.195
  153   HG23  VAL  17          2HG2      VAL  17 -11.320  16.730 -17.056
  154    H    LEU  18           H        LEU  18  -8.165  15.778 -14.177
  155    HA   LEU  18           HA       LEU  18  -5.638  16.890 -14.111
  156    HB2  LEU  18           2HB      LEU  18  -6.800  16.098 -12.128
  157    HB3  LEU  18           3HB      LEU  18  -6.637  14.432 -12.679
  158    HG   LEU  18           HG       LEU  18  -4.103  15.895 -12.367
  159   HD11  LEU  18          1HD1      LEU  18  -5.952  15.394 -10.059
  160   HD12  LEU  18          2HD1      LEU  18  -5.043  16.852 -10.453
  161   HD13  LEU  18          3HD1      LEU  18  -4.200  15.422  -9.858
  162   HD21  LEU  18          3HD2      LEU  18  -4.726  13.327 -11.027
  163   HD22  LEU  18          1HD2      LEU  18  -3.282  13.829 -11.906
  164   HD23  LEU  18          2HD2      LEU  18  -4.728  13.343 -12.791
  165    H    LYS  19           H        LYS  19  -6.572  13.599 -15.047
  166    HA   LYS  19           HA       LYS  19  -3.864  12.828 -15.638
  167    HB2  LYS  19           2HB      LYS  19  -6.390  11.519 -15.336
  168    HB3  LYS  19           3HB      LYS  19  -5.706  11.068 -16.892
  169    HG2  LYS  19           2HG      LYS  19  -4.037   9.874 -15.966
  170    HG3  LYS  19           3HG      LYS  19  -3.850  10.985 -14.607
  171    HD2  LYS  19           2HD      LYS  19  -6.384   9.505 -14.632
  172    HD3  LYS  19           3HD      LYS  19  -4.947   8.495 -14.447
  173    HE2  LYS  19           2HE      LYS  19  -4.394  10.523 -12.729
  174    HE3  LYS  19           3HE      LYS  19  -6.150  10.441 -12.601
  175    HZ1  LYS  19           3HZ      LYS  19  -5.241   7.831 -12.526
  176    HZ2  LYS  19           1HZ      LYS  19  -5.876   8.731 -11.242
  177    HZ3  LYS  19           2HZ      LYS  19  -4.206   8.701 -11.509
  178    H    ARG  20           H        ARG  20  -6.666  13.941 -17.446
  179    HA   ARG  20           HA       ARG  20  -5.895  13.343 -20.034
  180    HB2  ARG  20           2HB      ARG  20  -7.828  15.015 -18.773
  181    HB3  ARG  20           3HB      ARG  20  -7.047  15.950 -20.041
  182    HG2  ARG  20           2HG      ARG  20  -7.493  13.789 -21.465
  183    HG3  ARG  20           3HG      ARG  20  -8.739  13.514 -20.245
  184    HD2  ARG  20           2HD      ARG  20 -10.010  15.239 -20.963
  185    HD3  ARG  20           3HD      ARG  20  -8.613  16.239 -21.362
  186    HE   ARG  20           HE       ARG  20 -10.024  14.441 -23.116
  187   HH11  ARG  20          1HH1      ARG  20  -7.047  16.145 -22.522
  188   HH12  ARG  20          2HH1      ARG  20  -6.556  16.132 -24.183
  189   HH21  ARG  20          1HH2      ARG  20  -9.388  14.417 -25.307
  190   HH22  ARG  20          2HH2      ARG  20  -7.888  15.149 -25.767
  191    H    LEU  21           H        LEU  21  -5.023  16.156 -18.059
  192    HA   LEU  21           HA       LEU  21  -3.623  17.622 -19.949
  193    HB2  LEU  21           2HB      LEU  21  -4.193  18.372 -17.657
  194    HB3  LEU  21           3HB      LEU  21  -2.922  17.323 -17.032
  195    HG   LEU  21           HG       LEU  21  -1.325  18.698 -18.487
  196   HD11  LEU  21          1HD1      LEU  21  -2.224  20.236 -19.806
  197   HD12  LEU  21          2HD1      LEU  21  -2.714  21.125 -18.365
  198   HD13  LEU  21          3HD1      LEU  21  -3.822  19.972 -19.108
  199   HD21  LEU  21          3HD2      LEU  21  -2.683  20.115 -16.199
  200   HD22  LEU  21          1HD2      LEU  21  -1.021  20.323 -16.753
  201   HD23  LEU  21          2HD2      LEU  21  -1.518  18.804 -16.008
  202    H    LEU  22           H        LEU  22  -2.641  14.797 -18.125
  203    HA   LEU  22           HA       LEU  22   0.125  14.971 -18.875
  204    HB2  LEU  22           2HB      LEU  22  -1.577  12.922 -17.514
  205    HB3  LEU  22           3HB      LEU  22   0.046  12.506 -18.059
  206    HG   LEU  22           HG       LEU  22  -0.297  14.907 -16.330
  207   HD11  LEU  22          1HD1      LEU  22  -0.611  13.775 -14.375
  208   HD12  LEU  22          2HD1      LEU  22   0.054  12.269 -15.008
  209   HD13  LEU  22          3HD1      LEU  22  -1.576  12.771 -15.458
  210   HD21  LEU  22          3HD2      LEU  22   1.916  14.785 -16.366
  211   HD22  LEU  22          1HD2      LEU  22   1.831  13.334 -17.365
  212   HD23  LEU  22          2HD2      LEU  22   1.842  13.193 -15.607
  213    H    ALA  23           H        ALA  23  -2.487  12.691 -19.724
  214    HA   ALA  23           HA       ALA  23  -1.178  11.237 -21.662
  215    HB1  ALA  23           1HB      ALA  23  -3.350  10.579 -20.878
  216    HB2  ALA  23           2HB      ALA  23  -4.083  12.035 -21.552
  217    HB3  ALA  23           3HB      ALA  23  -3.425  10.800 -22.626
  218    H    MET  24           H        MET  24  -2.802  14.360 -21.981
  219    HA   MET  24           HA       MET  24  -2.419  14.507 -24.819
  220    HB2  MET  24           2HB      MET  24  -4.215  15.687 -23.393
  221    HB3  MET  24           3HB      MET  24  -2.958  16.862 -23.027
  222    HG2  MET  24           2HG      MET  24  -2.785  16.726 -25.731
  223    HG3  MET  24           3HG      MET  24  -4.507  16.453 -25.477
  224    HE1  MET  24           3HE      MET  24  -5.443  19.487 -23.250
  225    HE2  MET  24           1HE      MET  24  -6.224  18.741 -24.645
  226    HE3  MET  24           2HE      MET  24  -5.526  17.730 -23.380
  227    H    LEU  25           H        LEU  25  -0.818  15.884 -21.978
  228    HA   LEU  25           HA       LEU  25   0.949  17.618 -23.204
  229    HB2  LEU  25           2HB      LEU  25   0.804  17.611 -20.845
  230    HB3  LEU  25           3HB      LEU  25   1.233  15.904 -20.752
  231    HG   LEU  25           HG       LEU  25   3.340  17.474 -21.976
  232   HD11  LEU  25          1HD1      LEU  25   2.500  19.276 -20.597
  233   HD12  LEU  25          2HD1      LEU  25   4.013  18.662 -19.931
  234   HD13  LEU  25          3HD1      LEU  25   2.478  18.219 -19.185
  235   HD21  LEU  25          3HD2      LEU  25   3.765  15.274 -21.186
  236   HD22  LEU  25          1HD2      LEU  25   3.107  15.649 -19.593
  237   HD23  LEU  25          2HD2      LEU  25   4.626  16.380 -20.113
  238    H    ARG  26           H        ARG  26   1.216  14.126 -22.756
  239    HA   ARG  26           HA       ARG  26   3.836  13.709 -23.518
  240    HB2  ARG  26           2HB      ARG  26   1.623  12.109 -23.011
  241    HB3  ARG  26           3HB      ARG  26   2.047  11.725 -24.673
  242    HG2  ARG  26           2HG      ARG  26   4.065  10.815 -24.098
  243    HG3  ARG  26           3HG      ARG  26   4.208  11.788 -22.632
  244    HD2  ARG  26           2HD      ARG  26   2.308  10.447 -21.681
  245    HD3  ARG  26           3HD      ARG  26   2.443   9.389 -23.086
  246    HE   ARG  26           HE       ARG  26   4.293   8.437 -22.140
  247   HH11  ARG  26          1HH1      ARG  26   3.642  11.466 -20.552
  248   HH12  ARG  26          2HH1      ARG  26   4.840  11.229 -19.323
  249   HH21  ARG  26          1HH2      ARG  26   5.874   8.113 -20.527
  250   HH22  ARG  26          2HH2      ARG  26   6.110   9.322 -19.311
  251    H    GLN  27           H        GLN  27   1.074  14.523 -25.482
  252    HA   GLN  27           HA       GLN  27   2.783  15.120 -27.718
  253    HB2  GLN  27           2HB      GLN  27   1.467  13.687 -29.308
  254    HB3  GLN  27           3HB      GLN  27   2.510  12.800 -28.205
  255    HG2  GLN  27           2HG      GLN  27   0.466  12.488 -26.745
  256    HG3  GLN  27           3HG      GLN  27  -0.475  13.086 -28.110
  257   HE21  GLN  27          1HE2      GLN  27  -1.528  11.312 -28.751
  258   HE22  GLN  27          2HE2      GLN  27  -0.775   9.837 -29.244
  259    H    HIS  28           H        HIS  28   1.716  17.119 -26.771
  260    HA   HIS  28           HA       HIS  28  -0.972  17.711 -26.954
  261    HB2  HIS  28           2HB      HIS  28   0.641  19.225 -25.921
  262    HB3  HIS  28           3HB      HIS  28   1.373  19.545 -27.490
  263    HD1  HIS  28           HD1      HIS  28   0.194  21.211 -29.028
  264    HD2  HIS  28           HD2      HIS  28  -1.855  20.480 -25.488
  265    HE1  HIS  28           HE1      HIS  28  -1.602  22.968 -28.916
  266    H    ALA  29           H        ALA  29  -2.255  18.759 -28.531
  267    HA   ALA  29           HA       ALA  29  -1.749  17.843 -31.209
  268    HB1  ALA  29           1HB      ALA  29  -3.944  18.653 -31.727
  269    HB2  ALA  29           2HB      ALA  29  -4.005  17.842 -30.161
  270    HB3  ALA  29           3HB      ALA  29  -3.994  19.604 -30.242
  271    H    PHE  30           H        PHE  30   0.247  19.106 -31.495
  272    HA   PHE  30           HA       PHE  30   0.454  21.857 -31.483
  273    HB2  PHE  30           2HB      PHE  30   2.267  20.098 -31.939
  274    HB3  PHE  30           3HB      PHE  30   1.737  20.160 -33.617
  275    HD1  PHE  30           HD2      PHE  30   1.793  22.414 -34.796
  276    HD2  PHE  30           HD1      PHE  30   3.776  21.659 -31.106
  277    HE1  PHE  30           HE2      PHE  30   3.243  24.364 -35.181
  278    HE2  PHE  30           HE1      PHE  30   5.228  23.609 -31.484
  279    HZ   PHE  30           HZ       PHE  30   4.964  24.963 -33.524
  Start of MODEL   15
    1    H1   GLY   1           H        GLY   1 -12.563   2.211  -0.810
    2    HA2  GLY   1           2HA      GLY   1 -13.867   4.100  -2.637
    3    HA3  GLY   1           3HA      GLY   1 -13.033   4.517  -1.147
    4    H    ILE   2           H        ILE   2 -12.631   5.815  -3.622
    5    HA   ILE   2           HA       ILE   2 -10.132   4.815  -4.707
    6    HB   ILE   2           HB       ILE   2 -11.398   7.457  -5.386
    7   HG12  ILE   2          2HG1      ILE   2 -13.146   5.762  -5.589
    8   HG13  ILE   2          3HG1      ILE   2 -12.626   6.295  -7.184
    9   HG21  ILE   2          1HG2      ILE   2  -9.262   7.278  -6.334
   10   HG22  ILE   2          2HG2      ILE   2  -9.494   5.581  -6.749
   11   HG23  ILE   2          3HG2      ILE   2 -10.366   6.831  -7.635
   12   HD11  ILE   2          3HD1      ILE   2 -12.741   3.670  -6.148
   13   HD12  ILE   2          1HD1      ILE   2 -12.222   4.201  -7.748
   14   HD13  ILE   2          2HD1      ILE   2 -11.046   4.061  -6.440
   15    H    ARG   3           H        ARG   3  -8.225   6.190  -4.866
   16    HA   ARG   3           HA       ARG   3  -7.675   7.477  -2.331
   17    HB2  ARG   3           2HB      ARG   3  -6.162   5.987  -4.110
   18    HB3  ARG   3           3HB      ARG   3  -5.565   7.625  -4.339
   19    HG2  ARG   3           2HG      ARG   3  -5.370   7.706  -1.786
   20    HG3  ARG   3           3HG      ARG   3  -5.541   5.950  -1.858
   21    HD2  ARG   3           2HD      ARG   3  -3.539   5.672  -2.987
   22    HD3  ARG   3           3HD      ARG   3  -3.533   7.329  -3.589
   23    HE   ARG   3           HE       ARG   3  -2.491   7.994  -1.659
   24   HH11  ARG   3          1HH1      ARG   3  -3.779   4.788  -1.226
   25   HH12  ARG   3          2HH1      ARG   3  -2.998   4.539   0.300
   26   HH21  ARG   3          1HH2      ARG   3  -1.457   7.678   0.349
   27   HH22  ARG   3          2HH2      ARG   3  -1.678   6.184   1.196
   28    H    CYS   4           H        CYS   4  -8.522   9.477  -2.182
   29    HA   CYS   4           HA       CYS   4  -7.897  11.381  -4.344
   30    HB2  CYS   4           2HB      CYS   4 -10.318  11.060  -2.615
   31    HB3  CYS   4           3HB      CYS   4  -9.891  12.666  -3.197
   32    HA   PRO   5           HA       PRO   5  -5.635  13.889  -1.544
   33    HB2  PRO   5           2HB      PRO   5  -6.320  16.396  -2.328
   34    HB3  PRO   5           3HB      PRO   5  -5.275  15.341  -3.288
   35    HG2  PRO   5           2HG      PRO   5  -8.200  15.900  -3.597
   36    HG3  PRO   5           3HG      PRO   5  -6.945  15.783  -4.845
   37    HD2  PRO   5           2HD      PRO   5  -8.659  13.757  -4.307
   38    HD3  PRO   5           3HD      PRO   5  -6.993  13.478  -4.855
   39    H    LYS   6           H        LYS   6  -7.114  13.049   0.216
   40    HA   LYS   6           HA       LYS   6  -8.445  13.365   2.040
   41    HB2  LYS   6           2HB      LYS   6  -7.492  16.213   1.688
   42    HB3  LYS   6           3HB      LYS   6  -8.211  15.553   3.151
   43    HG2  LYS   6           2HG      LYS   6  -6.203  13.803   2.797
   44    HG3  LYS   6           3HG      LYS   6  -5.490  15.244   2.068
   45    HD2  LYS   6           2HD      LYS   6  -4.966  15.921   4.123
   46    HD3  LYS   6           3HD      LYS   6  -6.692  16.139   4.422
   47    HE2  LYS   6           2HE      LYS   6  -6.731  13.667   5.033
   48    HE3  LYS   6           3HE      LYS   6  -4.971  13.756   5.056
   49    HZ1  LYS   6           3HZ      LYS   6  -6.814  14.571   7.039
   50    HZ2  LYS   6           1HZ      LYS   6  -5.878  15.895   6.555
   51    HZ3  LYS   6           2HZ      LYS   6  -5.126  14.491   7.124
   52    H    SER   7           H        SER   7 -10.136  13.028   0.166
   53    HA   SER   7           HA       SER   7 -12.416  14.493   0.827
   54    HB2  SER   7           2HB      SER   7 -12.685  15.589  -1.522
   55    HB3  SER   7           3HB      SER   7 -11.708  16.409  -0.304
   56    HG   SER   7           HG       SER   7 -10.891  15.949  -2.627
   57    H    TRP   8           H        TRP   8 -13.907  12.981   0.575
   58    HA   TRP   8           HA       TRP   8 -13.566  10.873  -1.378
   59    HB2  TRP   8           2HB      TRP   8 -15.480  11.379   0.878
   60    HB3  TRP   8           3HB      TRP   8 -15.844  10.150  -0.330
   61    HD1  TRP   8           HD1      TRP   8 -12.248  10.694   0.851
   62    HE1  TRP   8           HE1      TRP   8 -11.483   8.607   2.149
   63    HE3  TRP   8           HE3      TRP   8 -16.704   8.199   1.075
   64    HZ2  TRP   8           HZ2      TRP   8 -12.619   6.219   3.137
   65    HZ3  TRP   8           HZ3      TRP   8 -16.780   6.019   2.214
   66    HH2  TRP   8           HH2      TRP   8 -14.778   5.051   3.222
   67    H    LYS   9           H        LYS   9 -13.746  12.732  -3.052
   68    HA   LYS   9           HA       LYS   9 -16.416  12.556  -4.180
   69    HB2  LYS   9           2HB      LYS   9 -15.110  15.173  -3.442
   70    HB3  LYS   9           3HB      LYS   9 -16.380  15.061  -4.654
   71    HG2  LYS   9           2HG      LYS   9 -17.755  13.908  -2.821
   72    HG3  LYS   9           3HG      LYS   9 -16.546  14.553  -1.708
   73    HD2  LYS   9           2HD      LYS   9 -18.221  16.181  -1.721
   74    HD3  LYS   9           3HD      LYS   9 -17.009  16.815  -2.836
   75    HE2  LYS   9           2HE      LYS   9 -18.311  16.414  -4.690
   76    HE3  LYS   9           3HE      LYS   9 -19.212  15.117  -3.908
   77    HZ1  LYS   9           3HZ      LYS   9 -19.818  17.895  -4.056
   78    HZ2  LYS   9           1HZ      LYS   9 -19.794  17.364  -2.450
   79    HZ3  LYS   9           2HZ      LYS   9 -20.804  16.607  -3.576
   80    H    CYS  10           H        CYS  10 -13.659  14.709  -4.822
   81    HA   CYS  10           HA       CYS  10 -12.342  14.990  -6.655
   82    HB2  CYS  10           2HB      CYS  10 -12.783  12.040  -6.577
   83    HB3  CYS  10           3HB      CYS  10 -12.035  12.728  -8.014
   84    H    LYS  11           H        LYS  11 -13.796  16.383  -7.699
   85    HA   LYS  11           HA       LYS  11 -16.008  15.722  -9.206
   86    HB2  LYS  11           2HB      LYS  11 -14.171  17.987  -9.036
   87    HB3  LYS  11           3HB      LYS  11 -14.870  17.796 -10.639
   88    HG2  LYS  11           2HG      LYS  11 -16.777  18.686  -9.959
   89    HG3  LYS  11           3HG      LYS  11 -16.918  17.495  -8.664
   90    HD2  LYS  11           2HD      LYS  11 -15.355  18.917  -7.313
   91    HD3  LYS  11           3HD      LYS  11 -15.480  20.144  -8.576
   92    HE2  LYS  11           2HE      LYS  11 -17.759  20.505  -8.150
   93    HE3  LYS  11           3HE      LYS  11 -17.913  19.007  -7.234
   94    HZ1  LYS  11           3HZ      LYS  11 -17.806  21.198  -5.954
   95    HZ2  LYS  11           1HZ      LYS  11 -16.150  21.183  -6.300
   96    HZ3  LYS  11           2HZ      LYS  11 -16.840  19.922  -5.408
   97    H    ALA  12           H        ALA  12 -16.300  14.536 -10.968
   98    HA   ALA  12           HA       ALA  12 -14.336  13.154 -12.322
   99    HB1  ALA  12           1HB      ALA  12 -17.051  13.190 -12.398
  100    HB2  ALA  12           2HB      ALA  12 -16.650  13.855 -13.982
  101    HB3  ALA  12           3HB      ALA  12 -16.027  12.275 -13.506
  102    H    PHE  13           H        PHE  13 -15.784  16.282 -13.145
  103    HA   PHE  13           HA       PHE  13 -14.564  16.661 -15.624
  104    HB2  PHE  13           2HB      PHE  13 -16.393  18.061 -14.469
  105    HB3  PHE  13           3HB      PHE  13 -15.063  18.914 -13.692
  106    HD1  PHE  13           HD1      PHE  13 -15.543  17.644 -17.164
  107    HD2  PHE  13           HD2      PHE  13 -14.862  20.998 -14.635
  108    HE1  PHE  13           HE1      PHE  13 -15.319  19.087 -19.145
  109    HE2  PHE  13           HE2      PHE  13 -14.639  22.447 -16.611
  110    HZ   PHE  13           HZ       PHE  13 -14.868  21.492 -18.869
  111    H    LYS  14           H        LYS  14 -13.552  18.164 -12.551
  112    HA   LYS  14           HA       LYS  14 -11.095  19.114 -13.437
  113    HB2  LYS  14           2HB      LYS  14 -12.124  19.808 -11.323
  114    HB3  LYS  14           3HB      LYS  14 -11.856  18.203 -10.656
  115    HG2  LYS  14           2HG      LYS  14  -9.495  18.504 -10.672
  116    HG3  LYS  14           3HG      LYS  14  -9.637  20.003 -11.594
  117    HD2  LYS  14           2HD      LYS  14  -9.540  21.021  -9.599
  118    HD3  LYS  14           3HD      LYS  14 -11.219  20.507  -9.417
  119    HE2  LYS  14           2HE      LYS  14  -9.985  18.281  -8.583
  120    HE3  LYS  14           3HE      LYS  14  -8.756  19.467  -8.146
  121    HZ1  LYS  14           3HZ      LYS  14 -11.324  20.373  -7.371
  122    HZ2  LYS  14           1HZ      LYS  14  -9.960  20.091  -6.411
  123    HZ3  LYS  14           2HZ      LYS  14 -11.042  18.832  -6.733
  124    H    GLN  15           H        GLN  15 -12.020  15.927 -12.343
  125    HA   GLN  15           HA       GLN  15  -9.458  14.870 -11.872
  126    HB2  GLN  15           2HB      GLN  15 -12.112  13.657 -12.569
  127    HB3  GLN  15           3HB      GLN  15 -10.672  12.651 -12.487
  128    HG2  GLN  15           2HG      GLN  15 -11.033  14.399 -10.175
  129    HG3  GLN  15           3HG      GLN  15 -12.325  13.221 -10.400
  130   HE21  GLN  15          1HE2      GLN  15  -8.924  13.674  -9.807
  131   HE22  GLN  15          2HE2      GLN  15  -8.600  12.065  -9.268
  132    H    ARG  16           H        ARG  16 -11.459  14.944 -14.799
  133    HA   ARG  16           HA       ARG  16  -9.496  13.566 -16.380
  134    HB2  ARG  16           2HB      ARG  16 -11.952  15.118 -17.220
  135    HB3  ARG  16           3HB      ARG  16 -10.989  14.091 -18.273
  136    HG2  ARG  16           2HG      ARG  16 -12.251  13.002 -15.786
  137    HG3  ARG  16           3HG      ARG  16 -13.161  13.148 -17.292
  138    HD2  ARG  16           2HD      ARG  16 -10.526  11.912 -17.601
  139    HD3  ARG  16           3HD      ARG  16 -11.629  11.002 -16.568
  140    HE   ARG  16           HE       ARG  16 -13.103  11.636 -18.785
  141   HH11  ARG  16          1HH1      ARG  16 -10.105   9.970 -18.190
  142   HH12  ARG  16          2HH1      ARG  16 -10.266   8.920 -19.559
  143   HH21  ARG  16          1HH2      ARG  16 -13.326  10.260 -20.590
  144   HH22  ARG  16          2HH2      ARG  16 -12.098   9.087 -20.924
  145    H    VAL  17           H        VAL  17 -10.681  16.917 -16.208
  146    HA   VAL  17           HA       VAL  17  -9.128  18.064 -18.178
  147    HB   VAL  17           HB       VAL  17  -9.784  19.356 -15.528
  148   HG11  VAL  17          1HG1      VAL  17  -8.326  20.804 -16.603
  149   HG12  VAL  17          2HG1      VAL  17  -8.939  20.393 -18.206
  150   HG13  VAL  17          3HG1      VAL  17  -9.906  21.392 -17.120
  151   HG21  VAL  17          3HG2      VAL  17 -11.593  20.119 -17.574
  152   HG22  VAL  17          1HG2      VAL  17 -11.531  18.357 -17.536
  153   HG23  VAL  17          2HG2      VAL  17 -11.935  19.256 -16.074
  154    H    LEU  18           H        LEU  18  -8.256  17.310 -14.841
  155    HA   LEU  18           HA       LEU  18  -5.828  18.629 -14.657
  156    HB2  LEU  18           2HB      LEU  18  -6.854  17.554 -12.756
  157    HB3  LEU  18           3HB      LEU  18  -6.651  15.970 -13.501
  158    HG   LEU  18           HG       LEU  18  -4.087  17.182 -13.295
  159   HD11  LEU  18          1HD1      LEU  18  -5.251  16.948 -10.568
  160   HD12  LEU  18          2HD1      LEU  18  -5.489  18.447 -11.465
  161   HD13  LEU  18          3HD1      LEU  18  -3.857  17.871 -11.128
  162   HD21  LEU  18          3HD2      LEU  18  -4.032  15.215 -11.487
  163   HD22  LEU  18          1HD2      LEU  18  -3.997  14.919 -13.225
  164   HD23  LEU  18          2HD2      LEU  18  -5.513  14.773 -12.337
  165    H    LYS  19           H        LYS  19  -6.536  15.436 -16.011
  166    HA   LYS  19           HA       LYS  19  -3.770  14.970 -16.705
  167    HB2  LYS  19           2HB      LYS  19  -6.315  13.442 -17.246
  168    HB3  LYS  19           3HB      LYS  19  -4.748  12.933 -17.861
  169    HG2  LYS  19           2HG      LYS  19  -3.995  12.285 -15.814
  170    HG3  LYS  19           3HG      LYS  19  -4.983  13.468 -14.953
  171    HD2  LYS  19           2HD      LYS  19  -6.993  12.095 -15.611
  172    HD3  LYS  19           3HD      LYS  19  -5.865  10.858 -16.173
  173    HE2  LYS  19           2HE      LYS  19  -6.148  10.094 -14.058
  174    HE3  LYS  19           3HE      LYS  19  -4.867  11.259 -13.728
  175    HZ1  LYS  19           3HZ      LYS  19  -6.368  12.776 -12.850
  176    HZ2  LYS  19           1HZ      LYS  19  -6.937  11.297 -12.258
  177    HZ3  LYS  19           2HZ      LYS  19  -7.710  12.038 -13.567
  178    H    ARG  20           H        ARG  20  -6.731  15.966 -18.317
  179    HA   ARG  20           HA       ARG  20  -6.001  15.704 -20.971
  180    HB2  ARG  20           2HB      ARG  20  -7.729  17.731 -19.567
  181    HB3  ARG  20           3HB      ARG  20  -7.507  17.756 -21.311
  182    HG2  ARG  20           2HG      ARG  20  -8.273  15.153 -20.181
  183    HG3  ARG  20           3HG      ARG  20  -9.484  16.430 -20.048
  184    HD2  ARG  20           2HD      ARG  20  -8.695  16.770 -22.606
  185    HD3  ARG  20           3HD      ARG  20  -8.447  15.033 -22.427
  186    HE   ARG  20           HE       ARG  20 -10.976  15.662 -21.419
  187   HH11  ARG  20          1HH1      ARG  20  -9.273  15.630 -24.456
  188   HH12  ARG  20          2HH1      ARG  20 -10.697  15.339 -25.400
  189   HH21  ARG  20          1HH2      ARG  20 -12.857  15.279 -22.651
  190   HH22  ARG  20          2HH2      ARG  20 -12.735  15.141 -24.373
  191    H    LEU  21           H        LEU  21  -5.332  18.383 -18.747
  192    HA   LEU  21           HA       LEU  21  -4.150  20.158 -20.518
  193    HB2  LEU  21           2HB      LEU  21  -4.322  19.817 -17.681
  194    HB3  LEU  21           3HB      LEU  21  -2.680  20.289 -18.115
  195    HG   LEU  21           HG       LEU  21  -4.051  22.222 -17.528
  196   HD11  LEU  21          1HD1      LEU  21  -3.735  23.497 -19.690
  197   HD12  LEU  21          2HD1      LEU  21  -3.179  21.979 -20.394
  198   HD13  LEU  21          3HD1      LEU  21  -2.305  22.694 -19.039
  199   HD21  LEU  21          3HD2      LEU  21  -5.733  21.524 -19.930
  200   HD22  LEU  21          1HD2      LEU  21  -5.951  22.887 -18.833
  201   HD23  LEU  21          2HD2      LEU  21  -6.216  21.241 -18.258
  202    H    LEU  22           H        LEU  22  -2.833  17.285 -19.008
  203    HA   LEU  22           HA       LEU  22  -0.126  17.805 -19.808
  204    HB2  LEU  22           2HB      LEU  22  -1.573  15.473 -18.618
  205    HB3  LEU  22           3HB      LEU  22   0.063  15.277 -19.243
  206    HG   LEU  22           HG       LEU  22  -0.625  17.331 -17.156
  207   HD11  LEU  22          1HD1      LEU  22  -1.164  14.864 -16.565
  208   HD12  LEU  22          2HD1      LEU  22  -0.222  15.841 -15.439
  209   HD13  LEU  22          3HD1      LEU  22   0.589  14.682 -16.492
  210   HD21  LEU  22          3HD2      LEU  22   2.007  15.971 -17.577
  211   HD22  LEU  22          1HD2      LEU  22   1.660  17.536 -16.840
  212   HD23  LEU  22          2HD2      LEU  22   1.533  17.337 -18.588
  213    H    ALA  23           H        ALA  23  -2.539  15.378 -20.820
  214    HA   ALA  23           HA       ALA  23  -1.173  14.242 -22.918
  215    HB1  ALA  23           1HB      ALA  23  -3.187  13.224 -22.319
  216    HB2  ALA  23           2HB      ALA  23  -4.102  14.722 -22.490
  217    HB3  ALA  23           3HB      ALA  23  -3.502  13.887 -23.923
  218    H    MET  24           H        MET  24  -3.052  17.234 -22.901
  219    HA   MET  24           HA       MET  24  -2.722  17.686 -25.718
  220    HB2  MET  24           2HB      MET  24  -4.683  18.547 -24.537
  221    HB3  MET  24           3HB      MET  24  -3.651  19.541 -23.518
  222    HG2  MET  24           2HG      MET  24  -3.180  21.029 -25.209
  223    HG3  MET  24           3HG      MET  24  -3.543  19.862 -26.479
  224    HE1  MET  24           3HE      MET  24  -4.524  21.351 -27.775
  225    HE2  MET  24           1HE      MET  24  -6.197  20.816 -27.934
  226    HE3  MET  24           2HE      MET  24  -5.845  22.468 -27.427
  227    H    LEU  25           H        LEU  25  -1.209  18.861 -22.753
  228    HA   LEU  25           HA       LEU  25   0.341  20.917 -23.753
  229    HB2  LEU  25           2HB      LEU  25   0.288  20.603 -21.423
  230    HB3  LEU  25           3HB      LEU  25   0.830  18.931 -21.556
  231    HG   LEU  25           HG       LEU  25   3.063  19.648 -22.111
  232   HD11  LEU  25          1HD1      LEU  25   1.849  22.396 -22.144
  233   HD12  LEU  25          2HD1      LEU  25   2.740  21.574 -23.425
  234   HD13  LEU  25          3HD1      LEU  25   3.583  22.124 -21.977
  235   HD21  LEU  25          3HD2      LEU  25   2.016  19.757 -19.675
  236   HD22  LEU  25          1HD2      LEU  25   2.441  21.460 -19.846
  237   HD23  LEU  25          2HD2      LEU  25   3.687  20.222 -19.999
  238    H    ARG  26           H        ARG  26   1.312  17.502 -23.402
  239    HA   ARG  26           HA       ARG  26   3.233  17.930 -25.593
  240    HB2  ARG  26           2HB      ARG  26   3.636  16.778 -22.901
  241    HB3  ARG  26           3HB      ARG  26   4.376  15.891 -24.227
  242    HG2  ARG  26           2HG      ARG  26   4.786  18.836 -23.792
  243    HG3  ARG  26           3HG      ARG  26   5.834  17.595 -23.103
  244    HD2  ARG  26           2HD      ARG  26   5.738  16.825 -25.705
  245    HD3  ARG  26           3HD      ARG  26   5.619  18.577 -25.863
  246    HE   ARG  26           HE       ARG  26   7.690  18.261 -24.160
  247   HH11  ARG  26          1HH1      ARG  26   6.939  16.896 -27.274
  248   HH12  ARG  26          2HH1      ARG  26   8.598  16.720 -27.742
  249   HH21  ARG  26          1HH2      ARG  26   9.878  18.034 -24.765
  250   HH22  ARG  26          2HH2      ARG  26  10.268  17.367 -26.314
  251    H    GLN  27           H        GLN  27   2.263  15.045 -23.765
  252    HA   GLN  27           HA       GLN  27   0.503  13.963 -25.638
  253    HB2  GLN  27           2HB      GLN  27   3.051  13.960 -26.673
  254    HB3  GLN  27           3HB      GLN  27   2.925  12.350 -25.978
  255    HG2  GLN  27           2HG      GLN  27   0.796  12.056 -27.251
  256    HG3  GLN  27           3HG      GLN  27   1.141  13.586 -28.057
  257   HE21  GLN  27          1HE2      GLN  27   2.448  13.590 -29.773
  258   HE22  GLN  27          2HE2      GLN  27   3.337  12.225 -30.347
  259    H    HIS  28           H        HIS  28   0.905  14.135 -22.804
  260    HA   HIS  28           HA       HIS  28   1.819  11.855 -21.549
  261    HB2  HIS  28           2HB      HIS  28   1.011  13.903 -20.393
  262    HB3  HIS  28           3HB      HIS  28  -0.643  13.433 -20.774
  263    HD1  HIS  28           HD1      HIS  28   2.331  11.780 -19.050
  264    HD2  HIS  28           HD2      HIS  28  -1.791  12.161 -18.697
  265    HE1  HIS  28           HE1      HIS  28   1.715  10.512 -16.968
  266    H    ALA  29           H        ALA  29   0.863   9.913 -20.883
  267    HA   ALA  29           HA       ALA  29  -1.227   8.954 -22.689
  268    HB1  ALA  29           1HB      ALA  29   0.921   7.703 -22.442
  269    HB2  ALA  29           2HB      ALA  29   0.451   7.336 -20.782
  270    HB3  ALA  29           3HB      ALA  29  -0.525   6.743 -22.125
  271    H    PHE  30           H        PHE  30  -2.844   7.410 -21.759
  272    HA   PHE  30           HA       PHE  30  -4.330   8.682 -19.725
  273    HB2  PHE  30           2HB      PHE  30  -5.475   7.398 -21.411
  274    HB3  PHE  30           3HB      PHE  30  -4.595   5.939 -20.966
  275    HD1  PHE  30           HD1      PHE  30  -6.796   8.499 -19.374
  276    HD2  PHE  30           HD2      PHE  30  -5.694   4.398 -19.677
  277    HE1  PHE  30           HE1      PHE  30  -8.590   7.904 -17.799
  278    HE2  PHE  30           HE2      PHE  30  -7.488   3.797 -18.104
  279    HZ   PHE  30           HZ       PHE  30  -8.939   5.550 -17.163
  Start of MODEL   16
    1    H1   GLY   1           H        GLY   1 -15.636   4.374   0.904
    2    HA2  GLY   1           2HA      GLY   1 -15.530   5.489  -1.107
    3    HA3  GLY   1           3HA      GLY   1 -14.986   6.834  -0.116
    4    H    ILE   2           H        ILE   2 -13.850   7.333  -2.190
    5    HA   ILE   2           HA       ILE   2 -11.533   5.693  -2.786
    6    HB   ILE   2           HB       ILE   2 -12.136   8.384  -3.989
    7   HG12  ILE   2          2HG1      ILE   2 -13.197   5.700  -4.897
    8   HG13  ILE   2          3HG1      ILE   2 -14.157   6.969  -4.144
    9   HG21  ILE   2          1HG2      ILE   2  -9.981   7.615  -4.572
   10   HG22  ILE   2          2HG2      ILE   2 -10.561   5.974  -4.852
   11   HG23  ILE   2          3HG2      ILE   2 -11.009   7.269  -5.962
   12   HD11  ILE   2          3HD1      ILE   2 -13.061   8.326  -6.203
   13   HD12  ILE   2          1HD1      ILE   2 -13.190   6.710  -6.898
   14   HD13  ILE   2          2HD1      ILE   2 -14.625   7.514  -6.262
   15    H    ARG   3           H        ARG   3  -9.366   6.607  -2.876
   16    HA   ARG   3           HA       ARG   3  -8.740   8.033  -0.469
   17    HB2  ARG   3           2HB      ARG   3  -7.366   6.168  -1.548
   18    HB3  ARG   3           3HB      ARG   3  -6.820   7.381  -2.698
   19    HG2  ARG   3           2HG      ARG   3  -5.548   8.479  -1.153
   20    HG3  ARG   3           3HG      ARG   3  -6.561   7.973   0.201
   21    HD2  ARG   3           2HD      ARG   3  -5.657   5.582  -0.519
   22    HD3  ARG   3           3HD      ARG   3  -4.325   6.555  -1.143
   23    HE   ARG   3           HE       ARG   3  -4.847   7.375   1.475
   24   HH11  ARG   3          1HH1      ARG   3  -3.670   4.577  -0.231
   25   HH12  ARG   3          2HH1      ARG   3  -2.676   4.034   1.080
   26   HH21  ARG   3          1HH2      ARG   3  -3.542   6.670   3.208
   27   HH22  ARG   3          2HH2      ARG   3  -2.605   5.225   3.036
   28    H    CYS   4           H        CYS   4  -9.367  10.132  -0.500
   29    HA   CYS   4           HA       CYS   4  -8.285  11.816  -2.665
   30    HB2  CYS   4           2HB      CYS   4 -10.965  11.667  -1.491
   31    HB3  CYS   4           3HB      CYS   4 -10.317  13.303  -1.542
   32    HA   PRO   5           HA       PRO   5  -6.106  14.221   0.286
   33    HB2  PRO   5           2HB      PRO   5  -6.414  16.743  -0.669
   34    HB3  PRO   5           3HB      PRO   5  -5.389  15.537  -1.455
   35    HG2  PRO   5           2HG      PRO   5  -8.178  16.386  -2.135
   36    HG3  PRO   5           3HG      PRO   5  -6.808  16.074  -3.217
   37    HD2  PRO   5           2HD      PRO   5  -8.787  14.270  -2.814
   38    HD3  PRO   5           3HD      PRO   5  -7.110  13.790  -3.146
   39    H    LYS   6           H        LYS   6  -7.803  13.656   1.923
   40    HA   LYS   6           HA       LYS   6  -9.271  14.204   3.578
   41    HB2  LYS   6           2HB      LYS   6  -7.834  16.806   3.101
   42    HB3  LYS   6           3HB      LYS   6  -9.051  16.644   4.361
   43    HG2  LYS   6           2HG      LYS   6  -7.763  15.000   5.503
   44    HG3  LYS   6           3HG      LYS   6  -6.624  14.878   4.160
   45    HD2  LYS   6           2HD      LYS   6  -5.766  17.052   4.578
   46    HD3  LYS   6           3HD      LYS   6  -7.078  17.427   5.699
   47    HE2  LYS   6           2HE      LYS   6  -5.269  15.117   6.259
   48    HE3  LYS   6           3HE      LYS   6  -4.717  16.756   6.600
   49    HZ1  LYS   6           3HZ      LYS   6  -5.700  16.260   8.569
   50    HZ2  LYS   6           1HZ      LYS   6  -6.830  15.200   7.888
   51    HZ3  LYS   6           2HZ      LYS   6  -7.058  16.872   7.766
   52    H    SER   7           H        SER   7 -10.834  13.819   1.646
   53    HA   SER   7           HA       SER   7 -13.017  15.531   1.936
   54    HB2  SER   7           2HB      SER   7 -12.997  16.363  -0.534
   55    HB3  SER   7           3HB      SER   7 -12.048  17.237   0.668
   56    HG   SER   7           HG       SER   7 -10.237  16.518  -0.209
   57    H    TRP   8           H        TRP   8 -14.625  14.141   1.704
   58    HA   TRP   8           HA       TRP   8 -14.321  11.782   0.061
   59    HB2  TRP   8           2HB      TRP   8 -16.382  12.749   2.016
   60    HB3  TRP   8           3HB      TRP   8 -16.752  11.411   0.932
   61    HD1  TRP   8           HD1      TRP   8 -13.243  11.755   2.398
   62    HE1  TRP   8           HE1      TRP   8 -12.833   9.803   4.026
   63    HE3  TRP   8           HE3      TRP   8 -17.956   9.777   2.498
   64    HZ2  TRP   8           HZ2      TRP   8 -14.311   7.703   5.197
   65    HZ3  TRP   8           HZ3      TRP   8 -18.374   7.796   3.897
   66    HH2  TRP   8           HH2      TRP   8 -16.588   6.782   5.217
   67    H    LYS   9           H        LYS   9 -14.142  13.395  -1.841
   68    HA   LYS   9           HA       LYS   9 -16.818  13.622  -3.043
   69    HB2  LYS   9           2HB      LYS   9 -14.585  15.650  -3.109
   70    HB3  LYS   9           3HB      LYS   9 -15.931  15.678  -4.240
   71    HG2  LYS   9           2HG      LYS   9 -17.342  15.609  -2.007
   72    HG3  LYS   9           3HG      LYS   9 -15.867  16.315  -1.343
   73    HD2  LYS   9           2HD      LYS   9 -16.105  17.862  -3.492
   74    HD3  LYS   9           3HD      LYS   9 -17.806  17.433  -3.297
   75    HE2  LYS   9           2HE      LYS   9 -17.239  18.055  -0.764
   76    HE3  LYS   9           3HE      LYS   9 -16.039  19.067  -1.566
   77    HZ1  LYS   9           3HZ      LYS   9 -17.840  20.458  -1.483
   78    HZ2  LYS   9           1HZ      LYS   9 -18.970  19.215  -1.685
   79    HZ3  LYS   9           2HZ      LYS   9 -18.068  19.761  -3.007
   80    H    CYS  10           H        CYS  10 -13.526  14.300  -4.206
   81    HA   CYS  10           HA       CYS  10 -12.363  13.537  -6.005
   82    HB2  CYS  10           2HB      CYS  10 -13.922  10.971  -5.678
   83    HB3  CYS  10           3HB      CYS  10 -12.321  11.174  -6.384
   84    H    LYS  11           H        LYS  11 -13.996  15.159  -7.010
   85    HA   LYS  11           HA       LYS  11 -16.178  14.411  -8.521
   86    HB2  LYS  11           2HB      LYS  11 -14.115  16.474  -9.312
   87    HB3  LYS  11           3HB      LYS  11 -15.785  16.402  -9.859
   88    HG2  LYS  11           2HG      LYS  11 -15.728  16.448  -7.003
   89    HG3  LYS  11           3HG      LYS  11 -14.744  17.769  -7.636
   90    HD2  LYS  11           2HD      LYS  11 -17.558  17.182  -8.546
   91    HD3  LYS  11           3HD      LYS  11 -17.157  18.338  -7.275
   92    HE2  LYS  11           2HE      LYS  11 -15.871  19.663  -8.824
   93    HE3  LYS  11           3HE      LYS  11 -16.092  18.461 -10.094
   94    HZ1  LYS  11           3HZ      LYS  11 -18.256  19.072 -10.424
   95    HZ2  LYS  11           1HZ      LYS  11 -17.596  20.568  -9.987
   96    HZ3  LYS  11           2HZ      LYS  11 -18.464  19.663  -8.853
   97    H    ALA  12           H        ALA  12 -16.438  13.063 -10.165
   98    HA   ALA  12           HA       ALA  12 -14.457  11.550 -11.345
   99    HB1  ALA  12           1HB      ALA  12 -16.100  11.005 -13.085
  100    HB2  ALA  12           2HB      ALA  12 -16.809  10.958 -11.471
  101    HB3  ALA  12           3HB      ALA  12 -17.118  12.334 -12.530
  102    H    PHE  13           H        PHE  13 -15.792  14.644 -12.406
  103    HA   PHE  13           HA       PHE  13 -14.536  14.779 -14.907
  104    HB2  PHE  13           2HB      PHE  13 -16.374  16.291 -13.945
  105    HB3  PHE  13           3HB      PHE  13 -15.068  17.185 -13.173
  106    HD1  PHE  13           HD2      PHE  13 -15.375  15.665 -16.562
  107    HD2  PHE  13           HD1      PHE  13 -14.836  19.200 -14.253
  108    HE1  PHE  13           HE2      PHE  13 -15.045  16.960 -18.628
  109    HE2  PHE  13           HE1      PHE  13 -14.507  20.501 -16.316
  110    HZ   PHE  13           HZ       PHE  13 -14.610  19.381 -18.507
  111    H    LYS  14           H        LYS  14 -13.583  16.591 -11.986
  112    HA   LYS  14           HA       LYS  14 -11.086  17.394 -12.892
  113    HB2  LYS  14           2HB      LYS  14 -12.364  18.139 -10.800
  114    HB3  LYS  14           3HB      LYS  14 -11.655  16.739 -10.007
  115    HG2  LYS  14           2HG      LYS  14  -9.892  17.985  -9.528
  116    HG3  LYS  14           3HG      LYS  14  -9.523  18.046 -11.253
  117    HD2  LYS  14           2HD      LYS  14 -11.373  19.961 -11.171
  118    HD3  LYS  14           3HD      LYS  14 -10.805  20.072  -9.503
  119    HE2  LYS  14           2HE      LYS  14  -9.394  21.549 -10.566
  120    HE3  LYS  14           3HE      LYS  14  -8.442  20.066 -10.610
  121    HZ1  LYS  14           3HZ      LYS  14 -10.026  21.257 -12.815
  122    HZ2  LYS  14           1HZ      LYS  14  -9.384  19.693 -12.877
  123    HZ3  LYS  14           2HZ      LYS  14  -8.352  21.027 -12.754
  124    H    GLN  15           H        GLN  15 -12.122  14.323 -11.665
  125    HA   GLN  15           HA       GLN  15  -9.590  13.289 -10.938
  126    HB2  GLN  15           2HB      GLN  15 -12.239  12.057 -11.619
  127    HB3  GLN  15           3HB      GLN  15 -10.823  11.041 -11.390
  128    HG2  GLN  15           2HG      GLN  15 -11.587  13.050  -9.317
  129    HG3  GLN  15           3HG      GLN  15 -12.408  11.492  -9.402
  130   HE21  GLN  15          1HE2      GLN  15 -11.484   9.791  -8.468
  131   HE22  GLN  15          2HE2      GLN  15  -9.879   9.750  -7.831
  132    H    ARG  16           H        ARG  16 -11.560  12.761 -13.865
  133    HA   ARG  16           HA       ARG  16  -9.493  11.367 -15.236
  134    HB2  ARG  16           2HB      ARG  16 -10.954  11.564 -17.203
  135    HB3  ARG  16           3HB      ARG  16 -11.840  11.009 -15.789
  136    HG2  ARG  16           2HG      ARG  16 -12.683  13.295 -15.447
  137    HG3  ARG  16           3HG      ARG  16 -11.840  13.802 -16.913
  138    HD2  ARG  16           2HD      ARG  16 -13.377  11.498 -17.535
  139    HD3  ARG  16           3HD      ARG  16 -14.414  12.620 -16.654
  140    HE   ARG  16           HE       ARG  16 -12.925  13.916 -18.717
  141   HH11  ARG  16          1HH1      ARG  16 -15.743  11.973 -18.080
  142   HH12  ARG  16          2HH1      ARG  16 -16.608  12.539 -19.470
  143   HH21  ARG  16          1HH2      ARG  16 -14.054  14.669 -20.550
  144   HH22  ARG  16          2HH2      ARG  16 -15.646  14.072 -20.875
  145    H    VAL  17           H        VAL  17 -10.634  14.708 -15.242
  146    HA   VAL  17           HA       VAL  17  -9.118  15.647 -17.407
  147    HB   VAL  17           HB       VAL  17 -10.022  17.149 -14.946
  148   HG11  VAL  17          1HG1      VAL  17  -9.891  19.104 -16.619
  149   HG12  VAL  17          2HG1      VAL  17  -8.394  18.521 -15.888
  150   HG13  VAL  17          3HG1      VAL  17  -8.815  18.051 -17.536
  151   HG21  VAL  17          3HG2      VAL  17 -12.070  17.177 -15.816
  152   HG22  VAL  17          1HG2      VAL  17 -11.456  17.704 -17.384
  153   HG23  VAL  17          2HG2      VAL  17 -11.522  15.985 -16.994
  154    H    LEU  18           H        LEU  18  -8.333  15.278 -13.991
  155    HA   LEU  18           HA       LEU  18  -5.934  16.698 -13.925
  156    HB2  LEU  18           2HB      LEU  18  -7.070  15.878 -11.929
  157    HB3  LEU  18           3HB      LEU  18  -6.706  14.217 -12.394
  158    HG   LEU  18           HG       LEU  18  -4.303  15.826 -12.190
  159   HD11  LEU  18          1HD1      LEU  18  -4.353  16.038  -9.731
  160   HD12  LEU  18          2HD1      LEU  18  -6.060  15.599  -9.751
  161   HD13  LEU  18          3HD1      LEU  18  -5.523  17.085 -10.534
  162   HD21  LEU  18          3HD2      LEU  18  -3.955  13.551 -12.180
  163   HD22  LEU  18          1HD2      LEU  18  -5.363  13.230 -11.167
  164   HD23  LEU  18          2HD2      LEU  18  -3.902  13.915 -10.454
  165    H    LYS  19           H        LYS  19  -6.615  13.388 -14.922
  166    HA   LYS  19           HA       LYS  19  -3.815  12.798 -15.368
  167    HB2  LYS  19           2HB      LYS  19  -6.334  11.297 -15.316
  168    HB3  LYS  19           3HB      LYS  19  -5.226  10.771 -16.576
  169    HG2  LYS  19           2HG      LYS  19  -3.572  10.175 -15.037
  170    HG3  LYS  19           3HG      LYS  19  -4.325  11.102 -13.736
  171    HD2  LYS  19           2HD      LYS  19  -6.320   9.477 -14.081
  172    HD3  LYS  19           3HD      LYS  19  -5.128   8.458 -14.891
  173    HE2  LYS  19           2HE      LYS  19  -4.533   9.591 -12.190
  174    HE3  LYS  19           3HE      LYS  19  -5.575   8.176 -12.335
  175    HZ1  LYS  19           3HZ      LYS  19  -2.752   8.439 -13.199
  176    HZ2  LYS  19           1HZ      LYS  19  -3.741   7.148 -13.669
  177    HZ3  LYS  19           2HZ      LYS  19  -3.387   7.390 -12.033
  178    H    ARG  20           H        ARG  20  -6.696  13.491 -17.289
  179    HA   ARG  20           HA       ARG  20  -5.743  12.943 -19.828
  180    HB2  ARG  20           2HB      ARG  20  -8.080  13.590 -19.274
  181    HB3  ARG  20           3HB      ARG  20  -7.538  15.249 -19.054
  182    HG2  ARG  20           2HG      ARG  20  -7.210  15.586 -21.303
  183    HG3  ARG  20           3HG      ARG  20  -6.994  13.867 -21.637
  184    HD2  ARG  20           2HD      ARG  20  -9.323  13.447 -21.416
  185    HD3  ARG  20           3HD      ARG  20  -9.614  15.056 -20.757
  186    HE   ARG  20           HE       ARG  20  -9.681  15.878 -22.891
  187   HH11  ARG  20          1HH1      ARG  20  -8.237  12.710 -22.934
  188   HH12  ARG  20          2HH1      ARG  20  -8.210  12.603 -24.663
  189   HH21  ARG  20          1HH2      ARG  20  -9.650  15.749 -25.168
  190   HH22  ARG  20          2HH2      ARG  20  -9.013  14.333 -25.933
  191    H    LEU  21           H        LEU  21  -5.377  15.902 -17.911
  192    HA   LEU  21           HA       LEU  21  -4.146  17.511 -19.808
  193    HB2  LEU  21           2HB      LEU  21  -4.932  18.078 -17.441
  194    HB3  LEU  21           3HB      LEU  21  -3.355  17.497 -16.911
  195    HG   LEU  21           HG       LEU  21  -2.737  19.322 -18.892
  196   HD11  LEU  21          1HD1      LEU  21  -3.989  21.305 -18.464
  197   HD12  LEU  21          2HD1      LEU  21  -4.901  20.520 -17.174
  198   HD13  LEU  21          3HD1      LEU  21  -5.135  20.021 -18.849
  199   HD21  LEU  21          3HD2      LEU  21  -2.905  19.711 -15.905
  200   HD22  LEU  21          1HD2      LEU  21  -1.979  20.718 -17.019
  201   HD23  LEU  21          2HD2      LEU  21  -1.548  19.022 -16.798
  202    H    LEU  22           H        LEU  22  -2.830  14.926 -17.849
  203    HA   LEU  22           HA       LEU  22  -0.091  15.505 -18.483
  204    HB2  LEU  22           2HB      LEU  22  -1.523  13.254 -17.131
  205    HB3  LEU  22           3HB      LEU  22   0.169  13.079 -17.592
  206    HG   LEU  22           HG       LEU  22  -0.892  15.228 -15.760
  207   HD11  LEU  22          1HD1      LEU  22   0.455  13.818 -14.068
  208   HD12  LEU  22          2HD1      LEU  22   0.235  12.508 -15.227
  209   HD13  LEU  22          3HD1      LEU  22  -1.171  13.296 -14.511
  210   HD21  LEU  22          3HD2      LEU  22   1.139  16.131 -15.821
  211   HD22  LEU  22          1HD2      LEU  22   1.480  15.089 -17.203
  212   HD23  LEU  22          2HD2      LEU  22   1.915  14.566 -15.575
  213    H    ALA  23           H        ALA  23  -2.284  12.835 -19.374
  214    HA   ALA  23           HA       ALA  23  -0.676  11.548 -21.204
  215    HB1  ALA  23           1HB      ALA  23  -3.193  11.322 -22.314
  216    HB2  ALA  23           2HB      ALA  23  -2.500  10.273 -21.076
  217    HB3  ALA  23           3HB      ALA  23  -3.516  11.637 -20.609
  218    H    MET  24           H        MET  24  -2.736  14.376 -21.695
  219    HA   MET  24           HA       MET  24  -2.240  14.509 -24.516
  220    HB2  MET  24           2HB      MET  24  -4.268  15.431 -23.232
  221    HB3  MET  24           3HB      MET  24  -3.228  16.786 -22.813
  222    HG2  MET  24           2HG      MET  24  -4.477  17.453 -24.693
  223    HG3  MET  24           3HG      MET  24  -2.846  17.118 -25.270
  224    HE1  MET  24           3HE      MET  24  -6.734  15.666 -26.583
  225    HE2  MET  24           1HE      MET  24  -6.436  14.664 -25.162
  226    HE3  MET  24           2HE      MET  24  -6.352  16.421 -25.034
  227    H    LEU  25           H        LEU  25  -1.009  16.184 -21.651
  228    HA   LEU  25           HA       LEU  25   0.530  18.140 -22.850
  229    HB2  LEU  25           2HB      LEU  25   0.282  18.175 -20.504
  230    HB3  LEU  25           3HB      LEU  25   0.941  16.550 -20.335
  231    HG   LEU  25           HG       LEU  25   2.837  18.433 -21.503
  232   HD11  LEU  25          1HD1      LEU  25   1.749  18.951 -18.742
  233   HD12  LEU  25          2HD1      LEU  25   1.752  20.058 -20.114
  234   HD13  LEU  25          3HD1      LEU  25   3.274  19.594 -19.352
  235   HD21  LEU  25          3HD2      LEU  25   3.592  16.308 -20.778
  236   HD22  LEU  25          1HD2      LEU  25   2.822  16.493 -19.202
  237   HD23  LEU  25          2HD2      LEU  25   4.221  17.482 -19.621
  238    H    ARG  26           H        ARG  26   1.318  14.745 -22.265
  239    HA   ARG  26           HA       ARG  26   4.001  14.726 -22.911
  240    HB2  ARG  26           2HB      ARG  26   1.912  12.796 -22.631
  241    HB3  ARG  26           3HB      ARG  26   2.838  12.409 -24.075
  242    HG2  ARG  26           2HG      ARG  26   4.705  11.881 -22.906
  243    HG3  ARG  26           3HG      ARG  26   4.372  13.052 -21.629
  244    HD2  ARG  26           2HD      ARG  26   2.315  11.341 -21.273
  245    HD3  ARG  26           3HD      ARG  26   3.542  10.236 -21.891
  246    HE   ARG  26           HE       ARG  26   4.596  11.886 -19.836
  247   HH11  ARG  26          1HH1      ARG  26   2.564   9.114 -20.389
  248   HH12  ARG  26          2HH1      ARG  26   2.883   8.407 -18.840
  249   HH21  ARG  26          1HH2      ARG  26   5.024  10.966 -17.793
  250   HH22  ARG  26          2HH2      ARG  26   4.281   9.462 -17.363
  251    H    GLN  27           H        GLN  27   1.233  15.026 -25.010
  252    HA   GLN  27           HA       GLN  27   2.909  15.841 -27.195
  253    HB2  GLN  27           2HB      GLN  27   2.727  13.231 -27.191
  254    HB3  GLN  27           3HB      GLN  27   1.114  13.527 -27.826
  255    HG2  GLN  27           2HG      GLN  27   1.917  13.859 -29.856
  256    HG3  GLN  27           3HG      GLN  27   3.012  15.108 -29.264
  257   HE21  GLN  27          1HE2      GLN  27   4.734  14.549 -30.523
  258   HE22  GLN  27          2HE2      GLN  27   5.610  13.072 -30.337
  259    H    HIS  28           H        HIS  28   1.491  17.664 -26.452
  260    HA   HIS  28           HA       HIS  28  -1.254  17.764 -26.711
  261    HB2  HIS  28           2HB      HIS  28   0.360  19.574 -25.874
  262    HB3  HIS  28           3HB      HIS  28   0.522  20.044 -27.564
  263    HD1  HIS  28           HD1      HIS  28  -2.676  19.066 -25.778
  264    HD2  HIS  28           HD2      HIS  28  -0.910  22.362 -27.589
  265    HE1  HIS  28           HE1      HIS  28  -4.455  20.844 -25.820
  266    H    ALA  29           H        ALA  29  -2.528  18.901 -28.419
  267    HA   ALA  29           HA       ALA  29  -2.132  17.600 -30.929
  268    HB1  ALA  29           1HB      ALA  29  -4.069  19.624 -31.228
  269    HB2  ALA  29           2HB      ALA  29  -4.329  17.896 -30.989
  270    HB3  ALA  29           3HB      ALA  29  -4.252  18.977 -29.598
  271    H    PHE  30           H        PHE  30  -0.253  18.310 -31.886
  272    HA   PHE  30           HA       PHE  30   0.695  20.902 -32.065
  273    HB2  PHE  30           2HB      PHE  30   1.800  18.689 -32.799
  274    HB3  PHE  30           3HB      PHE  30   0.983  18.948 -34.336
  275    HD1  PHE  30           HD1      PHE  30   3.537  20.245 -32.036
  276    HD2  PHE  30           HD2      PHE  30   1.729  20.612 -35.872
  277    HE1  PHE  30           HE1      PHE  30   5.376  21.710 -32.759
  278    HE2  PHE  30           HE2      PHE  30   3.565  22.077 -36.601
  279    HZ   PHE  30           HZ       PHE  30   5.393  22.627 -35.045
  Start of MODEL   17
    1    H1   GLY   1           H        GLY   1  -4.781   4.164   1.727
    2    HA2  GLY   1           2HA      GLY   1  -2.826   5.848   0.320
    3    HA3  GLY   1           3HA      GLY   1  -3.289   4.309  -0.390
    4    H    ILE   2           H        ILE   2  -4.439   7.499   0.539
    5    HA   ILE   2           HA       ILE   2  -6.981   7.104  -0.803
    6    HB   ILE   2           HB       ILE   2  -5.953   9.724   0.256
    7   HG12  ILE   2          2HG1      ILE   2  -7.524   8.793   2.267
    8   HG13  ILE   2          3HG1      ILE   2  -6.766   7.297   1.733
    9   HG21  ILE   2          1HG2      ILE   2  -8.545   9.770   0.774
   10   HG22  ILE   2          2HG2      ILE   2  -7.911  10.201  -0.814
   11   HG23  ILE   2          3HG2      ILE   2  -8.582   8.593  -0.540
   12   HD11  ILE   2          3HD1      ILE   2  -4.857   7.823   2.723
   13   HD12  ILE   2          1HD1      ILE   2  -4.836   9.428   1.993
   14   HD13  ILE   2          2HD1      ILE   2  -5.721   9.153   3.494
   15    H    ARG   3           H        ARG   3  -7.726   8.581  -2.481
   16    HA   ARG   3           HA       ARG   3  -5.579   9.148  -4.389
   17    HB2  ARG   3           2HB      ARG   3  -8.573   9.004  -4.793
   18    HB3  ARG   3           3HB      ARG   3  -7.387   9.274  -6.063
   19    HG2  ARG   3           2HG      ARG   3  -6.443   7.077  -5.695
   20    HG3  ARG   3           3HG      ARG   3  -7.549   6.805  -4.347
   21    HD2  ARG   3           2HD      ARG   3  -9.356   7.370  -6.198
   22    HD3  ARG   3           3HD      ARG   3  -8.074   6.812  -7.272
   23    HE   ARG   3           HE       ARG   3  -8.288   4.894  -5.313
   24   HH11  ARG   3          1HH1      ARG   3 -10.391   6.306  -7.702
   25   HH12  ARG   3          2HH1      ARG   3 -11.347   4.874  -7.895
   26   HH21  ARG   3          1HH2      ARG   3  -9.540   3.003  -5.559
   27   HH22  ARG   3          2HH2      ARG   3 -10.863   2.996  -6.676
   28    H    CYS   4           H        CYS   4  -8.352  10.681  -2.817
   29    HA   CYS   4           HA       CYS   4  -7.535  13.276  -3.911
   30    HB2  CYS   4           2HB      CYS   4 -10.078  12.165  -2.834
   31    HB3  CYS   4           3HB      CYS   4  -9.783  13.886  -2.606
   32    HA   PRO   5           HA       PRO   5  -5.887  14.793  -0.140
   33    HB2  PRO   5           2HB      PRO   5  -6.791  17.352  -0.090
   34    HB3  PRO   5           3HB      PRO   5  -5.538  16.797  -1.207
   35    HG2  PRO   5           2HG      PRO   5  -8.465  17.198  -1.691
   36    HG3  PRO   5           3HG      PRO   5  -7.090  17.635  -2.722
   37    HD2  PRO   5           2HD      PRO   5  -8.590  15.423  -3.155
   38    HD3  PRO   5           3HD      PRO   5  -6.857  15.492  -3.537
   39    H    LYS   6           H        LYS   6  -7.364  13.284   1.052
   40    HA   LYS   6           HA       LYS   6  -8.874  12.818   2.695
   41    HB2  LYS   6           2HB      LYS   6  -8.082  15.652   3.326
   42    HB3  LYS   6           3HB      LYS   6  -9.200  14.761   4.351
   43    HG2  LYS   6           2HG      LYS   6  -6.889  13.156   3.836
   44    HG3  LYS   6           3HG      LYS   6  -6.395  14.744   4.428
   45    HD2  LYS   6           2HD      LYS   6  -8.634  13.366   5.818
   46    HD3  LYS   6           3HD      LYS   6  -6.997  12.758   6.078
   47    HE2  LYS   6           2HE      LYS   6  -6.536  15.368   6.409
   48    HE3  LYS   6           3HE      LYS   6  -8.231  15.327   6.891
   49    HZ1  LYS   6           3HZ      LYS   6  -5.902  14.108   8.176
   50    HZ2  LYS   6           1HZ      LYS   6  -7.381  13.295   8.294
   51    HZ3  LYS   6           2HZ      LYS   6  -7.239  14.878   8.871
   52    H    SER   7           H        SER   7 -10.406  12.785   0.754
   53    HA   SER   7           HA       SER   7 -12.885  13.811   1.516
   54    HB2  SER   7           2HB      SER   7 -13.134  15.391  -0.541
   55    HB3  SER   7           3HB      SER   7 -12.343  16.001   0.912
   56    HG   SER   7           HG       SER   7 -11.274  16.335  -1.226
   57    H    TRP   8           H        TRP   8 -14.175  12.269   0.788
   58    HA   TRP   8           HA       TRP   8 -13.448  10.690  -1.519
   59    HB2  TRP   8           2HB      TRP   8 -15.606  10.531   0.560
   60    HB3  TRP   8           3HB      TRP   8 -15.725   9.571  -0.912
   61    HD1  TRP   8           HD1      TRP   8 -12.359  10.153   0.829
   62    HE1  TRP   8           HE1      TRP   8 -11.495   7.896   1.713
   63    HE3  TRP   8           HE3      TRP   8 -16.467   7.272  -0.150
   64    HZ2  TRP   8           HZ2      TRP   8 -12.431   5.244   1.962
   65    HZ3  TRP   8           HZ3      TRP   8 -16.401   4.884   0.442
   66    HH2  TRP   8           HH2      TRP   8 -14.424   3.893   1.475
   67    H    LYS   9           H        LYS   9 -13.657  12.824  -2.798
   68    HA   LYS   9           HA       LYS   9 -16.378  12.927  -3.919
   69    HB2  LYS   9           2HB      LYS   9 -14.513  15.182  -3.239
   70    HB3  LYS   9           3HB      LYS   9 -15.736  15.374  -4.489
   71    HG2  LYS   9           2HG      LYS   9 -17.441  14.681  -2.774
   72    HG3  LYS   9           3HG      LYS   9 -16.160  14.812  -1.567
   73    HD2  LYS   9           2HD      LYS   9 -15.879  17.141  -2.013
   74    HD3  LYS   9           3HD      LYS   9 -16.938  17.057  -3.423
   75    HE2  LYS   9           2HE      LYS   9 -18.133  18.047  -1.575
   76    HE3  LYS   9           3HE      LYS   9 -18.816  16.462  -1.933
   77    HZ1  LYS   9           3HZ      LYS   9 -18.395  17.054   0.493
   78    HZ2  LYS   9           1HZ      LYS   9 -16.756  16.807   0.156
   79    HZ3  LYS   9           2HZ      LYS   9 -17.860  15.540  -0.040
   80    H    CYS  10           H        CYS  10 -13.283  14.430  -4.818
   81    HA   CYS  10           HA       CYS  10 -12.165  14.498  -6.802
   82    HB2  CYS  10           2HB      CYS  10 -13.036  11.622  -7.099
   83    HB3  CYS  10           3HB      CYS  10 -11.590  12.380  -7.758
   84    H    LYS  11           H        LYS  11 -13.781  15.950  -7.677
   85    HA   LYS  11           HA       LYS  11 -16.062  15.261  -9.064
   86    HB2  LYS  11           2HB      LYS  11 -14.277  17.554  -8.949
   87    HB3  LYS  11           3HB      LYS  11 -14.977  17.350 -10.549
   88    HG2  LYS  11           2HG      LYS  11 -17.102  16.994  -8.786
   89    HG3  LYS  11           3HG      LYS  11 -16.178  18.347  -8.130
   90    HD2  LYS  11           2HD      LYS  11 -16.847  18.231 -11.048
   91    HD3  LYS  11           3HD      LYS  11 -18.036  18.811  -9.878
   92    HE2  LYS  11           2HE      LYS  11 -15.304  19.939  -9.695
   93    HE3  LYS  11           3HE      LYS  11 -16.274  20.419 -11.087
   94    HZ1  LYS  11           3HZ      LYS  11 -17.822  20.552  -8.724
   95    HZ2  LYS  11           1HZ      LYS  11 -17.437  21.787  -9.814
   96    HZ3  LYS  11           2HZ      LYS  11 -16.400  21.445  -8.523
   97    H    ALA  12           H        ALA  12 -16.404  14.006 -10.765
   98    HA   ALA  12           HA       ALA  12 -14.477  12.700 -12.242
   99    HB1  ALA  12           1HB      ALA  12 -16.950  13.280 -13.720
  100    HB2  ALA  12           2HB      ALA  12 -16.200  11.734 -13.316
  101    HB3  ALA  12           3HB      ALA  12 -17.178  12.580 -12.116
  102    H    PHE  13           H        PHE  13 -16.148  15.731 -13.010
  103    HA   PHE  13           HA       PHE  13 -15.141  16.141 -15.569
  104    HB2  PHE  13           2HB      PHE  13 -16.918  17.484 -14.278
  105    HB3  PHE  13           3HB      PHE  13 -15.563  18.390 -13.613
  106    HD1  PHE  13           HD1      PHE  13 -16.901  17.262 -16.905
  107    HD2  PHE  13           HD2      PHE  13 -14.883  20.294 -14.702
  108    HE1  PHE  13           HE1      PHE  13 -16.891  18.701 -18.901
  109    HE2  PHE  13           HE2      PHE  13 -14.870  21.738 -16.694
  110    HZ   PHE  13           HZ       PHE  13 -15.876  20.942 -18.797
  111    H    LYS  14           H        LYS  14 -13.923  17.684 -12.591
  112    HA   LYS  14           HA       LYS  14 -11.594  18.735 -13.683
  113    HB2  LYS  14           2HB      LYS  14 -12.612  19.206 -11.401
  114    HB3  LYS  14           3HB      LYS  14 -11.830  17.731 -10.848
  115    HG2  LYS  14           2HG      LYS  14  -9.735  18.638 -10.947
  116    HG3  LYS  14           3HG      LYS  14 -10.172  19.785 -12.216
  117    HD2  LYS  14           2HD      LYS  14 -11.259  19.982  -9.418
  118    HD3  LYS  14           3HD      LYS  14  -9.741  20.744  -9.899
  119    HE2  LYS  14           2HE      LYS  14 -10.781  22.359 -11.075
  120    HE3  LYS  14           3HE      LYS  14 -12.014  21.258 -11.690
  121    HZ1  LYS  14           3HZ      LYS  14 -12.055  22.953  -9.342
  122    HZ2  LYS  14           1HZ      LYS  14 -12.685  21.400  -9.112
  123    HZ3  LYS  14           2HZ      LYS  14 -13.332  22.406 -10.307
  124    H    GLN  15           H        GLN  15 -12.247  15.528 -12.404
  125    HA   GLN  15           HA       GLN  15  -9.633  14.570 -12.214
  126    HB2  GLN  15           2HB      GLN  15 -12.282  13.245 -12.693
  127    HB3  GLN  15           3HB      GLN  15 -10.798  12.302 -12.727
  128    HG2  GLN  15           2HG      GLN  15 -11.432  14.068 -10.399
  129    HG3  GLN  15           3HG      GLN  15 -12.136  12.457 -10.535
  130   HE21  GLN  15          1HE2      GLN  15 -10.949  10.735  -9.980
  131   HE22  GLN  15          2HE2      GLN  15  -9.291  10.793  -9.498
  132    H    ARG  16           H        ARG  16 -11.875  14.566 -14.961
  133    HA   ARG  16           HA       ARG  16 -10.055  13.230 -16.715
  134    HB2  ARG  16           2HB      ARG  16 -12.767  14.301 -16.846
  135    HB3  ARG  16           3HB      ARG  16 -11.864  14.563 -18.331
  136    HG2  ARG  16           2HG      ARG  16 -12.460  12.505 -18.907
  137    HG3  ARG  16           3HG      ARG  16 -11.312  11.936 -17.694
  138    HD2  ARG  16           2HD      ARG  16 -12.970  11.589 -16.104
  139    HD3  ARG  16           3HD      ARG  16 -14.103  12.674 -16.909
  140    HE   ARG  16           HE       ARG  16 -13.474  10.410 -18.521
  141   HH11  ARG  16          1HH1      ARG  16 -15.404  11.476 -15.827
  142   HH12  ARG  16          2HH1      ARG  16 -16.631  10.275 -16.063
  143   HH21  ARG  16          1HH2      ARG  16 -15.082   8.825 -18.842
  144   HH22  ARG  16          2HH2      ARG  16 -16.446   8.767 -17.778
  145    H    VAL  17           H        VAL  17 -11.063  16.602 -16.272
  146    HA   VAL  17           HA       VAL  17  -9.721  17.797 -18.365
  147    HB   VAL  17           HB       VAL  17 -10.063  18.900 -15.572
  148   HG11  VAL  17          1HG1      VAL  17  -9.135  20.100 -18.137
  149   HG12  VAL  17          2HG1      VAL  17 -10.083  21.086 -17.022
  150   HG13  VAL  17          3HG1      VAL  17  -8.560  20.371 -16.492
  151   HG21  VAL  17          3HG2      VAL  17 -11.959  18.287 -17.607
  152   HG22  VAL  17          1HG2      VAL  17 -12.230  19.037 -16.034
  153   HG23  VAL  17          2HG2      VAL  17 -11.863  20.040 -17.437
  154    H    LEU  18           H        LEU  18  -8.468  16.876 -15.187
  155    HA   LEU  18           HA       LEU  18  -5.973  18.050 -15.268
  156    HB2  LEU  18           2HB      LEU  18  -7.057  16.704 -13.403
  157    HB3  LEU  18           3HB      LEU  18  -6.445  15.271 -14.226
  158    HG   LEU  18           HG       LEU  18  -4.349  17.220 -13.773
  159   HD11  LEU  18          1HD1      LEU  18  -4.251  17.165 -11.398
  160   HD12  LEU  18          2HD1      LEU  18  -5.637  16.078 -11.304
  161   HD13  LEU  18          3HD1      LEU  18  -5.858  17.743 -11.842
  162   HD21  LEU  18          3HD2      LEU  18  -3.591  15.107 -14.241
  163   HD22  LEU  18          1HD2      LEU  18  -4.868  14.323 -13.312
  164   HD23  LEU  18          2HD2      LEU  18  -3.518  15.094 -12.479
  165    H    LYS  19           H        LYS  19  -6.973  14.928 -16.622
  166    HA   LYS  19           HA       LYS  19  -4.357  14.398 -17.708
  167    HB2  LYS  19           2HB      LYS  19  -6.823  12.943 -17.326
  168    HB3  LYS  19           3HB      LYS  19  -6.227  12.721 -18.965
  169    HG2  LYS  19           2HG      LYS  19  -3.995  12.134 -17.930
  170    HG3  LYS  19           3HG      LYS  19  -4.842  12.065 -16.384
  171    HD2  LYS  19           2HD      LYS  19  -6.264  10.583 -18.413
  172    HD3  LYS  19           3HD      LYS  19  -4.597  10.020 -18.268
  173    HE2  LYS  19           2HE      LYS  19  -6.411  10.405 -15.898
  174    HE3  LYS  19           3HE      LYS  19  -6.296   8.882 -16.779
  175    HZ1  LYS  19           3HZ      LYS  19  -4.069  10.271 -15.389
  176    HZ2  LYS  19           1HZ      LYS  19  -3.916   8.843 -16.283
  177    HZ3  LYS  19           2HZ      LYS  19  -4.845   8.860 -14.870
  178    H    ARG  20           H        ARG  20  -7.430  15.635 -18.875
  179    HA   ARG  20           HA       ARG  20  -7.069  15.482 -21.610
  180    HB2  ARG  20           2HB      ARG  20  -8.457  17.527 -19.890
  181    HB3  ARG  20           3HB      ARG  20  -8.457  17.646 -21.645
  182    HG2  ARG  20           2HG      ARG  20  -9.289  15.068 -20.441
  183    HG3  ARG  20           3HG      ARG  20 -10.394  16.438 -20.313
  184    HD2  ARG  20           2HD      ARG  20 -11.092  15.935 -22.366
  185    HD3  ARG  20           3HD      ARG  20  -9.525  16.494 -22.948
  186    HE   ARG  20           HE       ARG  20  -9.385  13.791 -22.103
  187   HH11  ARG  20          1HH1      ARG  20 -10.530  15.816 -24.693
  188   HH12  ARG  20          2HH1      ARG  20 -10.406  14.573 -25.894
  189   HH21  ARG  20          1HH2      ARG  20  -9.217  12.147 -23.675
  190   HH22  ARG  20          2HH2      ARG  20  -9.660  12.486 -25.314
  191    H    LEU  21           H        LEU  21  -5.944  17.999 -19.377
  192    HA   LEU  21           HA       LEU  21  -4.880  19.790 -21.199
  193    HB2  LEU  21           2HB      LEU  21  -4.960  19.597 -18.485
  194    HB3  LEU  21           3HB      LEU  21  -3.243  19.361 -18.801
  195    HG   LEU  21           HG       LEU  21  -4.736  21.714 -19.921
  196   HD11  LEU  21          1HD1      LEU  21  -4.318  22.998 -18.023
  197   HD12  LEU  21          2HD1      LEU  21  -3.200  21.813 -17.349
  198   HD13  LEU  21          3HD1      LEU  21  -4.931  21.476 -17.374
  199   HD21  LEU  21          3HD2      LEU  21  -1.843  21.098 -19.353
  200   HD22  LEU  21          1HD2      LEU  21  -2.437  22.695 -19.805
  201   HD23  LEU  21          2HD2      LEU  21  -2.606  21.343 -20.924
  202    H    LEU  22           H        LEU  22  -3.562  16.766 -20.008
  203    HA   LEU  22           HA       LEU  22  -0.963  17.161 -21.156
  204    HB2  LEU  22           2HB      LEU  22  -2.391  14.856 -19.891
  205    HB3  LEU  22           3HB      LEU  22  -0.867  14.601 -20.739
  206    HG   LEU  22           HG       LEU  22  -1.284  16.388 -18.342
  207   HD11  LEU  22          1HD1      LEU  22  -1.249  14.364 -17.336
  208   HD12  LEU  22          2HD1      LEU  22   0.491  14.554 -17.549
  209   HD13  LEU  22          3HD1      LEU  22  -0.435  13.578 -18.689
  210   HD21  LEU  22          3HD2      LEU  22   1.423  15.905 -18.706
  211   HD22  LEU  22          1HD2      LEU  22   0.567  17.412 -19.031
  212   HD23  LEU  22          2HD2      LEU  22   0.818  16.244 -20.328
  213    H    ALA  23           H        ALA  23  -3.638  14.928 -21.932
  214    HA   ALA  23           HA       ALA  23  -2.640  13.848 -24.259
  215    HB1  ALA  23           1HB      ALA  23  -5.027  13.514 -24.922
  216    HB2  ALA  23           2HB      ALA  23  -4.634  12.964 -23.293
  217    HB3  ALA  23           3HB      ALA  23  -5.491  14.488 -23.526
  218    H    MET  24           H        MET  24  -4.347  16.912 -23.820
  219    HA   MET  24           HA       MET  24  -4.421  17.509 -26.625
  220    HB2  MET  24           2HB      MET  24  -6.007  18.372 -24.797
  221    HB3  MET  24           3HB      MET  24  -4.732  19.517 -24.403
  222    HG2  MET  24           2HG      MET  24  -5.600  20.863 -25.928
  223    HG3  MET  24           3HG      MET  24  -5.020  19.734 -27.150
  224    HE1  MET  24           3HE      MET  24  -7.900  18.600 -28.906
  225    HE2  MET  24           1HE      MET  24  -6.156  18.705 -28.664
  226    HE3  MET  24           2HE      MET  24  -7.078  17.418 -27.887
  227    H    LEU  25           H        LEU  25  -2.386  18.429 -23.889
  228    HA   LEU  25           HA       LEU  25  -0.882  20.441 -25.059
  229    HB2  LEU  25           2HB      LEU  25  -0.622  20.058 -22.751
  230    HB3  LEU  25           3HB      LEU  25  -0.201  18.364 -23.000
  231    HG   LEU  25           HG       LEU  25   1.965  18.983 -23.863
  232   HD11  LEU  25          1HD1      LEU  25   2.556  21.506 -23.596
  233   HD12  LEU  25          2HD1      LEU  25   0.818  21.737 -23.780
  234   HD13  LEU  25          3HD1      LEU  25   1.740  20.940 -25.054
  235   HD21  LEU  25          3HD2      LEU  25   2.141  18.739 -21.580
  236   HD22  LEU  25          1HD2      LEU  25   1.100  20.123 -21.243
  237   HD23  LEU  25          2HD2      LEU  25   2.753  20.379 -21.802
  238    H    ARG  26           H        ARG  26   0.167  17.043 -24.744
  239    HA   ARG  26           HA       ARG  26   1.287  17.155 -27.434
  240    HB2  ARG  26           2HB      ARG  26   3.175  17.862 -26.155
  241    HB3  ARG  26           3HB      ARG  26   2.899  16.620 -24.942
  242    HG2  ARG  26           2HG      ARG  26   3.764  14.945 -26.263
  243    HG3  ARG  26           3HG      ARG  26   3.455  15.824 -27.762
  244    HD2  ARG  26           2HD      ARG  26   5.299  17.188 -25.949
  245    HD3  ARG  26           3HD      ARG  26   5.880  15.619 -26.505
  246    HE   ARG  26           HE       ARG  26   4.934  17.006 -28.727
  247   HH11  ARG  26          1HH1      ARG  26   7.480  17.263 -26.366
  248   HH12  ARG  26          2HH1      ARG  26   8.568  18.082 -27.437
  249   HH21  ARG  26          1HH2      ARG  26   6.357  18.084 -30.147
  250   HH22  ARG  26          2HH2      ARG  26   7.928  18.549 -29.587
  251    H    GLN  27           H        GLN  27   1.868  14.916 -24.746
  252    HA   GLN  27           HA       GLN  27  -0.049  12.999 -25.390
  253    HB2  GLN  27           2HB      GLN  27   1.865  13.090 -27.371
  254    HB3  GLN  27           3HB      GLN  27   2.438  11.785 -26.340
  255    HG2  GLN  27           2HG      GLN  27  -0.421  11.661 -26.915
  256    HG3  GLN  27           3HG      GLN  27   0.604  11.540 -28.344
  257   HE21  GLN  27          1HE2      GLN  27   1.535   9.654 -28.787
  258   HE22  GLN  27          2HE2      GLN  27   1.555   8.279 -27.740
  259    H    HIS  28           H        HIS  28   1.273  14.156 -23.120
  260    HA   HIS  28           HA       HIS  28   3.177  12.554 -21.898
  261    HB2  HIS  28           2HB      HIS  28   2.160  14.796 -21.121
  262    HB3  HIS  28           3HB      HIS  28   0.922  13.809 -20.349
  263    HD1  HIS  28           HD1      HIS  28   1.869  12.038 -18.535
  264    HD2  HIS  28           HD2      HIS  28   4.438  15.103 -19.662
  265    HE1  HIS  28           HE1      HIS  28   3.644  12.116 -16.756
  266    H    ALA  29           H        ALA  29   3.070  10.835 -20.427
  267    HA   ALA  29           HA       ALA  29   0.571   9.275 -20.547
  268    HB1  ALA  29           1HB      ALA  29   2.310   8.199 -21.838
  269    HB2  ALA  29           2HB      ALA  29   3.411   8.264 -20.460
  270    HB3  ALA  29           3HB      ALA  29   1.969   7.252 -20.389
  271    H    PHE  30           H        PHE  30  -0.247  10.107 -18.609
  272    HA   PHE  30           HA       PHE  30   1.104  10.389 -16.203
  273    HB2  PHE  30           2HB      PHE  30  -1.210  11.209 -16.703
  274    HB3  PHE  30           3HB      PHE  30  -1.786   9.557 -16.507
  275    HD1  PHE  30           HD2      PHE  30  -0.065  12.318 -14.730
  276    HD2  PHE  30           HD1      PHE  30  -2.320   8.723 -14.397
  277    HE1  PHE  30           HE2      PHE  30  -0.299  12.692 -12.309
  278    HE2  PHE  30           HE1      PHE  30  -2.558   9.092 -11.976
  279    HZ   PHE  30           HZ       PHE  30  -1.546  11.078 -10.929
  Start of MODEL   18
    1    H1   GLY   1           H        GLY   1  -5.999   2.570   1.544
    2    HA2  GLY   1           2HA      GLY   1  -4.282   3.244  -0.684
    3    HA3  GLY   1           3HA      GLY   1  -5.497   2.029  -1.053
    4    H    ILE   2           H        ILE   2  -5.080   5.317   0.198
    5    HA   ILE   2           HA       ILE   2  -7.866   5.947  -0.309
    6    HB   ILE   2           HB       ILE   2  -5.740   7.928   0.468
    7   HG12  ILE   2          2HG1      ILE   2  -6.927   7.277   2.830
    8   HG13  ILE   2          3HG1      ILE   2  -6.885   5.706   2.037
    9   HG21  ILE   2          1HG2      ILE   2  -7.597   9.180   0.113
   10   HG22  ILE   2          2HG2      ILE   2  -8.696   7.838   0.423
   11   HG23  ILE   2          3HG2      ILE   2  -7.940   8.687   1.771
   12   HD11  ILE   2          3HD1      ILE   2  -4.740   5.479   2.507
   13   HD12  ILE   2          1HD1      ILE   2  -4.359   7.019   1.737
   14   HD13  ILE   2          2HD1      ILE   2  -4.828   6.975   3.436
   15    H    ARG   3           H        ARG   3  -8.485   7.800  -1.627
   16    HA   ARG   3           HA       ARG   3  -6.700   8.141  -3.948
   17    HB2  ARG   3           2HB      ARG   3  -9.619   7.637  -3.739
   18    HB3  ARG   3           3HB      ARG   3  -9.094   8.747  -4.997
   19    HG2  ARG   3           2HG      ARG   3  -7.435   6.409  -5.006
   20    HG3  ARG   3           3HG      ARG   3  -9.138   5.950  -5.083
   21    HD2  ARG   3           2HD      ARG   3  -9.426   6.856  -7.134
   22    HD3  ARG   3           3HD      ARG   3  -8.329   8.198  -6.810
   23    HE   ARG   3           HE       ARG   3  -6.708   6.006  -6.989
   24   HH11  ARG   3          1HH1      ARG   3  -9.071   7.508  -9.058
   25   HH12  ARG   3          2HH1      ARG   3  -8.297   7.007 -10.525
   26   HH21  ARG   3          1HH2      ARG   3  -5.679   5.340  -8.913
   27   HH22  ARG   3          2HH2      ARG   3  -6.368   5.773 -10.441
   28    H    CYS   4           H        CYS   4  -9.453   9.744  -2.336
   29    HA   CYS   4           HA       CYS   4  -8.293  12.337  -3.073
   30    HB2  CYS   4           2HB      CYS   4 -11.052  11.371  -2.508
   31    HB3  CYS   4           3HB      CYS   4 -10.673  13.037  -2.083
   32    HA   PRO   5           HA       PRO   5  -7.170  13.407   1.029
   33    HB2  PRO   5           2HB      PRO   5  -7.880  16.024   1.169
   34    HB3  PRO   5           3HB      PRO   5  -6.507  15.451   0.215
   35    HG2  PRO   5           2HG      PRO   5  -9.280  16.141  -0.679
   36    HG3  PRO   5           3HG      PRO   5  -7.728  16.536  -1.441
   37    HD2  PRO   5           2HD      PRO   5  -9.296  14.502  -2.299
   38    HD3  PRO   5           3HD      PRO   5  -7.525  14.450  -2.400
   39    H    LYS   6           H        LYS   6  -8.929  11.945   1.836
   40    HA   LYS   6           HA       LYS   6 -10.714  11.486   3.176
   41    HB2  LYS   6           2HB      LYS   6  -9.991  14.239   4.189
   42    HB3  LYS   6           3HB      LYS   6 -11.120  13.160   4.997
   43    HG2  LYS   6           2HG      LYS   6  -9.443  11.636   5.562
   44    HG3  LYS   6           3HG      LYS   6  -8.312  12.311   4.387
   45    HD2  LYS   6           2HD      LYS   6  -7.967  14.253   5.699
   46    HD3  LYS   6           3HD      LYS   6  -9.335  13.873   6.748
   47    HE2  LYS   6           2HE      LYS   6  -8.077  12.587   8.064
   48    HE3  LYS   6           3HE      LYS   6  -7.394  11.724   6.687
   49    HZ1  LYS   6           3HZ      LYS   6  -5.681  13.265   6.478
   50    HZ2  LYS   6           1HZ      LYS   6  -5.817  13.056   8.151
   51    HZ3  LYS   6           2HZ      LYS   6  -6.467  14.433   7.416
   52    H    SER   7           H        SER   7 -11.911  11.739   1.026
   53    HA   SER   7           HA       SER   7 -14.398  12.914   1.486
   54    HB2  SER   7           2HB      SER   7 -14.193  14.666  -0.434
   55    HB3  SER   7           3HB      SER   7 -13.605  15.089   1.174
   56    HG   SER   7           HG       SER   7 -12.251  15.087  -1.084
   57    H    TRP   8           H        TRP   8 -15.664  11.553   0.430
   58    HA   TRP   8           HA       TRP   8 -14.691  10.100  -1.871
   59    HB2  TRP   8           2HB      TRP   8 -17.164   9.971  -0.174
   60    HB3  TRP   8           3HB      TRP   8 -17.114   9.142  -1.728
   61    HD1  TRP   8           HD1      TRP   8 -14.047   9.292   0.571
   62    HE1  TRP   8           HE1      TRP   8 -13.505   6.904   1.366
   63    HE3  TRP   8           HE3      TRP   8 -18.128   6.861  -1.318
   64    HZ2  TRP   8           HZ2      TRP   8 -14.655   4.331   1.212
   65    HZ3  TRP   8           HZ3      TRP   8 -18.332   4.436  -0.951
   66    HH2  TRP   8           HH2      TRP   8 -16.630   3.199   0.288
   67    H    LYS   9           H        LYS   9 -14.531  12.337  -2.968
   68    HA   LYS   9           HA       LYS   9 -17.020  12.765  -4.483
   69    HB2  LYS   9           2HB      LYS   9 -15.071  14.832  -3.463
   70    HB3  LYS   9           3HB      LYS   9 -16.271  15.173  -4.703
   71    HG2  LYS   9           2HG      LYS   9 -18.064  14.728  -3.183
   72    HG3  LYS   9           3HG      LYS   9 -16.937  14.157  -1.950
   73    HD2  LYS   9           2HD      LYS   9 -16.102  16.312  -1.556
   74    HD3  LYS   9           3HD      LYS   9 -16.770  16.941  -3.065
   75    HE2  LYS   9           2HE      LYS   9 -18.534  15.894  -0.873
   76    HE3  LYS   9           3HE      LYS   9 -17.950  17.557  -0.872
   77    HZ1  LYS   9           3HZ      LYS   9 -20.082  17.506  -1.902
   78    HZ2  LYS   9           1HZ      LYS   9 -19.626  16.255  -2.946
   79    HZ3  LYS   9           2HZ      LYS   9 -18.940  17.791  -3.117
   80    H    CYS  10           H        CYS  10 -13.718  14.056  -4.752
   81    HA   CYS  10           HA       CYS  10 -12.291  14.179  -6.525
   82    HB2  CYS  10           2HB      CYS  10 -13.313  11.422  -7.212
   83    HB3  CYS  10           3HB      CYS  10 -11.727  12.100  -7.567
   84    H    LYS  11           H        LYS  11 -13.601  15.832  -7.522
   85    HA   LYS  11           HA       LYS  11 -15.686  15.470  -9.289
   86    HB2  LYS  11           2HB      LYS  11 -14.802  17.663  -8.469
   87    HB3  LYS  11           3HB      LYS  11 -13.468  17.500  -9.604
   88    HG2  LYS  11           2HG      LYS  11 -14.742  18.609 -11.045
   89    HG3  LYS  11           3HG      LYS  11 -15.692  17.128 -11.186
   90    HD2  LYS  11           2HD      LYS  11 -17.191  17.892  -9.436
   91    HD3  LYS  11           3HD      LYS  11 -16.211  19.341  -9.201
   92    HE2  LYS  11           2HE      LYS  11 -16.678  19.922 -11.599
   93    HE3  LYS  11           3HE      LYS  11 -17.828  18.586 -11.628
   94    HZ1  LYS  11           3HZ      LYS  11 -17.957  20.945  -9.827
   95    HZ2  LYS  11           1HZ      LYS  11 -19.056  19.659  -9.840
   96    HZ3  LYS  11           2HZ      LYS  11 -18.934  20.681 -11.183
   97    H    ALA  12           H        ALA  12 -15.734  14.028 -10.892
   98    HA   ALA  12           HA       ALA  12 -13.610  12.904 -12.243
   99    HB1  ALA  12           1HB      ALA  12 -15.233  12.263 -13.975
  100    HB2  ALA  12           2HB      ALA  12 -15.849  11.982 -12.346
  101    HB3  ALA  12           3HB      ALA  12 -16.405  13.376 -13.271
  102    H    PHE  13           H        PHE  13 -15.437  15.823 -13.051
  103    HA   PHE  13           HA       PHE  13 -14.337  16.328 -15.564
  104    HB2  PHE  13           2HB      PHE  13 -16.283  17.514 -14.367
  105    HB3  PHE  13           3HB      PHE  13 -15.043  18.515 -13.620
  106    HD1  PHE  13           HD2      PHE  13 -15.860  17.254 -17.040
  107    HD2  PHE  13           HD1      PHE  13 -14.699  20.547 -14.606
  108    HE1  PHE  13           HE2      PHE  13 -15.850  18.711 -19.022
  109    HE2  PHE  13           HE1      PHE  13 -14.689  22.010 -16.584
  110    HZ   PHE  13           HZ       PHE  13 -15.264  21.093 -18.796
  111    H    LYS  14           H        LYS  14 -13.427  17.969 -12.530
  112    HA   LYS  14           HA       LYS  14 -11.126  19.194 -13.473
  113    HB2  LYS  14           2HB      LYS  14 -12.214  19.690 -11.301
  114    HB3  LYS  14           3HB      LYS  14 -11.607  18.164 -10.671
  115    HG2  LYS  14           2HG      LYS  14  -9.474  18.929 -10.476
  116    HG3  LYS  14           3HG      LYS  14  -9.637  20.058 -11.823
  117    HD2  LYS  14           2HD      LYS  14 -10.645  21.676 -10.516
  118    HD3  LYS  14           3HD      LYS  14 -11.204  20.507  -9.317
  119    HE2  LYS  14           2HE      LYS  14  -8.869  20.174  -8.599
  120    HE3  LYS  14           3HE      LYS  14  -8.355  21.400  -9.757
  121    HZ1  LYS  14           3HZ      LYS  14 -10.349  22.585  -8.287
  122    HZ2  LYS  14           1HZ      LYS  14  -8.687  22.872  -8.151
  123    HZ3  LYS  14           2HZ      LYS  14  -9.433  21.734  -7.147
  124    H    GLN  15           H        GLN  15 -11.499  16.004 -11.973
  125    HA   GLN  15           HA       GLN  15  -8.828  15.279 -11.791
  126    HB2  GLN  15           2HB      GLN  15 -11.278  13.600 -12.323
  127    HB3  GLN  15           3HB      GLN  15  -9.689  12.912 -12.018
  128    HG2  GLN  15           2HG      GLN  15 -10.380  14.840  -9.994
  129    HG3  GLN  15           3HG      GLN  15 -11.622  13.598 -10.141
  130   HE21  GLN  15          1HE2      GLN  15  -9.048  14.369  -8.413
  131   HE22  GLN  15          2HE2      GLN  15  -8.416  12.805  -8.040
  132    H    ARG  16           H        ARG  16 -11.023  15.114 -14.547
  133    HA   ARG  16           HA       ARG  16  -9.139  13.761 -16.236
  134    HB2  ARG  16           2HB      ARG  16 -11.889  14.777 -16.460
  135    HB3  ARG  16           3HB      ARG  16 -10.957  14.875 -17.949
  136    HG2  ARG  16           2HG      ARG  16 -11.879  12.801 -18.170
  137    HG3  ARG  16           3HG      ARG  16 -10.363  12.388 -17.368
  138    HD2  ARG  16           2HD      ARG  16 -11.507  12.346 -15.213
  139    HD3  ARG  16           3HD      ARG  16 -13.021  12.791 -16.000
  140    HE   ARG  16           HE       ARG  16 -11.830  10.188 -15.896
  141   HH11  ARG  16          1HH1      ARG  16 -13.914  12.284 -17.734
  142   HH12  ARG  16          2HH1      ARG  16 -14.771  10.983 -18.493
  143   HH21  ARG  16          1HH2      ARG  16 -12.950   8.466 -16.888
  144   HH22  ARG  16          2HH2      ARG  16 -14.222   8.812 -18.010
  145    H    VAL  17           H        VAL  17 -10.305  17.095 -15.917
  146    HA   VAL  17           HA       VAL  17  -9.007  18.276 -18.046
  147    HB   VAL  17           HB       VAL  17  -9.321  19.520 -15.312
  148   HG11  VAL  17          1HG1      VAL  17  -9.724  21.516 -17.063
  149   HG12  VAL  17          2HG1      VAL  17  -8.142  21.125 -16.385
  150   HG13  VAL  17          3HG1      VAL  17  -8.587  20.534 -17.986
  151   HG21  VAL  17          3HG2      VAL  17 -11.380  20.362 -17.025
  152   HG22  VAL  17          1HG2      VAL  17 -11.303  18.606 -17.174
  153   HG23  VAL  17          2HG2      VAL  17 -11.520  19.349 -15.589
  154    H    LEU  18           H        LEU  18  -7.735  17.531 -14.830
  155    HA   LEU  18           HA       LEU  18  -5.298  18.818 -14.940
  156    HB2  LEU  18           2HB      LEU  18  -6.374  17.430 -13.059
  157    HB3  LEU  18           3HB      LEU  18  -5.567  16.054 -13.809
  158    HG   LEU  18           HG       LEU  18  -4.341  16.990 -11.875
  159   HD11  LEU  18          1HD1      LEU  18  -2.346  16.482 -12.795
  160   HD12  LEU  18          2HD1      LEU  18  -2.561  17.594 -14.147
  161   HD13  LEU  18          3HD1      LEU  18  -3.346  16.015 -14.171
  162   HD21  LEU  18          3HD2      LEU  18  -5.067  19.404 -12.646
  163   HD22  LEU  18          1HD2      LEU  18  -3.535  19.336 -13.517
  164   HD23  LEU  18          2HD2      LEU  18  -3.562  19.137 -11.764
  165    H    LYS  19           H        LYS  19  -6.146  15.612 -16.195
  166    HA   LYS  19           HA       LYS  19  -3.499  15.159 -17.240
  167    HB2  LYS  19           2HB      LYS  19  -6.096  13.663 -17.317
  168    HB3  LYS  19           3HB      LYS  19  -4.787  13.203 -18.398
  169    HG2  LYS  19           2HG      LYS  19  -4.335  11.823 -16.654
  170    HG3  LYS  19           3HG      LYS  19  -3.396  13.232 -16.153
  171    HD2  LYS  19           2HD      LYS  19  -4.608  13.422 -14.299
  172    HD3  LYS  19           3HD      LYS  19  -6.095  13.518 -15.245
  173    HE2  LYS  19           2HE      LYS  19  -5.978  10.984 -15.399
  174    HE3  LYS  19           3HE      LYS  19  -4.731  11.069 -14.155
  175    HZ1  LYS  19           3HZ      LYS  19  -6.620  12.550 -13.033
  176    HZ2  LYS  19           1HZ      LYS  19  -6.512  10.876 -12.811
  177    HZ3  LYS  19           2HZ      LYS  19  -7.597  11.511 -13.942
  178    H    ARG  20           H        ARG  20  -6.607  16.232 -18.471
  179    HA   ARG  20           HA       ARG  20  -6.210  16.004 -21.198
  180    HB2  ARG  20           2HB      ARG  20  -7.716  18.023 -19.552
  181    HB3  ARG  20           3HB      ARG  20  -7.689  18.111 -21.308
  182    HG2  ARG  20           2HG      ARG  20  -8.453  15.625 -21.167
  183    HG3  ARG  20           3HG      ARG  20  -8.945  16.073 -19.532
  184    HD2  ARG  20           2HD      ARG  20 -10.119  18.065 -20.665
  185    HD3  ARG  20           3HD      ARG  20  -9.921  17.145 -22.157
  186    HE   ARG  20           HE       ARG  20 -11.072  15.448 -20.279
  187   HH11  ARG  20          1HH1      ARG  20 -11.867  18.383 -21.974
  188   HH12  ARG  20          2HH1      ARG  20 -13.573  18.083 -21.961
  189   HH21  ARG  20          1HH2      ARG  20 -13.317  15.041 -20.255
  190   HH22  ARG  20          2HH2      ARG  20 -14.397  16.182 -20.982
  191    H    LEU  21           H        LEU  21  -5.217  18.630 -19.030
  192    HA   LEU  21           HA       LEU  21  -4.217  20.412 -20.901
  193    HB2  LEU  21           2HB      LEU  21  -4.422  21.050 -18.611
  194    HB3  LEU  21           3HB      LEU  21  -3.297  19.792 -18.103
  195    HG   LEU  21           HG       LEU  21  -2.215  21.804 -19.971
  196   HD11  LEU  21          1HD1      LEU  21  -2.288  23.630 -18.639
  197   HD12  LEU  21          2HD1      LEU  21  -2.315  22.684 -17.152
  198   HD13  LEU  21          3HD1      LEU  21  -3.790  22.880 -18.099
  199   HD21  LEU  21          3HD2      LEU  21  -0.586  20.378 -19.229
  200   HD22  LEU  21          1HD2      LEU  21  -1.326  20.180 -17.641
  201   HD23  LEU  21          2HD2      LEU  21  -0.447  21.660 -18.025
  202    H    LEU  22           H        LEU  22  -2.791  17.483 -19.611
  203    HA   LEU  22           HA       LEU  22  -0.192  17.962 -20.729
  204    HB2  LEU  22           2HB      LEU  22  -1.535  15.639 -19.407
  205    HB3  LEU  22           3HB      LEU  22   0.007  15.421 -20.231
  206    HG   LEU  22           HG       LEU  22   0.027  17.646 -18.345
  207   HD11  LEU  22          1HD1      LEU  22  -0.318  16.555 -16.353
  208   HD12  LEU  22          2HD1      LEU  22  -0.070  14.958 -17.057
  209   HD13  LEU  22          3HD1      LEU  22  -1.572  15.831 -17.360
  210   HD21  LEU  22          3HD2      LEU  22   2.137  16.756 -17.774
  211   HD22  LEU  22          1HD2      LEU  22   1.968  16.517 -19.513
  212   HD23  LEU  22          2HD2      LEU  22   1.723  15.163 -18.410
  213    H    ALA  23           H        ALA  23  -2.765  15.603 -21.474
  214    HA   ALA  23           HA       ALA  23  -1.693  14.477 -23.742
  215    HB1  ALA  23           1HB      ALA  23  -4.609  15.061 -23.745
  216    HB2  ALA  23           2HB      ALA  23  -3.753  13.567 -24.128
  217    HB3  ALA  23           3HB      ALA  23  -3.952  14.062 -22.448
  218    H    MET  24           H        MET  24  -3.488  17.507 -23.446
  219    HA   MET  24           HA       MET  24  -3.497  18.002 -26.276
  220    HB2  MET  24           2HB      MET  24  -5.262  18.870 -24.776
  221    HB3  MET  24           3HB      MET  24  -4.069  19.892 -23.986
  222    HG2  MET  24           2HG      MET  24  -4.205  21.445 -25.566
  223    HG3  MET  24           3HG      MET  24  -4.092  20.255 -26.860
  224    HE1  MET  24           3HE      MET  24  -7.117  22.591 -27.581
  225    HE2  MET  24           1HE      MET  24  -5.358  22.466 -27.594
  226    HE3  MET  24           2HE      MET  24  -6.325  21.379 -28.590
  227    H    LEU  25           H        LEU  25  -1.604  19.092 -23.502
  228    HA   LEU  25           HA       LEU  25  -0.143  21.134 -24.654
  229    HB2  LEU  25           2HB      LEU  25   0.092  20.788 -22.344
  230    HB3  LEU  25           3HB      LEU  25   0.556  19.102 -22.560
  231    HG   LEU  25           HG       LEU  25   2.721  19.791 -23.433
  232   HD11  LEU  25          1HD1      LEU  25   1.548  22.535 -23.168
  233   HD12  LEU  25          2HD1      LEU  25   2.365  21.801 -24.548
  234   HD13  LEU  25          3HD1      LEU  25   3.292  22.276 -23.125
  235   HD21  LEU  25          3HD2      LEU  25   2.385  19.499 -20.994
  236   HD22  LEU  25          1HD2      LEU  25   2.097  21.234 -20.860
  237   HD23  LEU  25          2HD2      LEU  25   3.671  20.639 -21.390
  238    H    ARG  26           H        ARG  26   0.786  17.694 -24.478
  239    HA   ARG  26           HA       ARG  26   2.432  18.122 -26.883
  240    HB2  ARG  26           2HB      ARG  26   3.107  16.786 -24.305
  241    HB3  ARG  26           3HB      ARG  26   3.766  16.103 -25.786
  242    HG2  ARG  26           2HG      ARG  26   4.083  18.998 -25.587
  243    HG3  ARG  26           3HG      ARG  26   4.907  18.094 -24.315
  244    HD2  ARG  26           2HD      ARG  26   6.444  17.293 -25.731
  245    HD3  ARG  26           3HD      ARG  26   5.239  16.923 -26.964
  246    HE   ARG  26           HE       ARG  26   5.687  18.937 -27.971
  247   HH11  ARG  26          1HH1      ARG  26   7.127  18.872 -24.803
  248   HH12  ARG  26          2HH1      ARG  26   8.029  20.332 -25.040
  249   HH21  ARG  26          1HH2      ARG  26   6.870  20.860 -28.296
  250   HH22  ARG  26          2HH2      ARG  26   7.882  21.462 -27.027
  251    H    GLN  27           H        GLN  27   1.630  15.225 -24.994
  252    HA   GLN  27           HA       GLN  27  -0.371  14.213 -26.652
  253    HB2  GLN  27           2HB      GLN  27   1.014  12.413 -27.802
  254    HB3  GLN  27           3HB      GLN  27   1.138  14.041 -28.458
  255    HG2  GLN  27           2HG      GLN  27   3.250  14.370 -27.330
  256    HG3  GLN  27           3HG      GLN  27   3.117  12.785 -26.571
  257   HE21  GLN  27          1HE2      GLN  27   5.187  12.368 -27.550
  258   HE22  GLN  27          2HE2      GLN  27   5.268  11.865 -29.201
  259    H    HIS  28           H        HIS  28   0.380  14.326 -23.886
  260    HA   HIS  28           HA       HIS  28   1.391  12.005 -22.788
  261    HB2  HIS  28           2HB      HIS  28   0.752  14.072 -21.531
  262    HB3  HIS  28           3HB      HIS  28  -0.935  13.586 -21.675
  263    HD1  HIS  28           HD1      HIS  28  -1.655  11.437 -20.334
  264    HD2  HIS  28           HD2      HIS  28   2.184  12.810 -19.536
  265    HE1  HIS  28           HE1      HIS  28  -0.956  10.283 -18.212
  266    H    ALA  29           H        ALA  29   0.439  10.096 -21.972
  267    HA   ALA  29           HA       ALA  29  -2.286   9.422 -22.537
  268    HB1  ALA  29           1HB      ALA  29  -0.547   9.082 -24.661
  269    HB2  ALA  29           2HB      ALA  29  -0.679   7.471 -23.956
  270    HB3  ALA  29           3HB      ALA  29  -2.131   8.329 -24.471
  271    H    PHE  30           H        PHE  30  -2.598   6.953 -22.162
  272    HA   PHE  30           HA       PHE  30  -1.841   6.353 -19.561
  273    HB2  PHE  30           2HB      PHE  30  -3.724   5.323 -20.943
  274    HB3  PHE  30           3HB      PHE  30  -2.502   4.253 -21.622
  275    HD1  PHE  30           HD1      PHE  30  -4.330   5.180 -18.577
  276    HD2  PHE  30           HD2      PHE  30  -1.585   2.452 -20.349
  277    HE1  PHE  30           HE1      PHE  30  -4.605   3.663 -16.659
  278    HE2  PHE  30           HE2      PHE  30  -1.856   0.930 -18.435
  279    HZ   PHE  30           HZ       PHE  30  -3.368   1.534 -16.587
  Start of MODEL   19
    1    H1   GLY   1           H        GLY   1 -11.132   2.281  -1.743
    2    HA2  GLY   1           2HA      GLY   1 -10.390   1.594  -4.493
    3    HA3  GLY   1           3HA      GLY   1 -11.688   2.677  -4.012
    4    H    ILE   2           H        ILE   2 -11.336   4.783  -4.236
    5    HA   ILE   2           HA       ILE   2  -8.683   5.691  -4.979
    6    HB   ILE   2           HB       ILE   2 -11.117   7.438  -4.715
    7   HG12  ILE   2          2HG1      ILE   2 -11.781   5.533  -6.081
    8   HG13  ILE   2          3HG1      ILE   2 -11.585   6.957  -7.097
    9   HG21  ILE   2          1HG2      ILE   2  -8.427   7.659  -5.888
   10   HG22  ILE   2          2HG2      ILE   2  -9.740   8.313  -6.865
   11   HG23  ILE   2          3HG2      ILE   2  -9.484   8.904  -5.224
   12   HD11  ILE   2          3HD1      ILE   2  -9.100   5.764  -7.160
   13   HD12  ILE   2          1HD1      ILE   2 -10.224   4.406  -7.191
   14   HD13  ILE   2          2HD1      ILE   2 -10.341   5.675  -8.410
   15    H    ARG   3           H        ARG   3  -7.736   7.628  -4.026
   16    HA   ARG   3           HA       ARG   3  -8.487   8.030  -1.210
   17    HB2  ARG   3           2HB      ARG   3  -5.912   7.152  -2.346
   18    HB3  ARG   3           3HB      ARG   3  -5.797   8.440  -1.155
   19    HG2  ARG   3           2HG      ARG   3  -7.463   6.768   0.132
   20    HG3  ARG   3           3HG      ARG   3  -6.532   5.611  -0.822
   21    HD2  ARG   3           2HD      ARG   3  -5.192   5.739   1.018
   22    HD3  ARG   3           3HD      ARG   3  -4.506   7.058   0.070
   23    HE   ARG   3           HE       ARG   3  -6.558   8.089   1.669
   24   HH11  ARG   3          1HH1      ARG   3  -3.386   6.692   1.993
   25   HH12  ARG   3          2HH1      ARG   3  -3.014   7.550   3.452
   26   HH21  ARG   3          1HH2      ARG   3  -6.081   9.224   3.589
   27   HH22  ARG   3          2HH2      ARG   3  -4.548   8.989   4.360
   28    H    CYS   4           H        CYS   4  -9.106  10.066  -0.967
   29    HA   CYS   4           HA       CYS   4  -7.843  12.143  -2.622
   30    HB2  CYS   4           2HB      CYS   4 -10.560  11.822  -1.435
   31    HB3  CYS   4           3HB      CYS   4  -9.928  13.455  -1.619
   32    HA   PRO   5           HA       PRO   5  -5.954  14.111   0.813
   33    HB2  PRO   5           2HB      PRO   5  -6.336  16.743   0.266
   34    HB3  PRO   5           3HB      PRO   5  -5.209  15.727  -0.641
   35    HG2  PRO   5           2HG      PRO   5  -7.996  16.562  -1.346
   36    HG3  PRO   5           3HG      PRO   5  -6.555  16.491  -2.377
   37    HD2  PRO   5           2HD      PRO   5  -8.459  14.565  -2.399
   38    HD3  PRO   5           3HD      PRO   5  -6.744  14.216  -2.699
   39    H    LYS   6           H        LYS   6  -7.708  13.213   2.226
   40    HA   LYS   6           HA       LYS   6  -9.290  13.418   3.853
   41    HB2  LYS   6           2HB      LYS   6  -8.443  16.306   4.013
   42    HB3  LYS   6           3HB      LYS   6  -9.057  15.286   5.307
   43    HG2  LYS   6           2HG      LYS   6  -6.955  13.865   4.907
   44    HG3  LYS   6           3HG      LYS   6  -6.353  15.270   4.024
   45    HD2  LYS   6           2HD      LYS   6  -5.548  15.710   6.130
   46    HD3  LYS   6           3HD      LYS   6  -7.097  16.555   6.190
   47    HE2  LYS   6           2HE      LYS   6  -7.998  14.300   7.104
   48    HE3  LYS   6           3HE      LYS   6  -6.304  13.954   7.445
   49    HZ1  LYS   6           3HZ      LYS   6  -6.365  16.256   8.577
   50    HZ2  LYS   6           1HZ      LYS   6  -7.023  14.925   9.388
   51    HZ3  LYS   6           2HZ      LYS   6  -8.041  16.027   8.607
   52    H    SER   7           H        SER   7 -10.849  13.212   1.997
   53    HA   SER   7           HA       SER   7 -13.034  14.907   2.362
   54    HB2  SER   7           2HB      SER   7 -12.990  15.878  -0.056
   55    HB3  SER   7           3HB      SER   7 -12.053  16.682   1.204
   56    HG   SER   7           HG       SER   7 -10.876  16.324  -0.765
   57    H    TRP   8           H        TRP   8 -14.639  13.533   2.037
   58    HA   TRP   8           HA       TRP   8 -14.320  11.268   0.269
   59    HB2  TRP   8           2HB      TRP   8 -16.406  12.133   2.246
   60    HB3  TRP   8           3HB      TRP   8 -16.763  10.857   1.086
   61    HD1  TRP   8           HD1      TRP   8 -13.263  11.087   2.580
   62    HE1  TRP   8           HE1      TRP   8 -12.881   9.059   4.118
   63    HE3  TRP   8           HE3      TRP   8 -18.005   9.177   2.595
   64    HZ2  TRP   8           HZ2      TRP   8 -14.391   6.930   5.195
   65    HZ3  TRP   8           HZ3      TRP   8 -18.453   7.142   3.903
   66    HH2  TRP   8           HH2      TRP   8 -16.682   6.043   5.175
   67    H    LYS   9           H        LYS   9 -14.113  12.967  -1.547
   68    HA   LYS   9           HA       LYS   9 -16.772  13.272  -2.767
   69    HB2  LYS   9           2HB      LYS   9 -14.530  15.293  -2.721
   70    HB3  LYS   9           3HB      LYS   9 -15.889  15.389  -3.832
   71    HG2  LYS   9           2HG      LYS   9 -16.867  15.043  -1.169
   72    HG3  LYS   9           3HG      LYS   9 -15.719  16.383  -1.211
   73    HD2  LYS   9           2HD      LYS   9 -17.722  17.427  -1.725
   74    HD3  LYS   9           3HD      LYS   9 -17.038  17.116  -3.323
   75    HE2  LYS   9           2HE      LYS   9 -18.400  14.841  -2.993
   76    HE3  LYS   9           3HE      LYS   9 -19.381  15.898  -1.979
   77    HZ1  LYS   9           3HZ      LYS   9 -19.458  15.666  -4.737
   78    HZ2  LYS   9           1HZ      LYS   9 -18.780  17.184  -4.421
   79    HZ3  LYS   9           2HZ      LYS   9 -20.292  16.782  -3.777
   80    H    CYS  10           H        CYS  10 -13.464  14.002  -3.849
   81    HA   CYS  10           HA       CYS  10 -12.331  13.402  -5.732
   82    HB2  CYS  10           2HB      CYS  10 -13.679  10.730  -5.294
   83    HB3  CYS  10           3HB      CYS  10 -12.181  11.024  -6.173
   84    H    LYS  11           H        LYS  11 -14.215  14.883  -6.613
   85    HA   LYS  11           HA       LYS  11 -16.315  13.915  -8.115
   86    HB2  LYS  11           2HB      LYS  11 -14.972  16.388  -7.805
   87    HB3  LYS  11           3HB      LYS  11 -15.095  16.089  -9.534
   88    HG2  LYS  11           2HG      LYS  11 -17.518  15.756  -9.284
   89    HG3  LYS  11           3HG      LYS  11 -17.373  16.124  -7.564
   90    HD2  LYS  11           2HD      LYS  11 -16.600  18.356  -8.063
   91    HD3  LYS  11           3HD      LYS  11 -16.577  17.998  -9.791
   92    HE2  LYS  11           2HE      LYS  11 -19.107  17.693  -8.226
   93    HE3  LYS  11           3HE      LYS  11 -18.588  19.290  -8.762
   94    HZ1  LYS  11           3HZ      LYS  11 -19.860  18.626 -10.521
   95    HZ2  LYS  11           1HZ      LYS  11 -19.464  16.989 -10.356
   96    HZ3  LYS  11           2HZ      LYS  11 -18.349  18.064 -11.035
   97    H    ALA  12           H        ALA  12 -16.415  12.576  -9.783
   98    HA   ALA  12           HA       ALA  12 -14.271  11.416 -11.072
   99    HB1  ALA  12           1HB      ALA  12 -16.806  11.772 -12.593
  100    HB2  ALA  12           2HB      ALA  12 -15.795  10.339 -12.401
  101    HB3  ALA  12           3HB      ALA  12 -16.840  10.865 -11.081
  102    H    PHE  13           H        PHE  13 -16.128  14.274 -12.024
  103    HA   PHE  13           HA       PHE  13 -14.958  14.672 -14.540
  104    HB2  PHE  13           2HB      PHE  13 -17.008  15.830 -13.489
  105    HB3  PHE  13           3HB      PHE  13 -15.845  16.931 -12.759
  106    HD1  PHE  13           HD2      PHE  13 -16.097  15.388 -16.146
  107    HD2  PHE  13           HD1      PHE  13 -15.921  18.956 -13.833
  108    HE1  PHE  13           HE2      PHE  13 -16.072  16.722 -18.213
  109    HE2  PHE  13           HE1      PHE  13 -15.897  20.297 -15.896
  110    HZ   PHE  13           HZ       PHE  13 -15.971  19.180 -18.090
  111    H    LYS  14           H        LYS  14 -14.283  16.589 -11.609
  112    HA   LYS  14           HA       LYS  14 -11.993  17.841 -12.509
  113    HB2  LYS  14           2HB      LYS  14 -13.133  18.484 -10.448
  114    HB3  LYS  14           3HB      LYS  14 -12.657  16.971  -9.690
  115    HG2  LYS  14           2HG      LYS  14 -10.338  18.319 -10.690
  116    HG3  LYS  14           3HG      LYS  14 -11.282  19.413  -9.676
  117    HD2  LYS  14           2HD      LYS  14 -10.900  16.663  -8.657
  118    HD3  LYS  14           3HD      LYS  14  -9.468  17.694  -8.698
  119    HE2  LYS  14           2HE      LYS  14 -11.120  19.434  -7.599
  120    HE3  LYS  14           3HE      LYS  14 -11.973  17.970  -7.111
  121    HZ1  LYS  14           3HZ      LYS  14 -10.530  18.341  -5.367
  122    HZ2  LYS  14           1HZ      LYS  14  -9.270  18.872  -6.363
  123    HZ3  LYS  14           2HZ      LYS  14  -9.662  17.228  -6.299
  124    H    GLN  15           H        GLN  15 -12.379  14.621 -11.182
  125    HA   GLN  15           HA       GLN  15  -9.671  14.046 -10.692
  126    HB2  GLN  15           2HB      GLN  15 -12.092  12.357 -11.227
  127    HB3  GLN  15           3HB      GLN  15 -10.503  11.614 -11.101
  128    HG2  GLN  15           2HG      GLN  15 -11.614  13.405  -8.965
  129    HG3  GLN  15           3HG      GLN  15 -11.920  11.669  -9.005
  130   HE21  GLN  15          1HE2      GLN  15 -10.788  12.300  -6.818
  131   HE22  GLN  15          2HE2      GLN  15  -9.085  12.006  -6.796
  132    H    ARG  16           H        ARG  16 -11.691  13.537 -13.563
  133    HA   ARG  16           HA       ARG  16  -9.577  12.354 -15.086
  134    HB2  ARG  16           2HB      ARG  16 -12.374  12.706 -15.365
  135    HB3  ARG  16           3HB      ARG  16 -11.620  13.458 -16.764
  136    HG2  ARG  16           2HG      ARG  16 -11.158  11.491 -17.680
  137    HG3  ARG  16           3HG      ARG  16 -10.451  10.879 -16.183
  138    HD2  ARG  16           2HD      ARG  16 -12.445   9.995 -15.445
  139    HD3  ARG  16           3HD      ARG  16 -13.415  11.114 -16.401
  140    HE   ARG  16           HE       ARG  16 -11.892   9.284 -18.000
  141   HH11  ARG  16          1HH1      ARG  16 -14.843   9.723 -16.206
  142   HH12  ARG  16          2HH1      ARG  16 -15.723   8.535 -17.109
  143   HH21  ARG  16          1HH2      ARG  16 -13.039   7.717 -19.197
  144   HH22  ARG  16          2HH2      ARG  16 -14.695   7.394 -18.809
  145    H    VAL  17           H        VAL  17 -11.152  15.541 -15.083
  146    HA   VAL  17           HA       VAL  17  -9.791  16.743 -17.160
  147    HB   VAL  17           HB       VAL  17 -10.629  18.035 -14.559
  148   HG11  VAL  17          1HG1      VAL  17 -10.826  20.050 -16.192
  149   HG12  VAL  17          2HG1      VAL  17  -9.251  19.620 -15.524
  150   HG13  VAL  17          3HG1      VAL  17  -9.674  19.139 -17.167
  151   HG21  VAL  17          3HG2      VAL  17 -12.218  16.794 -16.433
  152   HG22  VAL  17          1HG2      VAL  17 -12.743  18.026 -15.285
  153   HG23  VAL  17          2HG2      VAL  17 -12.274  18.488 -16.921
  154    H    LEU  18           H        LEU  18  -8.772  16.336 -13.800
  155    HA   LEU  18           HA       LEU  18  -6.511  17.926 -13.770
  156    HB2  LEU  18           2HB      LEU  18  -7.602  16.533 -11.901
  157    HB3  LEU  18           3HB      LEU  18  -6.564  15.226 -12.466
  158    HG   LEU  18           HG       LEU  18  -5.664  16.427 -10.500
  159   HD11  LEU  18          1HD1      LEU  18  -3.521  16.170 -11.188
  160   HD12  LEU  18          2HD1      LEU  18  -3.768  17.086 -12.675
  161   HD13  LEU  18          3HD1      LEU  18  -4.322  15.415 -12.567
  162   HD21  LEU  18          3HD2      LEU  18  -4.967  18.749 -12.218
  163   HD22  LEU  18          1HD2      LEU  18  -5.178  18.656 -10.470
  164   HD23  LEU  18          2HD2      LEU  18  -6.589  18.678 -11.528
  165    H    LYS  19           H        LYS  19  -6.874  14.606 -14.935
  166    HA   LYS  19           HA       LYS  19  -4.083  14.422 -15.671
  167    HB2  LYS  19           2HB      LYS  19  -6.452  12.591 -15.861
  168    HB3  LYS  19           3HB      LYS  19  -4.994  12.240 -16.780
  169    HG2  LYS  19           2HG      LYS  19  -3.813  12.549 -14.472
  170    HG3  LYS  19           3HG      LYS  19  -5.426  12.229 -13.832
  171    HD2  LYS  19           2HD      LYS  19  -4.763  10.076 -13.960
  172    HD3  LYS  19           3HD      LYS  19  -5.223  10.247 -15.656
  173    HE2  LYS  19           2HE      LYS  19  -2.836  10.971 -16.088
  174    HE3  LYS  19           3HE      LYS  19  -2.473  10.436 -14.448
  175    HZ1  LYS  19           3HZ      LYS  19  -2.077   8.486 -15.445
  176    HZ2  LYS  19           1HZ      LYS  19  -2.968   8.877 -16.830
  177    HZ3  LYS  19           2HZ      LYS  19  -3.759   8.307 -15.448
  178    H    ARG  20           H        ARG  20  -7.176  14.967 -17.250
  179    HA   ARG  20           HA       ARG  20  -6.485  14.628 -19.904
  180    HB2  ARG  20           2HB      ARG  20  -8.684  15.597 -18.531
  181    HB3  ARG  20           3HB      ARG  20  -8.158  16.981 -19.480
  182    HG2  ARG  20           2HG      ARG  20  -9.483  16.062 -21.043
  183    HG3  ARG  20           3HG      ARG  20  -8.059  15.070 -21.364
  184    HD2  ARG  20           2HD      ARG  20  -9.022  13.206 -20.555
  185    HD3  ARG  20           3HD      ARG  20  -9.796  14.066 -19.224
  186    HE   ARG  20           HE       ARG  20 -11.698  14.150 -20.472
  187   HH11  ARG  20          1HH1      ARG  20  -8.995  13.666 -22.612
  188   HH12  ARG  20          2HH1      ARG  20  -9.980  13.487 -24.027
  189   HH21  ARG  20          1HH2      ARG  20 -13.005  13.916 -22.327
  190   HH22  ARG  20          2HH2      ARG  20 -12.260  13.630 -23.864
  191    H    LEU  21           H        LEU  21  -6.075  17.502 -17.867
  192    HA   LEU  21           HA       LEU  21  -5.143  19.283 -19.773
  193    HB2  LEU  21           2HB      LEU  21  -5.504  19.337 -17.076
  194    HB3  LEU  21           3HB      LEU  21  -3.746  19.398 -17.194
  195    HG   LEU  21           HG       LEU  21  -5.347  21.299 -18.837
  196   HD11  LEU  21          1HD1      LEU  21  -6.362  21.368 -16.584
  197   HD12  LEU  21          2HD1      LEU  21  -5.536  22.864 -17.018
  198   HD13  LEU  21          3HD1      LEU  21  -4.772  21.725 -15.909
  199   HD21  LEU  21          3HD2      LEU  21  -3.292  22.040 -19.227
  200   HD22  LEU  21          1HD2      LEU  21  -2.618  20.903 -18.060
  201   HD23  LEU  21          2HD2      LEU  21  -3.166  22.492 -17.526
  202    H    LEU  22           H        LEU  22  -3.466  16.679 -18.132
  203    HA   LEU  22           HA       LEU  22  -0.860  17.444 -19.052
  204    HB2  LEU  22           2HB      LEU  22  -2.002  15.044 -17.681
  205    HB3  LEU  22           3HB      LEU  22  -0.371  14.993 -18.347
  206    HG   LEU  22           HG       LEU  22  -0.835  17.314 -16.642
  207   HD11  LEU  22          1HD1      LEU  22  -2.293  15.862 -15.416
  208   HD12  LEU  22          2HD1      LEU  22  -0.768  15.990 -14.539
  209   HD13  LEU  22          3HD1      LEU  22  -1.121  14.546 -15.487
  210   HD21  LEU  22          3HD2      LEU  22   1.183  15.388 -15.843
  211   HD22  LEU  22          1HD2      LEU  22   1.358  17.073 -16.334
  212   HD23  LEU  22          2HD2      LEU  22   1.291  15.802 -17.555
  213    H    ALA  23           H        ALA  23  -3.002  14.701 -19.839
  214    HA   ALA  23           HA       ALA  23  -1.563  13.612 -21.920
  215    HB1  ALA  23           1HB      ALA  23  -4.153  13.310 -20.848
  216    HB2  ALA  23           2HB      ALA  23  -4.334  13.489 -22.593
  217    HB3  ALA  23           3HB      ALA  23  -3.292  12.225 -21.940
  218    H    MET  24           H        MET  24  -3.810  16.337 -21.992
  219    HA   MET  24           HA       MET  24  -3.679  16.650 -24.837
  220    HB2  MET  24           2HB      MET  24  -5.617  17.381 -23.443
  221    HB3  MET  24           3HB      MET  24  -4.602  18.646 -22.764
  222    HG2  MET  24           2HG      MET  24  -4.576  19.864 -24.711
  223    HG3  MET  24           3HG      MET  24  -4.919  18.459 -25.718
  224    HE1  MET  24           3HE      MET  24  -7.465  21.213 -23.371
  225    HE2  MET  24           1HE      MET  24  -5.818  21.346 -23.988
  226    HE3  MET  24           2HE      MET  24  -7.184  21.739 -25.032
  227    H    LEU  25           H        LEU  25  -2.165  18.230 -22.056
  228    HA   LEU  25           HA       LEU  25  -0.852  20.288 -23.404
  229    HB2  LEU  25           2HB      LEU  25  -0.970  20.287 -21.018
  230    HB3  LEU  25           3HB      LEU  25  -0.101  18.757 -20.923
  231    HG   LEU  25           HG       LEU  25   1.873  20.027 -21.950
  232   HD11  LEU  25          1HD1      LEU  25   1.788  22.237 -22.265
  233   HD12  LEU  25          2HD1      LEU  25   0.909  22.513 -20.762
  234   HD13  LEU  25          3HD1      LEU  25   0.036  22.037 -22.218
  235   HD21  LEU  25          3HD2      LEU  25   2.718  20.258 -19.868
  236   HD22  LEU  25          1HD2      LEU  25   1.230  19.428 -19.412
  237   HD23  LEU  25          2HD2      LEU  25   1.334  21.185 -19.288
  238    H    ARG  26           H        ARG  26   0.108  16.937 -22.844
  239    HA   ARG  26           HA       ARG  26   2.605  17.355 -24.296
  240    HB2  ARG  26           2HB      ARG  26   3.195  15.115 -23.600
  241    HB3  ARG  26           3HB      ARG  26   2.603  16.016 -22.211
  242    HG2  ARG  26           2HG      ARG  26   0.314  14.894 -22.919
  243    HG3  ARG  26           3HG      ARG  26   1.408  13.703 -23.626
  244    HD2  ARG  26           2HD      ARG  26   2.569  13.641 -21.374
  245    HD3  ARG  26           3HD      ARG  26   1.198  14.559 -20.751
  246    HE   ARG  26           HE       ARG  26   0.408  12.188 -22.148
  247   HH11  ARG  26          1HH1      ARG  26   1.525  13.443 -19.098
  248   HH12  ARG  26          2HH1      ARG  26   0.827  12.160 -18.166
  249   HH21  ARG  26          1HH2      ARG  26  -0.515  10.493 -20.932
  250   HH22  ARG  26          2HH2      ARG  26  -0.332  10.482 -19.210
  251    H    GLN  27           H        GLN  27   0.318  17.715 -25.847
  252    HA   GLN  27           HA       GLN  27   0.003  15.262 -27.401
  253    HB2  GLN  27           2HB      GLN  27  -1.868  16.282 -28.429
  254    HB3  GLN  27           3HB      GLN  27  -1.963  16.718 -26.728
  255    HG2  GLN  27           2HG      GLN  27  -2.196  18.817 -27.390
  256    HG3  GLN  27           3HG      GLN  27  -0.497  18.770 -27.860
  257   HE21  GLN  27          1HE2      GLN  27  -0.141  19.462 -29.830
  258   HE22  GLN  27          2HE2      GLN  27  -1.214  19.322 -31.176
  259    H    HIS  28           H        HIS  28   2.477  16.954 -27.349
  260    HA   HIS  28           HA       HIS  28   2.836  18.470 -29.627
  261    HB2  HIS  28           2HB      HIS  28   4.474  17.982 -27.693
  262    HB3  HIS  28           3HB      HIS  28   4.964  16.583 -28.644
  263    HD1  HIS  28           HD1      HIS  28   4.106  19.665 -30.514
  264    HD2  HIS  28           HD2      HIS  28   7.501  17.816 -28.991
  265    HE1  HIS  28           HE1      HIS  28   6.052  20.833 -31.598
  266    H    ALA  29           H        ALA  29   3.568  18.044 -31.723
  267    HA   ALA  29           HA       ALA  29   2.520  15.688 -32.917
  268    HB1  ALA  29           1HB      ALA  29   2.438  17.263 -34.510
  269    HB2  ALA  29           2HB      ALA  29   3.793  18.165 -33.829
  270    HB3  ALA  29           3HB      ALA  29   4.094  16.765 -34.857
  271    H    PHE  30           H        PHE  30   3.460  13.784 -32.464
  272    HA   PHE  30           HA       PHE  30   6.142  13.346 -31.845
  273    HB2  PHE  30           2HB      PHE  30   4.230  11.754 -31.457
  274    HB3  PHE  30           3HB      PHE  30   4.302  11.347 -33.168
  275    HD1  PHE  30           HD1      PHE  30   6.592  11.598 -30.232
  276    HD2  PHE  30           HD2      PHE  30   5.497   9.484 -33.760
  277    HE1  PHE  30           HE1      PHE  30   8.317   9.910 -29.752
  278    HE2  PHE  30           HE2      PHE  30   7.219   7.793 -33.286
  279    HZ   PHE  30           HZ       PHE  30   8.632   8.004 -31.279
  Start of MODEL   20
    1    H1   GLY   1           H        GLY   1  -8.131   1.025   2.103
    2    HA2  GLY   1           2HA      GLY   1  -7.674   1.845  -0.347
    3    HA3  GLY   1           3HA      GLY   1  -9.336   1.584   0.161
    4    H    ILE   2           H        ILE   2  -6.799   4.074   0.128
    5    HA   ILE   2           HA       ILE   2  -8.787   6.182   0.265
    6    HB   ILE   2           HB       ILE   2  -5.843   6.575  -0.214
    7   HG12  ILE   2          2HG1      ILE   2  -7.233   6.267   2.456
    8   HG13  ILE   2          3HG1      ILE   2  -6.143   5.086   1.737
    9   HG21  ILE   2          1HG2      ILE   2  -6.349   8.673   1.106
   10   HG22  ILE   2          2HG2      ILE   2  -7.063   8.574  -0.503
   11   HG23  ILE   2          3HG2      ILE   2  -8.055   8.264   0.922
   12   HD11  ILE   2          3HD1      ILE   2  -4.457   7.061   1.713
   13   HD12  ILE   2          1HD1      ILE   2  -5.532   7.745   2.932
   14   HD13  ILE   2          2HD1      ILE   2  -4.766   6.181   3.209
   15    H    ARG   3           H        ARG   3  -8.848   7.925  -1.315
   16    HA   ARG   3           HA       ARG   3  -7.875   7.256  -3.986
   17    HB2  ARG   3           2HB      ARG   3 -10.670   7.141  -3.130
   18    HB3  ARG   3           3HB      ARG   3 -10.417   8.177  -4.529
   19    HG2  ARG   3           2HG      ARG   3  -8.981   6.029  -5.275
   20    HG3  ARG   3           3HG      ARG   3 -10.210   5.254  -4.273
   21    HD2  ARG   3           2HD      ARG   3 -10.916   7.240  -6.413
   22    HD3  ARG   3           3HD      ARG   3 -10.712   5.524  -6.763
   23    HE   ARG   3           HE       ARG   3 -12.463   5.514  -4.711
   24   HH11  ARG   3          1HH1      ARG   3 -12.370   7.220  -7.744
   25   HH12  ARG   3          2HH1      ARG   3 -14.093   7.304  -7.899
   26   HH21  ARG   3          1HH2      ARG   3 -14.733   5.618  -4.904
   27   HH22  ARG   3          2HH2      ARG   3 -15.437   6.393  -6.283
   28    H    CYS   4           H        CYS   4  -9.782   9.593  -2.093
   29    HA   CYS   4           HA       CYS   4  -8.407  11.754  -3.553
   30    HB2  CYS   4           2HB      CYS   4 -11.225  11.429  -2.662
   31    HB3  CYS   4           3HB      CYS   4 -10.532  13.044  -2.556
   32    HA   PRO   5           HA       PRO   5  -6.732  13.311   0.190
   33    HB2  PRO   5           2HB      PRO   5  -6.963  15.996  -0.134
   34    HB3  PRO   5           3HB      PRO   5  -5.806  15.015  -1.042
   35    HG2  PRO   5           2HG      PRO   5  -8.490  16.041  -1.882
   36    HG3  PRO   5           3HG      PRO   5  -6.972  15.995  -2.798
   37    HD2  PRO   5           2HD      PRO   5  -8.943  14.172  -3.151
   38    HD3  PRO   5           3HD      PRO   5  -7.224  13.771  -3.348
   39    H    LYS   6           H        LYS   6  -8.631  12.372   1.370
   40    HA   LYS   6           HA       LYS   6 -10.334  12.502   2.879
   41    HB2  LYS   6           2HB      LYS   6  -8.926  15.134   3.285
   42    HB3  LYS   6           3HB      LYS   6 -10.287  14.645   4.286
   43    HG2  LYS   6           2HG      LYS   6  -8.904  13.515   5.587
   44    HG3  LYS   6           3HG      LYS   6  -8.480  12.477   4.224
   45    HD2  LYS   6           2HD      LYS   6  -6.940  14.543   3.606
   46    HD3  LYS   6           3HD      LYS   6  -7.052  14.835   5.343
   47    HE2  LYS   6           2HE      LYS   6  -6.416  12.361   5.596
   48    HE3  LYS   6           3HE      LYS   6  -5.933  12.450   3.903
   49    HZ1  LYS   6           3HZ      LYS   6  -4.012  12.893   5.147
   50    HZ2  LYS   6           1HZ      LYS   6  -4.815  13.950   6.197
   51    HZ3  LYS   6           2HZ      LYS   6  -4.526  14.407   4.595
   52    H    SER   7           H        SER   7 -11.670  12.585   0.801
   53    HA   SER   7           HA       SER   7 -13.860  14.270   1.174
   54    HB2  SER   7           2HB      SER   7 -13.541  15.576  -1.059
   55    HB3  SER   7           3HB      SER   7 -12.737  16.164   0.396
   56    HG   SER   7           HG       SER   7 -11.661  15.260  -1.924
   57    H    TRP   8           H        TRP   8 -15.438  13.004   0.484
   58    HA   TRP   8           HA       TRP   8 -14.957  11.004  -1.546
   59    HB2  TRP   8           2HB      TRP   8 -17.239  11.647   0.295
   60    HB3  TRP   8           3HB      TRP   8 -17.483  10.557  -1.068
   61    HD1  TRP   8           HD1      TRP   8 -14.277  10.590   1.064
   62    HE1  TRP   8           HE1      TRP   8 -14.061   8.307   2.233
   63    HE3  TRP   8           HE3      TRP   8 -18.762   8.551  -0.301
   64    HZ2  TRP   8           HZ2      TRP   8 -15.589   5.953   2.535
   65    HZ3  TRP   8           HZ3      TRP   8 -19.308   6.278   0.469
   66    HH2  TRP   8           HH2      TRP   8 -17.752   5.008   1.858
   67    H    LYS   9           H        LYS   9 -14.521  12.929  -3.069
   68    HA   LYS   9           HA       LYS   9 -17.033  13.531  -4.484
   69    HB2  LYS   9           2HB      LYS   9 -14.730  15.355  -3.850
   70    HB3  LYS   9           3HB      LYS   9 -15.771  15.665  -5.233
   71    HG2  LYS   9           2HG      LYS   9 -17.715  15.582  -3.612
   72    HG3  LYS   9           3HG      LYS   9 -16.510  15.631  -2.324
   73    HD2  LYS   9           2HD      LYS   9 -15.790  17.665  -4.107
   74    HD3  LYS   9           3HD      LYS   9 -17.544  17.775  -3.947
   75    HE2  LYS   9           2HE      LYS   9 -17.063  17.558  -1.404
   76    HE3  LYS   9           3HE      LYS   9 -15.426  18.039  -1.848
   77    HZ1  LYS   9           3HZ      LYS   9 -17.212  19.769  -3.121
   78    HZ2  LYS   9           1HZ      LYS   9 -16.102  20.130  -1.897
   79    HZ3  LYS   9           2HZ      LYS   9 -17.678  19.666  -1.498
   80    H    CYS  10           H        CYS  10 -13.600  14.138  -5.187
   81    HA   CYS  10           HA       CYS  10 -12.341  13.685  -7.032
   82    HB2  CYS  10           2HB      CYS  10 -13.864  11.079  -7.111
   83    HB3  CYS  10           3HB      CYS  10 -12.231  11.385  -7.692
   84    H    LYS  11           H        LYS  11 -13.980  15.392  -7.918
   85    HA   LYS  11           HA       LYS  11 -16.025  14.783  -9.665
   86    HB2  LYS  11           2HB      LYS  11 -14.464  17.069  -9.022
   87    HB3  LYS  11           3HB      LYS  11 -14.516  16.945 -10.775
   88    HG2  LYS  11           2HG      LYS  11 -16.968  16.846 -10.680
   89    HG3  LYS  11           3HG      LYS  11 -16.892  17.025  -8.926
   90    HD2  LYS  11           2HD      LYS  11 -15.325  19.087 -10.095
   91    HD3  LYS  11           3HD      LYS  11 -16.885  19.051 -10.919
   92    HE2  LYS  11           2HE      LYS  11 -17.896  18.953  -8.559
   93    HE3  LYS  11           3HE      LYS  11 -16.302  19.463  -8.004
   94    HZ1  LYS  11           3HZ      LYS  11 -16.526  21.370  -9.591
   95    HZ2  LYS  11           1HZ      LYS  11 -17.590  21.404  -8.276
   96    HZ3  LYS  11           2HZ      LYS  11 -18.146  20.930  -9.801
   97    H    ALA  12           H        ALA  12 -16.069  13.526 -11.397
   98    HA   ALA  12           HA       ALA  12 -13.909  12.356 -12.651
   99    HB1  ALA  12           1HB      ALA  12 -16.686  12.320 -12.959
  100    HB2  ALA  12           2HB      ALA  12 -16.039  12.744 -14.545
  101    HB3  ALA  12           3HB      ALA  12 -15.507  11.267 -13.742
  102    H    PHE  13           H        PHE  13 -15.577  15.362 -13.488
  103    HA   PHE  13           HA       PHE  13 -14.262  15.885 -15.903
  104    HB2  PHE  13           2HB      PHE  13 -16.294  17.078 -14.877
  105    HB3  PHE  13           3HB      PHE  13 -15.122  18.040 -13.982
  106    HD1  PHE  13           HD2      PHE  13 -15.202  16.816 -17.503
  107    HD2  PHE  13           HD1      PHE  13 -15.060  20.156 -14.869
  108    HE1  PHE  13           HE2      PHE  13 -14.974  18.325 -19.434
  109    HE2  PHE  13           HE1      PHE  13 -14.833  21.670 -16.795
  110    HZ   PHE  13           HZ       PHE  13 -14.788  20.755 -19.081
  111    H    LYS  14           H        LYS  14 -13.607  17.446 -12.762
  112    HA   LYS  14           HA       LYS  14 -11.230  18.679 -13.453
  113    HB2  LYS  14           2HB      LYS  14 -12.432  19.136 -11.366
  114    HB3  LYS  14           3HB      LYS  14 -12.011  17.538 -10.763
  115    HG2  LYS  14           2HG      LYS  14  -9.775  18.098 -10.473
  116    HG3  LYS  14           3HG      LYS  14  -9.884  19.487 -11.558
  117    HD2  LYS  14           2HD      LYS  14 -11.492  20.487  -9.856
  118    HD3  LYS  14           3HD      LYS  14 -10.954  19.212  -8.760
  119    HE2  LYS  14           2HE      LYS  14  -9.025  21.052 -10.148
  120    HE3  LYS  14           3HE      LYS  14  -9.772  21.468  -8.606
  121    HZ1  LYS  14           3HZ      LYS  14  -8.018  19.143  -9.171
  122    HZ2  LYS  14           1HZ      LYS  14  -8.863  19.354  -7.720
  123    HZ3  LYS  14           2HZ      LYS  14  -7.673  20.466  -8.175
  124    H    GLN  15           H        GLN  15 -11.715  15.438 -12.087
  125    HA   GLN  15           HA       GLN  15  -9.071  14.689 -11.753
  126    HB2  GLN  15           2HB      GLN  15 -11.522  13.092 -12.467
  127    HB3  GLN  15           3HB      GLN  15  -9.957  12.328 -12.219
  128    HG2  GLN  15           2HG      GLN  15 -11.050  14.145 -10.125
  129    HG3  GLN  15           3HG      GLN  15 -11.670  12.501 -10.267
  130   HE21  GLN  15          1HE2      GLN  15 -10.004  13.920  -8.215
  131   HE22  GLN  15          2HE2      GLN  15  -8.636  12.891  -7.980
  132    H    ARG  16           H        ARG  16 -11.087  14.502 -14.659
  133    HA   ARG  16           HA       ARG  16  -9.087  13.245 -16.257
  134    HB2  ARG  16           2HB      ARG  16 -11.819  14.000 -16.544
  135    HB3  ARG  16           3HB      ARG  16 -10.922  14.697 -17.887
  136    HG2  ARG  16           2HG      ARG  16 -11.268  12.712 -18.855
  137    HG3  ARG  16           3HG      ARG  16  -9.925  12.175 -17.844
  138    HD2  ARG  16           2HD      ARG  16 -11.698  11.664 -16.075
  139    HD3  ARG  16           3HD      ARG  16 -12.873  11.844 -17.377
  140    HE   ARG  16           HE       ARG  16 -12.272   9.777 -18.121
  141   HH11  ARG  16          1HH1      ARG  16  -9.697  11.033 -16.142
  142   HH12  ARG  16          2HH1      ARG  16  -8.762   9.576 -16.205
  143   HH21  ARG  16          1HH2      ARG  16 -11.049   7.853 -18.211
  144   HH22  ARG  16          2HH2      ARG  16  -9.532   7.768 -17.383
  145    H    VAL  17           H        VAL  17 -10.225  16.589 -15.914
  146    HA   VAL  17           HA       VAL  17  -8.734  17.811 -17.891
  147    HB   VAL  17           HB       VAL  17  -9.360  18.932 -15.155
  148   HG11  VAL  17          1HG1      VAL  17  -9.212  21.124 -16.318
  149   HG12  VAL  17          2HG1      VAL  17  -7.673  20.267 -16.225
  150   HG13  VAL  17          3HG1      VAL  17  -8.583  20.284 -17.735
  151   HG21  VAL  17          3HG2      VAL  17 -11.115  18.112 -17.146
  152   HG22  VAL  17          1HG2      VAL  17 -11.477  19.188 -15.796
  153   HG23  VAL  17          2HG2      VAL  17 -10.997  19.859 -17.355
  154    H    LEU  18           H        LEU  18  -7.746  16.841 -14.650
  155    HA   LEU  18           HA       LEU  18  -5.304  18.132 -14.459
  156    HB2  LEU  18           2HB      LEU  18  -6.459  16.761 -12.700
  157    HB3  LEU  18           3HB      LEU  18  -5.844  15.324 -13.515
  158    HG   LEU  18           HG       LEU  18  -3.519  16.332 -13.132
  159   HD11  LEU  18          1HD1      LEU  18  -3.297  17.888 -11.312
  160   HD12  LEU  18          2HD1      LEU  18  -5.043  17.912 -11.067
  161   HD13  LEU  18          3HD1      LEU  18  -4.351  18.587 -12.541
  162   HD21  LEU  18          3HD2      LEU  18  -3.449  15.449 -10.824
  163   HD22  LEU  18          1HD2      LEU  18  -4.289  14.379 -11.947
  164   HD23  LEU  18          2HD2      LEU  18  -5.212  15.379 -10.825
  165    H    LYS  19           H        LYS  19  -6.056  15.015 -15.972
  166    HA   LYS  19           HA       LYS  19  -3.325  14.632 -16.831
  167    HB2  LYS  19           2HB      LYS  19  -5.882  13.095 -17.205
  168    HB3  LYS  19           3HB      LYS  19  -4.433  12.678 -18.111
  169    HG2  LYS  19           2HG      LYS  19  -3.260  12.074 -16.176
  170    HG3  LYS  19           3HG      LYS  19  -4.423  12.877 -15.118
  171    HD2  LYS  19           2HD      LYS  19  -6.091  11.224 -15.592
  172    HD3  LYS  19           3HD      LYS  19  -5.085  10.497 -16.848
  173    HE2  LYS  19           2HE      LYS  19  -4.502  10.564 -13.889
  174    HE3  LYS  19           3HE      LYS  19  -5.005   9.159 -14.826
  175    HZ1  LYS  19           3HZ      LYS  19  -2.763   8.852 -14.790
  176    HZ2  LYS  19           1HZ      LYS  19  -2.406  10.505 -14.744
  177    HZ3  LYS  19           2HZ      LYS  19  -2.879   9.782 -16.198
  178    H    ARG  20           H        ARG  20  -6.367  15.700 -18.220
  179    HA   ARG  20           HA       ARG  20  -5.793  15.582 -20.922
  180    HB2  ARG  20           2HB      ARG  20  -7.863  16.545 -19.436
  181    HB3  ARG  20           3HB      ARG  20  -7.172  18.039 -20.057
  182    HG2  ARG  20           2HG      ARG  20  -7.512  15.926 -22.060
  183    HG3  ARG  20           3HG      ARG  20  -9.011  16.527 -21.349
  184    HD2  ARG  20           2HD      ARG  20  -8.313  18.828 -21.893
  185    HD3  ARG  20           3HD      ARG  20  -6.862  18.185 -22.662
  186    HE   ARG  20           HE       ARG  20  -9.012  16.927 -23.863
  187   HH11  ARG  20          1HH1      ARG  20  -7.814  20.176 -23.505
  188   HH12  ARG  20          2HH1      ARG  20  -8.473  20.724 -25.011
  189   HH21  ARG  20          1HH2      ARG  20  -9.885  17.636 -25.847
  190   HH22  ARG  20          2HH2      ARG  20  -9.651  19.279 -26.342
  191    H    LEU  21           H        LEU  21  -4.986  18.138 -18.600
  192    HA   LEU  21           HA       LEU  21  -3.902  20.005 -20.336
  193    HB2  LEU  21           2HB      LEU  21  -4.088  19.671 -17.582
  194    HB3  LEU  21           3HB      LEU  21  -2.358  19.790 -17.896
  195    HG   LEU  21           HG       LEU  21  -3.223  21.965 -17.344
  196   HD11  LEU  21          1HD1      LEU  21  -2.926  22.188 -20.292
  197   HD12  LEU  21          2HD1      LEU  21  -1.591  21.509 -19.362
  198   HD13  LEU  21          3HD1      LEU  21  -2.179  23.132 -19.003
  199   HD21  LEU  21          3HD2      LEU  21  -5.287  22.578 -17.874
  200   HD22  LEU  21          1HD2      LEU  21  -5.488  21.095 -18.808
  201   HD23  LEU  21          2HD2      LEU  21  -4.868  22.551 -19.588
  202    H    LEU  22           H        LEU  22  -2.509  17.052 -19.066
  203    HA   LEU  22           HA       LEU  22   0.147  17.612 -19.998
  204    HB2  LEU  22           2HB      LEU  22  -1.236  15.221 -18.849
  205    HB3  LEU  22           3HB      LEU  22   0.358  15.056 -19.582
  206    HG   LEU  22           HG       LEU  22   0.557  15.253 -17.181
  207   HD11  LEU  22          1HD1      LEU  22   1.903  16.801 -19.050
  208   HD12  LEU  22          2HD1      LEU  22   2.424  16.435 -17.406
  209   HD13  LEU  22          3HD1      LEU  22   1.528  17.917 -17.736
  210   HD21  LEU  22          3HD2      LEU  22  -1.633  16.686 -17.112
  211   HD22  LEU  22          1HD2      LEU  22  -0.507  18.038 -17.232
  212   HD23  LEU  22          2HD2      LEU  22  -0.382  16.904 -15.887
  213    H    ALA  23           H        ALA  23  -2.332  15.244 -20.992
  214    HA   ALA  23           HA       ALA  23  -1.099  14.222 -23.227
  215    HB1  ALA  23           1HB      ALA  23  -2.993  13.071 -23.256
  216    HB2  ALA  23           2HB      ALA  23  -3.728  14.219 -22.136
  217    HB3  ALA  23           3HB      ALA  23  -3.838  14.489 -23.875
  218    H    MET  24           H        MET  24  -2.962  17.210 -22.935
  219    HA   MET  24           HA       MET  24  -2.800  17.812 -25.739
  220    HB2  MET  24           2HB      MET  24  -4.678  18.603 -24.362
  221    HB3  MET  24           3HB      MET  24  -3.568  19.575 -23.406
  222    HG2  MET  24           2HG      MET  24  -3.209  20.222 -26.153
  223    HG3  MET  24           3HG      MET  24  -4.929  20.277 -25.773
  224    HE1  MET  24           3HE      MET  24  -5.204  22.971 -23.042
  225    HE2  MET  24           1HE      MET  24  -6.058  21.949 -24.199
  226    HE3  MET  24           2HE      MET  24  -5.188  21.217 -22.851
  227    H    LEU  25           H        LEU  25  -1.106  18.825 -22.812
  228    HA   LEU  25           HA       LEU  25   0.389  20.931 -23.792
  229    HB2  LEU  25           2HB      LEU  25   0.468  20.483 -21.481
  230    HB3  LEU  25           3HB      LEU  25   1.012  18.827 -21.742
  231    HG   LEU  25           HG       LEU  25   3.202  19.601 -22.392
  232   HD11  LEU  25          1HD1      LEU  25   3.628  22.133 -22.018
  233   HD12  LEU  25          2HD1      LEU  25   1.895  22.287 -22.306
  234   HD13  LEU  25          3HD1      LEU  25   2.935  21.584 -23.545
  235   HD21  LEU  25          3HD2      LEU  25   2.866  21.294 -20.021
  236   HD22  LEU  25          1HD2      LEU  25   3.900  19.889 -20.279
  237   HD23  LEU  25          2HD2      LEU  25   2.199  19.668 -19.867
  238    H    ARG  26           H        ARG  26   1.361  17.501 -23.687
  239    HA   ARG  26           HA       ARG  26   3.150  18.045 -25.963
  240    HB2  ARG  26           2HB      ARG  26   3.665  16.406 -23.490
  241    HB3  ARG  26           3HB      ARG  26   4.583  16.163 -24.970
  242    HG2  ARG  26           2HG      ARG  26   4.489  18.955 -24.242
  243    HG3  ARG  26           3HG      ARG  26   5.137  17.963 -22.934
  244    HD2  ARG  26           2HD      ARG  26   7.002  18.552 -24.232
  245    HD3  ARG  26           3HD      ARG  26   6.626  16.894 -24.699
  246    HE   ARG  26           HE       ARG  26   5.376  18.848 -26.383
  247   HH11  ARG  26          1HH1      ARG  26   8.302  17.056 -25.794
  248   HH12  ARG  26          2HH1      ARG  26   8.853  17.165 -27.434
  249   HH21  ARG  26          1HH2      ARG  26   6.090  18.998 -28.544
  250   HH22  ARG  26          2HH2      ARG  26   7.595  18.271 -28.996
  251    H    GLN  27           H        GLN  27   2.282  15.066 -24.237
  252    HA   GLN  27           HA       GLN  27   0.407  14.087 -26.054
  253    HB2  GLN  27           2HB      GLN  27   1.907  12.346 -27.167
  254    HB3  GLN  27           3HB      GLN  27   2.014  13.994 -27.772
  255    HG2  GLN  27           2HG      GLN  27   4.174  14.100 -27.309
  256    HG3  GLN  27           3HG      GLN  27   3.904  13.575 -25.648
  257   HE21  GLN  27          1HE2      GLN  27   4.681  12.583 -28.881
  258   HE22  GLN  27          2HE2      GLN  27   5.207  10.986 -28.485
  259    H    HIS  28           H        HIS  28   0.981  14.107 -23.244
  260    HA   HIS  28           HA       HIS  28   1.961  11.762 -22.171
  261    HB2  HIS  28           2HB      HIS  28   1.204  13.773 -20.884
  262    HB3  HIS  28           3HB      HIS  28  -0.459  13.258 -21.148
  263    HD1  HIS  28           HD1      HIS  28   2.721  11.934 -19.544
  264    HD2  HIS  28           HD2      HIS  28  -1.407  11.581 -19.237
  265    HE1  HIS  28           HE1      HIS  28   2.318  10.493 -17.523
  266    H    ALA  29           H        ALA  29   1.016   9.798 -21.519
  267    HA   ALA  29           HA       ALA  29  -0.675   8.581 -23.396
  268    HB1  ALA  29           1HB      ALA  29   0.041   7.709 -20.600
  269    HB2  ALA  29           2HB      ALA  29  -0.757   6.694 -21.802
  270    HB3  ALA  29           3HB      ALA  29   0.881   7.281 -22.090
  271    H    PHE  30           H        PHE  30  -2.779   7.562 -22.965
  272    HA   PHE  30           HA       PHE  30  -4.745   9.387 -22.296
  273    HB2  PHE  30           2HB      PHE  30  -5.087   7.290 -23.610
  274    HB3  PHE  30           3HB      PHE  30  -5.000   6.379 -22.106
  275    HD1  PHE  30           HD1      PHE  30  -6.922   9.009 -23.870
  276    HD2  PHE  30           HD2      PHE  30  -6.891   6.098 -20.765
  277    HE1  PHE  30           HE1      PHE  30  -9.336   9.346 -23.535
  278    HE2  PHE  30           HE2      PHE  30  -9.305   6.430 -20.425
  279    HZ   PHE  30           HZ       PHE  30 -10.531   8.055 -21.812