*HEADER    REPLICATION, HYDROLASE                  02-AUG-06   2HWT              
*TITLE     NMR SOLUTION STRUCTURE OF THE MASTER-REP PROTEIN NUCLEASE             
*TITLE    2 DOMAIN (2-95) FROM THE FABA BEAN NECROTIC YELLOWS VIRUS              
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: PUTATIVE REPLICASE-ASSOCIATED PROTEIN;                     
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: NUCLEASE DOMAIN (RESIDUES 2-95);                           
*COMPND   5 EC: 3.1.21.-;                                                        
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: FABA BEAN NECROTIC YELLOWS VIRUS;               
*SOURCE   3 ORGANISM_COMMON: VIRUS;                                              
*SOURCE   4 GENE: C2 COMPONENT 2;                                                
*SOURCE   5 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   6 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   7 EXPRESSION_SYSTEM_STRAIN: ROSETTA (DE3) PLYSS;                       
*SOURCE   8 EXPRESSION_SYSTEM_VECTOR_TYPE: PLASMID;                              
*SOURCE   9 EXPRESSION_SYSTEM_PLASMID: PET3A                                     
*KEYWDS    ALPHA, BETA                                                           
*EXPDTA    NMR, 31 STRUCTURES                                                    
*AUTHOR    S.VEGA-ROCHA, B.GRONENBORN, A.M.GRONENBORN, R.CAMPOS-OLIVAS           
*REVDAT   1   26-JUN-07 2HWT    0                                                

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#########UPPER LIMIT CONSTRAINTS#################
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  3 ARG  HA      4 GLN  H       3.27 
  4 GLN  H       4 GLN  HB2     3.76 
  4 GLN  H       4 GLN  HB3     3.92 
  4 GLN  H       4 GLN  HG2     5.50 
  4 GLN  H       4 GLN  HG3     5.50 
  4 GLN  HB2     4 GLN  HE21    5.50 
  4 GLN  HB3     4 GLN  HE21    5.50 
  5 VAL  H       5 VAL  QG2     6.53 
  5 VAL  HA      6 ILE  H       2.90 
  5 VAL  HA      8 TRP  HZ2     8.40            #peak   683
  5 VAL  HB      6 ILE  H       3.14 
  5 VAL  HB      8 TRP  HZ2     6.50            #peak   379
  5 VAL  QG1     6 ILE  H       5.00 
  5 VAL  QG1     8 TRP  HZ2     6.53            #peak   196
  5 VAL  QG2     6 ILE  H       6.53 
  5 VAL  QG2     8 TRP  HZ2     6.53            #peak   193
  6 ILE  H       6 ILE  HB      3.02 
  6 ILE  H       6 ILE  HG12    4.60 
  6 ILE  H       6 ILE  HG13    4.88 
  6 ILE  H       6 ILE  QG2     6.53 
  6 ILE  H       6 ILE  QD1     5.00 
  6 ILE  HA      8 TRP  HD1     6.00            #peak   487
  6 ILE  HG12   70 ARG  QG      5.00 
  6 ILE  HG12   70 ARG  QD      5.00 
  6 ILE  HG12   73 GLN  H       5.80 
  6 ILE  QD1    50 LYS  HA      6.30 
  6 ILE  QD1    70 ARG  QG      5.00 
  6 ILE  QD1    70 ARG  QD      5.00 
  7 CYS  HA      8 TRP  H       3.27 
  7 CYS  HA      8 TRP  HD1     5.50            #peak   449
  7 CYS  HA     45 TYR  QD      7.64            #peak   484
  7 CYS  HA     45 TYR  QE      7.63            #peak   150
  7 CYS  HA     47 GLU  HA      3.30 
  7 CYS  HA     48 MET  H       5.00 
  7 CYS  HB2     8 TRP  H       3.30 
  7 CYS  HB3     8 TRP  H       4.07 
  8 TRP  H       8 TRP  HD1     5.50 
  8 TRP  H       9 CYS  H       4.57 
  8 TRP  H      46 ILE  H       4.23 
  8 TRP  H      46 ILE  HB      5.50 
  8 TRP  H      46 ILE  QG2     5.50 
  8 TRP  H      47 GLU  HA      5.00 
  8 TRP  HA      8 TRP  HD1     5.50            #peak   685
  8 TRP  HA      8 TRP  HE3     5.50            #peak   123
  8 TRP  HA      8 TRP  HZ3     6.00            #peak   448
  8 TRP  HA      9 CYS  H       2.90 
  8 TRP  HA     66 PHE  QD      7.62            #peak   135
  8 TRP  HA     68 LYS  HA      3.30 
  8 TRP  HB2     8 TRP  HZ3     6.20            #peak   464
  8 TRP  HB2     9 CYS  H       5.50 
  8 TRP  HB2    66 PHE  QD      7.62            #peak    84
  8 TRP  HB3     9 CYS  H       3.70 
  8 TRP  HB3    66 PHE  HZ      5.50            #peak   418
  8 TRP  HD1     9 CYS  H       6.00 
  8 TRP  HD1    47 GLU  QG      6.38            #peak    33
  8 TRP  HD1    48 MET  HA      5.50            #peak   681
  8 TRP  HD1    52 THR  HB      6.50            #peak   488
  8 TRP  HD1    57 MET  HG2     5.50            #peak   539
  8 TRP  HD1    57 MET  HG3     5.50            #peak   252
  8 TRP  HE1    68 LYS  H       8.00 
  8 TRP  HE3    46 ILE  HB      6.00            #peak   384
  8 TRP  HE3    54 LEU  HA      5.50            #peak    70
  8 TRP  HE3    54 LEU  HB3     6.00            #peak   385
  8 TRP  HE3    54 LEU  QD1     6.53            #peak   207
  8 TRP  HE3    54 LEU  QD2     6.53            #peak   528
  8 TRP  HE3    57 MET  HA      6.50            #peak   529
  8 TRP  HE3    57 MET  HB2     5.50            #peak   210
  8 TRP  HE3    57 MET  HB3     5.50            #peak   627
  8 TRP  HE3    57 MET  HG2     5.50            #peak   211
  8 TRP  HE3    57 MET  HG3     5.50            #peak   208
  8 TRP  HE3    66 PHE  HA      5.50 
  8 TRP  HE3    66 PHE  HB3     5.22            #peak   394
  8 TRP  HE3    66 PHE  QD      7.62            #peak   429
  8 TRP  HE3    66 PHE  HZ      6.00            #peak   431
  8 TRP  HE3    67 GLU  H       5.00 
  8 TRP  HE3    67 GLU  HA      5.50            #peak   412
  8 TRP  HE3    68 LYS  HA      5.50            #peak    72
  8 TRP  HE3    68 LYS  HB3     5.50            #peak   212
  8 TRP  HE3    68 LYS  QD      6.38            #peak   206
  8 TRP  HZ2    52 THR  HB      5.50            #peak   400
  8 TRP  HZ2    53 SER  HA      5.50            #peak   120
  8 TRP  HZ2    53 SER  HB2     5.50            #peak   121
  8 TRP  HZ2    53 SER  HB3     5.50            #peak   399
  8 TRP  HZ2    54 LEU  H       5.50 
  8 TRP  HZ2    54 LEU  HA      5.50            #peak   390
  8 TRP  HZ2    54 LEU  HB2     5.50            #peak   378
  8 TRP  HZ2    57 MET  HG2     5.50            #peak   197
  8 TRP  HZ2    57 MET  HG3     5.50            #peak   190
  8 TRP  HZ2    68 LYS  QG      6.38            #peak   192
  8 TRP  HZ2    68 LYS  QD      6.38            #peak   194
  8 TRP  HZ2    68 LYS  QE      6.38            #peak   393
  8 TRP  HZ3    54 LEU  HA      5.38            #peak   463
  8 TRP  HZ3    54 LEU  HB2     5.50            #peak    35
  8 TRP  HZ3    54 LEU  HB3     5.50            #peak   613
  8 TRP  HZ3    54 LEU  QD1     5.00 
  8 TRP  HZ3    54 LEU  QD2     6.53            #peak   258
  8 TRP  HZ3    57 MET  HB2     5.50            #peak   257
  8 TRP  HZ3    57 MET  HG2     5.50            #peak   541
  8 TRP  HZ3    57 MET  HG3     5.50            #peak   255
  8 TRP  HZ3    66 PHE  HA      6.40            #peak   655
  8 TRP  HZ3    66 PHE  HB3     5.50            #peak    34
  8 TRP  HZ3    67 GLU  HA      5.50            #peak   138
  8 TRP  HZ3    68 LYS  H       5.50 
  8 TRP  HZ3    68 LYS  HA      5.50            #peak   417
  8 TRP  HZ3    68 LYS  HB3     5.50            #peak   679
  8 TRP  HZ3    68 LYS  QD      6.38            #peak   254
  8 TRP  HZ3    68 LYS  QE      6.38            #peak   548
  8 TRP  HH2    53 SER  HA      5.50            #peak   485
  8 TRP  HH2    53 SER  HB2     5.50            #peak   486
  8 TRP  HH2    54 LEU  HA      4.94            #peak    88
  8 TRP  HH2    54 LEU  HB2     5.25            #peak    31
  8 TRP  HH2    54 LEU  HB3     4.69            #peak    32
  8 TRP  HH2    54 LEU  QD1     5.00 
  8 TRP  HH2    54 LEU  QD2     5.00 
  8 TRP  HH2    57 MET  HB2     5.50            #peak   251
  8 TRP  HH2    57 MET  HG2     5.50            #peak   538
  8 TRP  HH2    57 MET  HG3     5.50            #peak   246
  8 TRP  HH2    68 LYS  QD      6.38            #peak   248
  8 TRP  HH2    68 LYS  QE      6.38            #peak    30
  9 CYS  H       9 CYS  HB3     3.55 
  9 CYS  H      10 PHE  H       5.50 
  9 CYS  H      67 GLU  H       4.42 
  9 CYS  H      68 LYS  HA      5.00 
  9 CYS  HA     10 PHE  H       2.90 
  9 CYS  HA     45 TYR  HA      5.00 
  9 CYS  HA     45 TYR  QD      7.64            #peak     3
  9 CYS  HA     45 TYR  QE      7.63            #peak   690
  9 CYS  HA     46 ILE  H       4.48 
  9 CYS  HB2    10 PHE  H       4.82 
  9 CYS  HB3    10 PHE  H       5.28 
  9 CYS  HB3    45 TYR  QD      7.64            #peak    87
  9 CYS  HB3    45 TYR  QE      7.63            #peak   107
 10 PHE  H      11 THR  H       5.50 
 10 PHE  H      44 GLY  H       4.01 
 10 PHE  H      45 TYR  HA      5.00 
 10 PHE  H      66 PHE  QE      7.62 
 10 PHE  H      67 GLU  H       5.00 
 10 PHE  HA     10 PHE  QD      7.62            #peak    10
 10 PHE  HA     11 THR  H       2.90 
 10 PHE  HA     11 THR  QG2     6.53            #peak   495
 10 PHE  HA     46 ILE  QD1     6.53            #peak   496
 10 PHE  HA     64 ALA  QB      5.00 
 10 PHE  HA     65 HIS  H       5.50 
 10 PHE  HA     66 PHE  HA      3.30 
 10 PHE  HA     66 PHE  HB2     5.50            #peak   438
 10 PHE  HA     66 PHE  QD      7.62            #peak   161
 10 PHE  HA     66 PHE  QE      7.62            #peak   162
 10 PHE  HA     67 GLU  H       4.26 
 10 PHE  QB     64 ALA  QB      7.00 
 10 PHE  HB2    11 THR  H       4.50 
 10 PHE  HB2    66 PHE  HA      5.50 
 10 PHE  HB2    66 PHE  QD      7.62            #peak   618
 10 PHE  HB2    66 PHE  QE      7.62            #peak   671
 10 PHE  HB2    66 PHE  HZ      5.50            #peak   670
 10 PHE  HB3    11 THR  H       4.00 
 10 PHE  HB3    66 PHE  HA      5.50 
 10 PHE  HB3    66 PHE  QD      7.62            #peak    28
 10 PHE  HB3    66 PHE  QE      7.25            #peak    67
 10 PHE  HB3    66 PHE  HZ      5.50            #peak    46
 10 PHE  QD     11 THR  H       5.50 
 10 PHE  QD     11 THR  HA      7.62            #peak   157
 10 PHE  QD     12 LEU  HG      7.62            #peak   669
 10 PHE  QD     19 LEU  QD1     8.65            #peak   304
 10 PHE  QD     19 LEU  QD2     5.50 
 10 PHE  QD     28 LEU  QD1     8.65            #peak   297
 10 PHE  QD     30 TYR  HA      7.62            #peak   665
 10 PHE  QD     30 TYR  HB3     7.62            #peak    65
 10 PHE  QD     42 PHE  HB2     7.62            #peak   562
 10 PHE  QD     42 PHE  HB3     7.62            #peak   116
 10 PHE  QD     61 ILE  HB      7.28            #peak    63
 10 PHE  QD     61 ILE  HG12    7.62            #peak   296
 10 PHE  QD     61 ILE  QG2     5.00 
 10 PHE  QD     61 ILE  QD1     8.65            #peak   299
 10 PHE  QD     63 GLY  H       7.62            #peak   586
 10 PHE  QD     64 ALA  H       5.50 
 10 PHE  QD     64 ALA  HA      7.62            #peak   154
 10 PHE  QD     66 PHE  QE      5.50 
 10 PHE  QE     11 THR  H       7.62            #peak   584
 10 PHE  QE     11 THR  HA      6.00 
 10 PHE  QE     12 LEU  H       7.62 
 10 PHE  QE     12 LEU  HG      7.62            #peak   259
 10 PHE  QE     19 LEU  QD1     5.00 
 10 PHE  QE     19 LEU  QD2     5.00 
 10 PHE  QE     28 LEU  QD1     8.37            #peak   260
 10 PHE  QE     30 TYR  HA      7.62            #peak     4
 10 PHE  QE     30 TYR  HB3     7.62            #peak    37
 10 PHE  QE     42 PHE  HA      7.62            #peak   482
 10 PHE  QE     42 PHE  HB2     7.62            #peak    92
 10 PHE  QE     42 PHE  HB3     7.62            #peak    93
 10 PHE  QE     42 PHE  QD      9.74            #peak   520
 10 PHE  QE     42 PHE  QE      9.74            #peak   426
 10 PHE  QE     57 MET  HG3     7.62            #peak   264
 10 PHE  QE     61 ILE  HB      7.62            #peak    36
 10 PHE  QE     61 ILE  HG12    7.62            #peak   265
 10 PHE  QE     61 ILE  QG2     5.00 
 10 PHE  QE     61 ILE  QD1     5.00 
 10 PHE  QE     64 ALA  HA      7.62            #peak   594
 10 PHE  QE     66 PHE  H       7.62 
 10 PHE  QE     66 PHE  QD      9.74            #peak   661
 10 PHE  QE     66 PHE  QE      5.00 
 10 PHE  QE     67 GLU  H       7.62 
 10 PHE  HZ     12 LEU  HB2     5.50            #peak   493
 10 PHE  HZ     12 LEU  HB3     5.50            #peak   305
 10 PHE  HZ     12 LEU  HG      6.00            #peak   557
 10 PHE  HZ     19 LEU  QB      6.38            #peak   518
 10 PHE  HZ     19 LEU  QD1     5.29            #peak   309
 10 PHE  HZ     19 LEU  QD2     6.00 
 10 PHE  HZ     28 LEU  QD1     6.16            #peak   307
 10 PHE  HZ     30 TYR  HA      6.00            #peak   481
 10 PHE  HZ     30 TYR  HB2     5.50            #peak   658
 10 PHE  HZ     30 TYR  HB3     5.50            #peak    68
 10 PHE  HZ     42 PHE  HB3     5.50            #peak   563
 10 PHE  HZ     42 PHE  QD      7.62            #peak   592
 10 PHE  HZ     44 GLY  QA      6.38            #peak   480
 10 PHE  HZ     61 ILE  HB      5.50            #peak   492
 10 PHE  HZ     61 ILE  QG2     5.00 
 10 PHE  HZ     61 ILE  QD1     5.00 
 10 PHE  HZ     66 PHE  QE      5.00 
 11 THR  H      11 THR  HB      3.61 
 11 THR  H      11 THR  QG2     6.12 
 11 THR  H      12 LEU  H       5.50 
 11 THR  H      64 ALA  QB      5.00 
 11 THR  H      65 HIS  H       3.92 
 11 THR  H      65 HIS  QB      5.00 
 11 THR  H      65 HIS  HB2     5.50 
 11 THR  H      66 PHE  HA      4.20 
 11 THR  H      66 PHE  QE      5.30 
 11 THR  H      66 PHE  HZ      6.50 
 11 THR  HA     12 LEU  H       2.90 
 11 THR  HA     43 GLN  H       5.47 
 11 THR  HA     43 GLN  HA      3.30 
 11 THR  HA     44 GLY  H       4.30 
 11 THR  HB     12 LEU  H       4.00 
 11 THR  HB     65 HIS  H       5.50 
 11 THR  HB     65 HIS  HB2     4.00 
 11 THR  HB     65 HIS  HB3     5.00 
 11 THR  QG2    12 LEU  H       2.70 
 11 THR  QG2    13 ASN  H       6.53 
 11 THR  QG2    41 HIS  HB2     5.50 
 11 THR  QG2    41 HIS  HB3     5.50 
 11 THR  QG2    41 HIS  HD2     5.00 
 11 THR  QG2    42 PHE  H       5.00 
 11 THR  QG2    43 GLN  HA      5.00 
 11 THR  QG2    44 GLY  H       6.53 
 11 THR  QG2    65 HIS  H       6.53 
 12 LEU  H      12 LEU  HB2     3.70 
 12 LEU  H      12 LEU  HB3     3.73 
 12 LEU  H      12 LEU  QD1     6.53 
 12 LEU  H      12 LEU  QD2     6.53 
 12 LEU  H      13 ASN  H       5.50 
 12 LEU  H      42 PHE  H       4.11 
 12 LEU  H      42 PHE  HB2     5.50 
 12 LEU  H      42 PHE  HB3     5.04 
 12 LEU  H      43 GLN  HA      5.00 
 12 LEU  H      43 GLN  HE22    5.50 
 12 LEU  H      66 PHE  QE      7.62            #peak   587
 12 LEU  HA     13 ASN  H       2.90 
 12 LEU  HA     42 PHE  H       5.00 
 12 LEU  HA     42 PHE  QD      7.62            #peak   413
 12 LEU  HA     64 ALA  HA      5.00 
 12 LEU  HA     64 ALA  QB      5.00 
 12 LEU  HA     65 HIS  H       5.00 
 12 LEU  QB     13 ASN  H       5.50 
 12 LEU  HB2    13 ASN  H       4.91 
 12 LEU  HB2    42 PHE  H       5.50 
 12 LEU  HG     13 ASN  H       5.25 
 12 LEU  HG     42 PHE  H       5.04 
 12 LEU  QD1    61 ILE  QG2     5.00 
 12 LEU  QD1    64 ALA  H       5.00 
 12 LEU  QD1    64 ALA  HA      5.00 
 12 LEU  QD1    64 ALA  QB      3.30 
 12 LEU  QD1    65 HIS  H       5.00 
 12 LEU  QD2    19 LEU  QD1     5.00 
 12 LEU  QD2    19 LEU  QD2     5.00 
 12 LEU  QD2    42 PHE  H       5.00 
 12 LEU  QD2    42 PHE  QD      5.00 
 12 LEU  QD2    42 PHE  QE      5.50 
 12 LEU  QD2    61 ILE  QG2     3.30 
 13 ASN  H      14 ASN  H       5.19 
 13 ASN  H      64 ALA  HA      4.50 
 13 ASN  HA     14 ASN  H       2.90 
 13 ASN  HA     41 HIS  H       5.50 
 13 ASN  HA     41 HIS  HA      5.00 
 13 ASN  HA     41 HIS  HB2     5.00 
 13 ASN  HA     41 HIS  HB3     5.00 
 13 ASN  HA     42 PHE  H       3.98 
 13 ASN  QB     14 ASN  H       3.30 
 14 ASN  H      14 ASN  HB2     3.70 
 14 ASN  H      15 PRO  HD2     4.20 
 14 ASN  H      15 PRO  HD3     4.20 
 14 ASN  H      40 ILE  H       5.00 
 14 ASN  H      40 ILE  HA      5.00 
 14 ASN  H      41 HIS  H       5.00 
 14 ASN  H      41 HIS  HA      3.79 
 14 ASN  H      41 HIS  HB2     5.00 
 14 ASN  H      41 HIS  HB3     5.50 
 14 ASN  HA     40 ILE  H       5.00 
 14 ASN  HB2    14 ASN  HD21    3.79 
 15 PRO  HA     16 LEU  H       2.80 
 15 PRO  HA     17 SER  H       3.98 
 15 PRO  HA     42 PHE  QD      7.62            #peak   457
 15 PRO  HA     42 PHE  QE      7.62            #peak   401
 15 PRO  QB     17 SER  H       3.30 
 15 PRO  HB2    16 LEU  H       3.24 
 15 PRO  HB2    17 SER  H       3.36 
 15 PRO  HB2    42 PHE  QD      7.62            #peak   217
 15 PRO  HB2    42 PHE  QE      7.34            #peak   199
 15 PRO  HB3    42 PHE  QD      7.62            #peak   216
 15 PRO  HB3    42 PHE  QE      7.62            #peak   526
 15 PRO  HG2    17 SER  H       5.00 
 15 PRO  HG2    42 PHE  H       5.50 
 15 PRO  HG2    42 PHE  QD      5.50 
 15 PRO  HG2    42 PHE  QE      7.62            #peak   204
 15 PRO  HG2    42 PHE  HZ      5.50            #peak   232
 15 PRO  HG3    40 ILE  H       5.50 
 15 PRO  HG3    42 PHE  H       5.50 
 15 PRO  HG3    42 PHE  QD      7.62            #peak   218
 15 PRO  HG3    42 PHE  QE      7.62            #peak   200
 15 PRO  HD2    41 HIS  HA      5.00 
 15 PRO  HD3    41 HIS  HA      5.00 
 16 LEU  H      16 LEU  QB      3.93 
 16 LEU  H      16 LEU  QD1     4.70 
 16 LEU  H      16 LEU  QD2     5.23 
 16 LEU  H      17 SER  H       2.83 
 16 LEU  HA     17 SER  H       3.39 
 16 LEU  QB     17 SER  H       3.30 
 17 SER  H      18 PRO  HD2     5.00 
 17 SER  HA     18 PRO  QG      5.00 
 17 SER  HA     18 PRO  HD2     3.30 
 17 SER  HA     18 PRO  HD3     3.30 
 17 SER  QB     18 PRO  QG      5.50 
 17 SER  HB2    18 PRO  HD2     5.50 
 17 SER  HB2    18 PRO  HD3     5.00 
 17 SER  HB3    18 PRO  HD2     5.50 
 17 SER  HB3    18 PRO  HD3     5.00 
 18 PRO  HA     19 LEU  H       2.83 
 18 PRO  HA     42 PHE  QD      7.62            #peak   125
 18 PRO  HA     42 PHE  QE      5.50 
 18 PRO  HA     42 PHE  HZ      4.82            #peak   131
 18 PRO  HB2    19 LEU  H       3.52 
 18 PRO  HB2    42 PHE  QD      7.62            #peak    12
 18 PRO  HB2    42 PHE  QE      7.62            #peak   382
 18 PRO  HB3    19 LEU  H       3.61 
 18 PRO  HB3    42 PHE  QE      7.62            #peak   383
 18 PRO  HG2    19 LEU  H       5.50 
 18 PRO  HG3    19 LEU  H       5.50 
 18 PRO  HG3    42 PHE  HZ      5.50            #peak    20
 18 PRO  HD3    19 LEU  H       5.50 
 19 LEU  H      19 LEU  HG      3.76 
 19 LEU  H      19 LEU  QD1     6.19 
 19 LEU  H      19 LEU  QD2     5.13 
 19 LEU  H      20 SER  H       4.70 
 19 LEU  H      30 TYR  QD      7.64 
 19 LEU  H      42 PHE  QE      5.50 
 19 LEU  H      42 PHE  HZ      4.85 
 19 LEU  HA     20 SER  H       2.90 
 19 LEU  QB     20 SER  H       3.30 
 19 LEU  QB     30 TYR  QD      8.52            #peak   288
 19 LEU  QB     30 TYR  QE      8.51            #peak   321
 19 LEU  HG     20 SER  H       5.13 
 19 LEU  QD1    20 SER  H       6.53 
 19 LEU  QD1    28 LEU  QD1     5.00 
 19 LEU  QD1    28 LEU  QD2     5.00 
 19 LEU  QD1    30 TYR  HA      6.53            #peak   326
 19 LEU  QD1    30 TYR  QD      8.67            #peak   290
 19 LEU  QD1    30 TYR  QE      8.66            #peak   322
 19 LEU  QD1    42 PHE  QD      5.00 
 19 LEU  QD1    42 PHE  QE      8.65            #peak   205
 19 LEU  QD1    42 PHE  HZ      6.53            #peak   234
 19 LEU  QD1    60 LEU  QD2     5.50 
 19 LEU  QD1    61 ILE  QG2     5.00 
 19 LEU  QD1    61 ILE  QD1     3.30 
 19 LEU  QD2    20 SER  H       4.64 
 19 LEU  QD2    28 LEU  QD2     5.50 
 19 LEU  QD2    30 TYR  QD      8.67            #peak   289
 19 LEU  QD2    30 TYR  QE      8.66            #peak   316
 19 LEU  QD2    42 PHE  QD      5.00 
 19 LEU  QD2    42 PHE  QE      8.65            #peak   203
 19 LEU  QD2    42 PHE  HZ      5.94            #peak   238
 19 LEU  QD2    61 ILE  QG2     3.30 
 19 LEU  QD2    61 ILE  QD1     3.30 
 20 SER  H      21 LEU  H       5.50 
 20 SER  HA     21 LEU  H       2.68 
 20 SER  QB     21 LEU  H       2.90 
 21 LEU  H      21 LEU  HB2     2.96 
 21 LEU  H      21 LEU  HB3     3.05 
 21 LEU  H      21 LEU  HG      5.50 
 21 LEU  H      21 LEU  QD1     5.63 
 21 LEU  H      21 LEU  QD2     5.26 
 21 LEU  H      22 HIS  H       5.50 
 21 LEU  H      28 LEU  HG      5.50 
 21 LEU  H      93 TYR  QD      7.64 
 21 LEU  H      93 TYR  QE      7.63 
 21 LEU  HA     22 HIS  H       2.83 
 21 LEU  HA     28 LEU  QD2     3.30 
 21 LEU  HA     93 TYR  QD      7.64            #peak    79
 21 LEU  HA     93 TYR  QE      7.63            #peak    98
 21 LEU  HB2    22 HIS  H       4.14 
 21 LEU  HB3    22 HIS  H       4.63 
 21 LEU  HB3    93 TYR  QD      7.64            #peak   235
 21 LEU  HB3    93 TYR  QE      7.63            #peak   272
 21 LEU  HB3    94 GLY  H       5.50 
 21 LEU  HG     22 HIS  H       5.19 
 21 LEU  HG     25 MET  H       5.50 
 21 LEU  QD1    22 HIS  H       5.35 
 21 LEU  QD1    25 MET  H       6.12 
 21 LEU  QD1    27 TYR  QD      8.67            #peak   267
 21 LEU  QD1    93 TYR  H       5.50 
 21 LEU  QD1    93 TYR  HB2     5.00 
 21 LEU  QD1    93 TYR  HB3     5.50 
 21 LEU  QD1    93 TYR  QD      8.67            #peak   237
 21 LEU  QD1    93 TYR  QE      8.66            #peak   273
 21 LEU  QD1    94 GLY  H       5.50 
 21 LEU  QD1    95 GLU  H       6.53 
 21 LEU  QD2    22 HIS  H       6.53 
 21 LEU  QD2    28 LEU  H       6.53 
 21 LEU  QD2    93 TYR  HB2     5.50 
 21 LEU  QD2    93 TYR  HB3     5.50 
 21 LEU  QD2    93 TYR  QD      8.67            #peak   236
 21 LEU  QD2    93 TYR  QE      8.66            #peak   678
 21 LEU  QD2    94 GLY  H       5.00 
 21 LEU  QD2    94 GLY  HA2     5.00 
 21 LEU  QD2    95 GLU  H       6.53 
 22 HIS  H      22 HIS  HB2     3.24 
 22 HIS  H      22 HIS  HB3     3.30 
 22 HIS  H      23 ASP  H       5.50 
 22 HIS  H      25 MET  H       4.79 
 22 HIS  H      25 MET  HA      5.80 
 22 HIS  H      25 MET  QB      6.04 
 22 HIS  H      25 MET  HG2     5.41 
 22 HIS  H      25 MET  QE      6.03 
 22 HIS  H      26 LYS  H       5.50 
 22 HIS  H      28 LEU  QD2     6.53 
 22 HIS  HA     22 HIS  HD2     5.50            #peak   128
 22 HIS  HA     22 HIS  HE1     6.00            #peak   405
 22 HIS  HA     23 ASP  H       2.90 
 22 HIS  HB2    23 ASP  H       5.10 
 22 HIS  HB2    25 MET  H       4.91 
 22 HIS  HB3    24 SER  H       5.50 
 22 HIS  HB3    25 MET  H       5.00 
 22 HIS  HD2    23 ASP  QB      6.38            #peak   536
 22 HIS  HD2    24 SER  HA      6.80            #peak   630
 22 HIS  HD2    25 MET  QE      6.53            #peak    15
 22 HIS  HD2    60 LEU  HA      5.50            #peak    76
 22 HIS  HD2    60 LEU  HB2     6.00            #peak   537
 22 HIS  HD2    60 LEU  HB3     5.50            #peak   226
 22 HIS  HD2    60 LEU  QD1     6.53            #peak   227
 22 HIS  HD2    60 LEU  QD2     6.53            #peak   228
 22 HIS  HE1    23 ASP  QB      6.38            #peak   376
 22 HIS  HE1    24 SER  H       5.50 
 22 HIS  HE1    24 SER  HA      5.50 
 22 HIS  HE1    24 SER  HB2     4.80 
 22 HIS  HE1    24 SER  HB3     4.80 
 22 HIS  HE1    25 MET  QE      6.53            #peak   377
 22 HIS  HE1    49 LYS  HB2     7.00            #peak   375
 22 HIS  HE1    59 LYS  HA      7.00            #peak   398
 22 HIS  HE1    60 LEU  QD1     6.53            #peak   188
 22 HIS  HE1    60 LEU  QD2     6.53            #peak   189
 23 ASP  H      24 SER  H       5.07 
 23 ASP  HA     25 MET  H       4.50 
 23 ASP  QB     24 SER  H       3.30 
 24 SER  H      24 SER  HB2     3.48 
 24 SER  H      25 MET  H       2.90 
 24 SER  HA     48 MET  QE      5.00 
 24 SER  QB     48 MET  QE      3.30 
 24 SER  HB2    25 MET  H       3.30 
 24 SER  HB3    25 MET  H       4.32 
 25 MET  H      25 MET  HG2     3.83 
 25 MET  H      25 MET  HG3     4.54 
 25 MET  H      25 MET  QE      6.47 
 25 MET  H      26 LYS  H       5.50 
 25 MET  H      46 ILE  QG2     5.50 
 25 MET  H      48 MET  HA      5.07 
 25 MET  H      48 MET  HB3     5.40 
 25 MET  H      49 LYS  QD      6.38 
 25 MET  H      49 LYS  QE      6.38 
 25 MET  HA     26 LYS  H       2.90 
 25 MET  HA     27 TYR  H       4.50 
 25 MET  HA     46 ILE  QG2     5.00 
 25 MET  HA     48 MET  HA      5.00 
 25 MET  HA     48 MET  QE      3.30 
 25 MET  HA     49 LYS  H       3.30 
 25 MET  QB     26 LYS  H       5.50 
 25 MET  QE     28 LEU  QD1     3.30 
 25 MET  QE     28 LEU  QD2     3.30 
 25 MET  QE     46 ILE  QG2     5.00 
 25 MET  QE     46 ILE  QD1     3.30 
 25 MET  QE     48 MET  QE      5.00 
 25 MET  QE     57 MET  QE      5.00 
 25 MET  QE     60 LEU  QD1     3.30 
 25 MET  QE     60 LEU  QD2     5.00 
 25 MET  QE     61 ILE  QD1     5.00 
 26 LYS  H      26 LYS  HB2     3.33 
 26 LYS  H      26 LYS  HB3     3.30 
 26 LYS  H      26 LYS  QG      6.38 
 26 LYS  H      26 LYS  QD      6.38 
 26 LYS  H      48 MET  HA      3.30 
 26 LYS  H      49 LYS  H       4.72 
 26 LYS  HB2    27 TYR  H       3.17 
 26 LYS  HB3    27 TYR  H       3.39 
 26 LYS  HB3    27 TYR  QD      7.64            #peak   263
 26 LYS  HB3    27 TYR  QE      7.63            #peak   293
 26 LYS  HB3    95 GLU  H       5.50 
 27 TYR  H      27 TYR  HB2     4.01 
 27 TYR  H      27 TYR  HB3     3.64 
 27 TYR  H      27 TYR  QD      5.00 
 27 TYR  H      28 LEU  H       5.50 
 27 TYR  H      46 ILE  HA      5.30 
 27 TYR  H      46 ILE  QG2     5.00 
 27 TYR  H      48 MET  HA      5.00 
 27 TYR  H      95 GLU  QB      5.00 
 27 TYR  HA     27 TYR  QD      5.00 
 27 TYR  HA     27 TYR  QE      5.50 
 27 TYR  HA     28 LEU  H       2.80 
 27 TYR  HA     94 GLY  HA2     5.00 
 27 TYR  HA     94 GLY  HA3     5.50 
 27 TYR  HA     95 GLU  H       3.30 
 27 TYR  HB2    28 LEU  H       4.14 
 27 TYR  HB2    95 GLU  H       5.41 
 27 TYR  HB3    28 LEU  H       4.00 
 27 TYR  QD     28 LEU  H       7.48 
 27 TYR  QD     28 LEU  HG      7.64            #peak   419
 27 TYR  QD     29 VAL  HA      7.64            #peak     5
 27 TYR  QD     29 VAL  HB      7.64            #peak    38
 27 TYR  QD     29 VAL  QG1     8.67            #peak   696
 27 TYR  QD     45 TYR  H       7.63 
 27 TYR  QD     45 TYR  QD      9.78            #peak   631
 27 TYR  QD     45 TYR  QE      9.77            #peak   164
 27 TYR  QD     77 ARG  QD      8.52            #peak   547
 27 TYR  QD     92 GLU  HA      7.64            #peak   141
 27 TYR  QD     94 GLY  HA2     7.64            #peak   139
 27 TYR  QD     94 GLY  HA3     7.64            #peak    94
 27 TYR  QD     95 GLU  H       5.00 
 27 TYR  QD     95 GLU  HA      5.00 
 27 TYR  QE     29 VAL  HA      7.63            #peak     9
 27 TYR  QE     29 VAL  HB      7.63            #peak    62
 27 TYR  QE     29 VAL  QG1     8.66            #peak   295
 27 TYR  QE     29 VAL  QG2     5.00 
 27 TYR  QE     45 TYR  H       7.63 
 27 TYR  QE     77 ARG  HA      7.63            #peak   184
 27 TYR  QE     77 ARG  QD      8.51            #peak   115
 27 TYR  QE     92 GLU  HA      7.63            #peak   153
 27 TYR  QE     92 GLU  HB3     7.63            #peak    64
 27 TYR  QE     94 GLY  HA3     7.63            #peak   185
 27 TYR  QE     95 GLU  HA      5.00 
 27 TYR  QE     95 GLU  QG      5.00 
 28 LEU  H      28 LEU  HB2     4.11 
 28 LEU  H      28 LEU  HB3     3.86 
 28 LEU  H      28 LEU  QD1     6.53 
 28 LEU  H      28 LEU  QD2     6.53 
 28 LEU  H      29 VAL  H       5.50 
 28 LEU  H      93 TYR  H       3.73 
 28 LEU  H      94 GLY  HA2     5.00 
 28 LEU  HA     29 VAL  H       2.90 
 28 LEU  HA     46 ILE  HA      5.00 
 28 LEU  HB2    29 VAL  H       4.63 
 28 LEU  HB2    30 TYR  QD      7.64            #peak    58
 28 LEU  HB2    30 TYR  QE      7.63            #peak   315
 28 LEU  HB2    93 TYR  QD      7.64            #peak    21
 28 LEU  HB2    93 TYR  QE      7.63            #peak   708
 28 LEU  HB3    29 VAL  H       4.60 
 28 LEU  HB3    30 TYR  QD      7.64            #peak   687
 28 LEU  HB3    30 TYR  QE      7.63            #peak   640
 28 LEU  HB3    93 TYR  H       5.50 
 28 LEU  HB3    93 TYR  QD      7.64            #peak   710
 28 LEU  HB3    93 TYR  QE      7.63            #peak   709
 28 LEU  HG     30 TYR  QD      7.64            #peak   469
 28 LEU  HG     30 TYR  QE      7.63            #peak   319
 28 LEU  HG     93 TYR  QD      7.64            #peak   610
 28 LEU  HG     93 TYR  QE      7.63            #peak   471
 28 LEU  QD1    29 VAL  H       3.30 
 28 LEU  QD1    30 TYR  HA      5.00 
 28 LEU  QD1    30 TYR  QD      5.50 
 28 LEU  QD1    46 ILE  HA      5.00 
 28 LEU  QD1    46 ILE  QD1     5.00 
 28 LEU  QD2    29 VAL  H       6.53 
 28 LEU  QD2    46 ILE  QD1     5.00 
 28 LEU  QD2    93 TYR  H       6.53 
 28 LEU  QD2    93 TYR  QD      5.00 
 28 LEU  QD2    93 TYR  QE      5.00 
 28 LEU  QD2    94 GLY  H       5.00 
 29 VAL  H      29 VAL  QG1     5.07 
 29 VAL  H      29 VAL  QG2     4.73 
 29 VAL  H      30 TYR  H       5.50 
 29 VAL  H      45 TYR  H       4.38 
 29 VAL  H      46 ILE  HA      5.00 
 29 VAL  H      46 ILE  HG12    5.50 
 29 VAL  H      46 ILE  QG2     6.53 
 29 VAL  HA     30 TYR  H       3.11 
 29 VAL  HA     30 TYR  QD      6.96            #peak   580
 29 VAL  HA     92 GLU  HA      3.27            #peak   442
 29 VAL  HA     92 GLU  HB3     5.50            #peak   318
 29 VAL  HA     92 GLU  QG      6.38            #peak   637
 29 VAL  HA     93 TYR  H       4.14 
 29 VAL  HB     30 TYR  H       5.00 
 29 VAL  HB     45 TYR  H       5.00 
 29 VAL  HB     45 TYR  QD      7.64            #peak    24
 29 VAL  HB     45 TYR  QE      7.63            #peak    59
 29 VAL  QG1    30 TYR  HA      6.53            #peak   324
 29 VAL  QG1    30 TYR  QD      8.67            #peak   291
 29 VAL  QG1    45 TYR  H       6.53 
 29 VAL  QG1    45 TYR  QD      8.67            #peak   240
 29 VAL  QG1    45 TYR  QE      8.66            #peak   285
 29 VAL  QG1    81 MET  QE      5.00 
 29 VAL  QG1    92 GLU  H       5.50 
 29 VAL  QG2    30 TYR  H       4.02 
 29 VAL  QG2    45 TYR  H       6.53 
 29 VAL  QG2    45 TYR  QD      8.67            #peak   693
 29 VAL  QG2    45 TYR  QE      8.66            #peak   556
 29 VAL  QG2    81 MET  QE      5.50 
 29 VAL  QG2    92 GLU  HA      4.80 
 29 VAL  QG2    92 GLU  HB2     5.00 
 29 VAL  QG2    92 GLU  HB3     5.50 
 29 VAL  QG2    92 GLU  QG      5.00 
 30 TYR  H      30 TYR  QD      7.64 
 30 TYR  H      31 GLN  H       5.50 
 30 TYR  H      44 GLY  QA      5.00 
 30 TYR  H      91 TRP  H       5.00 
 30 TYR  H      92 GLU  HA      4.07 
 30 TYR  HA     31 GLN  H       2.90 
 30 TYR  HA     44 GLY  QA      5.00 
 30 TYR  HA     80 SER  QB      6.38            #peak   441
 30 TYR  HA     81 MET  QE      5.00 
 30 TYR  HB2    31 GLN  H       4.00 
 30 TYR  HB3    31 GLN  H       4.00 
 30 TYR  HB3    42 PHE  QD      7.62            #peak   491
 30 TYR  HB3    43 GLN  H       5.50 
 30 TYR  QD     31 GLN  H       5.00 
 30 TYR  QD     31 GLN  HA      7.64            #peak   462
 30 TYR  QD     42 PHE  HA      7.64            #peak   179
 30 TYR  QD     42 PHE  HB3     7.64            #peak   109
 30 TYR  QD     42 PHE  QD      9.76            #peak   341
 30 TYR  QD     42 PHE  QE      9.76            #peak   428
 30 TYR  QD     91 TRP  HB3     7.64            #peak    61
 30 TYR  QD     91 TRP  HD1     7.64            #peak   504
 30 TYR  QD     91 TRP  HZ3     6.34            #peak   166
 30 TYR  QE     42 PHE  QD      9.75            #peak   644
 30 TYR  QE     42 PHE  QE      9.75            #peak   645
 30 TYR  QE     88 GLU  H       7.63 
 30 TYR  QE     91 TRP  HB2     7.63            #peak   705
 30 TYR  QE     91 TRP  HB3     7.63            #peak   704
 30 TYR  QE     91 TRP  HZ3     7.63            #peak   643
 30 TYR  QE     93 TYR  QD      9.77            #peak     2
 30 TYR  QE     93 TYR  QE      9.76            #peak     6
 31 GLN  H      31 GLN  HB3     3.83 
 31 GLN  H      31 GLN  QG      6.35 
 31 GLN  H      32 THR  H       5.50 
 31 GLN  H      42 PHE  QB      5.00 
 31 GLN  H      43 GLN  H       3.55 
 31 GLN  H      44 GLY  QA      5.00 
 31 GLN  H      81 MET  QE      3.30 
 31 GLN  H      91 TRP  H       5.30 
 31 GLN  HA     32 THR  H       2.90 
 31 GLN  HA     90 PRO  HA      3.60 
 31 GLN  HA     91 TRP  H       5.00 
 31 GLN  HA     91 TRP  HZ3     5.34            #peak   143
 31 GLN  HA     91 TRP  HH2     5.50            #peak   414
 31 GLN  HB2    32 THR  H       3.30 
 31 GLN  HB3    32 THR  H       4.00 
 31 GLN  QG     81 MET  QE      5.00 
 32 THR  H      32 THR  HB      4.00 
 32 THR  H      33 GLU  H       5.50 
 32 THR  H      81 MET  QE      5.91 
 32 THR  H      87 LEU  H       5.28 
 32 THR  H      88 GLU  H       3.83 
 32 THR  H      90 PRO  HA      5.00 
 32 THR  H      91 TRP  HZ3     5.00 
 32 THR  H      91 TRP  HH2     5.00 
 32 THR  HA     33 GLU  H       3.45 
 32 THR  HA     42 PHE  HA      3.30 
 32 THR  HA     42 PHE  QD      5.00 
 32 THR  HA     42 PHE  QE      7.62            #peak   409
 32 THR  HA     43 GLN  H       4.20 
 32 THR  HA     91 TRP  HZ3     5.50            #peak   577
 32 THR  HA     91 TRP  HH2     5.70            #peak   680
 32 THR  HB     33 GLU  H       4.45 
 32 THR  HB     42 PHE  QD      7.62            #peak   126
 32 THR  HB     42 PHE  QE      7.62            #peak   410
 32 THR  HB     88 GLU  H       3.60 
 32 THR  HB     88 GLU  HB2     5.50 
 32 THR  HB     88 GLU  HB3     5.00 
 32 THR  HB     91 TRP  HZ2     6.00            #peak   411
 32 THR  HB     91 TRP  HZ3     5.50            #peak   145
 32 THR  HB     91 TRP  HH2     5.50            #peak   130
 32 THR  QG2    33 GLU  H       5.10 
 32 THR  QG2    40 ILE  HB      5.00 
 32 THR  QG2    40 ILE  QG1     5.00 
 32 THR  QG2    40 ILE  QG2     5.00 
 32 THR  QG2    40 ILE  QD1     5.00 
 32 THR  QG2    41 HIS  H       5.00 
 32 THR  QG2    42 PHE  HA      5.50 
 32 THR  QG2    42 PHE  QD      3.30 
 32 THR  QG2    42 PHE  QE      5.00 
 32 THR  QG2    87 LEU  QD1     5.00 
 32 THR  QG2    91 TRP  HZ2     6.53            #peak   213
 32 THR  QG2    91 TRP  HZ3     6.53            #peak   268
 32 THR  QG2    91 TRP  HH2     5.75            #peak   229
 33 GLU  H      33 GLU  HB2     4.14 
 33 GLU  H      33 GLU  HB3     3.89 
 33 GLU  H      33 GLU  QG      6.38 
 33 GLU  H      34 GLN  H       4.60 
 33 GLU  H      41 HIS  H       3.76 
 33 GLU  H      41 HIS  HA      5.04 
 33 GLU  H      42 PHE  HA      4.63 
 33 GLU  H      42 PHE  QD      7.62 
 33 GLU  H      87 LEU  QD1     5.00 
 33 GLU  HA     34 GLN  H       2.90 
 33 GLU  HA     41 HIS  H       5.00 
 33 GLU  HA     86 ARG  H       5.50 
 33 GLU  HA     86 ARG  HA      5.00 
 33 GLU  HA     87 LEU  H       3.79 
 33 GLU  HA     88 GLU  H       4.54 
 33 GLU  HB2    34 GLN  H       4.00 
 33 GLU  HB3    34 GLN  H       3.98 
 33 GLU  QG     34 GLN  H       5.00 
 33 GLU  QG     86 ARG  HA      5.00 
 33 GLU  QG     87 LEU  H       3.30 
 34 GLN  H      34 GLN  HB2     3.14 
 34 GLN  H      34 GLN  HB3     3.30 
 34 GLN  H      34 GLN  QG      6.38 
 34 GLN  H      35 GLY  H       5.50 
 34 GLN  H      85 THR  HB      5.00 
 34 GLN  H      85 THR  QG2     6.53 
 34 GLN  H      86 ARG  HA      4.69 
 34 GLN  H      87 LEU  H       4.69 
 34 GLN  H      87 LEU  QB      5.50 
 34 GLN  H      87 LEU  HB2     4.94 
 34 GLN  H      87 LEU  HB3     5.50 
 34 GLN  H      87 LEU  HG      3.30 
 34 GLN  H      87 LEU  QD1     3.80 
 34 GLN  H      87 LEU  QD2     5.00 
 34 GLN  HA     34 GLN  HE21    5.50 
 34 GLN  HA     34 GLN  HE22    5.50 
 34 GLN  HA     35 GLY  H       2.90 
 34 GLN  HA     40 ILE  HA      5.00 
 34 GLN  HA     40 ILE  QG2     5.00 
 34 GLN  HA     41 HIS  H       5.00 
 34 GLN  HA     87 LEU  QD1     3.30 
 34 GLN  HA     87 LEU  QD2     5.00 
 34 GLN  QB     35 GLY  H       3.80 
 34 GLN  QB     85 THR  HB      5.50 
 34 GLN  QB     85 THR  QG2     5.50 
 34 GLN  QB     86 ARG  HA      5.80 
 34 GLN  HB2    87 LEU  H       5.50 
 34 GLN  HB2    87 LEU  QD1     5.50 
 34 GLN  HB2    87 LEU  QD2     5.50 
 34 GLN  HB3    87 LEU  QD1     5.00 
 34 GLN  HB3    87 LEU  QD2     5.50 
 34 GLN  QG     35 GLY  H       6.38 
 34 GLN  QG     40 ILE  HA      5.00 
 34 GLN  QG     41 HIS  H       5.50 
 34 GLN  QG     41 HIS  HD2     6.38            #peak    51
 34 GLN  HE21   35 GLY  H       5.50 
 34 GLN  HE22   35 GLY  H       5.50 
 34 GLN  HE22   87 LEU  QD1     5.50 
 34 GLN  HE22   87 LEU  QD2     5.50 
 35 GLY  H      36 GLU  H       4.66 
 35 GLY  H      40 ILE  HA      3.30 
 35 GLY  H      40 ILE  QG2     5.00 
 35 GLY  H      41 HIS  H       4.91 
 35 GLY  HA2    36 GLU  H       2.90 
 35 GLY  HA3    36 GLU  H       2.90 
 36 GLU  H      36 GLU  HB2     4.14 
 36 GLU  H      36 GLU  HB3     3.21 
 36 GLU  H      36 GLU  QG      6.38 
 36 GLU  H      37 ALA  H       5.50 
 36 GLU  HA     37 ALA  H       2.90 
 36 GLU  HB2    37 ALA  H       3.89 
 36 GLU  HB3    37 ALA  H       4.57 
 36 GLU  QG     37 ALA  H       5.00 
 36 GLU  QG     41 HIS  HD2     6.38            #peak    52
 36 GLU  QG     42 PHE  QD      8.50            #peak   456
 37 ALA  H      38 GLY  H       4.48 
 37 ALA  HA     38 GLY  H       2.90 
 37 ALA  QB     38 GLY  H       3.30 
 37 ALA  QB     39 ASN  H       5.00 
 37 ALA  QB     39 ASN  HD21    5.00 
 37 ALA  QB     39 ASN  HD22    5.00 
 38 GLY  H      39 ASN  H       2.90 
 38 GLY  HA2    39 ASN  H       3.55 
 39 ASN  H      39 ASN  HB2     3.24 
 39 ASN  H      39 ASN  HB3     3.61 
 39 ASN  H      40 ILE  H       5.16 
 39 ASN  HA     40 ILE  H       2.65 
 39 ASN  HB2    40 ILE  H       3.30 
 39 ASN  HB3    40 ILE  H       3.30 
 40 ILE  H      40 ILE  HB      3.58 
 40 ILE  H      40 ILE  HG12    4.04 
 40 ILE  H      40 ILE  QG2     4.85 
 40 ILE  H      41 HIS  H       4.54 
 40 ILE  HA     41 HIS  H       2.90 
 40 ILE  HB     41 HIS  H       3.24 
 40 ILE  HB     41 HIS  HD2     5.50            #peak    53
 40 ILE  HG13   41 HIS  H       5.50 
 40 ILE  HG13   42 PHE  HZ      5.19            #peak   233
 40 ILE  QG2    41 HIS  H       3.30 
 40 ILE  QG2    42 PHE  QD      5.40 
 40 ILE  QG2    42 PHE  QE      8.65            #peak   202
 40 ILE  QD1    41 HIS  H       6.53 
 40 ILE  QD1    42 PHE  QD      5.00 
 41 HIS  H      41 HIS  HD2     5.50 
 41 HIS  H      42 PHE  H       5.50 
 41 HIS  HA     41 HIS  HD2     5.50            #peak   460
 41 HIS  HA     42 PHE  H       2.90 
 41 HIS  HB2    42 PHE  H       3.80 
 41 HIS  HB3    42 PHE  H       3.60 
 41 HIS  HD2    87 LEU  HB2     5.13            #peak   468
 41 HIS  HD2    87 LEU  HB3     6.30            #peak   284
 42 PHE  H      42 PHE  HB2     3.39 
 42 PHE  H      42 PHE  HB3     4.04 
 42 PHE  H      43 GLN  H       5.50 
 42 PHE  HA     42 PHE  QD      6.94            #peak   337
 42 PHE  HA     43 GLN  H       2.90 
 42 PHE  HB3    43 GLN  H       3.30 
 42 PHE  QD     43 GLN  H       7.47 
 42 PHE  QD     91 TRP  HZ3     7.62            #peak   340
 42 PHE  QE     61 ILE  QG2     8.65            #peak   527
 42 PHE  QE     91 TRP  HZ3     7.62            #peak   427
 42 PHE  QE     91 TRP  HH2     6.97            #peak   697
 43 GLN  H      43 GLN  HB2     3.39 
 43 GLN  H      43 GLN  HB3     3.55 
 43 GLN  H      43 GLN  HG2     5.50 
 43 GLN  H      43 GLN  HG3     5.50 
 43 GLN  H      44 GLY  H       4.94 
 43 GLN  HA     44 GLY  H       2.90 
 43 GLN  QB     44 GLY  H       3.30 
 43 GLN  HB2    43 GLN  HE21    5.50 
 44 GLY  H      45 TYR  H       5.50 
 44 GLY  H      81 MET  HG2     5.50 
 44 GLY  H      81 MET  HG3     5.50 
 44 GLY  QA     45 TYR  H       2.90 
 45 TYR  H      45 TYR  QD      7.64 
 45 TYR  H      46 ILE  H       4.94 
 45 TYR  HA     45 TYR  QD      7.64            #peak   711
 45 TYR  HA     46 ILE  H       3.30 
 45 TYR  HA     47 GLU  QG      5.50 
 45 TYR  QB     46 ILE  H       6.04 
 45 TYR  QD     46 ILE  H       7.64 
 45 TYR  QD     47 GLU  QG      8.52            #peak   703
 45 TYR  QD     77 ARG  HA      7.64            #peak    83
 45 TYR  QD     77 ARG  QD      8.52            #peak   628
 45 TYR  QD     92 GLU  QG      8.52            #peak   692
 45 TYR  QE     47 GLU  HA      7.63            #peak   459
 45 TYR  QE     47 GLU  QG      8.51            #peak    55
 45 TYR  QE     76 ALA  QB      8.66            #peak   286
 45 TYR  QE     77 ARG  HA      7.63            #peak   105
 45 TYR  QE     77 ARG  QG      5.50 
 45 TYR  QE     77 ARG  QD      5.00 
 45 TYR  QE     81 MET  QE      5.00 
 46 ILE  H      46 ILE  QG2     6.53 
 46 ILE  H      46 ILE  QD1     6.53 
 46 ILE  H      47 GLU  HA      4.80 
 46 ILE  HB     57 MET  QE      5.00 
 46 ILE  QG1    57 MET  QE      5.00 
 46 ILE  QG2    46 ILE  QD1     5.00 
 46 ILE  QG2    57 MET  QE      5.00 
 46 ILE  QD1    57 MET  QE      3.30 
 46 ILE  QD1    61 ILE  QD1     5.00 
 48 MET  H      49 LYS  H       5.50 
 48 MET  HA     48 MET  QE      3.30 
 48 MET  HA     49 LYS  H       2.90 
 48 MET  HB2    49 LYS  H       3.30 
 48 MET  HB3    49 LYS  H       3.30 
 48 MET  HB3    50 LYS  H       3.83 
 48 MET  QE     49 LYS  H       3.30 
 48 MET  QE     60 LEU  QD1     2.70 
 48 MET  QE     60 LEU  QD2     3.30 
 49 LYS  H      49 LYS  HB2     3.14 
 49 LYS  H      49 LYS  HB3     3.21 
 49 LYS  H      50 LYS  H       2.90 
 49 LYS  H      52 THR  QG2     4.98 
 49 LYS  HB2    50 LYS  H       3.30 
 49 LYS  HB3    50 LYS  H       3.30 
 49 LYS  QE     50 LYS  H       6.38 
 50 LYS  H      50 LYS  HB2     3.36 
 50 LYS  H      50 LYS  HB3     3.89 
 50 LYS  H      50 LYS  QG      5.29 
 50 LYS  H      51 ARG  H       2.90 
 50 LYS  HA     51 ARG  H       3.48 
 50 LYS  HB2    51 ARG  H       2.90 
 50 LYS  HB3    51 ARG  H       2.90 
 50 LYS  QG     51 ARG  H       6.38 
 51 ARG  H      51 ARG  HB2     3.21 
 51 ARG  H      51 ARG  HB3     3.08 
 51 ARG  H      51 ARG  QD      6.38 
 52 THR  HA     53 SER  H       3.21 
 52 THR  HB     53 SER  H       4.35 
 52 THR  QG2    53 SER  H       4.98 
 52 THR  QG2    56 GLY  H       3.30 
 52 THR  QG2    56 GLY  HA2     3.30 
 52 THR  QG2    56 GLY  HA3     3.30 
 52 THR  QG2    57 MET  H       4.33 
 53 SER  H      55 ALA  H       5.00 
 53 SER  H      56 GLY  H       4.66 
 53 SER  HA     54 LEU  H       2.90 
 53 SER  HA     55 ALA  H       4.79 
 53 SER  HB2    54 LEU  H       2.90 
 53 SER  HB2    55 ALA  H       5.00 
 53 SER  HB3    54 LEU  H       3.30 
 53 SER  HB3    55 ALA  H       4.26 
 54 LEU  H      54 LEU  HB2     3.17 
 54 LEU  H      54 LEU  HB3     3.55 
 54 LEU  H      54 LEU  QD1     6.53 
 54 LEU  H      54 LEU  QD2     6.37 
 54 LEU  H      55 ALA  H       2.90 
 54 LEU  H      55 ALA  QB      6.53 
 54 LEU  H      56 GLY  H       5.00 
 54 LEU  HA     56 GLY  H       4.20 
 54 LEU  HA     57 MET  H       3.30 
 54 LEU  HA     58 LYS  H       4.60 
 54 LEU  HA     66 PHE  QD      7.62            #peak    85
 54 LEU  HB2    55 ALA  H       4.50 
 54 LEU  HB2    58 LYS  QE      5.00 
 54 LEU  HB3    55 ALA  H       3.30 
 54 LEU  HB3    58 LYS  QE      3.30 
 54 LEU  HG     58 LYS  QB      5.00 
 54 LEU  HG     58 LYS  QG      5.00 
 54 LEU  HG     58 LYS  QD      5.00 
 54 LEU  HG     58 LYS  HE3     5.00 
 54 LEU  QD1    55 ALA  H       6.53 
 54 LEU  QD1    57 MET  H       5.00 
 54 LEU  QD1    58 LYS  H       5.50 
 54 LEU  QD1    58 LYS  QG      5.50 
 54 LEU  QD1    58 LYS  HE2     5.00 
 54 LEU  QD1    58 LYS  HE3     5.00 
 54 LEU  QD1    66 PHE  H       5.00 
 54 LEU  QD1    66 PHE  HB2     5.50 
 54 LEU  QD1    66 PHE  HB3     5.50 
 54 LEU  QD2    58 LYS  H       5.50 
 54 LEU  QD2    58 LYS  QG      5.00 
 54 LEU  QD2    58 LYS  HE2     5.00 
 54 LEU  QD2    58 LYS  HE3     3.30 
 54 LEU  QD2    66 PHE  H       5.50 
 55 ALA  H      56 GLY  H       2.90 
 55 ALA  H      57 MET  H       4.79 
 55 ALA  HA     57 MET  H       5.00 
 55 ALA  HA     58 LYS  H       4.00 
 55 ALA  HA     59 LYS  H       4.00 
 55 ALA  QB     56 GLY  H       2.70 
 55 ALA  QB     59 LYS  H       5.00 
 56 GLY  H      56 GLY  HA3     2.90 
 56 GLY  H      57 MET  H       2.90 
 56 GLY  H      58 LYS  H       4.42 
 56 GLY  H      59 LYS  H       5.00 
 56 GLY  QA     59 LYS  H       5.00 
 56 GLY  HA2    58 LYS  H       5.00 
 56 GLY  HA2    59 LYS  H       4.51 
 56 GLY  HA3    58 LYS  H       5.00 
 56 GLY  HA3    59 LYS  H       5.07 
 57 MET  H      57 MET  HB2     3.30 
 57 MET  H      57 MET  HB3     3.70 
 57 MET  H      57 MET  HG2     3.92 
 57 MET  H      57 MET  HG3     3.58 
 57 MET  H      58 LYS  H       2.90 
 57 MET  H      59 LYS  H       4.35 
 57 MET  H      66 PHE  QE      7.62 
 57 MET  HA     57 MET  QE      5.00 
 57 MET  HA     58 LYS  H       3.48 
 57 MET  HA     60 LEU  H       5.00 
 57 MET  HA     60 LEU  HB2     5.00 
 57 MET  HA     61 ILE  H       5.50 
 57 MET  HB2    57 MET  QE      5.00 
 57 MET  HB2    58 LYS  H       3.52 
 57 MET  HB2    66 PHE  QD      5.50 
 57 MET  HB2    66 PHE  QE      5.50 
 57 MET  HB2    66 PHE  HZ      5.50            #peak   281
 57 MET  HB3    58 LYS  H       3.73 
 57 MET  HB3    66 PHE  QD      5.50 
 57 MET  HB3    66 PHE  QE      5.50 
 57 MET  HB3    66 PHE  HZ      5.50 
 57 MET  HG2    58 LYS  H       4.50 
 57 MET  HG2    66 PHE  QD      7.62            #peak   675
 57 MET  HG2    66 PHE  QE      7.62            #peak   300
 57 MET  HG2    66 PHE  HZ      5.50            #peak   673
 57 MET  HG3    66 PHE  QD      7.62            #peak   241
 57 MET  HG3    66 PHE  QE      7.62            #peak   294
 57 MET  HG3    66 PHE  HZ      5.25            #peak   275
 57 MET  QE     60 LEU  QD1     3.30 
 57 MET  QE     60 LEU  QD2     5.00 
 57 MET  QE     61 ILE  QD1     5.00 
 58 LYS  H      58 LYS  HB2     3.45 
 58 LYS  H      58 LYS  HB3     2.99 
 58 LYS  H      59 LYS  H       2.90 
 58 LYS  H      60 LEU  H       4.63 
 58 LYS  HA     59 LYS  H       3.50 
 58 LYS  HA     60 LEU  H       5.34 
 58 LYS  HA     61 ILE  H       5.00 
 58 LYS  HA     66 PHE  QD      7.62            #peak    82
 58 LYS  HA     66 PHE  QE      7.62            #peak   465
 58 LYS  HA     66 PHE  HZ      4.97            #peak   650
 58 LYS  HB2    59 LYS  H       4.00 
 59 LYS  H      59 LYS  QB      3.62 
 59 LYS  H      59 LYS  QG      5.54 
 59 LYS  H      59 LYS  QD      4.42 
 59 LYS  H      60 LEU  H       2.83 
 59 LYS  H      61 ILE  H       5.00 
 59 LYS  HA     60 LEU  H       3.50 
 59 LYS  HA     61 ILE  H       4.50 
 59 LYS  QB     60 LEU  H       2.90 
 59 LYS  QG     60 LEU  H       6.38 
 60 LEU  H      60 LEU  HB3     3.50 
 60 LEU  H      60 LEU  QD1     5.63 
 60 LEU  H      61 ILE  H       5.50 
 60 LEU  H      61 ILE  HA      5.50 
 60 LEU  HA     60 LEU  QD1     5.00 
 60 LEU  HB2    61 ILE  H       3.17 
 60 LEU  HB2    66 PHE  QD      7.62            #peak   615
 60 LEU  HB2    66 PHE  QE      7.62            #peak   470
 60 LEU  HB3    61 ILE  H       3.48 
 60 LEU  HG     61 ILE  H       5.00 
 60 LEU  QD1    61 ILE  H       5.00 
 61 ILE  H      61 ILE  HG12    4.94 
 61 ILE  H      61 ILE  QG2     6.53 
 61 ILE  H      62 PRO  HD2     5.50 
 61 ILE  HA     66 PHE  QE      7.62            #peak   156
 61 ILE  HB     64 ALA  QB      5.00 
 61 ILE  HB     66 PHE  QD      7.62            #peak    29
 61 ILE  HB     66 PHE  QE      7.56            #peak   616
 61 ILE  HB     66 PHE  HZ      5.25            #peak    47
 61 ILE  HG12   66 PHE  QD      7.62            #peak   242
 61 ILE  HG12   66 PHE  HZ      5.50            #peak   276
 61 ILE  QG2    64 ALA  H       5.00 
 61 ILE  QG2    64 ALA  HA      5.50 
 61 ILE  QG2    64 ALA  QB      3.30 
 61 ILE  QG2    66 PHE  QD      5.00 
 61 ILE  QG2    66 PHE  QE      5.00 
 61 ILE  QG2    66 PHE  HZ      5.50 
 61 ILE  QD1    64 ALA  QB      5.00 
 61 ILE  QD1    66 PHE  QD      5.50 
 61 ILE  QD1    66 PHE  QE      5.00 
 61 ILE  QD1    66 PHE  HZ      5.00 
 62 PRO  HA     63 GLY  H       3.21 
 62 PRO  HA     64 ALA  H       5.00 
 62 PRO  HB3    63 GLY  H       4.26 
 63 GLY  H      64 ALA  H       2.90 
 63 GLY  HA2    64 ALA  H       3.45 
 64 ALA  H      64 ALA  QB      4.17 
 64 ALA  H      65 HIS  H       4.82 
 64 ALA  HA     65 HIS  H       3.24 
 64 ALA  HA     66 PHE  QD      7.62            #peak   137
 64 ALA  HA     66 PHE  QE      7.62            #peak   570
 64 ALA  QB     65 HIS  H       4.48 
 64 ALA  QB     66 PHE  QD      8.65            #peak   244
 64 ALA  QB     66 PHE  QE      5.50 
 64 ALA  QB     66 PHE  HZ      6.00            #peak   277
 65 HIS  H      65 HIS  HB3     2.93 
 65 HIS  H      65 HIS  HD2     5.50 
 65 HIS  H      66 PHE  H       5.50 
 65 HIS  H      66 PHE  QE      7.62 
 65 HIS  HA     66 PHE  H       2.90 
 65 HIS  HA     66 PHE  QD      7.62            #peak   136
 65 HIS  HA     66 PHE  QE      7.62            #peak   158
 65 HIS  QB     66 PHE  H       5.00 
 65 HIS  HD2    66 PHE  H       3.98 
 65 HIS  HD2    67 GLU  QG      6.38            #peak    27
 66 PHE  H      66 PHE  HB2     3.79 
 66 PHE  H      67 GLU  H       4.72 
 66 PHE  HA     66 PHE  QD      5.50 
 66 PHE  HA     66 PHE  QE      5.50 
 66 PHE  HA     66 PHE  HZ      6.00            #peak   576
 66 PHE  HA     67 GLU  H       2.90 
 66 PHE  HB2    67 GLU  H       4.00 
 66 PHE  HB3    67 GLU  H       3.98 
 66 PHE  QD     67 GLU  H       7.62 
 67 GLU  H      67 GLU  HB2     3.67 
 67 GLU  H      67 GLU  HB3     3.58 
 67 GLU  H      67 GLU  QG      6.38 
 67 GLU  H      68 LYS  H       5.50 
 67 GLU  HA     68 LYS  H       2.68 
 67 GLU  HA     70 ARG  H       5.50 
 67 GLU  HA     71 GLY  H       6.40 
 67 GLU  HB2    68 LYS  H       4.50 
 67 GLU  HB3    68 LYS  H       4.14 
 67 GLU  QG     68 LYS  H       6.38 
 68 LYS  H      68 LYS  HB2     3.21 
 68 LYS  H      68 LYS  HB3     3.48 
 68 LYS  H      68 LYS  QG      6.38 
 68 LYS  H      68 LYS  QD      6.38 
 69 ARG  HA     70 ARG  H       3.42 
 69 ARG  QD     70 ARG  H       6.38 
 70 ARG  H      70 ARG  HB2     3.95 
 70 ARG  H      70 ARG  HB3     4.11 
 70 ARG  H      70 ARG  QG      5.73 
 70 ARG  H      71 GLY  H       5.50 
 70 ARG  H      73 GLN  H       5.50 
 70 ARG  HA     71 GLY  H       2.90 
 70 ARG  HA     72 THR  H       5.50 
 70 ARG  HA     73 GLN  H       5.00 
 70 ARG  QB     71 GLY  H       5.50 
 70 ARG  HB2    71 GLY  H       5.22 
 71 GLY  H      72 THR  H       5.50 
 71 GLY  HA2    72 THR  H       3.30 
 71 GLY  HA3    72 THR  H       3.30 
 72 THR  H      72 THR  QG2     5.38 
 72 THR  H      73 GLN  H       5.50 
 72 THR  HA     73 GLN  H       2.90 
 72 THR  HA     79 TYR  QD      7.64            #peak   147
 72 THR  HA     79 TYR  QE      7.63            #peak   572
 72 THR  HB     73 GLN  H       4.51 
 73 GLN  H      74 GLY  H       5.50 
 73 GLN  HA     74 GLY  H       2.90 
 74 GLY  H      75 GLU  H       5.50 
 74 GLY  HA2    75 GLU  H       3.30 
 74 GLY  HA3    75 GLU  H       3.30 
 75 GLU  H      75 GLU  QG      6.16 
 75 GLU  H      76 ALA  H       4.07 
 75 GLU  HA     76 ALA  H       3.50 
 75 GLU  HA     78 ALA  H       3.80 
 75 GLU  HA     78 ALA  QB      3.80 
 75 GLU  QB     76 ALA  H       4.67 
 75 GLU  QG     76 ALA  H       6.38 
 76 ALA  H      77 ARG  H       5.50 
 76 ALA  HA     77 ARG  H       3.30 
 76 ALA  HA     78 ALA  H       5.00 
 76 ALA  HA     79 TYR  H       3.80 
 76 ALA  HA     79 TYR  HB2     5.00 
 76 ALA  HA     79 TYR  HB3     5.00 
 76 ALA  HA     80 SER  H       5.00 
 76 ALA  QB     77 ARG  H       3.30 
 76 ALA  QB     79 TYR  QD      8.67            #peak   558
 77 ARG  H      77 ARG  QB      4.14 
 77 ARG  H      77 ARG  QG      6.38 
 77 ARG  H      77 ARG  QD      6.38 
 77 ARG  H      78 ALA  H       4.07 
 77 ARG  H      78 ALA  HA      5.30 
 77 ARG  H      79 TYR  H       5.50 
 77 ARG  HA     78 ALA  H       3.30 
 77 ARG  QB     78 ALA  H       5.00 
 78 ALA  H      79 TYR  H       3.42 
 78 ALA  QB     79 TYR  H       3.30 
 78 ALA  QB     79 TYR  QD      8.67            #peak   551
 78 ALA  QB     79 TYR  QE      8.66            #peak   554
 79 TYR  H      79 TYR  HB2     3.52 
 79 TYR  H      79 TYR  HB3     3.48 
 79 TYR  H      79 TYR  QD      5.00 
 79 TYR  HA     79 TYR  QD      5.00 
 79 TYR  QD     80 SER  QB      8.52            #peak   415
 79 TYR  QD     83 GLU  HA      7.64            #peak   102
 79 TYR  QD     86 ARG  HD3     7.64            #peak    97
 79 TYR  QE     80 SER  QB      8.51            #peak   466
 79 TYR  QE     82 LYS  QE      8.51            #peak   112
 79 TYR  QE     83 GLU  HA      7.63            #peak   113
 79 TYR  QE     86 ARG  HD2     7.63            #peak    57
 79 TYR  QE     86 ARG  HD3     7.63            #peak   110
 81 MET  QE     90 PRO  HB2     5.00 
 81 MET  QE     90 PRO  HB3     5.00 
 82 LYS  HA     83 GLU  H       2.90 
 82 LYS  HA     84 ASP  H       4.38 
 82 LYS  QB     83 GLU  H       5.00 
 82 LYS  QB     84 ASP  H       5.00 
 82 LYS  QG     83 GLU  H       5.50 
 83 GLU  H      83 GLU  HB2     3.05 
 83 GLU  H      83 GLU  HB3     3.70 
 83 GLU  H      83 GLU  QG      6.28 
 83 GLU  H      84 ASP  H       3.30 
 83 GLU  QB     84 ASP  H       2.90 
 83 GLU  QB     84 ASP  HA      5.00 
 83 GLU  HB2    84 ASP  H       3.64 
 83 GLU  HB3    84 ASP  H       3.92 
 83 GLU  QG     84 ASP  H       6.38 
 84 ASP  H      85 THR  H       4.32 
 84 ASP  HA     86 ARG  H       4.29 
 84 ASP  QB     85 THR  QG2     5.00 
 84 ASP  HB2    85 THR  H       5.31 
 84 ASP  HB3    85 THR  H       5.50 
 84 ASP  HB3    86 ARG  H       5.50 
 85 THR  H      85 THR  QG2     6.53 
 85 THR  H      86 ARG  H       2.90 
 85 THR  HA     86 ARG  H       3.30 
 85 THR  HB     86 ARG  H       5.22 
 85 THR  QG2    86 ARG  H       5.50 
 85 THR  QG2    87 LEU  H       6.53 
 86 ARG  H      86 ARG  HB2     3.05 
 86 ARG  H      86 ARG  HB3     3.05 
 86 ARG  H      87 LEU  H       5.31 
 86 ARG  HA     87 LEU  H       2.90 
 86 ARG  HA     88 GLU  H       4.30 
 86 ARG  HB2    87 LEU  H       4.66 
 86 ARG  HB3    87 LEU  H       5.50 
 87 LEU  H      87 LEU  HB2     3.33 
 87 LEU  H      87 LEU  HB3     3.52 
 87 LEU  H      87 LEU  QD1     6.06 
 87 LEU  H      88 GLU  H       3.02 
 87 LEU  H      88 GLU  HA      4.82 
 87 LEU  HB2    88 GLU  H       3.30 
 87 LEU  HB3    88 GLU  H       2.90 
 87 LEU  HG     88 GLU  H       5.50 
 87 LEU  QD1    88 GLU  H       5.50 
 88 GLU  H      88 GLU  HB2     3.67 
 88 GLU  H      88 GLU  HB3     3.64 
 88 GLU  HA     89 GLY  H       2.90 
 88 GLU  HA     91 TRP  HZ3     6.30            #peak   144
 88 GLU  HA     91 TRP  HH2     5.50            #peak   129
 88 GLU  HB2    89 GLY  H       4.00 
 88 GLU  HB2    91 TRP  HZ2     5.00 
 88 GLU  HB2    91 TRP  HZ3     5.50            #peak    42
 88 GLU  HB2    91 TRP  HH2     3.30 
 88 GLU  HB3    89 GLY  H       3.98 
 88 GLU  HB3    91 TRP  HZ2     5.50 
 88 GLU  HB3    91 TRP  HZ3     5.50            #peak    41
 88 GLU  HB3    91 TRP  HH2     3.30 
 88 GLU  HG2    89 GLY  H       3.70 
 88 GLU  HG2    91 TRP  HZ2     3.30 
 88 GLU  HG3    91 TRP  HZ2     5.00 
 89 GLY  HA2    90 PRO  HA      3.30 
 89 GLY  HA3    90 PRO  HA      3.30 
 89 GLY  H      91 TRP  HZ2     5.50 
 90 PRO  HA     91 TRP  H       3.30 
 91 TRP  H      91 TRP  HA      2.90 
 91 TRP  H      91 TRP  HB3     3.76 
 91 TRP  H      92 GLU  H       4.45 
 91 TRP  HA     91 TRP  HE1     6.30 
 91 TRP  HA     92 GLU  H       2.68 
 91 TRP  HB2    92 GLU  H       4.50 
 91 TRP  HB2    93 TYR  QD      7.64            #peak   639
 91 TRP  HB2    93 TYR  QE      7.63            #peak    44
 91 TRP  HB3    92 GLU  H       4.94 
 91 TRP  HB3    93 TYR  QD      7.64            #peak    23
 91 TRP  HB3    93 TYR  QE      7.63            #peak   651
 91 TRP  HD1    92 GLU  H       5.50 
 91 TRP  HD1    93 TYR  QE      7.63            #peak   503
 92 GLU  H      92 GLU  HB2     3.36 
 92 GLU  H      92 GLU  HB3     3.76 
 92 GLU  H      92 GLU  QG      6.38 
 92 GLU  H      93 TYR  H       5.00 
 92 GLU  HA     93 TYR  H       2.90 
 92 GLU  HA     93 TYR  QD      7.64            #peak   133
 92 GLU  HA     93 TYR  QE      7.63            #peak   458
 92 GLU  HB2    93 TYR  H       4.45 
 92 GLU  HB3    93 TYR  H       4.14 
 92 GLU  QG     93 TYR  H       5.00 
 93 TYR  H      93 TYR  HB2     4.20 
 93 TYR  H      93 TYR  HB3     3.92 
 93 TYR  H      93 TYR  QD      5.00 
 93 TYR  H      94 GLY  H       5.19 
 93 TYR  HA     93 TYR  QD      7.64            #peak   134
 93 TYR  HA     94 GLY  H       2.59 
 93 TYR  HB2    94 GLY  H       3.70 
 93 TYR  HB3    94 GLY  H       3.30 
 93 TYR  QD     94 GLY  H       5.50 
 93 TYR  QD     94 GLY  HA3     7.64            #peak    81
 94 GLY  H      94 GLY  HA3     2.93 
 94 GLY  H      95 GLU  H       4.50 
 94 GLY  HA2    95 GLU  H       2.90 
 94 GLY  HA3    95 GLU  H       2.90 
 95 GLU  H      95 GLU  HB2     3.61 
 95 GLU  H      95 GLU  HB3     3.76 
 95 GLU  H      95 GLU  QG      5.94 
###############################################
#########LOWER LIMIT CONSTRAINTS#################
###############################################

89  GLY   HA3    90  PRO  CA     2.61  50.0
89  GLY   HA2    90  PRO  CA     2.61  50.0

##Contacts B1-B3################################

 8  TRP   N    46  ILE  O     2.7 # HN8 protected
 8  TRP   H    46  ILE  O     1.8 # 

 8  TRP   O    46  ILE  N     2.7 # HN46 protected
 8  TRP   O    46  ILE  H     1.8 # 
 
 10  PHE   N    44  GLY  O     2.7 # HN10 protected
 10  PHE   H    44  GLY  O     1.8 # 
 
 10  PHE   O    44  GLY  N     2.7 # HN44 protected
 10  PHE   O    44  GLY  H     1.8 # 
 
 12  LEU   N    42  PHE  O     2.7 # HN12 protected
 12  LEU   H    42  PHE  O     1.8 # 
 
 12  LEU   O    42  PHE  N     2.7 # HN42 protected
 12  LEU   O    42  PHE  H     1.8 # 

##Contacts B1-B4################################

 9  CYS   N    67  GLU  O     2.7 # HN9 protected
 9  CYS   H    67  GLU  O     1.8 # 

 9  CYS   O    67  GLU  N     2.7 # HN67 not protected
 9  CYS   O    67  GLU  H     1.8 # 
 
 11  THR   N    65  HIS  O     2.7 # HN11 not protected
 11  THR   H    65  HIS  O     1.8 # 
 
 11  THR   O 65  HIS  N     2.7 # HN65 not protected
 11  THR   O 65  HIS  H     1.8 # 

 ##Contacts B2-B3################################
 29  VAL   N    45  TYR  O     2.7 # HN29 protected
 29  VAL   H    45  TYR  O     1.8 #

 29  VAL   O    45  TYR  N     2.7 # HN45 protected
 29  VAL   O    45  TYR  H     1.8 # 

 31  GLN   N    43  GLN  O     2.7 # HN31 protected
 31  GLN   H    43  GLN  O     1.8 #

 31  GLN   O    43  GLN  N     2.7 # HN43 protected
 31  GLN   O    43  GLN  H     1.8 # 
 
 33  GLU   N    41  HIS  O     2.7 # HN33 protected
 33  GLU   H    41  HIS  O     1.8 #

 33  GLU   O    41  HIS  N     2.7 # HN41 protected
 33  GLU   O    41  HIS  H     1.8 # 

##Contacts B2-B5################################

 28  LEU   N    93  TYR  O     2.7 # HN28 protected
 28  LEU   H    93  TYR  O     1.8 #

 28  LEU   O    93  TYR  N     2.7 # HN93 NOT protected!!
 28  LEU   O    93  TYR  H     1.8 # 
 
 30  TYR   N    91  TRP  O     2.7 # HN30 NOT protected!!
 30  TYR   H    91  TRP  O     1.8 #

 30  TYR   O    91  TRP  N     2.7 # HN91 NOT protected!!
 30  TYR   O    91  TRP  H     1.8 #
###############################################
#########ANGULAR CONSTRAINTS#################
###############################################

   4 GLN   PHI    -116.0   -72.0
   4 GLN   PSI     143.0   171.0
   5 VAL   PHI    -143.0  -101.0
   5 VAL   PSI     135.0   157.0
   6 ILE   PHI    -114.0   -88.0
   6 ILE   PSI     135.0   149.0
   7 CYS   PHI    -145.0   -80.0
   7 CYS   PSI     116.0   154.0
   8 TRP   PHI    -141.0  -109.0
   8 TRP   PSI     116.0   160.0
   9 CYS   PHI    -131.0   -93.0
   9 CYS   PSI     118.0   142.0
  10 PHE   PHI    -143.0  -127.0
  10 PHE   PSI     136.0   162.0
  11 THR   PHI    -133.0  -115.0
  11 THR   PSI     122.0   148.0
  12 LEU   PHI    -153.0  -109.0
  12 LEU   PSI     119.0   143.0
  13 ASN   PHI    -107.0   -61.0
  13 ASN   PSI     123.0   143.0
  19 LEU   PHI    -130.0   -70.0
  19 LEU   PSI     115.0   171.0
  20 SER   PHI    -149.0  -103.0
  20 SER   PSI     127.0   171.0
  23 ASP   PHI     -85.0   -55.0
  23 ASP   PSI     -43.0   -25.0
  27 TYR   PHI    -162.0  -132.0
  27 TYR   PSI     132.0   154.0
  28 LEU   PHI    -144.0  -112.0
  28 LEU   PSI     127.0   137.0
  29 VAL   PHI    -139.0  -113.0
  29 VAL   PSI     123.0   161.0
  30 TYR   PHI    -152.0  -112.0
  30 TYR   PSI     140.0   166.0
  31 GLN   PHI    -151.0  -123.0
  31 GLN   PSI     125.0   155.0
  32 THR   PHI    -126.0   -96.0
  32 THR   PSI     118.0   146.0
  33 GLU   PHI    -153.0  -107.0
  33 GLU   PSI     132.0   164.0
  34 GLN   PHI    -127.0   -85.0
  34 GLN   PSI     115.0   139.0
  40 ILE   PHI    -135.0   -87.0
  40 ILE   PSI     139.0   165.0
  41 HIS   PHI    -150.0  -110.0
  41 HIS   PSI     132.0   164.0
  42 PHE   PHI    -132.0   -94.0
  42 PHE   PSI     127.0   157.0
  43 GLN   PHI    -145.0  -113.0
  43 GLN   PSI     121.0   161.0
  45 TYR   PHI    -123.0  -103.0
  45 TYR   PSI     117.0   143.0
  46 ILE   PHI    -139.0  -119.0
  46 ILE   PSI     128.0   158.0
  47 GLU   PHI    -133.0   -97.0
  47 GLU   PSI     114.0   134.0
  48 MET   PHI    -115.0   -81.0
  48 MET   PSI     133.0   179.0
  52 THR   PHI    -138.0  -100.0
  52 THR   PSI     116.0   160.0
  53 SER   PHI     -96.0   -76.0
  53 SER   PSI     153.0   179.0
  54 LEU   PHI     -69.0   -53.0
  54 LEU   PSI     -53.0   -31.0
  55 ALA   PHI     -67.0   -55.0
  55 ALA   PSI     -48.0   -30.0
  56 GLY   PHI     -71.0   -61.0
  56 GLY   PSI     -46.0   -34.0
  57 MET   PHI     -72.0   -60.0
  57 MET   PSI     -48.0   -22.0
  58 LYS   PHI     -69.0   -55.0
  58 LYS   PSI     -50.0   -24.0
  59 LYS   PHI     -74.0   -58.0
  59 LYS   PSI     -43.0   -33.0
  60 LEU   PHI     -81.0   -69.0
  60 LEU   PSI     -38.0   -16.0
  65 HIS   PHI    -111.0   -95.0
  65 HIS   PSI     112.0   140.0
  66 PHE   PHI    -137.0  -107.0
  66 PHE   PSI     134.0   158.0
  67 GLU   PHI    -157.0  -129.0
  67 GLU   PSI     112.0   150.0
  75 GLU   PHI     -78.0   -58.0
  75 GLU   PSI     -50.0   -28.0
  76 ALA   PHI     -94.0   -64.0
  76 ALA   PSI     -46.0    10.0
  79 TYR   PHI     -86.0   -54.0
  79 TYR   PSI     -54.0    -8.0
  83 GLU   PHI     -63.0   -53.0
  83 GLU   PSI     -45.0   -35.0
  84 ASP   PHI     -76.0   -54.0
  84 ASP   PSI     -36.0   -18.0
  85 THR   PHI    -120.0   -88.0
  85 THR   PSI     -13.0     7.0
  86 ARG   PHI    -101.0   -47.0
  86 ARG   PSI     121.0   149.0
  88 GLU   PHI    -148.0  -108.0
  88 GLU   PSI     138.0   174.0
  91 TRP   PHI    -143.0   -91.0
  91 TRP   PSI     108.0   150.0
  92 GLU   PHI    -153.0  -119.0
  92 GLU   PSI     138.0   164.0
  93 TYR   PHI    -141.0  -113.0
  93 TYR   PSI     130.0   162.0
  22 HIS   CHI1   -200.0  -160.0
  65 HIS   CHI1   -200.0  -160.0
  42 PHE   CHI1    -80.0   -40.0
  66 PHE   CHI1    -95.0   -25.0
  91 TRP   CHI1    -80.0   -40.0
  93 TYR   CHI1    -80.0   -40.0


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    ALA   2          1H        ALA   2 -14.624   1.461  20.222
    2    HA   ALA   2           HA       ALA   2 -13.789   0.995  17.950
    3   1HB   ALA   2          1HB       ALA   2 -12.720   3.044  17.539
    4   2HB   ALA   2          2HB       ALA   2 -13.771   3.349  18.924
    5   3HB   ALA   2          3HB       ALA   2 -12.041   3.113  19.166
    6    H    ARG   3           H        ARG   3 -12.399  -0.246  16.881
    7    HA   ARG   3           HA       ARG   3  -9.803  -0.840  18.143
    8   1HB   ARG   3          1HB       ARG   3 -11.800  -2.551  16.778
    9   2HB   ARG   3          2HB       ARG   3 -10.111  -2.898  16.432
   10   1HG   ARG   3          1HG       ARG   3  -9.793  -2.922  18.973
   11   2HG   ARG   3          2HG       ARG   3 -11.553  -3.024  19.053
   12   1HD   ARG   3          1HD       ARG   3 -11.480  -5.036  17.639
   13   2HD   ARG   3          2HD       ARG   3  -9.719  -4.941  17.619
   14    HE   ARG   3           HE       ARG   3 -10.476  -4.991  20.279
   15   1HH1  ARG   3          1HH1      ARG   3 -10.741  -7.063  17.495
   16   2HH1  ARG   3          2HH1      ARG   3 -10.734  -8.527  18.421
   17   1HH2  ARG   3          1HH2      ARG   3 -10.465  -6.911  21.510
   18   2HH2  ARG   3          2HH2      ARG   3 -10.578  -8.440  20.706
   19    H    GLN   4           H        GLN   4  -7.969  -0.590  16.975
   20    HA   GLN   4           HA       GLN   4  -8.263   0.603  14.314
   21   1HB   GLN   4          1HB       GLN   4  -6.249   0.825  16.493
   22   2HB   GLN   4          2HB       GLN   4  -5.681   1.014  14.839
   23   1HG   GLN   4          1HG       GLN   4  -7.387   2.781  14.509
   24   2HG   GLN   4          2HG       GLN   4  -7.804   2.640  16.217
   25   1HE2  GLN   4          1HE2      GLN   4  -7.026   5.038  15.254
   26   2HE2  GLN   4          2HE2      GLN   4  -5.452   5.443  15.840
   27    H    VAL   5           H        VAL   5  -6.851  -0.026  12.592
   28    HA   VAL   5           HA       VAL   5  -5.878  -2.798  12.847
   29    HB   VAL   5           HB       VAL   5  -6.388  -3.139  10.493
   30   1HG1  VAL   5          1HG1      VAL   5  -9.007  -2.383  10.848
   31   2HG1  VAL   5          2HG1      VAL   5  -8.282  -3.889  11.413
   32   3HG1  VAL   5          3HG1      VAL   5  -8.402  -2.504  12.499
   33   1HG2  VAL   5          1HG2      VAL   5  -6.679  -1.461   9.067
   34   2HG2  VAL   5          2HG2      VAL   5  -8.051  -0.856   9.995
   35   3HG2  VAL   5          3HG2      VAL   5  -6.415  -0.331  10.395
   36    H    ILE   6           H        ILE   6  -4.070  -3.380  11.466
   37    HA   ILE   6           HA       ILE   6  -2.112  -1.240  11.361
   38    HB   ILE   6           HB       ILE   6  -1.738  -4.153  10.664
   39   1HG1  ILE   6          1HG1      ILE   6  -0.550  -3.933  13.052
   40   2HG1  ILE   6          2HG1      ILE   6  -1.795  -2.708  13.265
   41   1HG2  ILE   6          1HG2      ILE   6   0.656  -3.271  11.545
   42   2HG2  ILE   6          2HG2      ILE   6   0.175  -3.289   9.849
   43   3HG2  ILE   6          3HG2      ILE   6   0.031  -1.805  10.790
   44   1HD1  ILE   6          1HD1      ILE   6  -3.168  -4.335  13.859
   45   2HD1  ILE   6          2HD1      ILE   6  -3.116  -4.912  12.193
   46   3HD1  ILE   6          3HD1      ILE   6  -1.998  -5.568  13.388
   47    H    CYS   7           H        CYS   7  -0.911  -0.678   9.511
   48    HA   CYS   7           HA       CYS   7  -2.440  -0.705   7.081
   49   1HB   CYS   7          1HB       CYS   7  -0.824   0.810   6.223
   50   2HB   CYS   7          2HB       CYS   7  -1.036   1.232   7.918
   51    HG   CYS   7           HG       CYS   7   1.704   0.332   6.309
   52    H    TRP   8           H        TRP   8  -1.627  -1.420   5.013
   53    HA   TRP   8           HA       TRP   8   0.004  -3.852   5.274
   54   1HB   TRP   8          1HB       TRP   8  -2.075  -3.054   3.232
   55   2HB   TRP   8          2HB       TRP   8  -1.046  -4.474   3.063
   56    HD1  TRP   8           HD1      TRP   8  -3.517  -3.076   5.725
   57    HE1  TRP   8           HE1      TRP   8  -4.814  -5.068   6.712
   58    HE3  TRP   8           HE3      TRP   8  -1.245  -6.874   3.164
   59    HZ2  TRP   8           HZ2      TRP   8  -4.867  -7.878   6.441
   60    HZ3  TRP   8           HZ3      TRP   8  -1.977  -9.185   3.587
   61    HH2  TRP   8           HH2      TRP   8  -3.751  -9.673   5.192
   62    H    CYS   9           H        CYS   9   2.042  -3.647   4.648
   63    HA   CYS   9           HA       CYS   9   2.748  -1.596   2.685
   64   1HB   CYS   9          1HB       CYS   9   5.095  -2.095   3.392
   65   2HB   CYS   9          2HB       CYS   9   4.062  -1.534   4.701
   66    HG   CYS   9           HG       CYS   9   5.944  -3.645   5.407
   67    H    PHE  10           H        PHE  10   2.945  -2.144   0.628
   68    HA   PHE  10           HA       PHE  10   4.057  -4.773  -0.046
   69   1HB   PHE  10          1HB       PHE  10   2.351  -5.354  -1.501
   70   2HB   PHE  10          2HB       PHE  10   1.449  -4.555  -0.218
   71    HD1  PHE  10           HD2      PHE  10   1.036  -2.003  -0.551
   72    HD2  PHE  10           HD1      PHE  10   2.022  -4.708  -3.685
   73    HE1  PHE  10           HE2      PHE  10   0.080  -0.441  -2.194
   74    HE2  PHE  10           HE1      PHE  10   1.068  -3.150  -5.334
   75    HZ   PHE  10           HZ       PHE  10   0.094  -1.014  -4.590
   76    H    THR  11           H        THR  11   4.780  -4.888  -2.336
   77    HA   THR  11           HA       THR  11   5.515  -2.257  -3.425
   78    HB   THR  11           HB       THR  11   7.468  -4.542  -3.483
   79    HG1  THR  11           HG1      THR  11   8.107  -4.098  -1.500
   80   1HG2  THR  11          1HG2      THR  11   8.799  -2.121  -3.313
   81   2HG2  THR  11          2HG2      THR  11   7.404  -1.760  -4.331
   82   3HG2  THR  11          3HG2      THR  11   8.517  -3.053  -4.783
   83    H    LEU  12           H        LEU  12   4.890  -2.074  -5.467
   84    HA   LEU  12           HA       LEU  12   4.497  -4.526  -7.046
   85   1HB   LEU  12          1HB       LEU  12   2.459  -3.301  -6.758
   86   2HB   LEU  12          2HB       LEU  12   3.236  -1.799  -7.257
   87    HG   LEU  12           HG       LEU  12   3.315  -2.484  -9.522
   88   1HD1  LEU  12          1HD1      LEU  12   2.217  -4.858  -9.971
   89   2HD1  LEU  12          2HD1      LEU  12   2.898  -5.186  -8.378
   90   3HD1  LEU  12          3HD1      LEU  12   3.948  -4.659  -9.693
   91   1HD2  LEU  12          1HD2      LEU  12   0.745  -2.929  -8.091
   92   2HD2  LEU  12          2HD2      LEU  12   0.831  -3.329  -9.806
   93   3HD2  LEU  12          3HD2      LEU  12   1.188  -1.689  -9.265
   94    H    ASN  13           H        ASN  13   5.891  -4.912  -8.625
   95    HA   ASN  13           HA       ASN  13   7.538  -2.697  -9.627
   96   1HB   ASN  13          1HB       ASN  13   8.927  -4.669 -10.564
   97   2HB   ASN  13          2HB       ASN  13   8.981  -4.359  -8.831
   98   1HD2  ASN  13          1HD2      ASN  13   9.344  -6.338  -8.043
   99   2HD2  ASN  13          2HD2      ASN  13   8.314  -7.703  -8.289
  100    H    ASN  14           H        ASN  14   7.542  -2.123 -11.735
  101    HA   ASN  14           HA       ASN  14   6.695  -1.845 -13.836
  102   1HB   ASN  14          1HB       ASN  14   8.102  -4.089 -13.849
  103   2HB   ASN  14          2HB       ASN  14   6.526  -4.811 -14.162
  104   1HD2  ASN  14          1HD2      ASN  14   8.047  -5.304 -16.109
  105   2HD2  ASN  14          2HD2      ASN  14   7.858  -4.237 -17.456
  106    HA   PRO  15           HA       PRO  15   2.373  -2.947 -12.397
  107   1HB   PRO  15          1HB       PRO  15   1.490  -0.387 -12.207
  108   2HB   PRO  15          2HB       PRO  15   2.283  -1.231 -10.872
  109   1HG   PRO  15          1HG       PRO  15   3.430   0.733 -12.818
  110   2HG   PRO  15          2HG       PRO  15   3.677   0.620 -11.066
  111   1HD   PRO  15          1HD       PRO  15   5.482  -0.316 -12.855
  112   2HD   PRO  15          2HD       PRO  15   5.232  -1.071 -11.268
  113    H    LEU  16           H        LEU  16   0.665  -3.111 -13.771
  114    HA   LEU  16           HA       LEU  16   1.055  -2.165 -16.487
  115   1HB   LEU  16          1HB       LEU  16  -0.765  -4.114 -15.153
  116   2HB   LEU  16          2HB       LEU  16  -1.215  -3.457 -16.725
  117    HG   LEU  16           HG       LEU  16   1.505  -4.441 -16.739
  118   1HD1  LEU  16          1HD1      LEU  16   0.946  -6.035 -15.114
  119   2HD1  LEU  16          2HD1      LEU  16   0.746  -6.872 -16.653
  120   3HD1  LEU  16          3HD1      LEU  16  -0.668  -6.279 -15.781
  121   1HD2  LEU  16          1HD2      LEU  16   0.073  -3.951 -18.702
  122   2HD2  LEU  16          2HD2      LEU  16  -0.946  -5.321 -18.260
  123   3HD2  LEU  16          3HD2      LEU  16   0.739  -5.584 -18.712
  124    H    SER  17           H        SER  17  -0.341  -0.953 -13.740
  125    HA   SER  17           HA       SER  17  -1.488   1.265 -14.990
  126   1HB   SER  17          1HB       SER  17  -3.680   0.800 -15.311
  127   2HB   SER  17          2HB       SER  17  -3.154  -0.883 -15.316
  128    HG   SER  17           HG       SER  17  -4.800  -0.696 -13.836
  129    HA   PRO  18           HA       PRO  18  -1.372   2.809 -10.887
  130   1HB   PRO  18          1HB       PRO  18  -3.380   4.637 -10.892
  131   2HB   PRO  18          2HB       PRO  18  -1.856   4.881 -11.754
  132   1HG   PRO  18          1HG       PRO  18  -4.504   3.966 -12.809
  133   2HG   PRO  18          2HG       PRO  18  -3.360   5.125 -13.511
  134   1HD   PRO  18          1HD       PRO  18  -3.539   2.558 -14.357
  135   2HD   PRO  18          2HD       PRO  18  -2.012   3.464 -14.370
  136    H    LEU  19           H        LEU  19  -2.349   2.717  -8.844
  137    HA   LEU  19           HA       LEU  19  -4.403   0.713  -8.587
  138   1HB   LEU  19          1HB       LEU  19  -3.201   2.354  -6.373
  139   2HB   LEU  19          2HB       LEU  19  -3.962   0.768  -6.260
  140    HG   LEU  19           HG       LEU  19  -1.416   1.178  -7.798
  141   1HD1  LEU  19          1HD1      LEU  19  -1.365   1.962  -5.321
  142   2HD1  LEU  19          2HD1      LEU  19  -0.099   0.894  -5.926
  143   3HD1  LEU  19          3HD1      LEU  19  -1.421   0.235  -4.964
  144   1HD2  LEU  19          1HD2      LEU  19  -1.635  -1.309  -6.447
  145   2HD2  LEU  19          2HD2      LEU  19  -1.632  -0.994  -8.183
  146   3HD2  LEU  19          3HD2      LEU  19  -3.154  -1.006  -7.291
  147    H    SER  20           H        SER  20  -6.173   1.126  -6.898
  148    HA   SER  20           HA       SER  20  -7.196   3.849  -6.897
  149   1HB   SER  20          1HB       SER  20  -9.413   3.114  -7.782
  150   2HB   SER  20          2HB       SER  20  -8.118   3.006  -8.975
  151    HG   SER  20           HG       SER  20  -9.102   1.083  -9.131
  152    H    LEU  21           H        LEU  21  -9.234   4.002  -5.585
  153    HA   LEU  21           HA       LEU  21  -8.844   2.810  -3.066
  154   1HB   LEU  21          1HB       LEU  21  -9.913   4.904  -3.119
  155   2HB   LEU  21          2HB       LEU  21 -11.116   4.349  -4.282
  156    HG   LEU  21           HG       LEU  21 -12.034   2.867  -2.465
  157   1HD1  LEU  21          1HD1      LEU  21  -9.734   3.936  -1.089
  158   2HD1  LEU  21          2HD1      LEU  21 -10.803   2.608  -0.636
  159   3HD1  LEU  21          3HD1      LEU  21 -11.223   4.265  -0.202
  160   1HD2  LEU  21          1HD2      LEU  21 -13.405   4.653  -2.772
  161   2HD2  LEU  21          2HD2      LEU  21 -12.118   5.831  -2.519
  162   3HD2  LEU  21          3HD2      LEU  21 -12.854   5.018  -1.138
  163    H    HIS  22           H        HIS  22 -10.129   1.307  -1.922
  164    HA   HIS  22           HA       HIS  22 -11.624  -0.550  -3.656
  165   1HB   HIS  22          1HB       HIS  22  -9.402  -1.320  -2.591
  166   2HB   HIS  22          2HB       HIS  22 -10.300  -1.356  -1.076
  167    HD1  HIS  22           HD1      HIS  22 -10.495  -3.815  -0.679
  168    HD2  HIS  22           HD2      HIS  22 -11.634  -2.737  -4.526
  169    HE1  HIS  22           HE1      HIS  22 -11.456  -5.900  -1.705
  170    H    ASP  23           H        ASP  23 -13.636  -1.160  -3.062
  171    HA   ASP  23           HA       ASP  23 -15.094   0.401  -1.246
  172   1HB   ASP  23          1HB       ASP  23 -15.621  -2.020  -2.875
  173   2HB   ASP  23          2HB       ASP  23 -16.699  -1.745  -1.509
  174    H    SER  24           H        SER  24 -13.206  -2.448  -0.801
  175    HA   SER  24           HA       SER  24 -14.441  -3.166   1.715
  176   1HB   SER  24          1HB       SER  24 -11.820  -4.231   0.674
  177   2HB   SER  24          2HB       SER  24 -12.973  -5.019   1.750
  178    HG   SER  24           HG       SER  24 -13.917  -5.786   0.050
  179    H    MET  25           H        MET  25 -11.450  -1.645   0.604
  180    HA   MET  25           HA       MET  25 -10.333  -1.377   3.220
  181   1HB   MET  25          1HB       MET  25  -8.547  -0.275   2.196
  182   2HB   MET  25          2HB       MET  25  -9.112  -1.378   0.949
  183   1HG   MET  25          1HG       MET  25 -10.214   0.378  -0.216
  184   2HG   MET  25          2HG       MET  25  -9.942   1.504   1.113
  185   1HE   MET  25          1HE       MET  25  -8.089  -1.137  -0.729
  186   2HE   MET  25          2HE       MET  25  -7.849  -0.138  -2.164
  187   3HE   MET  25          3HE       MET  25  -6.497  -0.463  -1.077
  188    H    LYS  26           H        LYS  26  -9.507   1.112   3.598
  189    HA   LYS  26           HA       LYS  26 -11.943   2.769   3.614
  190   1HB   LYS  26          1HB       LYS  26 -10.504   1.720   5.841
  191   2HB   LYS  26          2HB       LYS  26 -10.281   3.464   5.823
  192   1HG   LYS  26          1HG       LYS  26 -12.798   3.643   5.601
  193   2HG   LYS  26          2HG       LYS  26 -12.852   1.922   5.987
  194   1HD   LYS  26          1HD       LYS  26 -11.425   2.558   8.036
  195   2HD   LYS  26          2HD       LYS  26 -11.940   4.212   7.698
  196   1HE   LYS  26          1HE       LYS  26 -14.288   3.478   7.825
  197   2HE   LYS  26          2HE       LYS  26 -13.741   1.850   8.223
  198   1HZ   LYS  26          1HZ       LYS  26 -12.466   3.513  10.006
  199   2HZ   LYS  26          2HZ       LYS  26 -13.766   2.483  10.333
  200   3HZ   LYS  26          3HZ       LYS  26 -14.051   4.100   9.926
  201    H    TYR  27           H        TYR  27  -8.417   2.692   3.627
  202    HA   TYR  27           HA       TYR  27  -8.424   5.316   2.315
  203   1HB   TYR  27          1HB       TYR  27  -7.786   5.287   4.865
  204   2HB   TYR  27          2HB       TYR  27  -6.248   4.673   4.269
  205    HD1  TYR  27           HD1      TYR  27  -8.595   7.306   3.021
  206    HD2  TYR  27           HD2      TYR  27  -4.662   6.346   4.332
  207    HE1  TYR  27           HE1      TYR  27  -7.876   9.606   2.529
  208    HE2  TYR  27           HE2      TYR  27  -3.933   8.644   3.845
  209    HH   TYR  27           HH       TYR  27  -5.775  11.140   3.568
  210    H    LEU  28           H        LEU  28  -6.693   5.687   0.888
  211    HA   LEU  28           HA       LEU  28  -5.025   3.342   0.280
  212   1HB   LEU  28          1HB       LEU  28  -6.616   3.234  -1.411
  213   2HB   LEU  28          2HB       LEU  28  -6.720   4.986  -1.556
  214    HG   LEU  28           HG       LEU  28  -4.639   5.079  -2.738
  215   1HD1  LEU  28          1HD1      LEU  28  -3.058   3.607  -2.217
  216   2HD1  LEU  28          2HD1      LEU  28  -3.903   2.451  -3.246
  217   3HD1  LEU  28          3HD1      LEU  28  -4.230   2.492  -1.515
  218   1HD2  LEU  28          1HD2      LEU  28  -6.484   4.623  -4.161
  219   2HD2  LEU  28          2HD2      LEU  28  -6.487   2.914  -3.725
  220   3HD2  LEU  28          3HD2      LEU  28  -5.165   3.578  -4.687
  221    H    VAL  29           H        VAL  29  -2.923   3.780   0.182
  222    HA   VAL  29           HA       VAL  29  -2.043   6.472  -0.574
  223    HB   VAL  29           HB       VAL  29  -1.084   5.014   1.893
  224   1HG1  VAL  29          1HG1      VAL  29   0.041   7.237   0.312
  225   2HG1  VAL  29          2HG1      VAL  29   0.033   7.451   2.065
  226   3HG1  VAL  29          3HG1      VAL  29   0.844   6.058   1.347
  227   1HG2  VAL  29          1HG2      VAL  29  -1.876   7.414   2.776
  228   2HG2  VAL  29          2HG2      VAL  29  -2.989   7.227   1.422
  229   3HG2  VAL  29          3HG2      VAL  29  -2.948   6.016   2.704
  230    H    TYR  30           H        TYR  30  -0.583   6.328  -2.132
  231    HA   TYR  30           HA       TYR  30   1.513   4.334  -2.032
  232   1HB   TYR  30          1HB       TYR  30   1.020   3.186  -3.999
  233   2HB   TYR  30          2HB       TYR  30  -0.564   3.364  -3.254
  234    HD1  TYR  30           HD2      TYR  30  -2.121   5.137  -4.104
  235    HD2  TYR  30           HD1      TYR  30   1.495   4.143  -6.113
  236    HE1  TYR  30           HE2      TYR  30  -2.962   6.224  -6.145
  237    HE2  TYR  30           HE1      TYR  30   0.665   5.228  -8.159
  238    HH   TYR  30           HH       TYR  30  -2.066   5.741  -8.991
  239    H    GLN  31           H        GLN  31   3.184   4.708  -3.653
  240    HA   GLN  31           HA       GLN  31   3.087   7.268  -5.041
  241   1HB   GLN  31          1HB       GLN  31   4.894   8.258  -3.970
  242   2HB   GLN  31          2HB       GLN  31   4.035   7.503  -2.634
  243   1HG   GLN  31          1HG       GLN  31   5.583   5.624  -2.683
  244   2HG   GLN  31          2HG       GLN  31   6.437   6.357  -4.040
  245   1HE2  GLN  31          1HE2      GLN  31   5.142   7.821  -1.095
  246   2HE2  GLN  31          2HE2      GLN  31   6.654   8.429  -0.521
  247    H    THR  32           H        THR  32   4.800   7.535  -6.600
  248    HA   THR  32           HA       THR  32   5.678   4.959  -7.665
  249    HB   THR  32           HB       THR  32   5.991   7.626  -9.032
  250    HG1  THR  32           HG1      THR  32   3.926   6.859 -10.081
  251   1HG2  THR  32          1HG2      THR  32   5.328   5.357 -10.683
  252   2HG2  THR  32          2HG2      THR  32   6.746   5.013  -9.693
  253   3HG2  THR  32          3HG2      THR  32   6.733   6.421 -10.756
  254    H    GLU  33           H        GLU  33   7.790   4.400  -7.984
  255    HA   GLU  33           HA       GLU  33   9.850   6.330  -7.164
  256   1HB   GLU  33          1HB       GLU  33   9.291   3.632  -6.052
  257   2HB   GLU  33          2HB       GLU  33  10.978   4.069  -6.276
  258   1HG   GLU  33          1HG       GLU  33  10.884   5.775  -4.727
  259   2HG   GLU  33          2HG       GLU  33   9.134   5.940  -4.862
  260    H    GLN  34           H        GLN  34  12.009   5.811  -7.954
  261    HA   GLN  34           HA       GLN  34  11.867   4.535 -10.587
  262   1HB   GLN  34          1HB       GLN  34  13.029   6.924  -9.685
  263   2HB   GLN  34          2HB       GLN  34  14.378   5.849 -10.031
  264   1HG   GLN  34          1HG       GLN  34  12.397   5.749 -12.126
  265   2HG   GLN  34          2HG       GLN  34  12.956   7.396 -11.843
  266   1HE2  GLN  34          1HE2      GLN  34  13.880   7.261 -13.965
  267   2HE2  GLN  34          2HE2      GLN  34  15.406   6.486 -14.195
  268    H    GLY  35           H        GLY  35  12.927   2.703 -11.054
  269   1HA   GLY  35          1HA       GLY  35  15.342   1.824 -10.026
  270   2HA   GLY  35          2HA       GLY  35  14.104   1.173  -8.963
  271    H    GLU  36           H        GLU  36  15.553  -0.674 -10.124
  272    HA   GLU  36           HA       GLU  36  15.678  -2.345 -11.707
  273   1HB   GLU  36          1HB       GLU  36  13.409  -3.489 -11.947
  274   2HB   GLU  36          2HB       GLU  36  14.038  -3.304 -10.316
  275   1HG   GLU  36          1HG       GLU  36  12.596  -1.380  -9.960
  276   2HG   GLU  36          2HG       GLU  36  11.987  -1.519 -11.608
  277    H    ALA  37           H        ALA  37  16.331  -1.095 -13.519
  278    HA   ALA  37           HA       ALA  37  16.219  -0.469 -15.704
  279   1HB   ALA  37          1HB       ALA  37  15.059  -1.866 -16.999
  280   2HB   ALA  37          2HB       ALA  37  14.512  -2.618 -15.500
  281   3HB   ALA  37          3HB       ALA  37  13.520  -1.389 -16.281
  282    H    GLY  38           H        GLY  38  14.797   0.828 -17.304
  283   1HA   GLY  38          1HA       GLY  38  14.201   3.297 -16.219
  284   2HA   GLY  38          2HA       GLY  38  13.588   2.727 -17.764
  285    H    ASN  39           H        ASN  39  12.169   0.476 -16.418
  286    HA   ASN  39           HA       ASN  39   9.643   1.587 -16.216
  287   1HB   ASN  39          1HB       ASN  39  10.517  -0.892 -14.730
  288   2HB   ASN  39          2HB       ASN  39   8.909  -0.516 -15.344
  289   1HD2  ASN  39          1HD2      ASN  39  11.502  -2.377 -15.865
  290   2HD2  ASN  39          2HD2      ASN  39  11.381  -2.612 -17.573
  291    H    ILE  40           H        ILE  40   8.236   1.351 -14.162
  292    HA   ILE  40           HA       ILE  40   9.693   2.463 -11.855
  293    HB   ILE  40           HB       ILE  40   7.322   3.616 -11.481
  294   1HG1  ILE  40          1HG1      ILE  40   7.596   3.519 -14.493
  295   2HG1  ILE  40          2HG1      ILE  40   6.384   2.644 -13.564
  296   1HG2  ILE  40          1HG2      ILE  40   8.592   5.432 -11.622
  297   2HG2  ILE  40          2HG2      ILE  40   9.870   4.423 -12.299
  298   3HG2  ILE  40          3HG2      ILE  40   8.742   5.253 -13.370
  299   1HD1  ILE  40          1HD1      ILE  40   5.306   4.548 -14.405
  300   2HD1  ILE  40          2HD1      ILE  40   5.624   4.898 -12.705
  301   3HD1  ILE  40          3HD1      ILE  40   6.645   5.604 -13.957
  302    H    HIS  41           H        HIS  41   8.403   2.311  -9.800
  303    HA   HIS  41           HA       HIS  41   6.610  -0.010  -9.751
  304   1HB   HIS  41          1HB       HIS  41   7.858  -0.626  -7.547
  305   2HB   HIS  41          2HB       HIS  41   8.556  -1.100  -9.092
  306    HD1  HIS  41           HD1      HIS  41  10.970  -1.107  -8.290
  307    HD2  HIS  41           HD2      HIS  41   9.044   2.524  -7.677
  308    HE1  HIS  41           HE1      HIS  41  12.780   0.511  -7.638
  309    H    PHE  42           H        PHE  42   5.217  -0.106  -7.919
  310    HA   PHE  42           HA       PHE  42   4.763   2.534  -6.719
  311   1HB   PHE  42          1HB       PHE  42   2.914   0.162  -7.035
  312   2HB   PHE  42          2HB       PHE  42   2.479   1.665  -6.227
  313    HD1  PHE  42           HD1      PHE  42   3.954   3.506  -8.169
  314    HD2  PHE  42           HD2      PHE  42   1.286   0.241  -8.754
  315    HE1  PHE  42           HE1      PHE  42   3.259   4.465 -10.327
  316    HE2  PHE  42           HE2      PHE  42   0.588   1.195 -10.912
  317    HZ   PHE  42           HZ       PHE  42   1.574   3.308 -11.701
  318    H    GLN  43           H        GLN  43   4.767   2.850  -4.553
  319    HA   GLN  43           HA       GLN  43   4.905   0.553  -2.761
  320   1HB   GLN  43          1HB       GLN  43   7.165   2.268  -3.438
  321   2HB   GLN  43          2HB       GLN  43   6.844   2.229  -1.709
  322   1HG   GLN  43          1HG       GLN  43   7.554   0.119  -1.495
  323   2HG   GLN  43          2HG       GLN  43   6.807  -0.394  -3.008
  324   1HE2  GLN  43          1HE2      GLN  43   7.920   0.527  -4.998
  325   2HE2  GLN  43          2HE2      GLN  43   9.647   0.476  -4.996
  326    H    GLY  44           H        GLY  44   3.794   0.884  -0.933
  327   1HA   GLY  44          1HA       GLY  44   3.637   3.292   0.492
  328   2HA   GLY  44          2HA       GLY  44   2.240   3.204  -0.572
  329    H    TYR  45           H        TYR  45   1.194   3.284   1.629
  330    HA   TYR  45           HA       TYR  45   0.936   0.551   2.701
  331   1HB   TYR  45          1HB       TYR  45   0.185   1.735   4.835
  332   2HB   TYR  45          2HB       TYR  45   1.898   1.833   4.440
  333    HD1  TYR  45           HD2      TYR  45   2.891   3.938   3.721
  334    HD2  TYR  45           HD1      TYR  45  -1.236   3.696   4.729
  335    HE1  TYR  45           HE2      TYR  45   2.785   6.392   3.848
  336    HE2  TYR  45           HE1      TYR  45  -1.354   6.150   4.858
  337    HH   TYR  45           HH       TYR  45   1.527   8.145   4.573
  338    H    ILE  46           H        ILE  46  -1.089  -0.273   3.008
  339    HA   ILE  46           HA       ILE  46  -3.371   1.449   2.311
  340    HB   ILE  46           HB       ILE  46  -3.043  -1.405   1.380
  341   1HG1  ILE  46          1HG1      ILE  46  -2.886   1.151  -0.232
  342   2HG1  ILE  46          2HG1      ILE  46  -1.497   0.178   0.242
  343   1HG2  ILE  46          1HG2      ILE  46  -5.108   0.632   0.570
  344   2HG2  ILE  46          2HG2      ILE  46  -5.066  -1.082   0.164
  345   3HG2  ILE  46          3HG2      ILE  46  -5.366  -0.578   1.826
  346   1HD1  ILE  46          1HD1      ILE  46  -1.902  -0.482  -1.934
  347   2HD1  ILE  46          2HD1      ILE  46  -2.707  -1.734  -0.986
  348   3HD1  ILE  46          3HD1      ILE  46  -3.653  -0.444  -1.729
  349    H    GLU  47           H        GLU  47  -4.983   1.372   3.735
  350    HA   GLU  47           HA       GLU  47  -4.932  -0.743   5.770
  351   1HB   GLU  47          1HB       GLU  47  -6.504   1.823   5.914
  352   2HB   GLU  47          2HB       GLU  47  -6.063   0.745   7.231
  353   1HG   GLU  47          1HG       GLU  47  -3.631   1.482   6.172
  354   2HG   GLU  47          2HG       GLU  47  -4.594   2.954   6.059
  355    H    MET  48           H        MET  48  -6.346  -2.337   5.565
  356    HA   MET  48           HA       MET  48  -8.590  -2.118   3.770
  357   1HB   MET  48          1HB       MET  48  -7.557  -4.347   5.519
  358   2HB   MET  48          2HB       MET  48  -9.022  -4.497   4.557
  359   1HG   MET  48          1HG       MET  48  -6.815  -3.524   2.971
  360   2HG   MET  48          2HG       MET  48  -6.427  -5.053   3.758
  361   1HE   MET  48          1HE       MET  48  -8.139  -3.077   1.321
  362   2HE   MET  48          2HE       MET  48  -8.771  -4.221   0.136
  363   3HE   MET  48          3HE       MET  48  -9.790  -3.680   1.471
  364    H    LYS  49           H        LYS  49 -10.672  -3.347   4.725
  365    HA   LYS  49           HA       LYS  49 -11.990  -1.540   6.353
  366   1HB   LYS  49          1HB       LYS  49 -12.679  -3.830   4.973
  367   2HB   LYS  49          2HB       LYS  49 -12.984  -4.275   6.647
  368   1HG   LYS  49          1HG       LYS  49 -14.652  -2.720   6.902
  369   2HG   LYS  49          2HG       LYS  49 -14.019  -1.673   5.630
  370   1HD   LYS  49          1HD       LYS  49 -16.003  -2.655   4.776
  371   2HD   LYS  49          2HD       LYS  49 -14.654  -3.476   3.986
  372   1HE   LYS  49          1HE       LYS  49 -16.247  -5.135   4.629
  373   2HE   LYS  49          2HE       LYS  49 -14.853  -5.283   5.697
  374   1HZ   LYS  49          1HZ       LYS  49 -16.064  -4.046   7.385
  375   2HZ   LYS  49          2HZ       LYS  49 -16.921  -5.431   6.928
  376   3HZ   LYS  49          3HZ       LYS  49 -17.404  -3.912   6.360
  377    H    LYS  50           H        LYS  50 -10.887  -4.793   7.329
  378    HA   LYS  50           HA       LYS  50  -9.687  -4.016   9.720
  379   1HB   LYS  50          1HB       LYS  50 -12.566  -4.090   9.847
  380   2HB   LYS  50          2HB       LYS  50 -11.887  -5.321  10.904
  381   1HG   LYS  50          1HG       LYS  50 -10.661  -3.713  12.138
  382   2HG   LYS  50          2HG       LYS  50 -11.001  -2.449  10.954
  383   1HD   LYS  50          1HD       LYS  50 -13.513  -3.178  11.612
  384   2HD   LYS  50          2HD       LYS  50 -12.680  -3.514  13.133
  385   1HE   LYS  50          1HE       LYS  50 -12.006  -1.288  13.387
  386   2HE   LYS  50          2HE       LYS  50 -12.309  -0.909  11.692
  387   1HZ   LYS  50          1HZ       LYS  50 -13.975  -0.229  13.609
  388   2HZ   LYS  50          2HZ       LYS  50 -14.591  -1.772  13.292
  389   3HZ   LYS  50          3HZ       LYS  50 -14.511  -0.624  12.053
  390    H    ARG  51           H        ARG  51 -12.050  -6.630   9.231
  391    HA   ARG  51           HA       ARG  51  -9.982  -8.582   9.837
  392   1HB   ARG  51          1HB       ARG  51 -12.448  -8.549  10.708
  393   2HB   ARG  51          2HB       ARG  51 -12.813  -9.294   9.158
  394   1HG   ARG  51          1HG       ARG  51 -11.693 -11.234   9.671
  395   2HG   ARG  51          2HG       ARG  51 -10.657 -10.447  10.862
  396   1HD   ARG  51          1HD       ARG  51 -13.023 -10.056  12.038
  397   2HD   ARG  51          2HD       ARG  51 -13.402 -11.525  11.139
  398    HE   ARG  51           HE       ARG  51 -10.949 -11.741  12.585
  399   1HH1  ARG  51          1HH1      ARG  51 -14.414 -11.929  12.876
  400   2HH1  ARG  51          2HH1      ARG  51 -14.372 -12.991  14.244
  401   1HH2  ARG  51          1HH2      ARG  51 -10.881 -13.141  14.386
  402   2HH2  ARG  51          2HH2      ARG  51 -12.362 -13.678  15.102
  403    H    THR  52           H        THR  52  -9.357  -7.405   7.497
  404    HA   THR  52           HA       THR  52 -10.203  -9.317   5.422
  405    HB   THR  52           HB       THR  52  -8.744  -6.832   4.676
  406    HG1  THR  52           HG1      THR  52 -11.502  -6.881   5.405
  407   1HG2  THR  52          1HG2      THR  52  -9.339  -8.351   2.920
  408   2HG2  THR  52          2HG2      THR  52 -10.392  -6.942   2.791
  409   3HG2  THR  52          3HG2      THR  52 -11.004  -8.440   3.491
  410    H    SER  53           H        SER  53  -8.777 -10.870   5.035
  411    HA   SER  53           HA       SER  53  -6.040 -10.666   5.863
  412   1HB   SER  53          1HB       SER  53  -5.972 -12.935   4.520
  413   2HB   SER  53          2HB       SER  53  -6.797 -12.844   6.075
  414    HG   SER  53           HG       SER  53  -7.914 -13.802   4.108
  415    H    LEU  54           H        LEU  54  -4.404 -11.655   4.119
  416    HA   LEU  54           HA       LEU  54  -3.806  -9.639   2.329
  417   1HB   LEU  54          1HB       LEU  54  -2.220 -11.355   3.072
  418   2HB   LEU  54          2HB       LEU  54  -3.077 -12.557   2.107
  419    HG   LEU  54           HG       LEU  54  -2.405 -11.439   0.063
  420   1HD1  LEU  54          1HD1      LEU  54  -2.417  -9.139   0.995
  421   2HD1  LEU  54          2HD1      LEU  54  -0.979  -9.510   0.043
  422   3HD1  LEU  54          3HD1      LEU  54  -0.892  -9.500   1.805
  423   1HD2  LEU  54          1HD2      LEU  54  -0.876 -13.088   0.781
  424   2HD2  LEU  54          2HD2      LEU  54  -0.207 -12.036   2.029
  425   3HD2  LEU  54          3HD2      LEU  54   0.100 -11.691   0.327
  426    H    ALA  55           H        ALA  55  -5.922 -12.380   1.937
  427    HA   ALA  55           HA       ALA  55  -6.127 -12.554  -0.819
  428   1HB   ALA  55          1HB       ALA  55  -8.420 -12.850   1.113
  429   2HB   ALA  55          2HB       ALA  55  -8.265 -13.584  -0.483
  430   3HB   ALA  55          3HB       ALA  55  -7.194 -14.086   0.827
  431    H    GLY  56           H        GLY  56  -7.485 -10.184   1.378
  432   1HA   GLY  56          1HA       GLY  56  -9.330  -9.043  -0.466
  433   2HA   GLY  56          2HA       GLY  56  -8.750  -8.297   1.014
  434    H    MET  57           H        MET  57  -6.047  -8.119   0.534
  435    HA   MET  57           HA       MET  57  -5.949  -5.843  -1.182
  436   1HB   MET  57          1HB       MET  57  -3.715  -7.379   0.158
  437   2HB   MET  57          2HB       MET  57  -3.539  -5.815  -0.628
  438   1HG   MET  57          1HG       MET  57  -5.603  -6.004   1.471
  439   2HG   MET  57          2HG       MET  57  -3.926  -6.118   2.000
  440   1HE   MET  57          1HE       MET  57  -5.452  -3.395  -0.956
  441   2HE   MET  57          2HE       MET  57  -6.509  -4.391   0.044
  442   3HE   MET  57          3HE       MET  57  -6.302  -2.679   0.414
  443    H    LYS  58           H        LYS  58  -4.549  -9.108  -1.360
  444    HA   LYS  58           HA       LYS  58  -3.203  -8.831  -3.783
  445   1HB   LYS  58          1HB       LYS  58  -3.487 -10.838  -1.988
  446   2HB   LYS  58          2HB       LYS  58  -4.506 -11.441  -3.289
  447   1HG   LYS  58          1HG       LYS  58  -2.639 -11.257  -4.847
  448   2HG   LYS  58          2HG       LYS  58  -1.616 -10.631  -3.552
  449   1HD   LYS  58          1HD       LYS  58  -2.984 -13.310  -3.415
  450   2HD   LYS  58          2HD       LYS  58  -1.362 -13.092  -4.076
  451   1HE   LYS  58          1HE       LYS  58  -1.039 -11.811  -1.760
  452   2HE   LYS  58          2HE       LYS  58  -2.321 -12.919  -1.274
  453   1HZ   LYS  58          1HZ       LYS  58  -0.272 -14.238  -2.760
  454   2HZ   LYS  58          2HZ       LYS  58  -0.903 -14.610  -1.236
  455   3HZ   LYS  58          3HZ       LYS  58   0.351 -13.483  -1.379
  456    H    LYS  59           H        LYS  59  -6.587  -9.283  -3.115
  457    HA   LYS  59           HA       LYS  59  -7.454 -10.218  -5.610
  458   1HB   LYS  59          1HB       LYS  59  -8.645  -9.294  -3.196
  459   2HB   LYS  59          2HB       LYS  59  -9.409  -8.441  -4.530
  460   1HG   LYS  59          1HG       LYS  59  -9.933 -10.573  -5.599
  461   2HG   LYS  59          2HG       LYS  59  -9.165 -11.430  -4.261
  462   1HD   LYS  59          1HD       LYS  59 -10.804 -10.264  -2.733
  463   2HD   LYS  59          2HD       LYS  59 -11.649  -9.727  -4.188
  464   1HE   LYS  59          1HE       LYS  59 -11.504 -12.315  -4.761
  465   2HE   LYS  59          2HE       LYS  59 -11.418 -12.444  -3.005
  466   1HZ   LYS  59          1HZ       LYS  59 -13.498 -11.397  -2.774
  467   2HZ   LYS  59          2HZ       LYS  59 -13.704 -12.540  -4.004
  468   3HZ   LYS  59          3HZ       LYS  59 -13.534 -10.903  -4.392
  469    H    LEU  60           H        LEU  60  -6.628  -7.006  -4.495
  470    HA   LEU  60           HA       LEU  60  -7.701  -5.687  -6.820
  471   1HB   LEU  60          1HB       LEU  60  -6.038  -4.802  -4.486
  472   2HB   LEU  60          2HB       LEU  60  -6.341  -3.734  -5.855
  473    HG   LEU  60           HG       LEU  60  -8.838  -4.193  -5.364
  474   1HD1  LEU  60          1HD1      LEU  60  -9.246  -5.616  -3.708
  475   2HD1  LEU  60          2HD1      LEU  60  -8.627  -4.394  -2.599
  476   3HD1  LEU  60          3HD1      LEU  60  -7.550  -5.643  -3.225
  477   1HD2  LEU  60          1HD2      LEU  60  -7.057  -2.215  -4.611
  478   2HD2  LEU  60          2HD2      LEU  60  -7.909  -2.610  -3.118
  479   3HD2  LEU  60          3HD2      LEU  60  -8.817  -2.121  -4.550
  480    H    ILE  61           H        ILE  61  -4.535  -6.745  -5.685
  481    HA   ILE  61           HA       ILE  61  -3.512  -6.378  -8.410
  482    HB   ILE  61           HB       ILE  61  -1.995  -5.570  -5.926
  483   1HG1  ILE  61          1HG1      ILE  61  -2.109  -3.342  -7.454
  484   2HG1  ILE  61          2HG1      ILE  61  -3.651  -4.078  -7.877
  485   1HG2  ILE  61          1HG2      ILE  61  -1.246  -5.817  -8.807
  486   2HG2  ILE  61          2HG2      ILE  61  -0.465  -4.603  -7.796
  487   3HG2  ILE  61          3HG2      ILE  61  -0.353  -6.310  -7.368
  488   1HD1  ILE  61          1HD1      ILE  61  -2.701  -3.085  -5.226
  489   2HD1  ILE  61          2HD1      ILE  61  -4.184  -2.702  -6.101
  490   3HD1  ILE  61          3HD1      ILE  61  -3.994  -4.279  -5.333
  491    HA   PRO  62           HA       PRO  62  -2.618 -10.605  -6.729
  492   1HB   PRO  62          1HB       PRO  62  -3.344 -11.907  -8.999
  493   2HB   PRO  62          2HB       PRO  62  -4.496 -11.467  -7.734
  494   1HG   PRO  62          1HG       PRO  62  -3.907 -10.085 -10.323
  495   2HG   PRO  62          2HG       PRO  62  -5.473 -10.409  -9.560
  496   1HD   PRO  62          1HD       PRO  62  -4.260  -7.992  -9.427
  497   2HD   PRO  62          2HD       PRO  62  -5.283  -8.619  -8.119
  498    H    GLY  63           H        GLY  63  -0.414 -10.545  -6.705
  499   1HA   GLY  63          1HA       GLY  63   1.380 -11.729  -8.010
  500   2HA   GLY  63          2HA       GLY  63   0.954 -10.640  -9.321
  501    H    ALA  64           H        ALA  64   1.101  -9.690  -5.946
  502    HA   ALA  64           HA       ALA  64   3.570  -8.189  -6.511
  503   1HB   ALA  64          1HB       ALA  64   0.945  -7.176  -5.658
  504   2HB   ALA  64          2HB       ALA  64   2.326  -6.546  -4.760
  505   3HB   ALA  64          3HB       ALA  64   2.257  -6.364  -6.513
  506    H    HIS  65           H        HIS  65   4.570  -7.350  -4.421
  507    HA   HIS  65           HA       HIS  65   4.632  -9.566  -2.519
  508   1HB   HIS  65          1HB       HIS  65   6.717  -8.517  -3.630
  509   2HB   HIS  65          2HB       HIS  65   6.485  -7.196  -2.489
  510    HD1  HIS  65           HD1      HIS  65   8.795  -9.553  -2.681
  511    HD2  HIS  65           HD2      HIS  65   5.824  -9.029   0.175
  512    HE1  HIS  65           HE1      HIS  65   9.622 -10.740  -0.625
  513    H    PHE  66           H        PHE  66   3.298  -9.421  -0.845
  514    HA   PHE  66           HA       PHE  66   2.831  -6.772   0.356
  515   1HB   PHE  66          1HB       PHE  66   1.063  -9.090  -0.155
  516   2HB   PHE  66          2HB       PHE  66   0.833  -8.273   1.387
  517    HD1  PHE  66           HD1      PHE  66   0.932  -7.725  -2.275
  518    HD2  PHE  66           HD2      PHE  66  -0.338  -6.255   1.512
  519    HE1  PHE  66           HE1      PHE  66  -0.407  -5.994  -3.400
  520    HE2  PHE  66           HE2      PHE  66  -1.681  -4.522   0.393
  521    HZ   PHE  66           HZ       PHE  66  -1.717  -4.391  -2.065
  522    H    GLU  67           H        GLU  67   2.558  -6.708   2.693
  523    HA   GLU  67           HA       GLU  67   3.582  -8.951   4.219
  524   1HB   GLU  67          1HB       GLU  67   5.237  -6.678   3.491
  525   2HB   GLU  67          2HB       GLU  67   5.096  -6.843   5.235
  526   1HG   GLU  67          1HG       GLU  67   5.734  -9.269   4.923
  527   2HG   GLU  67          2HG       GLU  67   6.154  -8.843   3.265
  528    H    LYS  68           H        LYS  68   2.105  -9.119   5.765
  529    HA   LYS  68           HA       LYS  68   0.995  -6.665   6.948
  530   1HB   LYS  68          1HB       LYS  68  -0.561  -8.353   5.879
  531   2HB   LYS  68          2HB       LYS  68  -0.126  -9.459   7.175
  532   1HG   LYS  68          1HG       LYS  68  -0.836  -7.169   8.523
  533   2HG   LYS  68          2HG       LYS  68  -1.974  -7.217   7.174
  534   1HD   LYS  68          1HD       LYS  68  -2.749  -9.375   7.794
  535   2HD   LYS  68          2HD       LYS  68  -1.433  -9.586   8.952
  536   1HE   LYS  68          1HE       LYS  68  -2.508  -7.374   9.969
  537   2HE   LYS  68          2HE       LYS  68  -3.946  -8.022   9.182
  538   1HZ   LYS  68          1HZ       LYS  68  -2.354  -9.188  11.371
  539   2HZ   LYS  68          2HZ       LYS  68  -3.293 -10.186  10.380
  540   3HZ   LYS  68          3HZ       LYS  68  -4.027  -8.954  11.278
  541    H    ARG  69           H        ARG  69   3.559  -8.206   7.576
  542    HA   ARG  69           HA       ARG  69   3.172  -9.287  10.198
  543   1HB   ARG  69          1HB       ARG  69   5.278  -9.176   8.276
  544   2HB   ARG  69          2HB       ARG  69   5.892  -8.547   9.799
  545   1HG   ARG  69          1HG       ARG  69   5.063 -10.608  10.915
  546   2HG   ARG  69          2HG       ARG  69   4.631 -11.237   9.323
  547   1HD   ARG  69          1HD       ARG  69   6.866 -11.351   8.636
  548   2HD   ARG  69          2HD       ARG  69   7.410 -10.280   9.928
  549    HE   ARG  69           HE       ARG  69   6.282 -12.634  11.012
  550   1HH1  ARG  69          1HH1      ARG  69   9.115 -11.468   9.361
  551   2HH1  ARG  69          2HH1      ARG  69  10.164 -12.670  10.037
  552   1HH2  ARG  69          1HH2      ARG  69   7.652 -14.223  11.909
  553   2HH2  ARG  69          2HH2      ARG  69   9.330 -14.237  11.485
  554    H    ARG  70           H        ARG  70   3.027  -6.200   9.110
  555    HA   ARG  70           HA       ARG  70   2.981  -4.179  10.160
  556   1HB   ARG  70          1HB       ARG  70   3.643  -5.571  12.747
  557   2HB   ARG  70          2HB       ARG  70   2.761  -4.067  12.513
  558   1HG   ARG  70          1HG       ARG  70   0.876  -5.249  11.611
  559   2HG   ARG  70          2HG       ARG  70   1.767  -6.772  11.645
  560   1HD   ARG  70          1HD       ARG  70   0.116  -6.372  13.532
  561   2HD   ARG  70          2HD       ARG  70   1.748  -6.853  13.995
  562    HE   ARG  70           HE       ARG  70   1.428  -4.016  13.935
  563   1HH1  ARG  70          1HH1      ARG  70   0.861  -6.872  15.843
  564   2HH1  ARG  70          2HH1      ARG  70   0.875  -6.024  17.354
  565   1HH2  ARG  70          1HH2      ARG  70   1.449  -2.888  15.917
  566   2HH2  ARG  70          2HH2      ARG  70   1.209  -3.758  17.395
  567    H    GLY  71           H        GLY  71   5.264  -4.764   8.857
  568   1HA   GLY  71          1HA       GLY  71   7.594  -4.508  10.506
  569   2HA   GLY  71          2HA       GLY  71   7.540  -4.390   8.754
  570    H    THR  72           H        THR  72   5.255  -2.303   9.695
  571    HA   THR  72           HA       THR  72   6.938  -0.092  10.498
  572    HB   THR  72           HB       THR  72   6.050   1.289   8.497
  573    HG1  THR  72           HG1      THR  72   6.062  -0.353   6.613
  574   1HG2  THR  72          1HG2      THR  72   8.439   0.151   9.008
  575   2HG2  THR  72          2HG2      THR  72   8.115   1.129   7.576
  576   3HG2  THR  72          3HG2      THR  72   8.049  -0.631   7.476
  577    H    GLN  73           H        GLN  73   4.582  -1.508  11.502
  578    HA   GLN  73           HA       GLN  73   2.194  -0.143  11.104
  579   1HB   GLN  73          1HB       GLN  73   2.148  -2.195  12.307
  580   2HB   GLN  73          2HB       GLN  73   3.279  -1.594  13.512
  581   1HG   GLN  73          1HG       GLN  73   0.848  -0.001  13.310
  582   2HG   GLN  73          2HG       GLN  73   0.559  -1.678  13.769
  583   1HE2  GLN  73          1HE2      GLN  73   0.277   0.796  15.315
  584   2HE2  GLN  73          2HE2      GLN  73   1.270   0.591  16.714
  585    H    GLY  74           H        GLY  74   2.212   2.047  11.076
  586   1HA   GLY  74          1HA       GLY  74   1.828   4.050  12.264
  587   2HA   GLY  74          2HA       GLY  74   2.689   3.373  13.638
  588    H    GLU  75           H        GLU  75   4.929   2.501  11.889
  589    HA   GLU  75           HA       GLU  75   6.440   4.942  12.048
  590   1HB   GLU  75          1HB       GLU  75   7.060   2.255  12.216
  591   2HB   GLU  75          2HB       GLU  75   7.721   2.716  10.654
  592   1HG   GLU  75          1HG       GLU  75   9.183   4.268  11.590
  593   2HG   GLU  75          2HG       GLU  75   8.289   4.332  13.108
  594    H    ALA  76           H        ALA  76   4.848   3.113   9.561
  595    HA   ALA  76           HA       ALA  76   6.209   4.249   7.337
  596   1HB   ALA  76          1HB       ALA  76   4.410   2.197   7.690
  597   2HB   ALA  76          2HB       ALA  76   3.477   3.402   6.803
  598   3HB   ALA  76          3HB       ALA  76   4.999   2.804   6.143
  599    H    ARG  77           H        ARG  77   4.041   5.557   9.535
  600    HA   ARG  77           HA       ARG  77   2.585   7.285   7.783
  601   1HB   ARG  77          1HB       ARG  77   2.246   6.503  10.360
  602   2HB   ARG  77          2HB       ARG  77   2.929   8.106  10.597
  603   1HG   ARG  77          1HG       ARG  77   1.110   9.165   9.742
  604   2HG   ARG  77          2HG       ARG  77   0.715   7.838   8.648
  605   1HD   ARG  77          1HD       ARG  77  -0.959   7.513  10.136
  606   2HD   ARG  77          2HD       ARG  77   0.293   6.608  10.986
  607    HE   ARG  77           HE       ARG  77   0.185   9.394  11.694
  608   1HH1  ARG  77          1HH1      ARG  77  -1.076   6.215  12.348
  609   2HH1  ARG  77          2HH1      ARG  77  -1.551   6.595  13.971
  610   1HH2  ARG  77          1HH2      ARG  77  -0.437   9.906  13.828
  611   2HH2  ARG  77          2HH2      ARG  77  -1.188   8.696  14.811
  612    H    ALA  78           H        ALA  78   5.727   7.325   9.117
  613    HA   ALA  78           HA       ALA  78   6.009  10.199   8.539
  614   1HB   ALA  78          1HB       ALA  78   8.103  10.028   9.914
  615   2HB   ALA  78          2HB       ALA  78   6.599   9.763  10.800
  616   3HB   ALA  78          3HB       ALA  78   7.605   8.390  10.339
  617    H    TYR  79           H        TYR  79   8.042   7.263   8.451
  618    HA   TYR  79           HA       TYR  79   9.801   8.289   6.489
  619   1HB   TYR  79          1HB       TYR  79  10.636   6.558   7.874
  620   2HB   TYR  79          2HB       TYR  79   9.270   5.506   7.520
  621    HD1  TYR  79           HD1      TYR  79  11.363   7.432   5.124
  622    HD2  TYR  79           HD2      TYR  79  10.289   3.598   6.625
  623    HE1  TYR  79           HE1      TYR  79  12.655   6.370   3.321
  624    HE2  TYR  79           HE2      TYR  79  11.579   2.526   4.826
  625    HH   TYR  79           HH       TYR  79  12.961   2.840   3.113
  626    H    SER  80           H        SER  80   7.214   5.848   6.265
  627    HA   SER  80           HA       SER  80   5.937   5.138   4.521
  628   1HB   SER  80          1HB       SER  80   6.702   7.869   3.484
  629   2HB   SER  80          2HB       SER  80   5.590   6.800   2.631
  630    HG   SER  80           HG       SER  80   4.700   8.422   4.187
  631    H    MET  81           H        MET  81   8.012   6.982   2.377
  632    HA   MET  81           HA       MET  81   9.274   4.478   1.483
  633   1HB   MET  81          1HB       MET  81   7.686   6.432  -0.055
  634   2HB   MET  81          2HB       MET  81   9.185   5.920  -0.817
  635   1HG   MET  81          1HG       MET  81   7.413   4.517  -1.584
  636   2HG   MET  81          2HG       MET  81   8.474   3.570  -0.544
  637   1HE   MET  81          1HE       MET  81   5.037   5.465  -0.796
  638   2HE   MET  81          2HE       MET  81   4.391   5.226   0.828
  639   3HE   MET  81          3HE       MET  81   5.819   6.233   0.586
  640    H    LYS  82           H        LYS  82  11.125   5.118  -0.162
  641    HA   LYS  82           HA       LYS  82  12.904   6.849   1.342
  642   1HB   LYS  82          1HB       LYS  82  13.199   4.564  -0.346
  643   2HB   LYS  82          2HB       LYS  82  14.147   5.880  -1.028
  644   1HG   LYS  82          1HG       LYS  82  14.835   6.070   1.578
  645   2HG   LYS  82          2HG       LYS  82  14.551   4.334   1.435
  646   1HD   LYS  82          1HD       LYS  82  16.025   4.452  -0.654
  647   2HD   LYS  82          2HD       LYS  82  16.508   6.046  -0.071
  648   1HE   LYS  82          1HE       LYS  82  18.144   4.670   0.818
  649   2HE   LYS  82          2HE       LYS  82  17.001   4.815   2.152
  650   1HZ   LYS  82          1HZ       LYS  82  17.888   2.488   0.892
  651   2HZ   LYS  82          2HZ       LYS  82  16.239   2.645   0.547
  652   3HZ   LYS  82          3HZ       LYS  82  16.768   2.628   2.153
  653    H    GLU  83           H        GLU  83  12.953   8.952   0.932
  654    HA   GLU  83           HA       GLU  83  11.848  10.160  -1.359
  655   1HB   GLU  83          1HB       GLU  83  13.330  11.041   1.025
  656   2HB   GLU  83          2HB       GLU  83  13.542  12.070  -0.385
  657   1HG   GLU  83          1HG       GLU  83  11.189  12.451  -0.546
  658   2HG   GLU  83          2HG       GLU  83  10.863  11.261   0.713
  659    H    ASP  84           H        ASP  84  15.104   9.138  -0.558
  660    HA   ASP  84           HA       ASP  84  16.534  10.482  -2.538
  661   1HB   ASP  84          1HB       ASP  84  17.039   8.421  -0.646
  662   2HB   ASP  84          2HB       ASP  84  17.630   7.862  -2.209
  663    H    THR  85           H        THR  85  14.651   7.517  -2.687
  664    HA   THR  85           HA       THR  85  15.240   7.321  -5.566
  665    HB   THR  85           HB       THR  85  14.109   4.983  -5.205
  666    HG1  THR  85           HG1      THR  85  15.250   5.177  -2.647
  667   1HG2  THR  85          1HG2      THR  85  16.810   5.153  -3.955
  668   2HG2  THR  85          2HG2      THR  85  16.613   5.706  -5.618
  669   3HG2  THR  85          3HG2      THR  85  16.206   4.046  -5.188
  670    H    ARG  86           H        ARG  86  13.074   8.758  -3.728
  671    HA   ARG  86           HA       ARG  86  10.592   7.750  -4.712
  672   1HB   ARG  86          1HB       ARG  86  10.787   8.998  -2.588
  673   2HB   ARG  86          2HB       ARG  86  11.221  10.443  -3.491
  674   1HG   ARG  86          1HG       ARG  86   9.063  10.588  -4.465
  675   2HG   ARG  86          2HG       ARG  86   8.620   8.987  -3.869
  676   1HD   ARG  86          1HD       ARG  86   7.945   9.824  -1.921
  677   2HD   ARG  86          2HD       ARG  86   9.466  10.689  -1.704
  678    HE   ARG  86           HE       ARG  86   7.635  11.940  -3.547
  679   1HH1  ARG  86          1HH1      ARG  86   8.654  11.664  -0.229
  680   2HH1  ARG  86          2HH1      ARG  86   8.023  13.211   0.230
  681   1HH2  ARG  86          1HH2      ARG  86   6.801  13.978  -2.956
  682   2HH2  ARG  86          2HH2      ARG  86   6.968  14.527  -1.322
  683    H    LEU  87           H        LEU  87   9.592   8.157  -6.575
  684    HA   LEU  87           HA       LEU  87  10.763  10.162  -8.365
  685   1HB   LEU  87          1HB       LEU  87   9.890   7.524  -8.746
  686   2HB   LEU  87          2HB       LEU  87   8.721   8.544  -9.580
  687    HG   LEU  87           HG       LEU  87  11.683   8.339 -10.088
  688   1HD1  LEU  87          1HD1      LEU  87   9.228   7.725 -11.719
  689   2HD1  LEU  87          2HD1      LEU  87  10.451   6.593 -11.144
  690   3HD1  LEU  87          3HD1      LEU  87  10.862   7.782 -12.379
  691   1HD2  LEU  87          1HD2      LEU  87   9.683  10.348 -11.099
  692   2HD2  LEU  87          2HD2      LEU  87  11.220  10.022 -11.900
  693   3HD2  LEU  87          3HD2      LEU  87  11.200  10.657 -10.255
  694    H    GLU  88           H        GLU  88   7.527   8.917  -7.516
  695    HA   GLU  88           HA       GLU  88   6.509  11.667  -7.792
  696   1HB   GLU  88          1HB       GLU  88   5.874   9.570  -9.480
  697   2HB   GLU  88          2HB       GLU  88   4.533   9.589  -8.344
  698   1HG   GLU  88          1HG       GLU  88   3.926  10.952 -10.182
  699   2HG   GLU  88          2HG       GLU  88   4.264  12.023  -8.824
  700    H    GLY  89           H        GLY  89   4.197  11.769  -6.776
  701   1HA   GLY  89          1HA       GLY  89   2.758  11.253  -4.997
  702   2HA   GLY  89          2HA       GLY  89   3.911  10.050  -4.440
  703    HA   PRO  90           HA       PRO  90   3.269   9.833  -2.476
  704   1HB   PRO  90          1HB       PRO  90   1.876  10.646  -0.293
  705   2HB   PRO  90          2HB       PRO  90   3.576  10.170  -0.224
  706   1HG   PRO  90          1HG       PRO  90   2.381  12.911  -0.338
  707   2HG   PRO  90          2HG       PRO  90   3.721  12.315   0.659
  708   1HD   PRO  90          1HD       PRO  90   4.114  13.748  -1.604
  709   2HD   PRO  90          2HD       PRO  90   5.245  12.491  -1.060
  710    H    TRP  91           H        TRP  91   0.927   9.237  -2.149
  711    HA   TRP  91           HA       TRP  91  -0.942  11.211  -3.232
  712   1HB   TRP  91          1HB       TRP  91  -0.322   8.524  -4.447
  713   2HB   TRP  91          2HB       TRP  91  -1.859   9.338  -4.729
  714    HD1  TRP  91           HD1      TRP  91  -0.721  12.312  -5.073
  715    HE1  TRP  91           HE1      TRP  91   0.577  12.911  -7.214
  716    HE3  TRP  91           HE3      TRP  91   0.658   7.609  -6.529
  717    HZ2  TRP  91           HZ2      TRP  91   1.996  11.568  -9.251
  718    HZ3  TRP  91           HZ3      TRP  91   1.983   7.353  -8.587
  719    HH2  TRP  91           HH2      TRP  91   2.638   9.292  -9.918
  720    H    GLU  92           H        GLU  92  -2.873  11.157  -2.256
  721    HA   GLU  92           HA       GLU  92  -3.503   8.807  -0.593
  722   1HB   GLU  92          1HB       GLU  92  -3.717  11.731  -0.051
  723   2HB   GLU  92          2HB       GLU  92  -4.930  10.669   0.649
  724   1HG   GLU  92          1HG       GLU  92  -3.334   9.496   1.910
  725   2HG   GLU  92          2HG       GLU  92  -1.993  10.171   0.986
  726    H    TYR  93           H        TYR  93  -5.488   7.905  -0.767
  727    HA   TYR  93           HA       TYR  93  -7.562   9.300  -2.286
  728   1HB   TYR  93          1HB       TYR  93  -6.489   6.559  -2.975
  729   2HB   TYR  93          2HB       TYR  93  -7.992   7.216  -3.613
  730    HD1  TYR  93           HD1      TYR  93  -7.900   9.285  -5.048
  731    HD2  TYR  93           HD2      TYR  93  -4.407   7.128  -3.932
  732    HE1  TYR  93           HE1      TYR  93  -6.657  10.368  -6.871
  733    HE2  TYR  93           HE2      TYR  93  -3.153   8.207  -5.752
  734    HH   TYR  93           HH       TYR  93  -4.193  10.911  -7.352
  735    H    GLY  94           H        GLY  94  -9.688   8.241  -2.108
  736   1HA   GLY  94          1HA       GLY  94 -11.226   6.818  -1.026
  737   2HA   GLY  94          2HA       GLY  94  -9.960   6.343   0.098
  738    H    GLU  95           H        GLU  95 -11.293   6.680   1.895
  739    HA   GLU  95           HA       GLU  95 -12.826   8.899   2.471
  740   1HB   GLU  95          1HB       GLU  95 -12.955   6.980   3.888
  741   2HB   GLU  95          2HB       GLU  95 -11.249   7.093   4.301
  742   1HG   GLU  95          1HG       GLU  95 -11.599   8.629   5.894
  743   2HG   GLU  95          2HG       GLU  95 -12.841   9.466   4.963
  Start of MODEL    2
    1   1H    ALA   2          1H        ALA   2 -14.575  -0.468  19.887
    2    HA   ALA   2           HA       ALA   2 -14.452  -1.417  17.299
    3   1HB   ALA   2          1HB       ALA   2 -14.821   0.262  15.852
    4   2HB   ALA   2          2HB       ALA   2 -15.771   0.945  17.172
    5   3HB   ALA   2          3HB       ALA   2 -14.109   1.475  16.916
    6    H    ARG   3           H        ARG   3 -12.350  -1.182  16.324
    7    HA   ARG   3           HA       ARG   3 -10.313   0.119  17.974
    8   1HB   ARG   3          1HB       ARG   3  -8.915  -1.842  18.046
    9   2HB   ARG   3          2HB       ARG   3 -10.491  -2.251  18.709
   10   1HG   ARG   3          1HG       ARG   3 -10.915  -2.973  16.180
   11   2HG   ARG   3          2HG       ARG   3  -9.165  -3.194  16.243
   12   1HD   ARG   3          1HD       ARG   3 -10.887  -4.299  18.421
   13   2HD   ARG   3          2HD       ARG   3 -10.758  -5.157  16.886
   14    HE   ARG   3           HE       ARG   3  -8.175  -4.689  17.589
   15   1HH1  ARG   3          1HH1      ARG   3 -10.895  -6.173  19.177
   16   2HH1  ARG   3          2HH1      ARG   3  -9.923  -7.266  20.106
   17   1HH2  ARG   3          1HH2      ARG   3  -6.885  -6.123  18.806
   18   2HH2  ARG   3          2HH2      ARG   3  -7.642  -7.236  19.895
   19    H    GLN   4           H        GLN   4  -8.273   0.416  16.874
   20    HA   GLN   4           HA       GLN   4  -8.655   1.002  14.080
   21   1HB   GLN   4          1HB       GLN   4  -6.442   2.018  14.194
   22   2HB   GLN   4          2HB       GLN   4  -7.437   2.556  15.541
   23   1HG   GLN   4          1HG       GLN   4  -6.173   1.479  17.093
   24   2HG   GLN   4          2HG       GLN   4  -5.688   0.204  15.976
   25   1HE2  GLN   4          1HE2      GLN   4  -5.172   3.571  16.843
   26   2HE2  GLN   4          2HE2      GLN   4  -3.564   3.677  16.222
   27    H    VAL   5           H        VAL   5  -7.110   0.337  12.418
   28    HA   VAL   5           HA       VAL   5  -6.072  -2.381  12.904
   29    HB   VAL   5           HB       VAL   5  -6.535  -2.910  10.559
   30   1HG1  VAL   5          1HG1      VAL   5  -8.437  -3.713  11.374
   31   2HG1  VAL   5          2HG1      VAL   5  -8.495  -2.439  12.594
   32   3HG1  VAL   5          3HG1      VAL   5  -9.210  -2.172  11.003
   33   1HG2  VAL   5          1HG2      VAL   5  -6.649  -0.171  10.217
   34   2HG2  VAL   5          2HG2      VAL   5  -7.068  -1.390   9.014
   35   3HG2  VAL   5          3HG2      VAL   5  -8.325  -0.686  10.030
   36    H    ILE   6           H        ILE   6  -4.247  -3.018  11.555
   37    HA   ILE   6           HA       ILE   6  -2.348  -0.840  11.305
   38    HB   ILE   6           HB       ILE   6  -1.925  -3.792  10.828
   39   1HG1  ILE   6          1HG1      ILE   6  -0.649  -3.264  13.153
   40   2HG1  ILE   6          2HG1      ILE   6  -1.992  -2.134  13.282
   41   1HG2  ILE   6          1HG2      ILE   6   0.483  -2.827  11.529
   42   2HG2  ILE   6          2HG2      ILE   6  -0.065  -2.959   9.858
   43   3HG2  ILE   6          3HG2      ILE   6  -0.182  -1.417  10.705
   44   1HD1  ILE   6          1HD1      ILE   6  -2.358  -4.376  14.328
   45   2HD1  ILE   6          2HD1      ILE   6  -3.582  -3.884  13.156
   46   3HD1  ILE   6          3HD1      ILE   6  -2.348  -5.059  12.703
   47    H    CYS   7           H        CYS   7  -1.176  -0.350   9.422
   48    HA   CYS   7           HA       CYS   7  -2.699  -0.598   6.998
   49   1HB   CYS   7          1HB       CYS   7   0.084   0.527   7.157
   50   2HB   CYS   7          2HB       CYS   7  -1.226   0.981   6.074
   51    HG   CYS   7           HG       CYS   7  -2.045   2.961   7.475
   52    H    TRP   8           H        TRP   8  -1.797  -1.365   4.966
   53    HA   TRP   8           HA       TRP   8  -0.095  -3.725   5.389
   54   1HB   TRP   8          1HB       TRP   8  -2.139  -3.101   3.252
   55   2HB   TRP   8          2HB       TRP   8  -1.067  -4.498   3.195
   56    HD1  TRP   8           HD1      TRP   8  -3.592  -3.029   5.770
   57    HE1  TRP   8           HE1      TRP   8  -4.887  -4.997   6.805
   58    HE3  TRP   8           HE3      TRP   8  -1.289  -6.888   3.332
   59    HZ2  TRP   8           HZ2      TRP   8  -4.928  -7.813   6.614
   60    HZ3  TRP   8           HZ3      TRP   8  -2.015  -9.189   3.816
   61    HH2  TRP   8           HH2      TRP   8  -3.796  -9.640   5.423
   62    H    CYS   9           H        CYS   9   1.953  -3.459   4.817
   63    HA   CYS   9           HA       CYS   9   2.659  -1.463   2.811
   64   1HB   CYS   9          1HB       CYS   9   5.003  -1.948   3.539
   65   2HB   CYS   9          2HB       CYS   9   3.957  -1.382   4.836
   66    HG   CYS   9           HG       CYS   9   5.890  -3.565   5.426
   67    H    PHE  10           H        PHE  10   2.860  -2.029   0.759
   68    HA   PHE  10           HA       PHE  10   4.019  -4.641   0.106
   69   1HB   PHE  10          1HB       PHE  10   2.315  -5.286  -1.323
   70   2HB   PHE  10          2HB       PHE  10   1.404  -4.491  -0.044
   71    HD1  PHE  10           HD2      PHE  10   0.963  -1.934  -0.417
   72    HD2  PHE  10           HD1      PHE  10   1.911  -4.702  -3.509
   73    HE1  PHE  10           HE2      PHE  10  -0.046  -0.422  -2.075
   74    HE2  PHE  10           HE1      PHE  10   0.905  -3.194  -5.172
   75    HZ   PHE  10           HZ       PHE  10  -0.077  -1.052  -4.456
   76    H    THR  11           H        THR  11   4.719  -4.764  -2.193
   77    HA   THR  11           HA       THR  11   5.412  -2.120  -3.287
   78    HB   THR  11           HB       THR  11   7.340  -4.423  -3.430
   79    HG1  THR  11           HG1      THR  11   7.526  -2.376  -1.480
   80   1HG2  THR  11          1HG2      THR  11   8.553  -1.861  -3.241
   81   2HG2  THR  11          2HG2      THR  11   7.257  -1.762  -4.433
   82   3HG2  THR  11          3HG2      THR  11   8.534  -2.965  -4.615
   83    H    LEU  12           H        LEU  12   4.848  -1.891  -5.347
   84    HA   LEU  12           HA       LEU  12   4.280  -4.312  -6.918
   85   1HB   LEU  12          1HB       LEU  12   2.497  -2.503  -6.395
   86   2HB   LEU  12          2HB       LEU  12   3.322  -1.571  -7.642
   87    HG   LEU  12           HG       LEU  12   2.827  -3.298  -9.285
   88   1HD1  LEU  12          1HD1      LEU  12   1.538  -4.710  -6.959
   89   2HD1  LEU  12          2HD1      LEU  12   2.874  -5.278  -7.959
   90   3HD1  LEU  12          3HD1      LEU  12   1.257  -5.134  -8.648
   91   1HD2  LEU  12          1HD2      LEU  12   1.210  -1.526  -9.020
   92   2HD2  LEU  12          2HD2      LEU  12   0.429  -2.392  -7.696
   93   3HD2  LEU  12          3HD2      LEU  12   0.370  -3.045  -9.333
   94    H    ASN  13           H        ASN  13   5.716  -4.814  -8.422
   95    HA   ASN  13           HA       ASN  13   7.450  -2.701  -9.494
   96   1HB   ASN  13          1HB       ASN  13   7.799  -5.707  -9.590
   97   2HB   ASN  13          2HB       ASN  13   8.959  -4.514 -10.167
   98   1HD2  ASN  13          1HD2      ASN  13   9.319  -6.560  -8.164
   99   2HD2  ASN  13          2HD2      ASN  13   9.752  -5.747  -6.702
  100    H    ASN  14           H        ASN  14   7.454  -2.176 -11.609
  101    HA   ASN  14           HA       ASN  14   6.618  -1.938 -13.718
  102   1HB   ASN  14          1HB       ASN  14   8.084  -4.004 -13.870
  103   2HB   ASN  14          2HB       ASN  14   6.608  -4.958 -13.761
  104   1HD2  ASN  14          1HD2      ASN  14   7.103  -5.811 -15.825
  105   2HD2  ASN  14          2HD2      ASN  14   6.781  -4.901 -17.258
  106    HA   PRO  15           HA       PRO  15   2.281  -3.011 -12.276
  107   1HB   PRO  15          1HB       PRO  15   1.413  -0.447 -12.074
  108   2HB   PRO  15          2HB       PRO  15   2.196  -1.304 -10.741
  109   1HG   PRO  15          1HG       PRO  15   3.361   0.665 -12.670
  110   2HG   PRO  15          2HG       PRO  15   3.601   0.540 -10.918
  111   1HD   PRO  15          1HD       PRO  15   5.406  -0.395 -12.706
  112   2HD   PRO  15          2HD       PRO  15   5.146  -1.157 -11.124
  113    H    LEU  16           H        LEU  16   0.581  -3.162 -13.659
  114    HA   LEU  16           HA       LEU  16   0.986  -2.204 -16.367
  115   1HB   LEU  16          1HB       LEU  16  -0.740  -4.208 -15.039
  116   2HB   LEU  16          2HB       LEU  16  -1.368  -3.466 -16.509
  117    HG   LEU  16           HG       LEU  16  -0.281  -5.594 -16.982
  118   1HD1  LEU  16          1HD1      LEU  16   1.085  -4.879 -18.797
  119   2HD1  LEU  16          2HD1      LEU  16   1.419  -3.333 -18.015
  120   3HD1  LEU  16          3HD1      LEU  16  -0.205  -3.691 -18.604
  121   1HD2  LEU  16          1HD2      LEU  16   2.410  -4.527 -16.361
  122   2HD2  LEU  16          2HD2      LEU  16   1.805  -6.183 -16.312
  123   3HD2  LEU  16          3HD2      LEU  16   1.424  -5.064 -15.001
  124    H    SER  17           H        SER  17  -0.400  -0.983 -13.623
  125    HA   SER  17           HA       SER  17  -1.528   1.245 -14.870
  126   1HB   SER  17          1HB       SER  17  -3.979   0.577 -14.034
  127   2HB   SER  17          2HB       SER  17  -3.416   0.216 -15.666
  128    HG   SER  17           HG       SER  17  -4.260  -1.655 -14.827
  129    HA   PRO  18           HA       PRO  18  -1.409   2.779 -10.763
  130   1HB   PRO  18          1HB       PRO  18  -3.402   4.622 -10.767
  131   2HB   PRO  18          2HB       PRO  18  -1.876   4.857 -11.626
  132   1HG   PRO  18          1HG       PRO  18  -4.528   3.964 -12.688
  133   2HG   PRO  18          2HG       PRO  18  -3.374   5.116 -13.385
  134   1HD   PRO  18          1HD       PRO  18  -3.571   2.553 -14.238
  135   2HD   PRO  18          2HD       PRO  18  -2.037   3.448 -14.246
  136    H    LEU  19           H        LEU  19  -2.374   2.665  -8.722
  137    HA   LEU  19           HA       LEU  19  -4.433   0.675  -8.466
  138   1HB   LEU  19          1HB       LEU  19  -3.258   2.342  -6.257
  139   2HB   LEU  19          2HB       LEU  19  -4.014   0.754  -6.135
  140    HG   LEU  19           HG       LEU  19  -1.467   1.139  -7.672
  141   1HD1  LEU  19          1HD1      LEU  19  -1.309   2.046  -5.298
  142   2HD1  LEU  19          2HD1      LEU  19  -0.154   0.796  -5.761
  143   3HD1  LEU  19          3HD1      LEU  19  -1.551   0.381  -4.768
  144   1HD2  LEU  19          1HD2      LEU  19  -1.582  -1.063  -7.925
  145   2HD2  LEU  19          2HD2      LEU  19  -3.187  -1.020  -7.196
  146   3HD2  LEU  19          3HD2      LEU  19  -1.767  -1.301  -6.187
  147    H    SER  20           H        SER  20  -6.232   1.082  -6.820
  148    HA   SER  20           HA       SER  20  -7.265   3.800  -6.829
  149   1HB   SER  20          1HB       SER  20  -8.741   1.498  -8.126
  150   2HB   SER  20          2HB       SER  20  -9.464   3.063  -7.754
  151    HG   SER  20           HG       SER  20  -8.482   2.613  -9.963
  152    H    LEU  21           H        LEU  21  -9.222   4.012  -5.481
  153    HA   LEU  21           HA       LEU  21  -8.901   2.788  -2.987
  154   1HB   LEU  21          1HB       LEU  21  -9.970   4.903  -3.111
  155   2HB   LEU  21          2HB       LEU  21 -11.206   4.286  -4.207
  156    HG   LEU  21           HG       LEU  21 -12.066   2.884  -2.327
  157   1HD1  LEU  21          1HD1      LEU  21 -10.953   4.438  -0.198
  158   2HD1  LEU  21          2HD1      LEU  21  -9.657   3.668  -1.113
  159   3HD1  LEU  21          3HD1      LEU  21 -10.951   2.689  -0.423
  160   1HD2  LEU  21          1HD2      LEU  21 -12.844   5.003  -0.990
  161   2HD2  LEU  21          2HD2      LEU  21 -13.377   4.738  -2.650
  162   3HD2  LEU  21          3HD2      LEU  21 -12.061   5.864  -2.315
  163    H    HIS  22           H        HIS  22 -10.230   1.302  -1.852
  164    HA   HIS  22           HA       HIS  22 -11.706  -0.551  -3.605
  165   1HB   HIS  22          1HB       HIS  22  -9.489  -1.338  -2.550
  166   2HB   HIS  22          2HB       HIS  22 -10.380  -1.374  -1.031
  167    HD1  HIS  22           HD1      HIS  22 -10.573  -3.838  -0.645
  168    HD2  HIS  22           HD2      HIS  22 -11.744  -2.736  -4.476
  169    HE1  HIS  22           HE1      HIS  22 -11.550  -5.914  -1.673
  170    H    ASP  23           H        ASP  23 -13.716  -1.177  -3.008
  171    HA   ASP  23           HA       ASP  23 -15.173   0.380  -1.183
  172   1HB   ASP  23          1HB       ASP  23 -15.794  -2.258  -2.513
  173   2HB   ASP  23          2HB       ASP  23 -16.952  -1.403  -1.499
  174    H    SER  24           H        SER  24 -13.291  -2.476  -0.760
  175    HA   SER  24           HA       SER  24 -14.523  -3.203   1.756
  176   1HB   SER  24          1HB       SER  24 -11.916  -4.283   0.697
  177   2HB   SER  24          2HB       SER  24 -13.071  -5.068   1.774
  178    HG   SER  24           HG       SER  24 -13.987  -4.310  -0.744
  179    H    MET  25           H        MET  25 -11.531  -1.691   0.640
  180    HA   MET  25           HA       MET  25 -10.390  -1.454   3.246
  181   1HB   MET  25          1HB       MET  25  -8.611  -0.350   2.218
  182   2HB   MET  25          2HB       MET  25  -9.198  -1.425   0.956
  183   1HG   MET  25          1HG       MET  25 -10.294   0.357  -0.167
  184   2HG   MET  25          2HG       MET  25 -10.018   1.456   1.183
  185   1HE   MET  25          1HE       MET  25  -7.966  -0.121  -2.134
  186   2HE   MET  25          2HE       MET  25  -6.582  -0.447  -1.091
  187   3HE   MET  25          3HE       MET  25  -8.156  -1.149  -0.713
  188    H    LYS  26           H        LYS  26  -9.559   1.023   3.659
  189    HA   LYS  26           HA       LYS  26 -11.963   2.721   3.656
  190   1HB   LYS  26          1HB       LYS  26 -10.683   1.546   5.916
  191   2HB   LYS  26          2HB       LYS  26 -10.406   3.282   5.977
  192   1HG   LYS  26          1HG       LYS  26 -12.586   3.760   6.346
  193   2HG   LYS  26          2HG       LYS  26 -13.163   2.397   5.384
  194   1HD   LYS  26          1HD       LYS  26 -11.993   1.067   7.405
  195   2HD   LYS  26          2HD       LYS  26 -12.464   2.542   8.252
  196   1HE   LYS  26          1HE       LYS  26 -14.506   1.331   6.496
  197   2HE   LYS  26          2HE       LYS  26 -14.084   0.417   7.943
  198   1HZ   LYS  26          1HZ       LYS  26 -15.570   2.865   7.692
  199   2HZ   LYS  26          2HZ       LYS  26 -14.365   2.939   8.876
  200   3HZ   LYS  26          3HZ       LYS  26 -15.551   1.736   8.952
  201    H    TYR  27           H        TYR  27  -8.448   2.535   3.838
  202    HA   TYR  27           HA       TYR  27  -8.324   5.253   2.721
  203   1HB   TYR  27          1HB       TYR  27  -7.689   5.007   5.230
  204   2HB   TYR  27          2HB       TYR  27  -6.217   4.261   4.618
  205    HD1  TYR  27           HD1      TYR  27  -8.213   7.200   3.452
  206    HD2  TYR  27           HD2      TYR  27  -4.470   5.751   4.865
  207    HE1  TYR  27           HE1      TYR  27  -7.230   9.429   3.118
  208    HE2  TYR  27           HE2      TYR  27  -3.477   7.977   4.535
  209    HH   TYR  27           HH       TYR  27  -5.014  10.665   4.334
  210    H    LEU  28           H        LEU  28  -6.674   5.640   1.243
  211    HA   LEU  28           HA       LEU  28  -5.066   3.310   0.445
  212   1HB   LEU  28          1HB       LEU  28  -6.754   3.337  -1.173
  213   2HB   LEU  28          2HB       LEU  28  -6.766   5.097  -1.257
  214    HG   LEU  28           HG       LEU  28  -4.718   5.116  -2.500
  215   1HD1  LEU  28          1HD1      LEU  28  -3.212   3.539  -2.074
  216   2HD1  LEU  28          2HD1      LEU  28  -4.144   2.478  -3.130
  217   3HD1  LEU  28          3HD1      LEU  28  -4.428   2.461  -1.389
  218   1HD2  LEU  28          1HD2      LEU  28  -5.393   3.899  -4.512
  219   2HD2  LEU  28          2HD2      LEU  28  -6.757   4.743  -3.780
  220   3HD2  LEU  28          3HD2      LEU  28  -6.583   3.000  -3.571
  221    H    VAL  29           H        VAL  29  -2.964   3.729   0.312
  222    HA   VAL  29           HA       VAL  29  -2.070   6.440  -0.349
  223    HB   VAL  29           HB       VAL  29  -1.068   4.873   2.033
  224   1HG1  VAL  29          1HG1      VAL  29   0.833   5.929   1.206
  225   2HG1  VAL  29          2HG1      VAL  29  -0.069   7.350   0.674
  226   3HG1  VAL  29          3HG1      VAL  29   0.218   7.079   2.393
  227   1HG2  VAL  29          1HG2      VAL  29  -2.860   7.237   1.717
  228   2HG2  VAL  29          2HG2      VAL  29  -2.997   5.860   2.810
  229   3HG2  VAL  29          3HG2      VAL  29  -1.816   7.128   3.134
  230    H    TYR  30           H        TYR  30  -0.658   6.337  -1.956
  231    HA   TYR  30           HA       TYR  30   1.425   4.330  -1.982
  232   1HB   TYR  30          1HB       TYR  30   0.873   3.257  -3.983
  233   2HB   TYR  30          2HB       TYR  30  -0.678   3.390  -3.164
  234    HD1  TYR  30           HD2      TYR  30  -2.383   4.941  -3.969
  235    HD2  TYR  30           HD1      TYR  30   1.342   4.536  -5.984
  236    HE1  TYR  30           HE2      TYR  30  -3.323   6.096  -5.926
  237    HE2  TYR  30           HE1      TYR  30   0.413   5.691  -7.947
  238    HH   TYR  30           HH       TYR  30  -2.594   6.005  -8.643
  239    H    GLN  31           H        GLN  31   3.106   4.790  -3.511
  240    HA   GLN  31           HA       GLN  31   2.964   7.389  -4.845
  241   1HB   GLN  31          1HB       GLN  31   4.984   8.202  -3.876
  242   2HB   GLN  31          2HB       GLN  31   3.952   7.685  -2.550
  243   1HG   GLN  31          1HG       GLN  31   5.314   5.972  -1.966
  244   2HG   GLN  31          2HG       GLN  31   5.867   5.701  -3.618
  245   1HE2  GLN  31          1HE2      GLN  31   5.871   8.669  -1.706
  246   2HE2  GLN  31          2HE2      GLN  31   7.583   8.896  -1.732
  247    H    THR  32           H        THR  32   4.645   7.711  -6.439
  248    HA   THR  32           HA       THR  32   5.425   5.180  -7.670
  249    HB   THR  32           HB       THR  32   5.692   7.948  -8.848
  250    HG1  THR  32           HG1      THR  32   3.693   7.124  -9.997
  251   1HG2  THR  32          1HG2      THR  32   6.838   6.768 -10.380
  252   2HG2  THR  32          2HG2      THR  32   5.258   6.169 -10.884
  253   3HG2  THR  32          3HG2      THR  32   6.244   5.224  -9.769
  254    H    GLU  33           H        GLU  33   7.485   4.511  -7.908
  255    HA   GLU  33           HA       GLU  33   9.645   6.366  -7.175
  256   1HB   GLU  33          1HB       GLU  33   9.036   3.672  -6.039
  257   2HB   GLU  33          2HB       GLU  33  10.719   4.149  -6.214
  258   1HG   GLU  33          1HG       GLU  33   9.623   6.351  -5.030
  259   2HG   GLU  33          2HG       GLU  33   8.702   5.036  -4.302
  260    H    GLN  34           H        GLN  34  11.769   5.717  -7.977
  261    HA   GLN  34           HA       GLN  34  11.526   4.331 -10.554
  262   1HB   GLN  34          1HB       GLN  34  12.411   6.773 -10.269
  263   2HB   GLN  34          2HB       GLN  34  13.900   5.982  -9.767
  264   1HG   GLN  34          1HG       GLN  34  14.468   5.756 -11.887
  265   2HG   GLN  34          2HG       GLN  34  13.070   4.712 -12.136
  266   1HE2  GLN  34          1HE2      GLN  34  11.825   5.321 -13.739
  267   2HE2  GLN  34          2HE2      GLN  34  11.560   6.943 -14.273
  268    H    GLY  35           H        GLY  35  12.803   2.610 -11.084
  269   1HA   GLY  35          1HA       GLY  35  15.178   1.778 -10.020
  270   2HA   GLY  35          2HA       GLY  35  13.975   1.151  -8.903
  271    H    GLU  36           H        GLU  36  15.391  -0.746  -9.962
  272    HA   GLU  36           HA       GLU  36  15.523  -2.495 -11.458
  273   1HB   GLU  36          1HB       GLU  36  13.252  -3.642 -11.659
  274   2HB   GLU  36          2HB       GLU  36  13.869  -3.378 -10.035
  275   1HG   GLU  36          1HG       GLU  36  12.433  -1.432  -9.787
  276   2HG   GLU  36          2HG       GLU  36  11.832  -1.656 -11.429
  277    H    ALA  37           H        ALA  37  16.197  -1.349 -13.327
  278    HA   ALA  37           HA       ALA  37  16.103  -0.839 -15.544
  279   1HB   ALA  37          1HB       ALA  37  14.570  -1.957 -16.916
  280   2HB   ALA  37          2HB       ALA  37  14.785  -3.027 -15.531
  281   3HB   ALA  37          3HB       ALA  37  13.344  -2.017 -15.649
  282    H    GLY  38           H        GLY  38  14.691   0.379 -17.220
  283   1HA   GLY  38          1HA       GLY  38  14.130   2.913 -16.279
  284   2HA   GLY  38          2HA       GLY  38  13.501   2.262 -17.785
  285    H    ASN  39           H        ASN  39  12.054   0.114 -16.321
  286    HA   ASN  39           HA       ASN  39   9.548   1.281 -16.160
  287   1HB   ASN  39          1HB       ASN  39  10.358  -1.137 -14.546
  288   2HB   ASN  39          2HB       ASN  39   8.775  -0.768 -15.225
  289   1HD2  ASN  39          1HD2      ASN  39  10.574  -3.093 -15.548
  290   2HD2  ASN  39          2HD2      ASN  39  10.794  -3.263 -17.253
  291    H    ILE  40           H        ILE  40   8.151   1.150 -14.083
  292    HA   ILE  40           HA       ILE  40   9.641   2.350 -11.843
  293    HB   ILE  40           HB       ILE  40   7.290   3.545 -11.497
  294   1HG1  ILE  40          1HG1      ILE  40   7.514   3.296 -14.504
  295   2HG1  ILE  40          2HG1      ILE  40   6.309   2.480 -13.514
  296   1HG2  ILE  40          1HG2      ILE  40   9.832   4.284 -12.399
  297   2HG2  ILE  40          2HG2      ILE  40   8.691   5.073 -13.486
  298   3HG2  ILE  40          3HG2      ILE  40   8.577   5.338 -11.747
  299   1HD1  ILE  40          1HD1      ILE  40   5.027   4.237 -13.994
  300   2HD1  ILE  40          2HD1      ILE  40   5.980   5.080 -12.773
  301   3HD1  ILE  40          3HD1      ILE  40   6.402   5.229 -14.479
  302    H    HIS  41           H        HIS  41   8.379   2.300  -9.770
  303    HA   HIS  41           HA       HIS  41   6.549   0.016  -9.596
  304   1HB   HIS  41          1HB       HIS  41   7.821  -0.569  -7.410
  305   2HB   HIS  41          2HB       HIS  41   8.505  -1.078  -8.951
  306    HD1  HIS  41           HD1      HIS  41  10.910  -1.111  -8.070
  307    HD2  HIS  41           HD2      HIS  41   9.049   2.585  -7.700
  308    HE1  HIS  41           HE1      HIS  41  12.742   0.508  -7.483
  309    H    PHE  42           H        PHE  42   5.242  -0.008  -7.673
  310    HA   PHE  42           HA       PHE  42   4.853   2.692  -6.584
  311   1HB   PHE  42          1HB       PHE  42   2.947   0.349  -6.747
  312   2HB   PHE  42          2HB       PHE  42   2.566   1.901  -6.010
  313    HD1  PHE  42           HD1      PHE  42   4.036   3.602  -8.082
  314    HD2  PHE  42           HD2      PHE  42   1.278   0.379  -8.428
  315    HE1  PHE  42           HE1      PHE  42   3.310   4.463 -10.269
  316    HE2  PHE  42           HE2      PHE  42   0.548   1.234 -10.617
  317    HZ   PHE  42           HZ       PHE  42   1.565   3.278 -11.540
  318    H    GLN  43           H        GLN  43   4.680   3.050  -4.386
  319    HA   GLN  43           HA       GLN  43   5.018   0.794  -2.568
  320   1HB   GLN  43          1HB       GLN  43   7.100   2.732  -3.227
  321   2HB   GLN  43          2HB       GLN  43   6.768   2.651  -1.503
  322   1HG   GLN  43          1HG       GLN  43   7.800   0.698  -1.298
  323   2HG   GLN  43          2HG       GLN  43   6.960   0.019  -2.691
  324   1HE2  GLN  43          1HE2      GLN  43   7.789   0.752  -4.834
  325   2HE2  GLN  43          2HE2      GLN  43   9.500   0.914  -5.012
  326    H    GLY  44           H        GLY  44   3.800   1.019  -0.801
  327   1HA   GLY  44          1HA       GLY  44   3.415   3.372   0.658
  328   2HA   GLY  44          2HA       GLY  44   2.078   3.232  -0.474
  329    H    TYR  45           H        TYR  45   1.110   3.236   1.857
  330    HA   TYR  45           HA       TYR  45   0.836   0.430   2.718
  331   1HB   TYR  45          1HB       TYR  45   0.363   1.233   4.961
  332   2HB   TYR  45          2HB       TYR  45   1.903   1.888   4.414
  333    HD1  TYR  45           HD1      TYR  45  -1.621   2.690   5.122
  334    HD2  TYR  45           HD2      TYR  45   2.205   4.246   4.100
  335    HE1  TYR  45           HE1      TYR  45  -2.416   4.961   5.630
  336    HE2  TYR  45           HE2      TYR  45   1.421   6.521   4.607
  337    HH   TYR  45           HH       TYR  45  -1.718   7.105   6.053
  338    H    ILE  46           H        ILE  46  -1.172  -0.427   2.892
  339    HA   ILE  46           HA       ILE  46  -3.454   1.352   2.331
  340    HB   ILE  46           HB       ILE  46  -3.166  -1.487   1.346
  341   1HG1  ILE  46          1HG1      ILE  46  -3.015   1.082  -0.242
  342   2HG1  ILE  46          2HG1      ILE  46  -1.613   0.132   0.239
  343   1HG2  ILE  46          1HG2      ILE  46  -5.475  -0.621   1.830
  344   2HG2  ILE  46          2HG2      ILE  46  -5.208   0.582   0.570
  345   3HG2  ILE  46          3HG2      ILE  46  -5.197  -1.135   0.166
  346   1HD1  ILE  46          1HD1      ILE  46  -3.792  -1.195  -1.288
  347   2HD1  ILE  46          2HD1      ILE  46  -2.666  -0.133  -2.134
  348   3HD1  ILE  46          3HD1      ILE  46  -2.063  -1.538  -1.254
  349    H    GLU  47           H        GLU  47  -5.036   1.281   3.785
  350    HA   GLU  47           HA       GLU  47  -4.996  -0.872   5.779
  351   1HB   GLU  47          1HB       GLU  47  -6.426   1.788   5.898
  352   2HB   GLU  47          2HB       GLU  47  -6.269   0.626   7.207
  353   1HG   GLU  47          1HG       GLU  47  -4.019   1.092   7.524
  354   2HG   GLU  47          2HG       GLU  47  -3.844   1.814   5.926
  355    H    MET  48           H        MET  48  -6.440  -2.443   5.607
  356    HA   MET  48           HA       MET  48  -8.673  -2.215   3.800
  357   1HB   MET  48          1HB       MET  48  -7.683  -4.437   5.583
  358   2HB   MET  48          2HB       MET  48  -9.140  -4.578   4.609
  359   1HG   MET  48          1HG       MET  48  -6.882  -3.657   3.051
  360   2HG   MET  48          2HG       MET  48  -6.564  -5.202   3.836
  361   1HE   MET  48          1HE       MET  48  -8.860  -4.215   0.221
  362   2HE   MET  48          2HE       MET  48  -9.925  -3.761   1.551
  363   3HE   MET  48          3HE       MET  48  -8.285  -3.115   1.474
  364    H    LYS  49           H        LYS  49 -10.773  -3.413   4.764
  365    HA   LYS  49           HA       LYS  49 -12.092  -1.573   6.343
  366   1HB   LYS  49          1HB       LYS  49 -12.788  -3.882   5.023
  367   2HB   LYS  49          2HB       LYS  49 -13.060  -4.317   6.705
  368   1HG   LYS  49          1HG       LYS  49 -14.749  -2.796   6.972
  369   2HG   LYS  49          2HG       LYS  49 -14.140  -1.732   5.702
  370   1HD   LYS  49          1HD       LYS  49 -14.727  -4.058   4.347
  371   2HD   LYS  49          2HD       LYS  49 -16.021  -3.953   5.543
  372   1HE   LYS  49          1HE       LYS  49 -15.260  -1.569   3.898
  373   2HE   LYS  49          2HE       LYS  49 -16.330  -2.806   3.242
  374   1HZ   LYS  49          1HZ       LYS  49 -17.171  -0.706   4.652
  375   2HZ   LYS  49          2HZ       LYS  49 -17.013  -1.847   5.890
  376   3HZ   LYS  49          3HZ       LYS  49 -18.012  -2.171   4.564
  377    H    LYS  50           H        LYS  50 -10.965  -4.784   7.420
  378    HA   LYS  50           HA       LYS  50  -9.791  -3.912   9.796
  379   1HB   LYS  50          1HB       LYS  50 -12.665  -4.050   9.905
  380   2HB   LYS  50          2HB       LYS  50 -11.969  -5.242  10.995
  381   1HG   LYS  50          1HG       LYS  50 -10.748  -3.559  12.170
  382   2HG   LYS  50          2HG       LYS  50 -11.198  -2.333  10.982
  383   1HD   LYS  50          1HD       LYS  50 -13.637  -3.274  11.763
  384   2HD   LYS  50          2HD       LYS  50 -12.708  -3.402  13.258
  385   1HE   LYS  50          1HE       LYS  50 -13.550  -1.253  13.386
  386   2HE   LYS  50          2HE       LYS  50 -11.950  -0.986  12.694
  387   1HZ   LYS  50          1HZ       LYS  50 -12.890  -0.039  10.946
  388   2HZ   LYS  50          2HZ       LYS  50 -14.421  -0.254  11.633
  389   3HZ   LYS  50          3HZ       LYS  50 -13.779  -1.440  10.612
  390    H    ARG  51           H        ARG  51 -12.083  -6.596   9.355
  391    HA   ARG  51           HA       ARG  51  -9.965  -8.478  10.019
  392   1HB   ARG  51          1HB       ARG  51 -12.442  -8.475  10.882
  393   2HB   ARG  51          2HB       ARG  51 -12.769  -9.296   9.362
  394   1HG   ARG  51          1HG       ARG  51 -11.030 -10.979   9.997
  395   2HG   ARG  51          2HG       ARG  51 -10.960 -10.208  11.583
  396   1HD   ARG  51          1HD       ARG  51 -13.532 -10.560  11.579
  397   2HD   ARG  51          2HD       ARG  51 -13.193 -11.747  10.320
  398    HE   ARG  51           HE       ARG  51 -12.611 -11.979  13.132
  399   1HH1  ARG  51          1HH1      ARG  51 -11.843 -13.098   9.926
  400   2HH1  ARG  51          2HH1      ARG  51 -11.205 -14.615  10.467
  401   1HH2  ARG  51          1HH2      ARG  51 -11.773 -13.973  13.857
  402   2HH2  ARG  51          2HH2      ARG  51 -11.167 -15.112  12.703
  403    H    THR  52           H        THR  52  -9.425  -7.314   7.624
  404    HA   THR  52           HA       THR  52 -10.225  -9.299   5.604
  405    HB   THR  52           HB       THR  52  -8.763  -6.862   4.758
  406    HG1  THR  52           HG1      THR  52 -11.530  -6.620   5.243
  407   1HG2  THR  52          1HG2      THR  52 -11.137  -8.414   3.726
  408   2HG2  THR  52          2HG2      THR  52  -9.495  -8.414   3.081
  409   3HG2  THR  52          3HG2      THR  52 -10.493  -6.966   2.954
  410    H    SER  53           H        SER  53  -8.794 -10.856   5.260
  411    HA   SER  53           HA       SER  53  -6.059 -10.626   6.085
  412   1HB   SER  53          1HB       SER  53  -5.977 -12.918   4.786
  413   2HB   SER  53          2HB       SER  53  -6.813 -12.801   6.334
  414    HG   SER  53           HG       SER  53  -8.256 -13.764   5.020
  415    H    LEU  54           H        LEU  54  -4.414 -11.638   4.363
  416    HA   LEU  54           HA       LEU  54  -3.819  -9.653   2.539
  417   1HB   LEU  54          1HB       LEU  54  -2.234 -11.358   3.322
  418   2HB   LEU  54          2HB       LEU  54  -3.078 -12.570   2.361
  419    HG   LEU  54           HG       LEU  54  -2.396 -11.454   0.313
  420   1HD1  LEU  54          1HD1      LEU  54  -2.395  -9.154   1.248
  421   2HD1  LEU  54          2HD1      LEU  54  -0.957  -9.536   0.301
  422   3HD1  LEU  54          3HD1      LEU  54  -0.876  -9.528   2.063
  423   1HD2  LEU  54          1HD2      LEU  54  -0.895 -13.126   1.099
  424   2HD2  LEU  54          2HD2      LEU  54  -0.182 -12.021   2.275
  425   3HD2  LEU  54          3HD2      LEU  54   0.081 -11.763   0.549
  426    H    ALA  55           H        ALA  55  -5.919 -12.412   2.189
  427    HA   ALA  55           HA       ALA  55  -6.115 -12.627  -0.566
  428   1HB   ALA  55          1HB       ALA  55  -7.167 -14.149   1.098
  429   2HB   ALA  55          2HB       ALA  55  -8.408 -12.925   1.366
  430   3HB   ALA  55          3HB       ALA  55  -8.240 -13.677  -0.220
  431    H    GLY  56           H        GLY  56  -7.512 -10.250   1.600
  432   1HA   GLY  56          1HA       GLY  56  -9.363  -9.152  -0.262
  433   2HA   GLY  56          2HA       GLY  56  -8.794  -8.380   1.211
  434    H    MET  57           H        MET  57  -6.092  -8.177   0.732
  435    HA   MET  57           HA       MET  57  -6.017  -5.922  -1.011
  436   1HB   MET  57          1HB       MET  57  -3.770  -7.416   0.352
  437   2HB   MET  57          2HB       MET  57  -3.608  -5.861  -0.454
  438   1HG   MET  57          1HG       MET  57  -5.673  -6.044   1.644
  439   2HG   MET  57          2HG       MET  57  -3.996  -6.130   2.175
  440   1HE   MET  57          1HE       MET  57  -6.418  -2.744   0.550
  441   2HE   MET  57          2HE       MET  57  -5.562  -3.465  -0.813
  442   3HE   MET  57          3HE       MET  57  -6.603  -4.464   0.203
  443    H    LYS  58           H        LYS  58  -4.583  -9.172  -1.148
  444    HA   LYS  58           HA       LYS  58  -3.239  -8.905  -3.575
  445   1HB   LYS  58          1HB       LYS  58  -3.494 -10.892  -1.750
  446   2HB   LYS  58          2HB       LYS  58  -4.490 -11.531  -3.050
  447   1HG   LYS  58          1HG       LYS  58  -2.614 -11.320  -4.598
  448   2HG   LYS  58          2HG       LYS  58  -1.614 -10.672  -3.296
  449   1HD   LYS  58          1HD       LYS  58  -2.940 -13.371  -3.155
  450   2HD   LYS  58          2HD       LYS  58  -1.317 -13.132  -3.807
  451   1HE   LYS  58          1HE       LYS  58  -1.019 -11.836  -1.501
  452   2HE   LYS  58          2HE       LYS  58  -2.300 -12.945  -1.013
  453   1HZ   LYS  58          1HZ       LYS  58   0.455 -13.464  -1.364
  454   2HZ   LYS  58          2HZ       LYS  58  -0.441 -14.451  -2.405
  455   3HZ   LYS  58          3HZ       LYS  58  -0.747 -14.480  -0.742
  456    H    LYS  59           H        LYS  59  -6.613  -9.373  -2.895
  457    HA   LYS  59           HA       LYS  59  -7.469 -10.370  -5.375
  458   1HB   LYS  59          1HB       LYS  59  -8.892 -10.342  -3.375
  459   2HB   LYS  59          2HB       LYS  59  -8.947  -8.585  -3.431
  460   1HG   LYS  59          1HG       LYS  59 -10.279  -8.570  -5.349
  461   2HG   LYS  59          2HG       LYS  59  -9.904 -10.252  -5.730
  462   1HD   LYS  59          1HD       LYS  59 -11.033 -10.360  -3.197
  463   2HD   LYS  59          2HD       LYS  59 -11.997  -9.152  -4.050
  464   1HE   LYS  59          1HE       LYS  59 -12.000 -10.926  -5.964
  465   2HE   LYS  59          2HE       LYS  59 -11.600 -12.050  -4.666
  466   1HZ   LYS  59          1HZ       LYS  59 -13.760 -12.139  -4.240
  467   2HZ   LYS  59          2HZ       LYS  59 -14.105 -10.879  -5.314
  468   3HZ   LYS  59          3HZ       LYS  59 -13.687 -10.534  -3.711
  469    H    LEU  60           H        LEU  60  -6.695  -7.132  -4.303
  470    HA   LEU  60           HA       LEU  60  -7.795  -5.862  -6.645
  471   1HB   LEU  60          1HB       LEU  60  -6.154  -4.915  -4.320
  472   2HB   LEU  60          2HB       LEU  60  -6.474  -3.872  -5.704
  473    HG   LEU  60           HG       LEU  60  -8.970  -4.418  -5.196
  474   1HD1  LEU  60          1HD1      LEU  60  -9.337  -5.723  -3.442
  475   2HD1  LEU  60          2HD1      LEU  60  -8.670  -4.456  -2.413
  476   3HD1  LEU  60          3HD1      LEU  60  -7.623  -5.734  -3.028
  477   1HD2  LEU  60          1HD2      LEU  60  -7.281  -2.324  -4.605
  478   2HD2  LEU  60          2HD2      LEU  60  -8.044  -2.678  -3.055
  479   3HD2  LEU  60          3HD2      LEU  60  -9.039  -2.311  -4.465
  480    H    ILE  61           H        ILE  61  -4.611  -6.844  -5.494
  481    HA   ILE  61           HA       ILE  61  -3.591  -6.494  -8.222
  482    HB   ILE  61           HB       ILE  61  -2.087  -5.623  -5.751
  483   1HG1  ILE  61          1HG1      ILE  61  -2.265  -3.415  -7.310
  484   2HG1  ILE  61          2HG1      ILE  61  -3.797  -4.191  -7.696
  485   1HG2  ILE  61          1HG2      ILE  61  -0.801  -4.609  -7.962
  486   2HG2  ILE  61          2HG2      ILE  61  -0.298  -6.015  -7.025
  487   3HG2  ILE  61          3HG2      ILE  61  -1.273  -6.228  -8.478
  488   1HD1  ILE  61          1HD1      ILE  61  -3.794  -4.373  -4.998
  489   2HD1  ILE  61          2HD1      ILE  61  -2.920  -2.861  -5.242
  490   3HD1  ILE  61          3HD1      ILE  61  -4.537  -3.063  -5.916
  491    HA   PRO  62           HA       PRO  62  -2.611 -10.676  -6.474
  492   1HB   PRO  62          1HB       PRO  62  -3.310 -12.029  -8.721
  493   2HB   PRO  62          2HB       PRO  62  -4.471 -11.592  -7.462
  494   1HG   PRO  62          1HG       PRO  62  -3.911 -10.240 -10.074
  495   2HG   PRO  62          2HG       PRO  62  -5.471 -10.584  -9.304
  496   1HD   PRO  62          1HD       PRO  62  -4.307  -8.140  -9.211
  497   2HD   PRO  62          2HD       PRO  62  -5.317  -8.768  -7.892
  498    H    GLY  63           H        GLY  63  -0.404 -10.519  -6.453
  499   1HA   GLY  63          1HA       GLY  63   1.414 -11.704  -7.742
  500   2HA   GLY  63          2HA       GLY  63   0.963 -10.644  -9.069
  501    H    ALA  64           H        ALA  64   1.214  -9.783  -5.653
  502    HA   ALA  64           HA       ALA  64   3.617  -8.206  -6.251
  503   1HB   ALA  64          1HB       ALA  64   2.605  -6.252  -5.973
  504   2HB   ALA  64          2HB       ALA  64   1.061  -7.102  -5.904
  505   3HB   ALA  64          3HB       ALA  64   1.949  -6.765  -4.418
  506    H    HIS  65           H        HIS  65   4.584  -7.311  -4.165
  507    HA   HIS  65           HA       HIS  65   4.652  -9.492  -2.223
  508   1HB   HIS  65          1HB       HIS  65   6.735  -8.431  -3.327
  509   2HB   HIS  65          2HB       HIS  65   6.472  -7.096  -2.209
  510    HD1  HIS  65           HD1      HIS  65   7.904  -7.308  -0.220
  511    HD2  HIS  65           HD2      HIS  65   6.718 -11.023  -1.653
  512    HE1  HIS  65           HE1      HIS  65   8.955  -8.991   1.325
  513    H    PHE  66           H        PHE  66   3.288  -9.334  -0.573
  514    HA   PHE  66           HA       PHE  66   2.767  -6.672   0.573
  515   1HB   PHE  66          1HB       PHE  66   1.047  -9.032   0.090
  516   2HB   PHE  66          2HB       PHE  66   0.789  -8.193   1.616
  517    HD1  PHE  66           HD1      PHE  66   0.882  -7.726  -2.053
  518    HD2  PHE  66           HD2      PHE  66  -0.396  -6.174   1.699
  519    HE1  PHE  66           HE1      PHE  66  -0.479  -6.040  -3.218
  520    HE2  PHE  66           HE2      PHE  66  -1.760  -4.486   0.540
  521    HZ   PHE  66           HZ       PHE  66  -1.804  -4.418  -1.922
  522    H    GLU  67           H        GLU  67   2.472  -6.564   2.905
  523    HA   GLU  67           HA       GLU  67   3.549  -8.755   4.478
  524   1HB   GLU  67          1HB       GLU  67   5.103  -6.400   3.763
  525   2HB   GLU  67          2HB       GLU  67   4.956  -6.589   5.505
  526   1HG   GLU  67          1HG       GLU  67   5.696  -8.995   5.145
  527   2HG   GLU  67          2HG       GLU  67   6.151  -8.490   3.519
  528    H    LYS  68           H        LYS  68   2.050  -8.975   5.995
  529    HA   LYS  68           HA       LYS  68   0.756  -6.579   7.091
  530   1HB   LYS  68          1HB       LYS  68  -0.599  -8.513   6.117
  531   2HB   LYS  68          2HB       LYS  68  -0.102  -9.435   7.530
  532   1HG   LYS  68          1HG       LYS  68  -1.047  -7.280   8.772
  533   2HG   LYS  68          2HG       LYS  68  -2.016  -7.192   7.300
  534   1HD   LYS  68          1HD       LYS  68  -3.149  -9.117   7.768
  535   2HD   LYS  68          2HD       LYS  68  -1.794  -9.829   8.648
  536   1HE   LYS  68          1HE       LYS  68  -3.260  -7.459   9.747
  537   2HE   LYS  68          2HE       LYS  68  -3.901  -9.087   9.957
  538   1HZ   LYS  68          1HZ       LYS  68  -2.082  -9.721  11.231
  539   2HZ   LYS  68          2HZ       LYS  68  -2.397  -8.150  11.771
  540   3HZ   LYS  68          3HZ       LYS  68  -1.119  -8.435  10.701
  541    H    ARG  69           H        ARG  69   3.452  -7.895   7.781
  542    HA   ARG  69           HA       ARG  69   3.207  -8.880  10.436
  543   1HB   ARG  69          1HB       ARG  69   5.328  -8.389   8.532
  544   2HB   ARG  69          2HB       ARG  69   5.797  -7.853  10.140
  545   1HG   ARG  69          1HG       ARG  69   5.382 -10.037  11.049
  546   2HG   ARG  69          2HG       ARG  69   4.730 -10.595   9.507
  547   1HD   ARG  69          1HD       ARG  69   7.142  -9.719   8.702
  548   2HD   ARG  69          2HD       ARG  69   7.529 -10.191  10.357
  549    HE   ARG  69           HE       ARG  69   6.081 -12.265   9.162
  550   1HH1  ARG  69          1HH1      ARG  69   9.175 -10.692   8.896
  551   2HH1  ARG  69          2HH1      ARG  69   9.988 -12.103   8.304
  552   1HH2  ARG  69          1HH2      ARG  69   7.140 -14.129   8.384
  553   2HH2  ARG  69          2HH2      ARG  69   8.829 -14.057   8.013
  554    H    ARG  70           H        ARG  70   2.792  -5.824   9.199
  555    HA   ARG  70           HA       ARG  70   2.502  -3.782  10.162
  556   1HB   ARG  70          1HB       ARG  70   2.984  -5.074  12.842
  557   2HB   ARG  70          2HB       ARG  70   2.049  -3.627  12.487
  558   1HG   ARG  70          1HG       ARG  70   0.223  -4.870  12.406
  559   2HG   ARG  70          2HG       ARG  70   0.885  -5.709  11.001
  560   1HD   ARG  70          1HD       ARG  70   0.817  -7.551  12.261
  561   2HD   ARG  70          2HD       ARG  70   2.212  -6.880  13.105
  562    HE   ARG  70           HE       ARG  70  -0.006  -5.792  14.324
  563   1HH1  ARG  70          1HH1      ARG  70   1.275  -8.981  13.770
  564   2HH1  ARG  70          2HH1      ARG  70   0.585  -9.651  15.211
  565   1HH2  ARG  70          1HH2      ARG  70  -0.921  -6.662  16.224
  566   2HH2  ARG  70          2HH2      ARG  70  -0.665  -8.331  16.605
  567    H    GLY  71           H        GLY  71   5.123  -4.729   9.349
  568   1HA   GLY  71          1HA       GLY  71   7.051  -3.807  11.267
  569   2HA   GLY  71          2HA       GLY  71   7.370  -4.250   9.597
  570    H    THR  72           H        THR  72   4.903  -2.136   9.405
  571    HA   THR  72           HA       THR  72   6.634   0.242   9.417
  572    HB   THR  72           HB       THR  72   5.226   0.923   7.317
  573    HG1  THR  72           HG1      THR  72   4.075  -1.245   7.587
  574   1HG2  THR  72          1HG2      THR  72   7.302  -1.176   6.799
  575   2HG2  THR  72          2HG2      THR  72   7.744   0.350   7.567
  576   3HG2  THR  72          3HG2      THR  72   7.023   0.348   5.957
  577    H    GLN  73           H        GLN  73   4.390  -0.881  11.124
  578    HA   GLN  73           HA       GLN  73   2.235   1.008  10.748
  579   1HB   GLN  73          1HB       GLN  73   1.952  -1.367  11.593
  580   2HB   GLN  73          2HB       GLN  73   2.666  -0.823  13.106
  581   1HG   GLN  73          1HG       GLN  73   0.297   0.593  11.964
  582   2HG   GLN  73          2HG       GLN  73   0.095  -0.911  12.861
  583   1HE2  GLN  73          1HE2      GLN  73  -0.365   2.149  13.271
  584   2HE2  GLN  73          2HE2      GLN  73   0.157   2.386  14.901
  585    H    GLY  74           H        GLY  74   3.230   3.024  11.016
  586   1HA   GLY  74          1HA       GLY  74   3.026   4.425  13.250
  587   2HA   GLY  74          2HA       GLY  74   4.536   3.584  13.568
  588    H    GLU  75           H        GLU  75   6.230   4.840  13.213
  589    HA   GLU  75           HA       GLU  75   6.189   7.261  11.834
  590   1HB   GLU  75          1HB       GLU  75   7.927   6.268  13.513
  591   2HB   GLU  75          2HB       GLU  75   8.710   5.654  12.063
  592   1HG   GLU  75          1HG       GLU  75   8.271   8.266  11.408
  593   2HG   GLU  75          2HG       GLU  75   8.600   8.365  13.138
  594    H    ALA  76           H        ALA  76   6.622   4.020  10.686
  595    HA   ALA  76           HA       ALA  76   7.925   4.543   8.250
  596   1HB   ALA  76          1HB       ALA  76   6.284   2.312   9.329
  597   2HB   ALA  76          2HB       ALA  76   6.587   2.362   7.592
  598   3HB   ALA  76          3HB       ALA  76   7.940   2.310   8.722
  599    H    ARG  77           H        ARG  77   4.773   5.286   9.291
  600    HA   ARG  77           HA       ARG  77   3.383   5.144   6.831
  601   1HB   ARG  77          1HB       ARG  77   2.366   5.337   9.141
  602   2HB   ARG  77          2HB       ARG  77   2.796   7.042   9.102
  603   1HG   ARG  77          1HG       ARG  77   1.468   7.007   6.843
  604   2HG   ARG  77          2HG       ARG  77   0.727   5.570   7.552
  605   1HD   ARG  77          1HD       ARG  77   0.881   8.255   8.914
  606   2HD   ARG  77          2HD       ARG  77  -0.513   7.686   7.996
  607    HE   ARG  77           HE       ARG  77   0.273   6.877  10.643
  608   1HH1  ARG  77          1HH1      ARG  77  -1.506   6.001   7.782
  609   2HH1  ARG  77          2HH1      ARG  77  -2.564   4.910   8.615
  610   1HH2  ARG  77          1HH2      ARG  77  -1.113   5.444  11.751
  611   2HH2  ARG  77          2HH2      ARG  77  -2.339   4.595  10.873
  612    H    ALA  78           H        ALA  78   5.749   7.298   8.011
  613    HA   ALA  78           HA       ALA  78   5.145   9.186   5.828
  614   1HB   ALA  78          1HB       ALA  78   4.852  10.616   7.555
  615   2HB   ALA  78          2HB       ALA  78   5.855   9.669   8.655
  616   3HB   ALA  78          3HB       ALA  78   6.610  10.723   7.460
  617    H    TYR  79           H        TYR  79   7.573   7.370   7.569
  618    HA   TYR  79           HA       TYR  79   9.772   8.442   6.040
  619   1HB   TYR  79          1HB       TYR  79  10.266   7.789   8.286
  620   2HB   TYR  79          2HB       TYR  79   9.563   6.193   8.044
  621    HD1  TYR  79           HD1      TYR  79  12.092   8.221   6.173
  622    HD2  TYR  79           HD2      TYR  79  11.178   4.555   8.130
  623    HE1  TYR  79           HE1      TYR  79  14.306   7.346   5.555
  624    HE2  TYR  79           HE2      TYR  79  13.390   3.671   7.518
  625    HH   TYR  79           HH       TYR  79  15.881   5.310   6.758
  626    H    SER  80           H        SER  80   7.403   6.106   5.530
  627    HA   SER  80           HA       SER  80   8.577   3.996   4.266
  628   1HB   SER  80          1HB       SER  80   6.472   4.397   2.602
  629   2HB   SER  80          2HB       SER  80   6.325   3.691   4.211
  630    HG   SER  80           HG       SER  80   4.869   5.336   4.137
  631    H    MET  81           H        MET  81   9.071   3.497   2.066
  632    HA   MET  81           HA       MET  81  10.060   3.850   0.048
  633   1HB   MET  81          1HB       MET  81   8.987   6.659   0.059
  634   2HB   MET  81          2HB       MET  81   9.293   5.608  -1.317
  635   1HG   MET  81          1HG       MET  81   7.145   5.090  -1.300
  636   2HG   MET  81          2HG       MET  81   7.422   4.242   0.219
  637   1HE   MET  81          1HE       MET  81   4.237   5.915  -0.289
  638   2HE   MET  81          2HE       MET  81   5.023   4.454   0.309
  639   3HE   MET  81          3HE       MET  81   4.333   5.613   1.446
  640    H    LYS  82           H        LYS  82  11.694   5.286  -1.094
  641    HA   LYS  82           HA       LYS  82  13.431   6.545   0.926
  642   1HB   LYS  82          1HB       LYS  82  13.952   4.474  -0.955
  643   2HB   LYS  82          2HB       LYS  82  14.884   5.884  -1.442
  644   1HG   LYS  82          1HG       LYS  82  14.935   5.016   1.408
  645   2HG   LYS  82          2HG       LYS  82  15.887   4.135   0.210
  646   1HD   LYS  82          1HD       LYS  82  16.338   6.865  -0.280
  647   2HD   LYS  82          2HD       LYS  82  16.433   6.657   1.471
  648   1HE   LYS  82          1HE       LYS  82  17.826   4.677  -0.254
  649   2HE   LYS  82          2HE       LYS  82  18.531   6.286  -0.108
  650   1HZ   LYS  82          1HZ       LYS  82  19.368   4.663   1.542
  651   2HZ   LYS  82          2HZ       LYS  82  17.816   4.572   2.207
  652   3HZ   LYS  82          3HZ       LYS  82  18.668   6.033   2.247
  653    H    GLU  83           H        GLU  83  14.278   8.543   0.544
  654    HA   GLU  83           HA       GLU  83  12.933  10.258  -1.242
  655   1HB   GLU  83          1HB       GLU  83  15.252  10.497   0.602
  656   2HB   GLU  83          2HB       GLU  83  15.090  11.723  -0.647
  657   1HG   GLU  83          1HG       GLU  83  12.911  12.329   0.148
  658   2HG   GLU  83          2HG       GLU  83  12.920  11.000   1.305
  659    H    ASP  84           H        ASP  84  15.967   8.512  -1.460
  660    HA   ASP  84           HA       ASP  84  16.942   9.833  -3.778
  661   1HB   ASP  84          1HB       ASP  84  18.410   8.563  -2.266
  662   2HB   ASP  84          2HB       ASP  84  17.591   7.072  -2.722
  663    H    THR  85           H        THR  85  14.914   7.012  -3.244
  664    HA   THR  85           HA       THR  85  14.755   6.533  -6.129
  665    HB   THR  85           HB       THR  85  13.388   4.511  -5.412
  666    HG1  THR  85           HG1      THR  85  13.899   3.937  -3.135
  667   1HG2  THR  85          1HG2      THR  85  16.088   4.346  -4.154
  668   2HG2  THR  85          2HG2      THR  85  15.973   4.711  -5.875
  669   3HG2  THR  85          3HG2      THR  85  15.282   3.217  -5.242
  670    H    ARG  86           H        ARG  86  13.334   8.595  -4.163
  671    HA   ARG  86           HA       ARG  86  10.553   8.075  -4.618
  672   1HB   ARG  86          1HB       ARG  86  12.015   9.733  -2.928
  673   2HB   ARG  86          2HB       ARG  86  11.202  10.846  -4.020
  674   1HG   ARG  86          1HG       ARG  86   9.347  10.632  -2.840
  675   2HG   ARG  86          2HG       ARG  86   9.304   8.910  -3.226
  676   1HD   ARG  86          1HD       ARG  86  10.522   8.347  -1.279
  677   2HD   ARG  86          2HD       ARG  86  10.970  10.027  -0.987
  678    HE   ARG  86           HE       ARG  86   8.591   8.730  -0.136
  679   1HH1  ARG  86          1HH1      ARG  86   9.835  11.783  -1.254
  680   2HH1  ARG  86          2HH1      ARG  86   8.627  12.722  -0.441
  681   1HH2  ARG  86          1HH2      ARG  86   6.995   9.954   0.939
  682   2HH2  ARG  86          2HH2      ARG  86   7.012  11.680   0.807
  683    H    LEU  87           H        LEU  87   9.484   8.417  -6.441
  684    HA   LEU  87           HA       LEU  87  10.614  10.280  -8.415
  685   1HB   LEU  87          1HB       LEU  87   9.579   7.651  -8.616
  686   2HB   LEU  87          2HB       LEU  87   8.481   8.721  -9.486
  687    HG   LEU  87           HG       LEU  87  11.443   8.441  -9.993
  688   1HD1  LEU  87          1HD1      LEU  87  10.477   7.583 -12.230
  689   2HD1  LEU  87          2HD1      LEU  87   9.011   7.287 -11.297
  690   3HD1  LEU  87          3HD1      LEU  87  10.520   6.495 -10.843
  691   1HD2  LEU  87          1HD2      LEU  87   9.315  10.190 -11.180
  692   2HD2  LEU  87          2HD2      LEU  87  10.760   9.747 -12.089
  693   3HD2  LEU  87          3HD2      LEU  87  10.910  10.640 -10.575
  694    H    GLU  88           H        GLU  88   7.394   9.120  -7.393
  695    HA   GLU  88           HA       GLU  88   6.441  11.897  -7.579
  696   1HB   GLU  88          1HB       GLU  88   5.715   9.885  -9.329
  697   2HB   GLU  88          2HB       GLU  88   4.401   9.889  -8.161
  698   1HG   GLU  88          1HG       GLU  88   3.769  11.339  -9.912
  699   2HG   GLU  88          2HG       GLU  88   4.196  12.356  -8.538
  700    H    GLY  89           H        GLY  89   4.155  12.025  -6.509
  701   1HA   GLY  89          1HA       GLY  89   2.735  11.466  -4.722
  702   2HA   GLY  89          2HA       GLY  89   3.888  10.238  -4.219
  703    HA   PRO  90           HA       PRO  90   3.285   9.976  -2.250
  704   1HB   PRO  90          1HB       PRO  90   1.944  10.743  -0.018
  705   2HB   PRO  90          2HB       PRO  90   3.641  10.250   0.003
  706   1HG   PRO  90          1HG       PRO  90   2.470  13.005  -0.013
  707   2HG   PRO  90          2HG       PRO  90   3.824  12.370   0.940
  708   1HD   PRO  90          1HD       PRO  90   4.185  13.858  -1.293
  709   2HD   PRO  90          2HD       PRO  90   5.314  12.578  -0.806
  710    H    TRP  91           H        TRP  91   0.953   9.381  -1.918
  711    HA   TRP  91           HA       TRP  91  -0.925  11.404  -2.893
  712   1HB   TRP  91          1HB       TRP  91  -0.346   8.754  -4.206
  713   2HB   TRP  91          2HB       TRP  91  -1.883   9.585  -4.432
  714    HD1  TRP  91           HD1      TRP  91  -0.704  12.564  -4.684
  715    HE1  TRP  91           HE1      TRP  91   0.545  13.224  -6.836
  716    HE3  TRP  91           HE3      TRP  91   0.547   7.899  -6.361
  717    HZ2  TRP  91           HZ2      TRP  91   1.882  11.937  -8.963
  718    HZ3  TRP  91           HZ3      TRP  91   1.810   7.700  -8.463
  719    HH2  TRP  91           HH2      TRP  91   2.463   9.679  -9.736
  720    H    GLU  92           H        GLU  92  -2.911  11.271  -1.997
  721    HA   GLU  92           HA       GLU  92  -3.466   8.922  -0.305
  722   1HB   GLU  92          1HB       GLU  92  -4.109  11.834   0.152
  723   2HB   GLU  92          2HB       GLU  92  -4.848  10.535   1.078
  724   1HG   GLU  92          1HG       GLU  92  -3.075  11.326   2.390
  725   2HG   GLU  92          2HG       GLU  92  -2.510   9.810   1.691
  726    H    TYR  93           H        TYR  93  -5.418   7.947  -0.477
  727    HA   TYR  93           HA       TYR  93  -7.518   9.232  -2.058
  728   1HB   TYR  93          1HB       TYR  93  -6.318   6.525  -2.658
  729   2HB   TYR  93          2HB       TYR  93  -7.860   7.071  -3.309
  730    HD1  TYR  93           HD1      TYR  93  -7.915   9.018  -4.866
  731    HD2  TYR  93           HD2      TYR  93  -4.258   7.258  -3.591
  732    HE1  TYR  93           HE1      TYR  93  -6.745  10.112  -6.733
  733    HE2  TYR  93           HE2      TYR  93  -3.077   8.348  -5.452
  734    HH   TYR  93           HH       TYR  93  -4.626   9.695  -8.073
  735    H    GLY  94           H        GLY  94  -9.607   8.083  -1.893
  736   1HA   GLY  94          1HA       GLY  94 -11.178   6.781  -0.769
  737   2HA   GLY  94          2HA       GLY  94  -9.894   6.163   0.260
  738    H    GLU  95           H        GLU  95 -11.059   6.445   2.159
  739    HA   GLU  95           HA       GLU  95 -12.238   8.954   2.860
  740   1HB   GLU  95          1HB       GLU  95 -13.187   6.994   3.831
  741   2HB   GLU  95          2HB       GLU  95 -11.626   6.459   4.438
  742   1HG   GLU  95          1HG       GLU  95 -11.584   8.363   5.980
  743   2HG   GLU  95          2HG       GLU  95 -13.166   8.864   5.387
  Start of MODEL    3
    1   1H    ALA   2          1H        ALA   2 -13.486   2.864  18.497
    2    HA   ALA   2           HA       ALA   2 -11.044   3.364  19.608
    3   1HB   ALA   2          1HB       ALA   2 -12.433   2.648  21.233
    4   2HB   ALA   2          2HB       ALA   2 -13.222   1.466  20.188
    5   3HB   ALA   2          3HB       ALA   2 -11.661   1.093  20.920
    6    H    ARG   3           H        ARG   3 -12.011   0.291  18.079
    7    HA   ARG   3           HA       ARG   3  -9.365  -0.797  18.255
    8   1HB   ARG   3          1HB       ARG   3 -11.625  -2.058  18.185
    9   2HB   ARG   3          2HB       ARG   3 -11.522  -1.842  16.443
   10   1HG   ARG   3          1HG       ARG   3 -10.576  -3.909  16.685
   11   2HG   ARG   3          2HG       ARG   3  -9.144  -2.880  16.753
   12   1HD   ARG   3          1HD       ARG   3  -8.977  -3.081  19.086
   13   2HD   ARG   3          2HD       ARG   3 -10.622  -3.698  19.233
   14    HE   ARG   3           HE       ARG   3  -9.409  -5.587  17.741
   15   1HH1  ARG   3          1HH1      ARG   3  -8.576  -4.049  20.751
   16   2HH1  ARG   3          2HH1      ARG   3  -7.731  -5.427  21.372
   17   1HH2  ARG   3          1HH2      ARG   3  -8.299  -7.409  18.548
   18   2HH2  ARG   3          2HH2      ARG   3  -7.573  -7.338  20.118
   19    H    GLN   4           H        GLN   4  -7.728  -0.463  16.909
   20    HA   GLN   4           HA       GLN   4  -8.309   0.676  14.257
   21   1HB   GLN   4          1HB       GLN   4  -6.153   1.747  14.328
   22   2HB   GLN   4          2HB       GLN   4  -7.019   2.131  15.809
   23   1HG   GLN   4          1HG       GLN   4  -5.742   0.330  16.949
   24   2HG   GLN   4          2HG       GLN   4  -4.800   0.129  15.473
   25   1HE2  GLN   4          1HE2      GLN   4  -5.333   2.024  18.285
   26   2HE2  GLN   4          2HE2      GLN   4  -4.030   3.134  18.055
   27    H    VAL   5           H        VAL   5  -6.939   0.033  12.485
   28    HA   VAL   5           HA       VAL   5  -5.895  -2.704  12.816
   29    HB   VAL   5           HB       VAL   5  -6.404  -3.100  10.470
   30   1HG1  VAL   5          1HG1      VAL   5  -8.291  -3.842  11.407
   31   2HG1  VAL   5          2HG1      VAL   5  -8.420  -2.437  12.467
   32   3HG1  VAL   5          3HG1      VAL   5  -9.028  -2.355  10.813
   33   1HG2  VAL   5          1HG2      VAL   5  -6.714  -1.457   9.007
   34   2HG2  VAL   5          2HG2      VAL   5  -8.083  -0.836   9.930
   35   3HG2  VAL   5          3HG2      VAL   5  -6.447  -0.297  10.308
   36    H    ILE   6           H        ILE   6  -4.085  -3.308  11.448
   37    HA   ILE   6           HA       ILE   6  -2.140  -1.160  11.289
   38    HB   ILE   6           HB       ILE   6  -1.740  -4.084  10.660
   39   1HG1  ILE   6          1HG1      ILE   6  -0.579  -3.829  13.047
   40   2HG1  ILE   6          2HG1      ILE   6  -1.810  -2.585  13.234
   41   1HG2  ILE   6          1HG2      ILE   6   0.133  -3.124   9.798
   42   2HG2  ILE   6          2HG2      ILE   6   0.036  -1.720  10.860
   43   3HG2  ILE   6          3HG2      ILE   6   0.647  -3.254  11.480
   44   1HD1  ILE   6          1HD1      ILE   6  -3.237  -4.165  13.815
   45   2HD1  ILE   6          2HD1      ILE   6  -3.120  -4.829  12.185
   46   3HD1  ILE   6          3HD1      ILE   6  -2.052  -5.421  13.458
   47    H    CYS   7           H        CYS   7  -0.951  -0.629   9.425
   48    HA   CYS   7           HA       CYS   7  -2.478  -0.750   6.994
   49   1HB   CYS   7          1HB       CYS   7  -0.870   0.764   6.092
   50   2HB   CYS   7          2HB       CYS   7  -1.136   1.247   7.763
   51    HG   CYS   7           HG       CYS   7   1.267  -0.589   8.299
   52    H    TRP   8           H        TRP   8  -1.644  -1.502   4.948
   53    HA   TRP   8           HA       TRP   8   0.034  -3.893   5.279
   54   1HB   TRP   8          1HB       TRP   8  -2.031  -3.184   3.188
   55   2HB   TRP   8          2HB       TRP   8  -0.988  -4.600   3.090
   56    HD1  TRP   8           HD1      TRP   8  -3.477  -3.128   5.695
   57    HE1  TRP   8           HE1      TRP   8  -4.789  -5.091   6.720
   58    HE3  TRP   8           HE3      TRP   8  -1.219  -6.992   3.224
   59    HZ2  TRP   8           HZ2      TRP   8  -4.858  -7.905   6.509
   60    HZ3  TRP   8           HZ3      TRP   8  -1.966  -9.289   3.694
   61    HH2  TRP   8           HH2      TRP   8  -3.747  -9.734   5.303
   62    H    CYS   9           H        CYS   9   2.076  -3.647   4.677
   63    HA   CYS   9           HA       CYS   9   2.766  -1.626   2.683
   64   1HB   CYS   9          1HB       CYS   9   5.116  -2.104   3.397
   65   2HB   CYS   9          2HB       CYS   9   4.077  -1.538   4.699
   66    HG   CYS   9           HG       CYS   9   4.066  -3.734   6.155
   67    H    PHE  10           H        PHE  10   2.961  -2.192   0.630
   68    HA   PHE  10           HA       PHE  10   4.108  -4.810  -0.025
   69   1HB   PHE  10          1HB       PHE  10   2.408  -5.424  -1.481
   70   2HB   PHE  10          2HB       PHE  10   1.503  -4.659  -0.180
   71    HD1  PHE  10           HD2      PHE  10   1.002  -2.125  -0.484
   72    HD2  PHE  10           HD1      PHE  10   2.051  -4.760  -3.658
   73    HE1  PHE  10           HE2      PHE  10  -0.016  -0.576  -2.102
   74    HE2  PHE  10           HE1      PHE  10   1.036  -3.214  -5.281
   75    HZ   PHE  10           HZ       PHE  10  -0.001  -1.120  -4.504
   76    H    THR  11           H        THR  11   4.827  -4.935  -2.313
   77    HA   THR  11           HA       THR  11   5.569  -2.293  -3.382
   78    HB   THR  11           HB       THR  11   7.439  -4.613  -3.674
   79    HG1  THR  11           HG1      THR  11   7.365  -4.579  -1.495
   80   1HG2  THR  11          1HG2      THR  11   7.442  -2.015  -4.586
   81   2HG2  THR  11          2HG2      THR  11   8.852  -3.069  -4.478
   82   3HG2  THR  11          3HG2      THR  11   8.492  -1.939  -3.173
   83    H    LEU  12           H        LEU  12   4.966  -2.008  -5.422
   84    HA   LEU  12           HA       LEU  12   4.327  -4.381  -7.039
   85   1HB   LEU  12          1HB       LEU  12   2.585  -2.559  -6.456
   86   2HB   LEU  12          2HB       LEU  12   3.420  -1.599  -7.675
   87    HG   LEU  12           HG       LEU  12   2.877  -3.243  -9.378
   88   1HD1  LEU  12          1HD1      LEU  12   2.925  -5.280  -8.142
   89   2HD1  LEU  12          2HD1      LEU  12   1.300  -5.094  -8.799
   90   3HD1  LEU  12          3HD1      LEU  12   1.608  -4.746  -7.098
   91   1HD2  LEU  12          1HD2      LEU  12   1.276  -1.482  -9.037
   92   2HD2  LEU  12          2HD2      LEU  12   0.519  -2.370  -7.714
   93   3HD2  LEU  12          3HD2      LEU  12   0.411  -2.984  -9.364
   94    H    ASN  13           H        ASN  13   5.729  -4.880  -8.576
   95    HA   ASN  13           HA       ASN  13   7.455  -2.761  -9.662
   96   1HB   ASN  13          1HB       ASN  13   8.922  -4.660 -10.396
   97   2HB   ASN  13          2HB       ASN  13   8.741  -4.522  -8.649
   98   1HD2  ASN  13          1HD2      ASN  13   7.984  -6.381 -11.474
   99   2HD2  ASN  13          2HD2      ASN  13   7.406  -7.783 -10.647
  100    H    ASN  14           H        ASN  14   7.413  -2.259 -11.777
  101    HA   ASN  14           HA       ASN  14   6.556  -2.078 -13.884
  102   1HB   ASN  14          1HB       ASN  14   8.095  -3.980 -14.176
  103   2HB   ASN  14          2HB       ASN  14   6.795  -5.092 -13.759
  104   1HD2  ASN  14          1HD2      ASN  14   6.899  -6.143 -15.727
  105   2HD2  ASN  14          2HD2      ASN  14   6.340  -5.422 -17.194
  106    HA   PRO  15           HA       PRO  15   2.271  -3.300 -12.391
  107   1HB   PRO  15          1HB       PRO  15   1.318  -0.769 -12.154
  108   2HB   PRO  15          2HB       PRO  15   2.142  -1.612 -10.837
  109   1HG   PRO  15          1HG       PRO  15   3.222   0.415 -12.758
  110   2HG   PRO  15          2HG       PRO  15   3.483   0.280 -11.009
  111   1HD   PRO  15          1HD       PRO  15   5.302  -0.575 -12.823
  112   2HD   PRO  15          2HD       PRO  15   5.083  -1.362 -11.247
  113    H    LEU  16           H        LEU  16   0.555  -3.484 -13.754
  114    HA   LEU  16           HA       LEU  16   0.912  -2.552 -16.468
  115   1HB   LEU  16          1HB       LEU  16  -1.137  -4.304 -15.136
  116   2HB   LEU  16          2HB       LEU  16  -1.249  -3.826 -16.828
  117    HG   LEU  16           HG       LEU  16   1.239  -4.866 -16.795
  118   1HD1  LEU  16          1HD1      LEU  16   1.568  -5.849 -14.804
  119   2HD1  LEU  16          2HD1      LEU  16   0.566  -7.134 -15.479
  120   3HD1  LEU  16          3HD1      LEU  16  -0.155  -5.913 -14.431
  121   1HD2  LEU  16          1HD2      LEU  16   0.206  -6.920 -17.708
  122   2HD2  LEU  16          2HD2      LEU  16  -0.475  -5.442 -18.389
  123   3HD2  LEU  16          3HD2      LEU  16  -1.367  -6.340 -17.160
  124    H    SER  17           H        SER  17  -0.392  -1.238 -13.733
  125    HA   SER  17           HA       SER  17  -1.502   0.982 -15.011
  126   1HB   SER  17          1HB       SER  17  -3.705   0.567 -15.295
  127   2HB   SER  17          2HB       SER  17  -3.238  -1.132 -15.239
  128    HG   SER  17           HG       SER  17  -4.948  -0.549 -13.766
  129    HA   PRO  18           HA       PRO  18  -1.262   2.615 -10.947
  130   1HB   PRO  18          1HB       PRO  18  -3.218   4.496 -10.953
  131   2HB   PRO  18          2HB       PRO  18  -1.707   4.679 -11.851
  132   1HG   PRO  18          1HG       PRO  18  -4.399   3.814 -12.832
  133   2HG   PRO  18          2HG       PRO  18  -3.239   4.925 -13.583
  134   1HD   PRO  18          1HD       PRO  18  -3.504   2.347 -14.367
  135   2HD   PRO  18          2HD       PRO  18  -1.954   3.209 -14.431
  136    H    LEU  19           H        LEU  19  -2.185   2.572  -8.883
  137    HA   LEU  19           HA       LEU  19  -4.269   0.626  -8.528
  138   1HB   LEU  19          1HB       LEU  19  -3.067   2.339  -6.374
  139   2HB   LEU  19          2HB       LEU  19  -3.786   0.737  -6.224
  140    HG   LEU  19           HG       LEU  19  -1.242   1.207  -7.756
  141   1HD1  LEU  19          1HD1      LEU  19  -1.117   2.004  -5.352
  142   2HD1  LEU  19          2HD1      LEU  19   0.043   0.768  -5.836
  143   3HD1  LEU  19          3HD1      LEU  19  -1.375   0.322  -4.888
  144   1HD2  LEU  19          1HD2      LEU  19  -1.335  -1.301  -6.503
  145   2HD2  LEU  19          2HD2      LEU  19  -1.497  -0.947  -8.224
  146   3HD2  LEU  19          3HD2      LEU  19  -2.933  -1.044  -7.203
  147    H    SER  20           H        SER  20  -6.052   1.090  -6.906
  148    HA   SER  20           HA       SER  20  -7.038   3.825  -6.939
  149   1HB   SER  20          1HB       SER  20  -9.229   3.164  -7.881
  150   2HB   SER  20          2HB       SER  20  -7.918   2.925  -9.036
  151    HG   SER  20           HG       SER  20  -9.101   0.919  -7.410
  152    H    LEU  21           H        LEU  21  -9.079   4.025  -5.648
  153    HA   LEU  21           HA       LEU  21  -8.746   2.844  -3.119
  154   1HB   LEU  21          1HB       LEU  21  -9.789   4.955  -3.219
  155   2HB   LEU  21          2HB       LEU  21 -10.993   4.390  -4.375
  156    HG   LEU  21           HG       LEU  21 -11.923   2.944  -2.533
  157   1HD1  LEU  21          1HD1      LEU  21 -11.061   4.445  -0.321
  158   2HD1  LEU  21          2HD1      LEU  21  -9.608   3.952  -1.188
  159   3HD1  LEU  21          3HD1      LEU  21 -10.769   2.738  -0.654
  160   1HD2  LEU  21          1HD2      LEU  21 -12.685   5.175  -1.246
  161   2HD2  LEU  21          2HD2      LEU  21 -13.318   4.696  -2.821
  162   3HD2  LEU  21          3HD2      LEU  21 -12.021   5.887  -2.716
  163    H    HIS  22           H        HIS  22 -10.063   1.365  -1.981
  164    HA   HIS  22           HA       HIS  22 -11.566  -0.481  -3.719
  165   1HB   HIS  22          1HB       HIS  22  -9.358  -1.279  -2.650
  166   2HB   HIS  22          2HB       HIS  22 -10.255  -1.297  -1.135
  167    HD1  HIS  22           HD1      HIS  22 -10.461  -3.759  -0.738
  168    HD2  HIS  22           HD2      HIS  22 -11.630  -2.667  -4.572
  169    HE1  HIS  22           HE1      HIS  22 -11.455  -5.833  -1.754
  170    H    ASP  23           H        ASP  23 -13.585  -1.075  -3.126
  171    HA   ASP  23           HA       ASP  23 -15.025   0.509  -1.308
  172   1HB   ASP  23          1HB       ASP  23 -15.646  -2.072  -2.726
  173   2HB   ASP  23          2HB       ASP  23 -16.793  -1.348  -1.602
  174    H    SER  24           H        SER  24 -13.180  -2.368  -0.873
  175    HA   SER  24           HA       SER  24 -14.432  -3.073   1.641
  176   1HB   SER  24          1HB       SER  24 -11.839  -4.198   0.594
  177   2HB   SER  24          2HB       SER  24 -13.015  -4.964   1.662
  178    HG   SER  24           HG       SER  24 -13.761  -5.796  -0.115
  179    H    MET  25           H        MET  25 -11.414  -1.611   0.526
  180    HA   MET  25           HA       MET  25 -10.263  -1.393   3.126
  181   1HB   MET  25          1HB       MET  25  -8.480  -0.297   2.094
  182   2HB   MET  25          2HB       MET  25  -9.083  -1.358   0.829
  183   1HG   MET  25          1HG       MET  25 -10.165   0.438  -0.280
  184   2HG   MET  25          2HG       MET  25  -9.885   1.525   1.078
  185   1HE   MET  25          1HE       MET  25  -8.049  -1.070  -0.839
  186   2HE   MET  25          2HE       MET  25  -7.789  -0.037  -2.245
  187   3HE   MET  25          3HE       MET  25  -6.449  -0.398  -1.156
  188    H    LYS  26           H        LYS  26  -9.408   1.073   3.552
  189    HA   LYS  26           HA       LYS  26 -11.835   2.741   3.664
  190   1HB   LYS  26          1HB       LYS  26 -10.293   1.672   5.814
  191   2HB   LYS  26          2HB       LYS  26 -10.083   3.418   5.805
  192   1HG   LYS  26          1HG       LYS  26 -12.828   2.939   5.417
  193   2HG   LYS  26          2HG       LYS  26 -12.300   1.871   6.721
  194   1HD   LYS  26          1HD       LYS  26 -11.150   3.941   7.697
  195   2HD   LYS  26          2HD       LYS  26 -12.136   4.868   6.564
  196   1HE   LYS  26          1HE       LYS  26 -14.021   3.279   7.658
  197   2HE   LYS  26          2HE       LYS  26 -12.907   3.422   9.017
  198   1HZ   LYS  26          1HZ       LYS  26 -13.431   5.564   9.323
  199   2HZ   LYS  26          2HZ       LYS  26 -14.827   5.198   8.442
  200   3HZ   LYS  26          3HZ       LYS  26 -13.502   5.909   7.669
  201    H    TYR  27           H        TYR  27  -8.311   2.669   3.525
  202    HA   TYR  27           HA       TYR  27  -8.372   5.268   2.178
  203   1HB   TYR  27          1HB       TYR  27  -7.751   5.345   4.732
  204   2HB   TYR  27          2HB       TYR  27  -6.194   4.751   4.167
  205    HD1  TYR  27           HD1      TYR  27  -8.664   7.387   3.182
  206    HD2  TYR  27           HD2      TYR  27  -4.585   6.355   3.813
  207    HE1  TYR  27           HE1      TYR  27  -8.001   9.687   2.615
  208    HE2  TYR  27           HE2      TYR  27  -3.911   8.653   3.249
  209    HH   TYR  27           HH       TYR  27  -5.697  11.168   3.335
  210    H    LEU  28           H        LEU  28  -6.673   5.621   0.723
  211    HA   LEU  28           HA       LEU  28  -4.976   3.275   0.181
  212   1HB   LEU  28          1HB       LEU  28  -6.529   3.212  -1.549
  213   2HB   LEU  28          2HB       LEU  28  -6.592   4.968  -1.684
  214    HG   LEU  28           HG       LEU  28  -4.471   5.019  -2.803
  215   1HD1  LEU  28          1HD1      LEU  28  -4.188   2.386  -1.629
  216   2HD1  LEU  28          2HD1      LEU  28  -2.956   3.492  -2.237
  217   3HD1  LEU  28          3HD1      LEU  28  -3.782   2.396  -3.345
  218   1HD2  LEU  28          1HD2      LEU  28  -6.509   4.490  -4.122
  219   2HD2  LEU  28          2HD2      LEU  28  -6.109   2.778  -3.980
  220   3HD2  LEU  28          3HD2      LEU  28  -5.020   3.871  -4.837
  221    H    VAL  29           H        VAL  29  -2.865   3.678   0.141
  222    HA   VAL  29           HA       VAL  29  -1.926   6.369  -0.549
  223    HB   VAL  29           HB       VAL  29  -1.060   4.830   1.902
  224   1HG1  VAL  29          1HG1      VAL  29   0.908   5.800   1.085
  225   2HG1  VAL  29          2HG1      VAL  29   0.076   7.267   0.566
  226   3HG1  VAL  29          3HG1      VAL  29   0.318   6.950   2.284
  227   1HG2  VAL  29          1HG2      VAL  29  -2.802   5.926   2.793
  228   2HG2  VAL  29          2HG2      VAL  29  -1.759   7.344   2.706
  229   3HG2  VAL  29          3HG2      VAL  29  -2.931   7.032   1.426
  230    H    TYR  30           H        TYR  30  -0.471   6.225  -2.112
  231    HA   TYR  30           HA       TYR  30   1.607   4.212  -2.027
  232   1HB   TYR  30          1HB       TYR  30   1.118   3.098  -4.018
  233   2HB   TYR  30          2HB       TYR  30  -0.465   3.267  -3.268
  234    HD1  TYR  30           HD2      TYR  30  -2.052   4.986  -4.112
  235    HD2  TYR  30           HD1      TYR  30   1.622   4.157  -6.092
  236    HE1  TYR  30           HE2      TYR  30  -2.895   6.107  -6.132
  237    HE2  TYR  30           HE1      TYR  30   0.789   5.276  -8.118
  238    HH   TYR  30           HH       TYR  30  -2.471   6.100  -8.554
  239    H    GLN  31           H        GLN  31   3.323   4.621  -3.553
  240    HA   GLN  31           HA       GLN  31   3.245   7.206  -4.913
  241   1HB   GLN  31          1HB       GLN  31   5.619   6.531  -3.205
  242   2HB   GLN  31          2HB       GLN  31   5.136   8.091  -3.856
  243   1HG   GLN  31          1HG       GLN  31   3.131   7.962  -2.323
  244   2HG   GLN  31          2HG       GLN  31   3.928   6.590  -1.555
  245   1HE2  GLN  31          1HE2      GLN  31   4.217   7.579   0.403
  246   2HE2  GLN  31          2HE2      GLN  31   5.308   8.896   0.646
  247    H    THR  32           H        THR  32   4.960   7.489  -6.472
  248    HA   THR  32           HA       THR  32   5.773   4.930  -7.627
  249    HB   THR  32           HB       THR  32   5.800   7.718  -8.797
  250    HG1  THR  32           HG1      THR  32   4.204   6.452 -10.208
  251   1HG2  THR  32          1HG2      THR  32   6.512   5.066 -10.056
  252   2HG2  THR  32          2HG2      THR  32   7.607   6.415  -9.756
  253   3HG2  THR  32          3HG2      THR  32   6.306   6.581 -10.935
  254    H    GLU  33           H        GLU  33   7.838   4.265  -7.775
  255    HA   GLU  33           HA       GLU  33   9.948   6.150  -6.953
  256   1HB   GLU  33          1HB       GLU  33   9.353   3.390  -6.023
  257   2HB   GLU  33          2HB       GLU  33  11.046   3.825  -6.214
  258   1HG   GLU  33          1HG       GLU  33  10.968   5.412  -4.548
  259   2HG   GLU  33          2HG       GLU  33   9.223   5.623  -4.686
  260    H    GLN  34           H        GLN  34  12.073   5.716  -7.818
  261    HA   GLN  34           HA       GLN  34  11.914   4.664 -10.534
  262   1HB   GLN  34          1HB       GLN  34  13.194   6.870  -9.394
  263   2HB   GLN  34          2HB       GLN  34  14.494   5.751  -9.784
  264   1HG   GLN  34          1HG       GLN  34  12.617   5.930 -11.957
  265   2HG   GLN  34          2HG       GLN  34  13.212   7.526 -11.503
  266   1HE2  GLN  34          1HE2      GLN  34  14.245   7.573 -13.568
  267   2HE2  GLN  34          2HE2      GLN  34  15.751   6.761 -13.806
  268    H    GLY  35           H        GLY  35  12.889   2.844 -11.203
  269   1HA   GLY  35          1HA       GLY  35  15.212   1.700 -10.193
  270   2HA   GLY  35          2HA       GLY  35  13.877   0.986  -9.301
  271    H    GLU  36           H        GLU  36  14.930  -0.948 -10.399
  272    HA   GLU  36           HA       GLU  36  15.014  -2.525 -12.062
  273   1HB   GLU  36          1HB       GLU  36  12.850  -3.262 -12.786
  274   2HB   GLU  36          2HB       GLU  36  12.701  -2.692 -11.130
  275   1HG   GLU  36          1HG       GLU  36  11.644  -0.688 -11.818
  276   2HG   GLU  36          2HG       GLU  36  12.031  -0.990 -13.511
  277    H    ALA  37           H        ALA  37  13.449  -2.675 -14.454
  278    HA   ALA  37           HA       ALA  37  15.137  -1.390 -16.268
  279   1HB   ALA  37          1HB       ALA  37  13.715  -3.383 -16.743
  280   2HB   ALA  37          2HB       ALA  37  12.322  -2.304 -16.833
  281   3HB   ALA  37          3HB       ALA  37  13.647  -2.133 -17.985
  282    H    GLY  38           H        GLY  38  13.652  -0.159 -18.190
  283   1HA   GLY  38          1HA       GLY  38  13.584   2.489 -17.423
  284   2HA   GLY  38          2HA       GLY  38  12.698   1.843 -18.795
  285    H    ASN  39           H        ASN  39  11.166   0.058 -16.912
  286    HA   ASN  39           HA       ASN  39   8.966   1.817 -16.513
  287   1HB   ASN  39          1HB       ASN  39   9.272  -0.942 -15.325
  288   2HB   ASN  39          2HB       ASN  39   7.779  -0.096 -15.721
  289   1HD2  ASN  39          1HD2      ASN  39  10.211  -2.184 -16.821
  290   2HD2  ASN  39          2HD2      ASN  39   9.672  -2.340 -18.455
  291    H    ILE  40           H        ILE  40   7.779   1.653 -14.280
  292    HA   ILE  40           HA       ILE  40   9.744   2.191 -12.150
  293    HB   ILE  40           HB       ILE  40   7.686   3.720 -11.347
  294   1HG1  ILE  40          1HG1      ILE  40   7.686   3.965 -14.363
  295   2HG1  ILE  40          2HG1      ILE  40   6.404   3.214 -13.418
  296   1HG2  ILE  40          1HG2      ILE  40   9.182   5.353 -13.116
  297   2HG2  ILE  40          2HG2      ILE  40   9.370   5.161 -11.373
  298   3HG2  ILE  40          3HG2      ILE  40  10.261   4.113 -12.477
  299   1HD1  ILE  40          1HD1      ILE  40   6.050   5.607 -14.183
  300   2HD1  ILE  40          2HD1      ILE  40   5.754   5.255 -12.480
  301   3HD1  ILE  40          3HD1      ILE  40   7.249   6.053 -12.969
  302    H    HIS  41           H        HIS  41   8.723   2.105  -9.933
  303    HA   HIS  41           HA       HIS  41   6.658   0.008  -9.817
  304   1HB   HIS  41          1HB       HIS  41   7.900  -0.689  -7.653
  305   2HB   HIS  41          2HB       HIS  41   8.578  -1.174  -9.204
  306    HD1  HIS  41           HD1      HIS  41  10.992  -1.291  -8.425
  307    HD2  HIS  41           HD2      HIS  41   9.220   2.400  -7.718
  308    HE1  HIS  41           HE1      HIS  41  12.870   0.237  -7.746
  309    H    PHE  42           H        PHE  42   5.384  -0.023  -7.855
  310    HA   PHE  42           HA       PHE  42   5.079   2.675  -6.733
  311   1HB   PHE  42          1HB       PHE  42   3.107   0.385  -6.872
  312   2HB   PHE  42          2HB       PHE  42   2.781   1.956  -6.147
  313    HD1  PHE  42           HD1      PHE  42   4.305   3.566  -8.272
  314    HD2  PHE  42           HD2      PHE  42   1.393   0.472  -8.517
  315    HE1  PHE  42           HE1      PHE  42   3.581   4.425 -10.461
  316    HE2  PHE  42           HE2      PHE  42   0.665   1.325 -10.706
  317    HZ   PHE  42           HZ       PHE  42   1.759   3.304 -11.682
  318    H    GLN  43           H        GLN  43   4.879   2.998  -4.518
  319    HA   GLN  43           HA       GLN  43   5.220   0.714  -2.739
  320   1HB   GLN  43          1HB       GLN  43   7.332   2.595  -3.411
  321   2HB   GLN  43          2HB       GLN  43   6.997   2.577  -1.684
  322   1HG   GLN  43          1HG       GLN  43   7.430   0.045  -3.224
  323   2HG   GLN  43          2HG       GLN  43   8.776   0.984  -2.582
  324   1HE2  GLN  43          1HE2      GLN  43   6.698  -1.498  -1.966
  325   2HE2  GLN  43          2HE2      GLN  43   6.836  -1.565  -0.245
  326    H    GLY  44           H        GLY  44   4.110   0.944  -0.888
  327   1HA   GLY  44          1HA       GLY  44   3.737   3.271   0.582
  328   2HA   GLY  44          2HA       GLY  44   2.385   3.168  -0.536
  329    H    TYR  45           H        TYR  45   1.264   3.111   1.632
  330    HA   TYR  45           HA       TYR  45   1.035   0.312   2.524
  331   1HB   TYR  45          1HB       TYR  45   0.556   1.085   4.771
  332   2HB   TYR  45          2HB       TYR  45   2.091   1.763   4.240
  333    HD1  TYR  45           HD1      TYR  45  -1.469   2.530   4.855
  334    HD2  TYR  45           HD2      TYR  45   2.395   4.116   4.044
  335    HE1  TYR  45           HE1      TYR  45  -2.290   4.786   5.388
  336    HE2  TYR  45           HE2      TYR  45   1.585   6.377   4.576
  337    HH   TYR  45           HH       TYR  45  -0.473   7.274   6.141
  338    H    ILE  46           H        ILE  46  -1.009  -0.501   2.850
  339    HA   ILE  46           HA       ILE  46  -3.264   1.279   2.211
  340    HB   ILE  46           HB       ILE  46  -2.984  -1.567   1.242
  341   1HG1  ILE  46          1HG1      ILE  46  -2.869   0.988  -0.371
  342   2HG1  ILE  46          2HG1      ILE  46  -1.449   0.074   0.125
  343   1HG2  ILE  46          1HG2      ILE  46  -5.058   0.516   0.572
  344   2HG2  ILE  46          2HG2      ILE  46  -5.009  -1.151  -0.000
  345   3HG2  ILE  46          3HG2      ILE  46  -5.292  -0.813   1.707
  346   1HD1  ILE  46          1HD1      ILE  46  -2.279  -1.857  -1.142
  347   2HD1  ILE  46          2HD1      ILE  46  -3.656  -0.892  -1.676
  348   3HD1  ILE  46          3HD1      ILE  46  -2.021  -0.439  -2.158
  349    H    GLU  47           H        GLU  47  -4.863   1.223   3.649
  350    HA   GLU  47           HA       GLU  47  -4.848  -0.923   5.654
  351   1HB   GLU  47          1HB       GLU  47  -6.210   1.773   5.775
  352   2HB   GLU  47          2HB       GLU  47  -6.099   0.603   7.082
  353   1HG   GLU  47          1HG       GLU  47  -3.898   1.063   7.499
  354   2HG   GLU  47          2HG       GLU  47  -3.587   1.613   5.854
  355    H    MET  48           H        MET  48  -6.327  -2.461   5.491
  356    HA   MET  48           HA       MET  48  -8.559  -2.185   3.689
  357   1HB   MET  48          1HB       MET  48  -7.626  -4.432   5.473
  358   2HB   MET  48          2HB       MET  48  -9.072  -4.538   4.478
  359   1HG   MET  48          1HG       MET  48  -6.763  -3.663   2.963
  360   2HG   MET  48          2HG       MET  48  -6.505  -5.223   3.739
  361   1HE   MET  48          1HE       MET  48  -9.823  -3.744   1.319
  362   2HE   MET  48          2HE       MET  48  -8.215  -3.033   1.465
  363   3HE   MET  48          3HE       MET  48  -8.594  -4.086   0.101
  364    H    LYS  49           H        LYS  49 -10.682  -3.337   4.655
  365    HA   LYS  49           HA       LYS  49 -11.948  -1.470   6.252
  366   1HB   LYS  49          1HB       LYS  49 -12.699  -3.767   4.917
  367   2HB   LYS  49          2HB       LYS  49 -13.014  -4.172   6.599
  368   1HG   LYS  49          1HG       LYS  49 -14.612  -2.522   6.837
  369   2HG   LYS  49          2HG       LYS  49 -13.989  -1.580   5.480
  370   1HD   LYS  49          1HD       LYS  49 -16.079  -2.613   4.850
  371   2HD   LYS  49          2HD       LYS  49 -14.761  -3.359   3.943
  372   1HE   LYS  49          1HE       LYS  49 -15.517  -5.329   4.649
  373   2HE   LYS  49          2HE       LYS  49 -14.971  -4.879   6.263
  374   1HZ   LYS  49          1HZ       LYS  49 -17.057  -4.509   6.957
  375   2HZ   LYS  49          2HZ       LYS  49 -17.493  -5.506   5.662
  376   3HZ   LYS  49          3HZ       LYS  49 -17.556  -3.824   5.492
  377    H    LYS  50           H        LYS  50 -10.920  -4.728   7.290
  378    HA   LYS  50           HA       LYS  50  -9.715  -3.922   9.674
  379   1HB   LYS  50          1HB       LYS  50 -12.593  -3.968   9.787
  380   2HB   LYS  50          2HB       LYS  50 -11.931  -5.189  10.866
  381   1HG   LYS  50          1HG       LYS  50 -10.690  -3.571  12.077
  382   2HG   LYS  50          2HG       LYS  50 -11.028  -2.322  10.876
  383   1HD   LYS  50          1HD       LYS  50 -13.473  -3.475  11.886
  384   2HD   LYS  50          2HD       LYS  50 -12.472  -2.864  13.205
  385   1HE   LYS  50          1HE       LYS  50 -13.681  -0.988  12.636
  386   2HE   LYS  50          2HE       LYS  50 -12.222  -0.771  11.670
  387   1HZ   LYS  50          1HZ       LYS  50 -13.931  -2.253  10.105
  388   2HZ   LYS  50          2HZ       LYS  50 -13.547  -0.617   9.917
  389   3HZ   LYS  50          3HZ       LYS  50 -14.911  -1.068  10.810
  390    H    ARG  51           H        ARG  51 -12.096  -6.522   9.194
  391    HA   ARG  51           HA       ARG  51 -10.053  -8.484   9.851
  392   1HB   ARG  51          1HB       ARG  51 -12.478  -8.456  10.743
  393   2HB   ARG  51          2HB       ARG  51 -12.914  -9.106   9.169
  394   1HG   ARG  51          1HG       ARG  51 -10.878 -10.758   9.892
  395   2HG   ARG  51          2HG       ARG  51 -11.623 -10.401  11.451
  396   1HD   ARG  51          1HD       ARG  51 -13.696 -11.267  10.784
  397   2HD   ARG  51          2HD       ARG  51 -13.263 -11.218   9.075
  398    HE   ARG  51           HE       ARG  51 -12.213 -13.248   9.310
  399   1HH1  ARG  51          1HH1      ARG  51 -12.945 -11.941  12.452
  400   2HH1  ARG  51          2HH1      ARG  51 -12.537 -13.398  13.297
  401   1HH2  ARG  51          1HH2      ARG  51 -11.673 -15.172  10.410
  402   2HH2  ARG  51          2HH2      ARG  51 -11.813 -15.235  12.134
  403    H    THR  52           H        THR  52  -9.407  -7.329   7.496
  404    HA   THR  52           HA       THR  52 -10.244  -9.259   5.436
  405    HB   THR  52           HB       THR  52  -8.719  -6.854   4.621
  406    HG1  THR  52           HG1      THR  52 -10.934  -5.772   4.642
  407   1HG2  THR  52          1HG2      THR  52  -9.507  -8.383   2.938
  408   2HG2  THR  52          2HG2      THR  52 -10.435  -6.889   2.810
  409   3HG2  THR  52          3HG2      THR  52 -11.149  -8.307   3.576
  410    H    SER  53           H        SER  53  -8.840 -10.840   5.089
  411    HA   SER  53           HA       SER  53  -6.109 -10.670   5.949
  412   1HB   SER  53          1HB       SER  53  -6.062 -12.957   4.636
  413   2HB   SER  53          2HB       SER  53  -6.905 -12.831   6.180
  414    HG   SER  53           HG       SER  53  -8.362 -13.756   4.856
  415    H    LEU  54           H        LEU  54  -4.470 -11.710   4.236
  416    HA   LEU  54           HA       LEU  54  -3.813  -9.728   2.430
  417   1HB   LEU  54          1HB       LEU  54  -2.281 -11.483   3.218
  418   2HB   LEU  54          2HB       LEU  54  -3.140 -12.661   2.228
  419    HG   LEU  54           HG       LEU  54  -2.453 -11.351   0.213
  420   1HD1  LEU  54          1HD1      LEU  54  -2.006  -9.273   1.697
  421   2HD1  LEU  54          2HD1      LEU  54  -0.961  -9.591   0.314
  422   3HD1  LEU  54          3HD1      LEU  54  -0.420 -10.004   1.940
  423   1HD2  LEU  54          1HD2      LEU  54  -1.203 -13.278   0.569
  424   2HD2  LEU  54          2HD2      LEU  54  -0.464 -12.646   2.041
  425   3HD2  LEU  54          3HD2      LEU  54   0.024 -12.015   0.467
  426    H    ALA  55           H        ALA  55  -5.970 -12.440   2.040
  427    HA   ALA  55           HA       ALA  55  -6.148 -12.623  -0.720
  428   1HB   ALA  55          1HB       ALA  55  -7.240 -14.143   0.920
  429   2HB   ALA  55          2HB       ALA  55  -8.460 -12.899   1.193
  430   3HB   ALA  55          3HB       ALA  55  -8.295 -13.637  -0.400
  431    H    GLY  56           H        GLY  56  -7.519 -10.245   1.463
  432   1HA   GLY  56          1HA       GLY  56  -9.336  -9.092  -0.400
  433   2HA   GLY  56          2HA       GLY  56  -8.763  -8.347   1.085
  434    H    MET  57           H        MET  57  -6.053  -8.191   0.625
  435    HA   MET  57           HA       MET  57  -5.924  -5.919  -1.092
  436   1HB   MET  57          1HB       MET  57  -3.702  -7.467   0.251
  437   2HB   MET  57          2HB       MET  57  -3.528  -5.892  -0.511
  438   1HG   MET  57          1HG       MET  57  -5.606  -6.101   1.565
  439   2HG   MET  57          2HG       MET  57  -3.938  -6.248   2.113
  440   1HE   MET  57          1HE       MET  57  -6.455  -4.435   0.121
  441   2HE   MET  57          2HE       MET  57  -6.189  -2.725   0.460
  442   3HE   MET  57          3HE       MET  57  -5.317  -3.510  -0.858
  443    H    LYS  58           H        LYS  58  -4.546  -9.192  -1.255
  444    HA   LYS  58           HA       LYS  58  -3.197  -8.912  -3.684
  445   1HB   LYS  58          1HB       LYS  58  -3.449 -10.906  -1.864
  446   2HB   LYS  58          2HB       LYS  58  -4.447 -11.539  -3.166
  447   1HG   LYS  58          1HG       LYS  58  -2.665 -12.122  -4.346
  448   2HG   LYS  58          2HG       LYS  58  -1.960 -10.511  -4.193
  449   1HD   LYS  58          1HD       LYS  58  -0.452 -12.120  -3.225
  450   2HD   LYS  58          2HD       LYS  58  -1.146 -11.138  -1.933
  451   1HE   LYS  58          1HE       LYS  58  -2.299 -12.877  -1.049
  452   2HE   LYS  58          2HE       LYS  58  -2.593 -13.621  -2.620
  453   1HZ   LYS  58          1HZ       LYS  58   0.155 -13.606  -1.631
  454   2HZ   LYS  58          2HZ       LYS  58  -0.660 -14.777  -2.540
  455   3HZ   LYS  58          3HZ       LYS  58  -0.933 -14.658  -0.875
  456    H    LYS  59           H        LYS  59  -6.567  -9.322  -2.995
  457    HA   LYS  59           HA       LYS  59  -7.443 -10.333  -5.467
  458   1HB   LYS  59          1HB       LYS  59  -8.893 -10.324  -3.522
  459   2HB   LYS  59          2HB       LYS  59  -8.860  -8.567  -3.464
  460   1HG   LYS  59          1HG       LYS  59 -10.173  -8.368  -5.399
  461   2HG   LYS  59          2HG       LYS  59  -9.921 -10.058  -5.841
  462   1HD   LYS  59          1HD       LYS  59 -11.564 -10.786  -4.484
  463   2HD   LYS  59          2HD       LYS  59 -11.146  -9.644  -3.204
  464   1HE   LYS  59          1HE       LYS  59 -12.336  -7.884  -4.284
  465   2HE   LYS  59          2HE       LYS  59 -12.556  -8.848  -5.743
  466   1HZ   LYS  59          1HZ       LYS  59 -14.311  -8.636  -3.655
  467   2HZ   LYS  59          2HZ       LYS  59 -13.606 -10.158  -3.439
  468   3HZ   LYS  59          3HZ       LYS  59 -14.370  -9.779  -4.900
  469    H    LEU  60           H        LEU  60  -6.625  -7.100  -4.412
  470    HA   LEU  60           HA       LEU  60  -7.720  -5.829  -6.757
  471   1HB   LEU  60          1HB       LEU  60  -6.069  -4.888  -4.436
  472   2HB   LEU  60          2HB       LEU  60  -6.380  -3.847  -5.824
  473    HG   LEU  60           HG       LEU  60  -8.883  -4.381  -5.307
  474   1HD1  LEU  60          1HD1      LEU  60  -7.536  -5.677  -3.133
  475   2HD1  LEU  60          2HD1      LEU  60  -9.254  -5.650  -3.529
  476   3HD1  LEU  60          3HD1      LEU  60  -8.562  -4.377  -2.524
  477   1HD2  LEU  60          1HD2      LEU  60  -8.947  -2.266  -4.598
  478   2HD2  LEU  60          2HD2      LEU  60  -7.192  -2.281  -4.768
  479   3HD2  LEU  60          3HD2      LEU  60  -7.929  -2.612  -3.200
  480    H    ILE  61           H        ILE  61  -4.545  -6.836  -5.604
  481    HA   ILE  61           HA       ILE  61  -3.523  -6.503  -8.333
  482    HB   ILE  61           HB       ILE  61  -1.994  -5.657  -5.870
  483   1HG1  ILE  61          1HG1      ILE  61  -2.172  -3.423  -7.365
  484   2HG1  ILE  61          2HG1      ILE  61  -3.697  -4.184  -7.802
  485   1HG2  ILE  61          1HG2      ILE  61  -0.745  -4.629  -8.105
  486   2HG2  ILE  61          2HG2      ILE  61  -0.219  -6.025  -7.167
  487   3HG2  ILE  61          3HG2      ILE  61  -1.216  -6.253  -8.603
  488   1HD1  ILE  61          1HD1      ILE  61  -3.802  -4.444  -5.135
  489   2HD1  ILE  61          2HD1      ILE  61  -2.842  -2.969  -5.266
  490   3HD1  ILE  61          3HD1      ILE  61  -4.438  -3.052  -6.012
  491    HA   PRO  62           HA       PRO  62  -2.587 -10.688  -6.558
  492   1HB   PRO  62          1HB       PRO  62  -3.347 -12.054  -8.778
  493   2HB   PRO  62          2HB       PRO  62  -4.478 -11.589  -7.502
  494   1HG   PRO  62          1HG       PRO  62  -3.949 -10.271 -10.137
  495   2HG   PRO  62          2HG       PRO  62  -5.499 -10.585  -9.334
  496   1HD   PRO  62          1HD       PRO  62  -4.300  -8.157  -9.288
  497   2HD   PRO  62          2HD       PRO  62  -5.292  -8.758  -7.944
  498    H    GLY  63           H        GLY  63  -0.379 -10.580  -6.580
  499   1HA   GLY  63          1HA       GLY  63   1.386 -11.807  -7.912
  500   2HA   GLY  63          2HA       GLY  63   0.940 -10.719  -9.218
  501    H    ALA  64           H        ALA  64   1.176  -9.800  -5.833
  502    HA   ALA  64           HA       ALA  64   3.640  -8.311  -6.437
  503   1HB   ALA  64          1HB       ALA  64   2.085  -6.817  -4.580
  504   2HB   ALA  64          2HB       ALA  64   2.635  -6.351  -6.190
  505   3HB   ALA  64          3HB       ALA  64   1.089  -7.176  -5.990
  506    H    HIS  65           H        HIS  65   4.633  -7.435  -4.346
  507    HA   HIS  65           HA       HIS  65   4.697  -9.636  -2.426
  508   1HB   HIS  65          1HB       HIS  65   6.781  -8.588  -3.535
  509   2HB   HIS  65          2HB       HIS  65   6.539  -7.257  -2.408
  510    HD1  HIS  65           HD1      HIS  65   8.038  -7.497  -0.471
  511    HD2  HIS  65           HD2      HIS  65   6.698 -11.186  -1.836
  512    HE1  HIS  65           HE1      HIS  65   9.070  -9.199   1.067
  513    H    PHE  66           H        PHE  66   3.343  -9.482  -0.767
  514    HA   PHE  66           HA       PHE  66   2.862  -6.827   0.414
  515   1HB   PHE  66          1HB       PHE  66   1.109  -9.154  -0.096
  516   2HB   PHE  66          2HB       PHE  66   0.873  -8.346   1.451
  517    HD1  PHE  66           HD1      PHE  66   0.964  -7.782  -2.208
  518    HD2  PHE  66           HD2      PHE  66  -0.307  -6.332   1.587
  519    HE1  PHE  66           HE1      PHE  66  -0.386  -6.054  -3.324
  520    HE2  PHE  66           HE2      PHE  66  -1.660  -4.603   0.477
  521    HZ   PHE  66           HZ       PHE  66  -1.702  -4.463  -1.981
  522    H    GLU  67           H        GLU  67   2.576  -6.748   2.750
  523    HA   GLU  67           HA       GLU  67   3.610  -8.970   4.300
  524   1HB   GLU  67          1HB       GLU  67   5.253  -6.694   3.558
  525   2HB   GLU  67          2HB       GLU  67   5.105  -6.842   5.303
  526   1HG   GLU  67          1HG       GLU  67   5.981  -9.056   5.266
  527   2HG   GLU  67          2HG       GLU  67   5.922  -9.108   3.505
  528    H    LYS  68           H        LYS  68   2.123  -9.136   5.836
  529    HA   LYS  68           HA       LYS  68   0.981  -6.683   6.986
  530   1HB   LYS  68          1HB       LYS  68  -0.512  -8.478   5.936
  531   2HB   LYS  68          2HB       LYS  68  -0.106  -9.473   7.328
  532   1HG   LYS  68          1HG       LYS  68  -0.892  -7.305   8.634
  533   2HG   LYS  68          2HG       LYS  68  -1.814  -7.059   7.149
  534   1HD   LYS  68          1HD       LYS  68  -3.314  -8.318   8.326
  535   2HD   LYS  68          2HD       LYS  68  -2.414  -9.609   7.528
  536   1HE   LYS  68          1HE       LYS  68  -0.984  -9.787   9.549
  537   2HE   LYS  68          2HE       LYS  68  -2.010  -8.589  10.338
  538   1HZ   LYS  68          1HZ       LYS  68  -2.421 -11.162  10.607
  539   2HZ   LYS  68          2HZ       LYS  68  -3.311 -10.939   9.187
  540   3HZ   LYS  68          3HZ       LYS  68  -3.704 -10.059  10.577
  541    H    ARG  69           H        ARG  69   3.568  -8.188   7.638
  542    HA   ARG  69           HA       ARG  69   3.202  -9.222  10.279
  543   1HB   ARG  69          1HB       ARG  69   5.251  -9.236   8.360
  544   2HB   ARG  69          2HB       ARG  69   5.910  -8.374   9.743
  545   1HG   ARG  69          1HG       ARG  69   5.041 -10.353  11.131
  546   2HG   ARG  69          2HG       ARG  69   4.919 -11.193   9.583
  547   1HD   ARG  69          1HD       ARG  69   7.115 -11.553   9.525
  548   2HD   ARG  69          2HD       ARG  69   7.460  -9.852   9.838
  549    HE   ARG  69           HE       ARG  69   6.693 -10.976  12.253
  550   1HH1  ARG  69          1HH1      ARG  69   9.249 -11.360   9.921
  551   2HH1  ARG  69          2HH1      ARG  69  10.415 -11.882  11.091
  552   1HH2  ARG  69          1HH2      ARG  69   8.219 -11.663  13.803
  553   2HH2  ARG  69          2HH2      ARG  69   9.828 -12.055  13.298
  554    H    ARG  70           H        ARG  70   3.045  -6.148   9.119
  555    HA   ARG  70           HA       ARG  70   2.974  -4.107  10.126
  556   1HB   ARG  70          1HB       ARG  70   3.583  -5.435  12.758
  557   2HB   ARG  70          2HB       ARG  70   2.688  -3.951  12.466
  558   1HG   ARG  70          1HG       ARG  70   0.871  -5.231  11.466
  559   2HG   ARG  70          2HG       ARG  70   1.773  -6.724  11.734
  560   1HD   ARG  70          1HD       ARG  70   1.085  -4.857  13.983
  561   2HD   ARG  70          2HD       ARG  70  -0.035  -6.103  13.435
  562    HE   ARG  70           HE       ARG  70   2.377  -7.371  13.882
  563   1HH1  ARG  70          1HH1      ARG  70   0.064  -5.550  15.741
  564   2HH1  ARG  70          2HH1      ARG  70   0.408  -6.378  17.224
  565   1HH2  ARG  70          1HH2      ARG  70   2.839  -8.468  15.828
  566   2HH2  ARG  70          2HH2      ARG  70   1.988  -8.037  17.272
  567    H    GLY  71           H        GLY  71   5.285  -4.701   8.886
  568   1HA   GLY  71          1HA       GLY  71   7.582  -4.428  10.574
  569   2HA   GLY  71          2HA       GLY  71   7.558  -4.311   8.820
  570    H    THR  72           H        THR  72   5.253  -2.228   9.705
  571    HA   THR  72           HA       THR  72   6.914  -0.013  10.544
  572    HB   THR  72           HB       THR  72   6.073   1.367   8.526
  573    HG1  THR  72           HG1      THR  72   5.733   0.118   6.650
  574   1HG2  THR  72          1HG2      THR  72   8.152   1.195   7.638
  575   2HG2  THR  72          2HG2      THR  72   8.081  -0.565   7.543
  576   3HG2  THR  72          3HG2      THR  72   8.446   0.222   9.078
  577    H    GLN  73           H        GLN  73   4.542  -1.431  11.502
  578    HA   GLN  73           HA       GLN  73   2.153  -0.096  11.055
  579   1HB   GLN  73          1HB       GLN  73   1.598  -0.824  13.439
  580   2HB   GLN  73          2HB       GLN  73   2.037  -2.089  12.300
  581   1HG   GLN  73          1HG       GLN  73   3.860  -2.666  13.453
  582   2HG   GLN  73          2HG       GLN  73   4.302  -0.991  13.782
  583   1HE2  GLN  73          1HE2      GLN  73   4.052  -3.538  15.429
  584   2HE2  GLN  73          2HE2      GLN  73   3.143  -3.045  16.813
  585    H    GLY  74           H        GLY  74   2.112   2.087  10.993
  586   1HA   GLY  74          1HA       GLY  74   1.695   4.111  12.128
  587   2HA   GLY  74          2HA       GLY  74   2.552   3.478  13.525
  588    H    GLU  75           H        GLU  75   4.772   2.600  11.661
  589    HA   GLU  75           HA       GLU  75   6.306   5.020  11.886
  590   1HB   GLU  75          1HB       GLU  75   6.928   2.351  11.957
  591   2HB   GLU  75          2HB       GLU  75   7.490   2.811  10.356
  592   1HG   GLU  75          1HG       GLU  75   9.357   3.494  11.331
  593   2HG   GLU  75          2HG       GLU  75   8.422   4.836  11.988
  594    H    ALA  76           H        ALA  76   4.624   3.320   9.368
  595    HA   ALA  76           HA       ALA  76   5.925   4.633   7.181
  596   1HB   ALA  76          1HB       ALA  76   4.589   2.387   7.242
  597   2HB   ALA  76          2HB       ALA  76   3.206   3.435   6.927
  598   3HB   ALA  76          3HB       ALA  76   4.562   3.402   5.800
  599    H    ARG  77           H        ARG  77   3.821   5.735   9.492
  600    HA   ARG  77           HA       ARG  77   2.218   7.451   7.815
  601   1HB   ARG  77          1HB       ARG  77   1.580   6.435  10.109
  602   2HB   ARG  77          2HB       ARG  77   2.527   7.751  10.788
  603   1HG   ARG  77          1HG       ARG  77   0.599   8.875  10.757
  604   2HG   ARG  77          2HG       ARG  77   0.933   9.084   9.036
  605   1HD   ARG  77          1HD       ARG  77  -0.256   6.719   8.903
  606   2HD   ARG  77          2HD       ARG  77  -0.996   7.282  10.401
  607    HE   ARG  77           HE       ARG  77  -1.486   8.272   7.739
  608   1HH1  ARG  77          1HH1      ARG  77  -1.667   8.953  11.149
  609   2HH1  ARG  77          2HH1      ARG  77  -2.915  10.143  10.977
  610   1HH2  ARG  77          1HH2      ARG  77  -3.128   9.837   7.501
  611   2HH2  ARG  77          2HH2      ARG  77  -3.745  10.645   8.902
  612    H    ALA  78           H        ALA  78   5.322   7.564   9.183
  613    HA   ALA  78           HA       ALA  78   5.431  10.487   8.812
  614   1HB   ALA  78          1HB       ALA  78   7.488  10.289  10.341
  615   2HB   ALA  78          2HB       ALA  78   5.888  10.160  11.073
  616   3HB   ALA  78          3HB       ALA  78   6.839   8.706  10.770
  617    H    TYR  79           H        TYR  79   7.319   7.487   8.524
  618    HA   TYR  79           HA       TYR  79   9.275   8.765   6.821
  619   1HB   TYR  79          1HB       TYR  79  10.153   7.105   8.272
  620   2HB   TYR  79          2HB       TYR  79   8.914   5.941   7.815
  621    HD1  TYR  79           HD1      TYR  79  11.077   8.070   5.652
  622    HD2  TYR  79           HD2      TYR  79  10.082   4.134   6.924
  623    HE1  TYR  79           HE1      TYR  79  12.586   7.143   3.945
  624    HE2  TYR  79           HE2      TYR  79  11.589   3.196   5.222
  625    HH   TYR  79           HH       TYR  79  13.113   3.646   3.664
  626    H    SER  80           H        SER  80   6.854   6.181   6.458
  627    HA   SER  80           HA       SER  80   5.733   5.388   4.644
  628   1HB   SER  80          1HB       SER  80   6.485   8.111   3.571
  629   2HB   SER  80          2HB       SER  80   5.449   6.982   2.699
  630    HG   SER  80           HG       SER  80   4.943   8.446   5.020
  631    H    MET  81           H        MET  81   7.930   7.262   2.641
  632    HA   MET  81           HA       MET  81   9.385   4.807   1.946
  633   1HB   MET  81          1HB       MET  81   7.727   6.503   0.192
  634   2HB   MET  81          2HB       MET  81   9.307   6.080  -0.454
  635   1HG   MET  81          1HG       MET  81   7.834   4.434  -1.237
  636   2HG   MET  81          2HG       MET  81   8.743   3.680   0.071
  637   1HE   MET  81          1HE       MET  81   4.437   4.985  -0.129
  638   2HE   MET  81          2HE       MET  81   5.316   6.074   0.944
  639   3HE   MET  81          3HE       MET  81   5.855   5.850  -0.721
  640    H    LYS  82           H        LYS  82  11.219   5.561   0.264
  641    HA   LYS  82           HA       LYS  82  12.732   7.593   1.722
  642   1HB   LYS  82          1HB       LYS  82  13.418   5.112   0.646
  643   2HB   LYS  82          2HB       LYS  82  14.163   6.281  -0.437
  644   1HG   LYS  82          1HG       LYS  82  15.442   7.227   1.300
  645   2HG   LYS  82          2HG       LYS  82  14.496   6.408   2.545
  646   1HD   LYS  82          1HD       LYS  82  15.325   4.237   1.394
  647   2HD   LYS  82          2HD       LYS  82  16.558   5.283   0.686
  648   1HE   LYS  82          1HE       LYS  82  16.044   5.301   3.637
  649   2HE   LYS  82          2HE       LYS  82  17.064   4.061   2.911
  650   1HZ   LYS  82          1HZ       LYS  82  18.106   6.249   1.824
  651   2HZ   LYS  82          2HZ       LYS  82  18.656   5.586   3.280
  652   3HZ   LYS  82          3HZ       LYS  82  17.580   6.892   3.298
  653    H    GLU  83           H        GLU  83  12.447   9.603   0.997
  654    HA   GLU  83           HA       GLU  83  11.523  10.354  -1.517
  655   1HB   GLU  83          1HB       GLU  83  13.139  11.845   0.544
  656   2HB   GLU  83          2HB       GLU  83  12.581  12.606  -0.939
  657   1HG   GLU  83          1HG       GLU  83  10.350  12.473  -0.321
  658   2HG   GLU  83          2HG       GLU  83  10.655  11.213   0.873
  659    H    ASP  84           H        ASP  84  14.785   9.748  -0.385
  660    HA   ASP  84           HA       ASP  84  16.235  10.892  -2.477
  661   1HB   ASP  84          1HB       ASP  84  16.737   8.827  -0.422
  662   2HB   ASP  84          2HB       ASP  84  17.778   8.754  -1.841
  663    H    THR  85           H        THR  85  14.608   7.786  -2.240
  664    HA   THR  85           HA       THR  85  15.432   7.166  -4.996
  665    HB   THR  85           HB       THR  85  14.088   4.941  -3.894
  666    HG1  THR  85           HG1      THR  85  16.153   5.830  -2.150
  667   1HG2  THR  85          1HG2      THR  85  16.934   5.598  -4.582
  668   2HG2  THR  85          2HG2      THR  85  15.797   4.555  -5.436
  669   3HG2  THR  85          3HG2      THR  85  16.504   4.025  -3.910
  670    H    ARG  86           H        ARG  86  13.038   8.733  -3.593
  671    HA   ARG  86           HA       ARG  86  10.767   7.390  -4.780
  672   1HB   ARG  86          1HB       ARG  86  10.891   8.856  -2.592
  673   2HB   ARG  86          2HB       ARG  86  10.630  10.181  -3.718
  674   1HG   ARG  86          1HG       ARG  86   8.477   9.649  -4.042
  675   2HG   ARG  86          2HG       ARG  86   8.802   7.914  -4.051
  676   1HD   ARG  86          1HD       ARG  86   7.534   8.189  -2.130
  677   2HD   ARG  86          2HD       ARG  86   9.186   8.210  -1.514
  678    HE   ARG  86           HE       ARG  86   8.114  10.813  -2.131
  679   1HH1  ARG  86          1HH1      ARG  86   8.460   8.335   0.289
  680   2HH1  ARG  86          2HH1      ARG  86   8.238   9.421   1.620
  681   1HH2  ARG  86          1HH2      ARG  86   7.820  12.254  -0.387
  682   2HH2  ARG  86          2HH2      ARG  86   7.873  11.650   1.235
  683    H    LEU  87           H        LEU  87   9.624   8.033  -6.566
  684    HA   LEU  87           HA       LEU  87  10.977   9.979  -8.301
  685   1HB   LEU  87          1HB       LEU  87  10.019   7.395  -8.765
  686   2HB   LEU  87          2HB       LEU  87   8.887   8.465  -9.587
  687    HG   LEU  87           HG       LEU  87  11.843   8.168 -10.077
  688   1HD1  LEU  87          1HD1      LEU  87  10.780   7.921 -12.459
  689   2HD1  LEU  87          2HD1      LEU  87   9.338   7.490 -11.540
  690   3HD1  LEU  87          3HD1      LEU  87  10.821   6.556 -11.344
  691   1HD2  LEU  87          1HD2      LEU  87   9.945  10.326 -10.952
  692   2HD2  LEU  87          2HD2      LEU  87  11.397   9.923 -11.869
  693   3HD2  LEU  87          3HD2      LEU  87  11.534  10.491 -10.204
  694    H    GLU  88           H        GLU  88   7.682   8.907  -7.456
  695    HA   GLU  88           HA       GLU  88   6.803  11.698  -7.747
  696   1HB   GLU  88          1HB       GLU  88   6.131   9.748  -9.541
  697   2HB   GLU  88          2HB       GLU  88   4.787   9.662  -8.411
  698   1HG   GLU  88          1HG       GLU  88   4.283  11.152 -10.255
  699   2HG   GLU  88          2HG       GLU  88   4.348  12.035  -8.731
  700    H    GLY  89           H        GLY  89   4.468  11.891  -6.791
  701   1HA   GLY  89          1HA       GLY  89   2.943  11.319  -5.077
  702   2HA   GLY  89          2HA       GLY  89   4.115  10.168  -4.451
  703    HA   PRO  90           HA       PRO  90   3.418   9.980  -2.505
  704   1HB   PRO  90          1HB       PRO  90   1.929  10.801  -0.388
  705   2HB   PRO  90          2HB       PRO  90   3.641  10.382  -0.254
  706   1HG   PRO  90          1HG       PRO  90   2.364  13.080  -0.475
  707   2HG   PRO  90          2HG       PRO  90   3.689  12.553   0.578
  708   1HD   PRO  90          1HD       PRO  90   4.110  13.941  -1.708
  709   2HD   PRO  90          2HD       PRO  90   5.261  12.736  -1.097
  710    H    TRP  91           H        TRP  91   1.082   9.321  -2.224
  711    HA   TRP  91           HA       TRP  91  -0.811  11.205  -3.420
  712   1HB   TRP  91          1HB       TRP  91  -0.050   8.520  -4.550
  713   2HB   TRP  91          2HB       TRP  91  -1.621   9.244  -4.883
  714    HD1  TRP  91           HD1      TRP  91  -0.595  12.270  -5.256
  715    HE1  TRP  91           HE1      TRP  91   0.699  12.882  -7.395
  716    HE3  TRP  91           HE3      TRP  91   0.968   7.598  -6.623
  717    HZ2  TRP  91           HZ2      TRP  91   2.185  11.559  -9.397
  718    HZ3  TRP  91           HZ3      TRP  91   2.322   7.357  -8.663
  719    HH2  TRP  91           HH2      TRP  91   2.916   9.298 -10.021
  720    H    GLU  92           H        GLU  92  -2.701  11.174  -2.391
  721    HA   GLU  92           HA       GLU  92  -3.364   8.799  -0.776
  722   1HB   GLU  92          1HB       GLU  92  -3.408  11.685  -0.145
  723   2HB   GLU  92          2HB       GLU  92  -4.799  10.766   0.412
  724   1HG   GLU  92          1HG       GLU  92  -3.280  10.760   2.195
  725   2HG   GLU  92          2HG       GLU  92  -3.156   9.161   1.462
  726    H    TYR  93           H        TYR  93  -5.363   7.930  -0.965
  727    HA   TYR  93           HA       TYR  93  -7.412   9.376  -2.470
  728   1HB   TYR  93          1HB       TYR  93  -6.405   6.615  -3.183
  729   2HB   TYR  93          2HB       TYR  93  -7.869   7.339  -3.840
  730    HD1  TYR  93           HD1      TYR  93  -7.663   9.442  -5.225
  731    HD2  TYR  93           HD2      TYR  93  -4.291   7.098  -4.109
  732    HE1  TYR  93           HE1      TYR  93  -6.343  10.502  -7.009
  733    HE2  TYR  93           HE2      TYR  93  -2.962   8.153  -5.889
  734    HH   TYR  93           HH       TYR  93  -3.143  10.526  -7.162
  735    H    GLY  94           H        GLY  94  -9.555   8.377  -2.294
  736   1HA   GLY  94          1HA       GLY  94 -11.131   6.981  -1.236
  737   2HA   GLY  94          2HA       GLY  94  -9.873   6.430  -0.139
  738    H    GLU  95           H        GLU  95 -11.177   6.757   1.680
  739    HA   GLU  95           HA       GLU  95 -12.633   9.006   2.338
  740   1HB   GLU  95          1HB       GLU  95 -12.758   6.995   3.671
  741   2HB   GLU  95          2HB       GLU  95 -11.073   7.156   4.145
  742   1HG   GLU  95          1HG       GLU  95 -11.686   8.321   5.914
  743   2HG   GLU  95          2HG       GLU  95 -12.378   9.554   4.862
  Start of MODEL    4
    1   1H    ALA   2          1H        ALA   2 -14.510   0.034  17.559
    2    HA   ALA   2           HA       ALA   2 -12.841  -0.567  19.473
    3   1HB   ALA   2          1HB       ALA   2 -13.319  -2.961  17.811
    4   2HB   ALA   2          2HB       ALA   2 -13.674  -2.669  19.514
    5   3HB   ALA   2          3HB       ALA   2 -14.741  -2.023  18.267
    6    H    ARG   3           H        ARG   3 -10.717   0.032  19.304
    7    HA   ARG   3           HA       ARG   3  -8.494  -0.179  18.871
    8   1HB   ARG   3          1HB       ARG   3  -9.506  -2.786  18.924
    9   2HB   ARG   3          2HB       ARG   3  -8.510  -2.718  17.476
   10   1HG   ARG   3          1HG       ARG   3  -6.921  -3.325  18.971
   11   2HG   ARG   3          2HG       ARG   3  -6.810  -1.574  19.158
   12   1HD   ARG   3          1HD       ARG   3  -8.665  -3.203  20.859
   13   2HD   ARG   3          2HD       ARG   3  -6.959  -3.037  21.274
   14    HE   ARG   3           HE       ARG   3  -7.810  -0.477  20.892
   15   1HH1  ARG   3          1HH1      ARG   3  -8.844  -3.131  22.892
   16   2HH1  ARG   3          2HH1      ARG   3  -9.444  -2.113  24.159
   17   1HH2  ARG   3          1HH2      ARG   3  -8.596   0.874  22.553
   18   2HH2  ARG   3          2HH2      ARG   3  -9.303   0.165  23.965
   19    H    GLN   4           H        GLN   4  -6.878  -0.386  17.082
   20    HA   GLN   4           HA       GLN   4  -8.123   0.414  14.538
   21   1HB   GLN   4          1HB       GLN   4  -5.880   1.460  16.084
   22   2HB   GLN   4          2HB       GLN   4  -5.464   1.171  14.400
   23   1HG   GLN   4          1HG       GLN   4  -7.422   2.528  13.731
   24   2HG   GLN   4          2HG       GLN   4  -7.707   2.889  15.432
   25   1HE2  GLN   4          1HE2      GLN   4  -7.088   4.870  15.879
   26   2HE2  GLN   4          2HE2      GLN   4  -5.659   5.649  15.301
   27    H    VAL   5           H        VAL   5  -7.005  -0.196  12.560
   28    HA   VAL   5           HA       VAL   5  -5.853  -2.884  12.795
   29    HB   VAL   5           HB       VAL   5  -6.423  -3.191  10.451
   30   1HG1  VAL   5          1HG1      VAL   5  -9.018  -2.383  10.870
   31   2HG1  VAL   5          2HG1      VAL   5  -8.312  -3.910  11.403
   32   3HG1  VAL   5          3HG1      VAL   5  -8.379  -2.536  12.507
   33   1HG2  VAL   5          1HG2      VAL   5  -8.048  -0.872  10.010
   34   2HG2  VAL   5          2HG2      VAL   5  -6.395  -0.381  10.381
   35   3HG2  VAL   5          3HG2      VAL   5  -6.706  -1.492   9.047
   36    H    ILE   6           H        ILE   6  -4.087  -3.484  11.370
   37    HA   ILE   6           HA       ILE   6  -2.094  -1.379  11.241
   38    HB   ILE   6           HB       ILE   6  -1.781  -4.291  10.511
   39   1HG1  ILE   6          1HG1      ILE   6  -0.559  -4.142  12.875
   40   2HG1  ILE   6          2HG1      ILE   6  -1.745  -2.868  13.130
   41   1HG2  ILE   6          1HG2      ILE   6   0.640  -3.455  11.362
   42   2HG2  ILE   6          2HG2      ILE   6   0.132  -3.449   9.674
   43   3HG2  ILE   6          3HG2      ILE   6   0.026  -1.972  10.632
   44   1HD1  ILE   6          1HD1      ILE   6  -3.526  -4.330  13.029
   45   2HD1  ILE   6          2HD1      ILE   6  -2.608  -5.548  12.142
   46   3HD1  ILE   6          3HD1      ILE   6  -2.292  -5.280  13.856
   47    H    CYS   7           H        CYS   7  -0.926  -0.821   9.370
   48    HA   CYS   7           HA       CYS   7  -2.504  -0.812   6.971
   49   1HB   CYS   7          1HB       CYS   7  -0.911   0.708   6.102
   50   2HB   CYS   7          2HB       CYS   7  -1.042   1.096   7.813
   51    HG   CYS   7           HG       CYS   7   1.319  -1.020   7.800
   52    H    TRP   8           H        TRP   8  -1.747  -1.526   4.885
   53    HA   TRP   8           HA       TRP   8  -0.130  -3.972   5.096
   54   1HB   TRP   8          1HB       TRP   8  -2.245  -3.150   3.101
   55   2HB   TRP   8          2HB       TRP   8  -1.239  -4.584   2.916
   56    HD1  TRP   8           HD1      TRP   8  -3.611  -3.150   5.649
   57    HE1  TRP   8           HE1      TRP   8  -4.925  -5.120   6.657
   58    HE3  TRP   8           HE3      TRP   8  -1.503  -6.976   2.992
   59    HZ2  TRP   8           HZ2      TRP   8  -5.050  -7.925   6.366
   60    HZ3  TRP   8           HZ3      TRP   8  -2.276  -9.273   3.418
   61    HH2  TRP   8           HH2      TRP   8  -4.013  -9.735   5.070
   62    H    CYS   9           H        CYS   9   1.897  -3.764   4.434
   63    HA   CYS   9           HA       CYS   9   2.563  -1.723   2.447
   64   1HB   CYS   9          1HB       CYS   9   4.922  -2.206   3.112
   65   2HB   CYS   9          2HB       CYS   9   3.913  -1.650   4.442
   66    HG   CYS   9           HG       CYS   9   5.697  -4.386   4.216
   67    H    PHE  10           H        PHE  10   2.790  -2.265   0.391
   68    HA   PHE  10           HA       PHE  10   3.823  -4.930  -0.276
   69   1HB   PHE  10          1HB       PHE  10   2.124  -5.425  -1.781
   70   2HB   PHE  10          2HB       PHE  10   1.236  -4.635  -0.482
   71    HD1  PHE  10           HD2      PHE  10   0.557  -2.246  -0.745
   72    HD2  PHE  10           HD1      PHE  10   2.169  -4.530  -3.955
   73    HE1  PHE  10           HE2      PHE  10  -0.343  -0.616  -2.352
   74    HE2  PHE  10           HE1      PHE  10   1.272  -2.902  -5.568
   75    HZ   PHE  10           HZ       PHE  10   0.013  -0.943  -4.767
   76    H    THR  11           H        THR  11   4.564  -5.064  -2.564
   77    HA   THR  11           HA       THR  11   5.418  -2.462  -3.632
   78    HB   THR  11           HB       THR  11   7.278  -4.827  -3.630
   79    HG1  THR  11           HG1      THR  11   7.090  -4.439  -1.478
   80   1HG2  THR  11          1HG2      THR  11   7.359  -2.032  -4.500
   81   2HG2  THR  11          2HG2      THR  11   8.336  -3.407  -5.014
   82   3HG2  THR  11          3HG2      THR  11   8.757  -2.525  -3.546
   83    H    LEU  12           H        LEU  12   4.839  -2.254  -5.685
   84    HA   LEU  12           HA       LEU  12   4.439  -4.692  -7.288
   85   1HB   LEU  12          1HB       LEU  12   2.365  -3.608  -7.077
   86   2HB   LEU  12          2HB       LEU  12   3.080  -2.017  -7.325
   87    HG   LEU  12           HG       LEU  12   3.296  -2.373  -9.654
   88   1HD1  LEU  12          1HD1      LEU  12   2.249  -4.812 -10.321
   89   2HD1  LEU  12          2HD1      LEU  12   3.205  -5.187  -8.888
   90   3HD1  LEU  12          3HD1      LEU  12   3.966  -4.411 -10.277
   91   1HD2  LEU  12          1HD2      LEU  12   0.870  -3.346 -10.149
   92   2HD2  LEU  12          2HD2      LEU  12   1.123  -1.741  -9.461
   93   3HD2  LEU  12          3HD2      LEU  12   0.704  -3.096  -8.411
   94    H    ASN  13           H        ASN  13   5.773  -5.014  -8.937
   95    HA   ASN  13           HA       ASN  13   7.419  -2.765  -9.867
   96   1HB   ASN  13          1HB       ASN  13   8.808  -4.689 -10.885
   97   2HB   ASN  13          2HB       ASN  13   8.861  -4.467  -9.138
   98   1HD2  ASN  13          1HD2      ASN  13   8.302  -6.109  -7.861
   99   2HD2  ASN  13          2HD2      ASN  13   7.632  -7.606  -8.404
  100    H    ASN  14           H        ASN  14   7.441  -2.144 -11.970
  101    HA   ASN  14           HA       ASN  14   6.580  -1.789 -14.053
  102   1HB   ASN  14          1HB       ASN  14   8.019  -3.802 -14.409
  103   2HB   ASN  14          2HB       ASN  14   6.595  -4.812 -14.180
  104   1HD2  ASN  14          1HD2      ASN  14   6.175  -5.633 -16.110
  105   2HD2  ASN  14          2HD2      ASN  14   5.990  -4.727 -17.569
  106    HA   PRO  15           HA       PRO  15   2.247  -2.831 -12.601
  107   1HB   PRO  15          1HB       PRO  15   1.424  -0.257 -12.341
  108   2HB   PRO  15          2HB       PRO  15   2.210  -1.151 -11.035
  109   1HG   PRO  15          1HG       PRO  15   3.383   0.834 -12.944
  110   2HG   PRO  15          2HG       PRO  15   3.644   0.673 -11.197
  111   1HD   PRO  15          1HD       PRO  15   5.410  -0.259 -13.026
  112   2HD   PRO  15          2HD       PRO  15   5.158  -1.046 -11.455
  113    H    LEU  16           H        LEU  16   0.530  -2.933 -13.967
  114    HA   LEU  16           HA       LEU  16   0.914  -1.925 -16.661
  115   1HB   LEU  16          1HB       LEU  16  -1.043  -3.800 -15.379
  116   2HB   LEU  16          2HB       LEU  16  -1.302  -3.184 -17.010
  117    HG   LEU  16           HG       LEU  16   1.283  -4.527 -16.363
  118   1HD1  LEU  16          1HD1      LEU  16  -0.263  -6.098 -15.459
  119   2HD1  LEU  16          2HD1      LEU  16   0.228  -6.687 -17.047
  120   3HD1  LEU  16          3HD1      LEU  16  -1.345  -5.917 -16.839
  121   1HD2  LEU  16          1HD2      LEU  16  -0.466  -4.292 -18.807
  122   2HD2  LEU  16          2HD2      LEU  16   1.010  -5.254 -18.730
  123   3HD2  LEU  16          3HD2      LEU  16   1.086  -3.504 -18.521
  124    H    SER  17           H        SER  17  -0.440  -0.760 -13.870
  125    HA   SER  17           HA       SER  17  -1.546   1.516 -15.051
  126   1HB   SER  17          1HB       SER  17  -4.000   0.855 -14.218
  127   2HB   SER  17          2HB       SER  17  -3.451   0.530 -15.862
  128    HG   SER  17           HG       SER  17  -3.458  -1.543 -15.457
  129    HA   PRO  18           HA       PRO  18  -1.384   2.939 -10.906
  130   1HB   PRO  18          1HB       PRO  18  -3.355   4.806 -10.850
  131   2HB   PRO  18          2HB       PRO  18  -1.830   5.044 -11.711
  132   1HG   PRO  18          1HG       PRO  18  -4.499   4.213 -12.780
  133   2HG   PRO  18          2HG       PRO  18  -3.335   5.368 -13.454
  134   1HD   PRO  18          1HD       PRO  18  -3.568   2.832 -14.372
  135   2HD   PRO  18          2HD       PRO  18  -2.024   3.707 -14.366
  136    H    LEU  19           H        LEU  19  -2.342   2.788  -8.863
  137    HA   LEU  19           HA       LEU  19  -4.354   0.775  -8.604
  138   1HB   LEU  19          1HB       LEU  19  -3.391   2.545  -6.383
  139   2HB   LEU  19          2HB       LEU  19  -3.973   0.884  -6.292
  140    HG   LEU  19           HG       LEU  19  -1.366   1.708  -7.565
  141   1HD1  LEU  19          1HD1      LEU  19  -1.679   2.032  -5.011
  142   2HD1  LEU  19          2HD1      LEU  19  -0.249   1.193  -5.611
  143   3HD1  LEU  19          3HD1      LEU  19  -1.601   0.271  -4.956
  144   1HD2  LEU  19          1HD2      LEU  19  -2.788  -0.874  -7.152
  145   2HD2  LEU  19          2HD2      LEU  19  -1.027  -0.850  -7.040
  146   3HD2  LEU  19          3HD2      LEU  19  -1.825  -0.319  -8.522
  147    H    SER  20           H        SER  20  -6.217   1.148  -7.021
  148    HA   SER  20           HA       SER  20  -7.374   3.812  -7.149
  149   1HB   SER  20          1HB       SER  20  -9.421   3.114  -8.227
  150   2HB   SER  20          2HB       SER  20  -8.067   2.659  -9.262
  151    HG   SER  20           HG       SER  20  -8.473   0.604  -8.914
  152    H    LEU  21           H        LEU  21  -9.048   4.155  -5.653
  153    HA   LEU  21           HA       LEU  21  -8.834   2.894  -3.210
  154   1HB   LEU  21          1HB       LEU  21  -9.851   5.018  -3.292
  155   2HB   LEU  21          2HB       LEU  21 -11.072   4.473  -4.441
  156    HG   LEU  21           HG       LEU  21 -12.007   3.033  -2.598
  157   1HD1  LEU  21          1HD1      LEU  21  -9.658   3.703  -1.305
  158   2HD1  LEU  21          2HD1      LEU  21 -11.068   2.927  -0.584
  159   3HD1  LEU  21          3HD1      LEU  21 -10.883   4.678  -0.492
  160   1HD2  LEU  21          1HD2      LEU  21 -12.593   5.386  -1.296
  161   2HD2  LEU  21          2HD2      LEU  21 -13.434   4.744  -2.707
  162   3HD2  LEU  21          3HD2      LEU  21 -12.138   5.923  -2.914
  163    H    HIS  22           H        HIS  22 -10.164   1.428  -2.066
  164    HA   HIS  22           HA       HIS  22 -11.700  -0.394  -3.800
  165   1HB   HIS  22          1HB       HIS  22  -9.501  -1.226  -2.747
  166   2HB   HIS  22          2HB       HIS  22 -10.384  -1.225  -1.223
  167    HD1  HIS  22           HD1      HIS  22 -10.650  -3.674  -0.805
  168    HD2  HIS  22           HD2      HIS  22 -11.787  -2.593  -4.651
  169    HE1  HIS  22           HE1      HIS  22 -11.680  -5.738  -1.806
  170    H    ASP  23           H        ASP  23 -13.701  -1.051  -3.151
  171    HA   ASP  23           HA       ASP  23 -15.135   0.579  -1.357
  172   1HB   ASP  23          1HB       ASP  23 -15.727  -1.938  -2.860
  173   2HB   ASP  23          2HB       ASP  23 -16.841  -1.422  -1.596
  174    H    SER  24           H        SER  24 -13.293  -2.300  -0.902
  175    HA   SER  24           HA       SER  24 -14.523  -2.970   1.631
  176   1HB   SER  24          1HB       SER  24 -11.942  -4.107   0.564
  177   2HB   SER  24          2HB       SER  24 -13.092  -4.856   1.671
  178    HG   SER  24           HG       SER  24 -14.036  -4.130  -0.845
  179    H    MET  25           H        MET  25 -11.518  -1.516   0.474
  180    HA   MET  25           HA       MET  25 -10.354  -1.263   3.070
  181   1HB   MET  25          1HB       MET  25  -8.567  -0.197   2.014
  182   2HB   MET  25          2HB       MET  25  -9.177  -1.282   0.773
  183   1HG   MET  25          1HG       MET  25 -10.273   0.504  -0.358
  184   2HG   MET  25          2HG       MET  25  -9.938   1.618   0.966
  185   1HE   MET  25          1HE       MET  25  -8.272  -1.048  -0.963
  186   2HE   MET  25          2HE       MET  25  -7.788  -0.073  -2.350
  187   3HE   MET  25          3HE       MET  25  -6.597  -0.518  -1.127
  188    H    LYS  26           H        LYS  26  -9.485   1.205   3.447
  189    HA   LYS  26           HA       LYS  26 -11.886   2.911   3.486
  190   1HB   LYS  26          1HB       LYS  26 -10.467   1.817   5.702
  191   2HB   LYS  26          2HB       LYS  26 -10.200   3.555   5.693
  192   1HG   LYS  26          1HG       LYS  26 -12.639   3.899   5.605
  193   2HG   LYS  26          2HG       LYS  26 -12.864   2.152   5.709
  194   1HD   LYS  26          1HD       LYS  26 -11.136   3.353   7.776
  195   2HD   LYS  26          2HD       LYS  26 -12.843   3.796   7.848
  196   1HE   LYS  26          1HE       LYS  26 -13.439   1.408   7.834
  197   2HE   LYS  26          2HE       LYS  26 -11.726   0.993   7.813
  198   1HZ   LYS  26          1HZ       LYS  26 -13.055   1.092  10.043
  199   2HZ   LYS  26          2HZ       LYS  26 -12.713   2.746   9.945
  200   3HZ   LYS  26          3HZ       LYS  26 -11.450   1.621   9.974
  201    H    TYR  27           H        TYR  27  -8.362   2.760   3.493
  202    HA   TYR  27           HA       TYR  27  -8.315   5.378   2.171
  203   1HB   TYR  27          1HB       TYR  27  -7.699   5.329   4.744
  204   2HB   TYR  27          2HB       TYR  27  -6.152   4.751   4.134
  205    HD1  TYR  27           HD1      TYR  27  -8.620   7.488   3.509
  206    HD2  TYR  27           HD2      TYR  27  -4.532   6.314   3.620
  207    HE1  TYR  27           HE1      TYR  27  -7.948   9.806   3.037
  208    HE2  TYR  27           HE2      TYR  27  -3.848   8.630   3.150
  209    HH   TYR  27           HH       TYR  27  -6.155  11.256   3.117
  210    H    LEU  28           H        LEU  28  -6.539   5.720   0.782
  211    HA   LEU  28           HA       LEU  28  -4.899   3.344   0.217
  212   1HB   LEU  28          1HB       LEU  28  -6.477   3.246  -1.493
  213   2HB   LEU  28          2HB       LEU  28  -6.533   4.999  -1.669
  214    HG   LEU  28           HG       LEU  28  -4.410   5.008  -2.798
  215   1HD1  LEU  28          1HD1      LEU  28  -4.168   2.378  -1.597
  216   2HD1  LEU  28          2HD1      LEU  28  -2.920   3.463  -2.208
  217   3HD1  LEU  28          3HD1      LEU  28  -3.760   2.375  -3.313
  218   1HD2  LEU  28          1HD2      LEU  28  -4.971   3.661  -4.785
  219   2HD2  LEU  28          2HD2      LEU  28  -6.344   4.593  -4.188
  220   3HD2  LEU  28          3HD2      LEU  28  -6.243   2.862  -3.862
  221    H    VAL  29           H        VAL  29  -2.791   3.757   0.155
  222    HA   VAL  29           HA       VAL  29  -1.864   6.425  -0.623
  223    HB   VAL  29           HB       VAL  29  -0.961   4.998   1.883
  224   1HG1  VAL  29          1HG1      VAL  29   0.977   6.038   1.379
  225   2HG1  VAL  29          2HG1      VAL  29   0.201   7.187   0.287
  226   3HG1  VAL  29          3HG1      VAL  29   0.146   7.450   2.030
  227   1HG2  VAL  29          1HG2      VAL  29  -2.926   7.108   1.350
  228   2HG2  VAL  29          2HG2      VAL  29  -2.764   6.031   2.738
  229   3HG2  VAL  29          3HG2      VAL  29  -1.774   7.487   2.632
  230    H    TYR  30           H        TYR  30  -0.362   6.247  -2.139
  231    HA   TYR  30           HA       TYR  30   1.695   4.216  -1.967
  232   1HB   TYR  30          1HB       TYR  30   1.247   3.091  -3.973
  233   2HB   TYR  30          2HB       TYR  30  -0.339   3.246  -3.225
  234    HD1  TYR  30           HD2      TYR  30  -1.946   4.939  -4.082
  235    HD2  TYR  30           HD1      TYR  30   1.742   4.148  -6.051
  236    HE1  TYR  30           HE2      TYR  30  -2.799   6.039  -6.110
  237    HE2  TYR  30           HE1      TYR  30   0.900   5.247  -8.084
  238    HH   TYR  30           HH       TYR  30  -1.033   5.961  -9.125
  239    H    GLN  31           H        GLN  31   3.443   4.570  -3.478
  240    HA   GLN  31           HA       GLN  31   3.428   7.167  -4.831
  241   1HB   GLN  31          1HB       GLN  31   5.807   6.376  -3.182
  242   2HB   GLN  31          2HB       GLN  31   5.361   7.966  -3.787
  243   1HG   GLN  31          1HG       GLN  31   3.402   7.898  -2.216
  244   2HG   GLN  31          2HG       GLN  31   4.118   6.448  -1.512
  245   1HE2  GLN  31          1HE2      GLN  31   5.579   9.458  -2.669
  246   2HE2  GLN  31          2HE2      GLN  31   6.334   9.872  -1.171
  247    H    THR  32           H        THR  32   5.158   7.414  -6.395
  248    HA   THR  32           HA       THR  32   5.881   4.833  -7.579
  249    HB   THR  32           HB       THR  32   5.899   7.606  -8.786
  250    HG1  THR  32           HG1      THR  32   4.064   5.497  -8.721
  251   1HG2  THR  32          1HG2      THR  32   7.637   6.191  -9.771
  252   2HG2  THR  32          2HG2      THR  32   6.324   6.469 -10.916
  253   3HG2  THR  32          3HG2      THR  32   6.445   4.927 -10.070
  254    H    GLU  33           H        GLU  33   7.940   4.167  -7.803
  255    HA   GLU  33           HA       GLU  33  10.083   6.060  -7.098
  256   1HB   GLU  33          1HB       GLU  33   9.494   3.355  -6.023
  257   2HB   GLU  33          2HB       GLU  33  11.184   3.747  -6.305
  258   1HG   GLU  33          1HG       GLU  33  11.282   5.137  -4.560
  259   2HG   GLU  33          2HG       GLU  33   9.700   5.835  -4.901
  260    H    GLN  34           H        GLN  34  12.228   5.426  -7.927
  261    HA   GLN  34           HA       GLN  34  11.959   4.277 -10.610
  262   1HB   GLN  34          1HB       GLN  34  13.251   6.570  -9.657
  263   2HB   GLN  34          2HB       GLN  34  14.547   5.443 -10.040
  264   1HG   GLN  34          1HG       GLN  34  12.647   5.393 -12.157
  265   2HG   GLN  34          2HG       GLN  34  13.055   7.070 -11.797
  266   1HE2  GLN  34          1HE2      GLN  34  15.628   7.018 -11.125
  267   2HE2  GLN  34          2HE2      GLN  34  16.604   6.420 -12.420
  268    H    GLY  35           H        GLY  35  12.976   2.450 -11.213
  269   1HA   GLY  35          1HA       GLY  35  15.338   1.404 -10.207
  270   2HA   GLY  35          2HA       GLY  35  14.049   0.730  -9.221
  271    H    GLU  36           H        GLU  36  15.504  -1.051 -10.532
  272    HA   GLU  36           HA       GLU  36  15.598  -2.592 -12.245
  273   1HB   GLU  36          1HB       GLU  36  13.313  -3.683 -12.561
  274   2HB   GLU  36          2HB       GLU  36  13.953  -3.636 -10.924
  275   1HG   GLU  36          1HG       GLU  36  12.540  -1.725 -10.409
  276   2HG   GLU  36          2HG       GLU  36  11.917  -1.731 -12.058
  277    H    ALA  37           H        ALA  37  16.259  -1.202 -13.952
  278    HA   ALA  37           HA       ALA  37  16.142  -0.395 -16.077
  279   1HB   ALA  37          1HB       ALA  37  14.130  -2.426 -15.937
  280   2HB   ALA  37          2HB       ALA  37  13.584  -1.118 -16.987
  281   3HB   ALA  37          3HB       ALA  37  15.118  -1.928 -17.310
  282    H    GLY  38           H        GLY  38  14.675   1.007 -17.573
  283   1HA   GLY  38          1HA       GLY  38  14.125   3.401 -16.308
  284   2HA   GLY  38          2HA       GLY  38  13.467   2.938 -17.870
  285    H    ASN  39           H        ASN  39  12.077   0.606 -16.627
  286    HA   ASN  39           HA       ASN  39   9.558   1.690 -16.305
  287   1HB   ASN  39          1HB       ASN  39  10.457  -0.839 -14.923
  288   2HB   ASN  39          2HB       ASN  39   8.850  -0.450 -15.530
  289   1HD2  ASN  39          1HD2      ASN  39  10.770  -2.667 -16.090
  290   2HD2  ASN  39          2HD2      ASN  39  10.920  -2.693 -17.811
  291    H    ILE  40           H        ILE  40   8.190   1.433 -14.257
  292    HA   ILE  40           HA       ILE  40   9.700   2.397 -11.918
  293    HB   ILE  40           HB       ILE  40   7.368   3.607 -11.474
  294   1HG1  ILE  40          1HG1      ILE  40   7.621   3.637 -14.489
  295   2HG1  ILE  40          2HG1      ILE  40   6.387   2.759 -13.592
  296   1HG2  ILE  40          1HG2      ILE  40   8.819   5.288 -13.294
  297   2HG2  ILE  40          2HG2      ILE  40   8.702   5.380 -11.537
  298   3HG2  ILE  40          3HG2      ILE  40   9.937   4.369 -12.287
  299   1HD1  ILE  40          1HD1      ILE  40   5.572   4.899 -12.688
  300   2HD1  ILE  40          2HD1      ILE  40   6.760   5.741 -13.683
  301   3HD1  ILE  40          3HD1      ILE  40   5.474   4.808 -14.447
  302    H    HIS  41           H        HIS  41   8.425   2.195  -9.860
  303    HA   HIS  41           HA       HIS  41   6.570  -0.079  -9.898
  304   1HB   HIS  41          1HB       HIS  41   7.802  -0.797  -7.714
  305   2HB   HIS  41          2HB       HIS  41   8.487  -1.235  -9.276
  306    HD1  HIS  41           HD1      HIS  41  10.906  -1.315  -8.516
  307    HD2  HIS  41           HD2      HIS  41   9.056   2.315  -7.703
  308    HE1  HIS  41           HE1      HIS  41  12.753   0.236  -7.803
  309    H    PHE  42           H        PHE  42   5.169  -0.209  -8.075
  310    HA   PHE  42           HA       PHE  42   4.767   2.395  -6.785
  311   1HB   PHE  42          1HB       PHE  42   2.876   0.069  -7.185
  312   2HB   PHE  42          2HB       PHE  42   2.468   1.544  -6.315
  313    HD1  PHE  42           HD1      PHE  42   3.983   3.429  -8.194
  314    HD2  PHE  42           HD2      PHE  42   1.235   0.254  -8.887
  315    HE1  PHE  42           HE1      PHE  42   3.300   4.486 -10.308
  316    HE2  PHE  42           HE2      PHE  42   0.548   1.305 -11.003
  317    HZ   PHE  42           HZ       PHE  42   1.582   3.423 -11.717
  318    H    GLN  43           H        GLN  43   4.816   2.645  -4.616
  319    HA   GLN  43           HA       GLN  43   4.878   0.294  -2.890
  320   1HB   GLN  43          1HB       GLN  43   7.210   1.867  -3.580
  321   2HB   GLN  43          2HB       GLN  43   6.897   1.929  -1.850
  322   1HG   GLN  43          1HG       GLN  43   7.403  -0.246  -1.538
  323   2HG   GLN  43          2HG       GLN  43   6.760  -0.735  -3.105
  324   1HE2  GLN  43          1HE2      GLN  43   8.073   0.105  -5.001
  325   2HE2  GLN  43          2HE2      GLN  43   9.790  -0.019  -4.857
  326    H    GLY  44           H        GLY  44   3.863   0.622  -0.996
  327   1HA   GLY  44          1HA       GLY  44   3.794   2.991   0.478
  328   2HA   GLY  44          2HA       GLY  44   2.384   2.992  -0.571
  329    H    TYR  45           H        TYR  45   1.283   3.031   1.563
  330    HA   TYR  45           HA       TYR  45   0.947   0.287   2.585
  331   1HB   TYR  45          1HB       TYR  45   0.420   1.260   4.788
  332   2HB   TYR  45          2HB       TYR  45   2.051   1.670   4.266
  333    HD1  TYR  45           HD2      TYR  45   2.458   3.975   3.291
  334    HD2  TYR  45           HD1      TYR  45  -1.133   2.942   5.326
  335    HE1  TYR  45           HE2      TYR  45   1.972   6.362   3.634
  336    HE2  TYR  45           HE1      TYR  45  -1.629   5.326   5.674
  337    HH   TYR  45           HH       TYR  45   0.690   7.806   4.974
  338    H    ILE  46           H        ILE  46  -1.112  -0.454   2.879
  339    HA   ILE  46           HA       ILE  46  -3.318   1.392   2.262
  340    HB   ILE  46           HB       ILE  46  -3.174  -1.447   1.250
  341   1HG1  ILE  46          1HG1      ILE  46  -2.740   1.132  -0.272
  342   2HG1  ILE  46          2HG1      ILE  46  -1.478  -0.016   0.159
  343   1HG2  ILE  46          1HG2      ILE  46  -5.409  -0.235   1.711
  344   2HG2  ILE  46          2HG2      ILE  46  -5.012   0.702   0.272
  345   3HG2  ILE  46          3HG2      ILE  46  -5.186  -1.049   0.164
  346   1HD1  ILE  46          1HD1      ILE  46  -2.290  -0.162  -2.194
  347   2HD1  ILE  46          2HD1      ILE  46  -2.386  -1.670  -1.283
  348   3HD1  ILE  46          3HD1      ILE  46  -3.841  -0.713  -1.560
  349    H    GLU  47           H        GLU  47  -4.913   1.345   3.704
  350    HA   GLU  47           HA       GLU  47  -4.939  -0.832   5.672
  351   1HB   GLU  47          1HB       GLU  47  -6.426   1.778   5.893
  352   2HB   GLU  47          2HB       GLU  47  -6.007   0.655   7.179
  353   1HG   GLU  47          1HG       GLU  47  -3.560   1.340   6.129
  354   2HG   GLU  47          2HG       GLU  47  -4.477   2.843   6.038
  355    H    MET  48           H        MET  48  -6.424  -2.359   5.473
  356    HA   MET  48           HA       MET  48  -8.650  -2.037   3.671
  357   1HB   MET  48          1HB       MET  48  -7.694  -4.316   5.396
  358   2HB   MET  48          2HB       MET  48  -9.181  -4.404   4.461
  359   1HG   MET  48          1HG       MET  48  -6.970  -3.509   2.837
  360   2HG   MET  48          2HG       MET  48  -6.622  -5.054   3.611
  361   1HE   MET  48          1HE       MET  48  -8.295  -3.005   1.224
  362   2HE   MET  48          2HE       MET  48  -8.922  -4.126   0.016
  363   3HE   MET  48          3HE       MET  48  -9.964  -3.568   1.326
  364    H    LYS  49           H        LYS  49 -10.781  -3.199   4.615
  365    HA   LYS  49           HA       LYS  49 -12.052  -1.356   6.228
  366   1HB   LYS  49          1HB       LYS  49 -12.794  -3.647   4.883
  367   2HB   LYS  49          2HB       LYS  49 -13.098  -4.068   6.563
  368   1HG   LYS  49          1HG       LYS  49 -14.722  -2.458   6.817
  369   2HG   LYS  49          2HG       LYS  49 -14.093  -1.466   5.499
  370   1HD   LYS  49          1HD       LYS  49 -16.153  -2.478   4.786
  371   2HD   LYS  49          2HD       LYS  49 -14.822  -3.228   3.902
  372   1HE   LYS  49          1HE       LYS  49 -15.576  -5.206   4.579
  373   2HE   LYS  49          2HE       LYS  49 -15.137  -4.754   6.225
  374   1HZ   LYS  49          1HZ       LYS  49 -17.451  -3.556   6.106
  375   2HZ   LYS  49          2HZ       LYS  49 -17.337  -5.197   6.499
  376   3HZ   LYS  49          3HZ       LYS  49 -17.761  -4.731   4.929
  377    H    LYS  50           H        LYS  50 -10.972  -4.603   7.246
  378    HA   LYS  50           HA       LYS  50  -9.774  -3.806   9.629
  379   1HB   LYS  50          1HB       LYS  50 -12.656  -3.867   9.755
  380   2HB   LYS  50          2HB       LYS  50 -11.975  -5.072  10.840
  381   1HG   LYS  50          1HG       LYS  50 -10.807  -3.461  12.078
  382   2HG   LYS  50          2HG       LYS  50 -11.017  -2.230  10.831
  383   1HD   LYS  50          1HD       LYS  50 -13.196  -1.805  11.427
  384   2HD   LYS  50          2HD       LYS  50 -13.439  -3.419  12.097
  385   1HE   LYS  50          1HE       LYS  50 -11.508  -1.549  13.398
  386   2HE   LYS  50          2HE       LYS  50 -13.237  -1.350  13.679
  387   1HZ   LYS  50          1HZ       LYS  50 -11.725  -2.913  15.167
  388   2HZ   LYS  50          2HZ       LYS  50 -12.152  -4.039  13.980
  389   3HZ   LYS  50          3HZ       LYS  50 -13.356  -3.251  14.870
  390    H    ARG  51           H        ARG  51 -12.157  -6.405   9.156
  391    HA   ARG  51           HA       ARG  51 -10.097  -8.366   9.781
  392   1HB   ARG  51          1HB       ARG  51 -12.657  -8.235  10.571
  393   2HB   ARG  51          2HB       ARG  51 -12.866  -9.214   9.125
  394   1HG   ARG  51          1HG       ARG  51 -12.417 -10.955  10.433
  395   2HG   ARG  51          2HG       ARG  51 -10.737 -10.419  10.368
  396   1HD   ARG  51          1HD       ARG  51 -11.054  -9.120  12.398
  397   2HD   ARG  51          2HD       ARG  51 -12.756  -9.576  12.445
  398    HE   ARG  51           HE       ARG  51 -11.456 -11.957  12.454
  399   1HH1  ARG  51          1HH1      ARG  51 -11.234  -9.076  14.397
  400   2HH1  ARG  51          2HH1      ARG  51 -10.743  -9.922  15.827
  401   1HH2  ARG  51          1HH2      ARG  51 -10.810 -13.081  14.331
  402   2HH2  ARG  51          2HH2      ARG  51 -10.501 -12.200  15.788
  403    H    THR  52           H        THR  52  -9.575  -7.172   7.383
  404    HA   THR  52           HA       THR  52 -10.470  -9.097   5.349
  405    HB   THR  52           HB       THR  52  -8.885  -6.776   4.461
  406    HG1  THR  52           HG1      THR  52 -11.570  -6.284   5.194
  407   1HG2  THR  52          1HG2      THR  52 -10.881  -6.678   2.859
  408   2HG2  THR  52          2HG2      THR  52 -11.392  -8.194   3.601
  409   3HG2  THR  52          3HG2      THR  52  -9.840  -8.098   2.769
  410    H    SER  53           H        SER  53  -9.122 -10.716   4.956
  411    HA   SER  53           HA       SER  53  -6.374 -10.645   5.765
  412   1HB   SER  53          1HB       SER  53  -6.421 -12.908   4.409
  413   2HB   SER  53          2HB       SER  53  -7.233 -12.784   5.970
  414    HG   SER  53           HG       SER  53  -8.309 -12.960   3.404
  415    H    LEU  54           H        LEU  54  -4.791 -11.696   4.012
  416    HA   LEU  54           HA       LEU  54  -4.113  -9.702   2.225
  417   1HB   LEU  54          1HB       LEU  54  -2.601 -11.488   2.966
  418   2HB   LEU  54          2HB       LEU  54  -3.505 -12.646   1.992
  419    HG   LEU  54           HG       LEU  54  -2.831 -11.357  -0.037
  420   1HD1  LEU  54          1HD1      LEU  54  -2.333  -9.276   1.419
  421   2HD1  LEU  54          2HD1      LEU  54  -1.305  -9.621   0.030
  422   3HD1  LEU  54          3HD1      LEU  54  -0.755 -10.027   1.655
  423   1HD2  LEU  54          1HD2      LEU  54  -1.609 -13.312   0.341
  424   2HD2  LEU  54          2HD2      LEU  54  -0.796 -12.641   1.756
  425   3HD2  LEU  54          3HD2      LEU  54  -0.376 -12.066   0.142
  426    H    ALA  55           H        ALA  55  -6.333 -12.361   1.831
  427    HA   ALA  55           HA       ALA  55  -6.550 -12.507  -0.928
  428   1HB   ALA  55          1HB       ALA  55  -8.840 -12.754   1.016
  429   2HB   ALA  55          2HB       ALA  55  -8.720 -13.472  -0.591
  430   3HB   ALA  55          3HB       ALA  55  -7.656 -14.023   0.703
  431    H    GLY  56           H        GLY  56  -7.796 -10.104   1.290
  432   1HA   GLY  56          1HA       GLY  56  -9.626  -8.894  -0.530
  433   2HA   GLY  56          2HA       GLY  56  -9.011  -8.178   0.953
  434    H    MET  57           H        MET  57  -6.314  -8.066   0.468
  435    HA   MET  57           HA       MET  57  -6.159  -5.796  -1.255
  436   1HB   MET  57          1HB       MET  57  -3.954  -7.370   0.088
  437   2HB   MET  57          2HB       MET  57  -3.763  -5.798  -0.678
  438   1HG   MET  57          1HG       MET  57  -5.837  -5.982   1.406
  439   2HG   MET  57          2HG       MET  57  -4.168  -6.142   1.948
  440   1HE   MET  57          1HE       MET  57  -5.548  -3.373  -1.013
  441   2HE   MET  57          2HE       MET  57  -6.674  -4.321  -0.042
  442   3HE   MET  57          3HE       MET  57  -6.416  -2.615   0.323
  443    H    LYS  58           H        LYS  58  -4.806  -9.082  -1.403
  444    HA   LYS  58           HA       LYS  58  -3.461  -8.835  -3.833
  445   1HB   LYS  58          1HB       LYS  58  -3.730 -10.816  -2.015
  446   2HB   LYS  58          2HB       LYS  58  -4.769 -11.435  -3.291
  447   1HG   LYS  58          1HG       LYS  58  -3.031 -12.043  -4.529
  448   2HG   LYS  58          2HG       LYS  58  -2.257 -10.468  -4.344
  449   1HD   LYS  58          1HD       LYS  58  -0.809 -12.151  -3.424
  450   2HD   LYS  58          2HD       LYS  58  -1.463 -11.186  -2.099
  451   1HE   LYS  58          1HE       LYS  58  -2.702 -12.906  -1.280
  452   2HE   LYS  58          2HE       LYS  58  -2.978 -13.609  -2.873
  453   1HZ   LYS  58          1HZ       LYS  58  -1.111 -14.844  -2.752
  454   2HZ   LYS  58          2HZ       LYS  58  -1.354 -14.684  -1.086
  455   3HZ   LYS  58          3HZ       LYS  58  -0.244 -13.683  -1.878
  456    H    LYS  59           H        LYS  59  -6.838  -9.154  -3.152
  457    HA   LYS  59           HA       LYS  59  -7.739 -10.170  -5.612
  458   1HB   LYS  59          1HB       LYS  59  -8.898  -9.087  -3.227
  459   2HB   LYS  59          2HB       LYS  59  -9.672  -8.346  -4.622
  460   1HG   LYS  59          1HG       LYS  59 -10.501 -10.363  -5.398
  461   2HG   LYS  59          2HG       LYS  59  -9.322 -11.311  -4.489
  462   1HD   LYS  59          1HD       LYS  59 -10.438 -10.878  -2.432
  463   2HD   LYS  59          2HD       LYS  59 -11.474  -9.659  -3.179
  464   1HE   LYS  59          1HE       LYS  59 -12.314 -11.560  -4.673
  465   2HE   LYS  59          2HE       LYS  59 -11.538 -12.643  -3.518
  466   1HZ   LYS  59          1HZ       LYS  59 -13.616 -12.516  -2.633
  467   2HZ   LYS  59          2HZ       LYS  59 -13.893 -10.938  -3.175
  468   3HZ   LYS  59          3HZ       LYS  59 -12.908 -11.208  -1.826
  469    H    LEU  60           H        LEU  60  -6.828  -6.948  -4.600
  470    HA   LEU  60           HA       LEU  60  -7.874  -5.683  -6.972
  471   1HB   LEU  60          1HB       LEU  60  -6.185  -4.735  -4.676
  472   2HB   LEU  60          2HB       LEU  60  -6.531  -3.711  -6.068
  473    HG   LEU  60           HG       LEU  60  -9.004  -4.136  -5.516
  474   1HD1  LEU  60          1HD1      LEU  60  -7.680  -5.556  -3.353
  475   2HD1  LEU  60          2HD1      LEU  60  -9.357  -5.620  -3.892
  476   3HD1  LEU  60          3HD1      LEU  60  -8.838  -4.356  -2.777
  477   1HD2  LEU  60          1HD2      LEU  60  -8.919  -2.053  -4.749
  478   2HD2  LEU  60          2HD2      LEU  60  -7.161  -2.198  -4.715
  479   3HD2  LEU  60          3HD2      LEU  60  -8.105  -2.570  -3.272
  480    H    ILE  61           H        ILE  61  -4.734  -6.747  -5.774
  481    HA   ILE  61           HA       ILE  61  -3.692  -6.555  -8.502
  482    HB   ILE  61           HB       ILE  61  -2.131  -5.551  -6.122
  483   1HG1  ILE  61          1HG1      ILE  61  -2.410  -3.360  -7.622
  484   2HG1  ILE  61          2HG1      ILE  61  -3.905  -4.170  -8.077
  485   1HG2  ILE  61          1HG2      ILE  61  -0.872  -4.560  -8.269
  486   2HG2  ILE  61          2HG2      ILE  61  -0.470  -6.117  -7.548
  487   3HG2  ILE  61          3HG2      ILE  61  -1.514  -6.046  -8.967
  488   1HD1  ILE  61          1HD1      ILE  61  -4.093  -4.418  -5.435
  489   2HD1  ILE  61          2HD1      ILE  61  -3.107  -2.957  -5.509
  490   3HD1  ILE  61          3HD1      ILE  61  -4.678  -3.003  -6.309
  491    HA   PRO  62           HA       PRO  62  -2.720 -10.597  -6.452
  492   1HB   PRO  62          1HB       PRO  62  -3.401 -12.108  -8.603
  493   2HB   PRO  62          2HB       PRO  62  -4.573 -11.583  -7.388
  494   1HG   PRO  62          1HG       PRO  62  -3.991 -10.421 -10.085
  495   2HG   PRO  62          2HG       PRO  62  -5.557 -10.709  -9.305
  496   1HD   PRO  62          1HD       PRO  62  -4.394  -8.265  -9.378
  497   2HD   PRO  62          2HD       PRO  62  -5.414  -8.797  -8.026
  498    H    GLY  63           H        GLY  63  -0.623 -11.094  -6.445
  499   1HA   GLY  63          1HA       GLY  63   1.120 -12.224  -7.826
  500   2HA   GLY  63          2HA       GLY  63   0.851 -10.946  -9.002
  501    H    ALA  64           H        ALA  64   0.588  -8.892  -6.909
  502    HA   ALA  64           HA       ALA  64   3.314  -8.125  -6.765
  503   1HB   ALA  64          1HB       ALA  64   0.745  -7.013  -5.751
  504   2HB   ALA  64          2HB       ALA  64   2.259  -6.388  -5.096
  505   3HB   ALA  64          3HB       ALA  64   1.943  -6.293  -6.828
  506    H    HIS  65           H        HIS  65   4.333  -7.436  -4.647
  507    HA   HIS  65           HA       HIS  65   4.197  -9.696  -2.802
  508   1HB   HIS  65          1HB       HIS  65   6.373  -8.771  -3.849
  509   2HB   HIS  65          2HB       HIS  65   6.215  -7.468  -2.674
  510    HD1  HIS  65           HD1      HIS  65   8.231  -8.107  -1.271
  511    HD2  HIS  65           HD2      HIS  65   5.494 -11.202  -1.707
  512    HE1  HIS  65           HE1      HIS  65   8.962  -9.884   0.351
  513    H    PHE  66           H        PHE  66   2.896  -9.512  -1.110
  514    HA   PHE  66           HA       PHE  66   2.533  -6.856   0.108
  515   1HB   PHE  66          1HB       PHE  66   0.694  -9.116  -0.399
  516   2HB   PHE  66          2HB       PHE  66   0.505  -8.313   1.156
  517    HD1  PHE  66           HD1      PHE  66   0.548  -7.740  -2.499
  518    HD2  PHE  66           HD2      PHE  66  -0.579  -6.243   1.323
  519    HE1  PHE  66           HE1      PHE  66  -0.755  -5.957  -3.585
  520    HE2  PHE  66           HE2      PHE  66  -1.884  -4.459   0.244
  521    HZ   PHE  66           HZ       PHE  66  -1.974  -4.314  -2.213
  522    H    GLU  67           H        GLU  67   2.269  -6.794   2.451
  523    HA   GLU  67           HA       GLU  67   3.295  -9.065   3.946
  524   1HB   GLU  67          1HB       GLU  67   4.902  -6.728   3.285
  525   2HB   GLU  67          2HB       GLU  67   4.776  -6.975   5.021
  526   1HG   GLU  67          1HG       GLU  67   5.644  -9.207   4.818
  527   2HG   GLU  67          2HG       GLU  67   5.643  -9.085   3.060
  528    H    LYS  68           H        LYS  68   1.841  -9.291   5.503
  529    HA   LYS  68           HA       LYS  68   0.596  -6.900   6.663
  530   1HB   LYS  68          1HB       LYS  68  -0.877  -8.682   5.722
  531   2HB   LYS  68          2HB       LYS  68  -0.248  -9.790   6.935
  532   1HG   LYS  68          1HG       LYS  68  -2.488  -8.684   7.404
  533   2HG   LYS  68          2HG       LYS  68  -1.279  -8.642   8.689
  534   1HD   LYS  68          1HD       LYS  68  -0.760  -6.374   8.256
  535   2HD   LYS  68          2HD       LYS  68  -1.636  -6.392   6.723
  536   1HE   LYS  68          1HE       LYS  68  -2.969  -5.231   8.340
  537   2HE   LYS  68          2HE       LYS  68  -3.735  -6.782   8.001
  538   1HZ   LYS  68          1HZ       LYS  68  -1.887  -6.499  10.280
  539   2HZ   LYS  68          2HZ       LYS  68  -3.129  -7.624  10.050
  540   3HZ   LYS  68          3HZ       LYS  68  -3.502  -6.017  10.427
  541    H    ARG  69           H        ARG  69   3.281  -8.358   7.266
  542    HA   ARG  69           HA       ARG  69   2.946  -9.114  10.037
  543   1HB   ARG  69          1HB       ARG  69   4.629 -10.075   8.294
  544   2HB   ARG  69          2HB       ARG  69   5.603  -8.673   8.716
  545   1HG   ARG  69          1HG       ARG  69   4.869  -9.738  11.163
  546   2HG   ARG  69          2HG       ARG  69   5.199 -11.148  10.154
  547   1HD   ARG  69          1HD       ARG  69   7.387 -10.251   9.585
  548   2HD   ARG  69          2HD       ARG  69   7.054  -8.800  10.529
  549    HE   ARG  69           HE       ARG  69   6.802 -11.144  12.115
  550   1HH1  ARG  69          1HH1      ARG  69   9.142  -8.999  10.686
  551   2HH1  ARG  69          2HH1      ARG  69  10.362  -9.330  11.870
  552   1HH2  ARG  69          1HH2      ARG  69   8.401 -11.589  13.680
  553   2HH2  ARG  69          2HH2      ARG  69   9.940 -10.804  13.572
  554    H    ARG  70           H        ARG  70   2.699  -6.249   8.752
  555    HA   ARG  70           HA       ARG  70   2.902  -4.124   9.544
  556   1HB   ARG  70          1HB       ARG  70   4.190  -5.229  12.031
  557   2HB   ARG  70          2HB       ARG  70   3.259  -3.748  11.850
  558   1HG   ARG  70          1HG       ARG  70   1.515  -4.878  12.622
  559   2HG   ARG  70          2HG       ARG  70   1.503  -5.752  11.089
  560   1HD   ARG  70          1HD       ARG  70   2.423  -7.617  11.990
  561   2HD   ARG  70          2HD       ARG  70   3.407  -6.708  13.135
  562    HE   ARG  70           HE       ARG  70   0.796  -6.410  13.969
  563   1HH1  ARG  70          1HH1      ARG  70   3.020  -9.041  13.464
  564   2HH1  ARG  70          2HH1      ARG  70   2.321 -10.040  14.695
  565   1HH2  ARG  70          1HH2      ARG  70  -0.133  -7.716  15.592
  566   2HH2  ARG  70          2HH2      ARG  70   0.527  -9.286  15.904
  567    H    GLY  71           H        GLY  71   4.528  -4.003   7.809
  568   1HA   GLY  71          1HA       GLY  71   7.245  -4.405   8.069
  569   2HA   GLY  71          2HA       GLY  71   6.529  -3.155   7.062
  570    H    THR  72           H        THR  72   5.302  -1.869   9.454
  571    HA   THR  72           HA       THR  72   7.547  -0.998  11.052
  572    HB   THR  72           HB       THR  72   6.346   1.404  10.021
  573    HG1  THR  72           HG1      THR  72   7.341   1.141   7.870
  574   1HG2  THR  72          1HG2      THR  72   8.561   1.089  11.187
  575   2HG2  THR  72          2HG2      THR  72   8.612   2.081   9.730
  576   3HG2  THR  72          3HG2      THR  72   9.171   0.410   9.679
  577    H    GLN  73           H        GLN  73   4.718  -2.112  11.209
  578    HA   GLN  73           HA       GLN  73   2.891  -1.937  12.554
  579   1HB   GLN  73          1HB       GLN  73   4.959  -1.634  14.158
  580   2HB   GLN  73          2HB       GLN  73   4.340   0.005  14.305
  581   1HG   GLN  73          1HG       GLN  73   2.390  -0.680  15.336
  582   2HG   GLN  73          2HG       GLN  73   2.520  -2.324  14.715
  583   1HE2  GLN  73          1HE2      GLN  73   2.222  -3.160  16.796
  584   2HE2  GLN  73          2HE2      GLN  73   3.483  -3.128  17.976
  585    H    GLY  74           H        GLY  74   3.233   0.004  10.378
  586   1HA   GLY  74          1HA       GLY  74   1.651   1.576   9.621
  587   2HA   GLY  74          2HA       GLY  74   1.212   1.904  11.291
  588    H    GLU  75           H        GLU  75   4.395   1.967  11.511
  589    HA   GLU  75           HA       GLU  75   4.622   4.731  11.790
  590   1HB   GLU  75          1HB       GLU  75   6.147   2.883  12.702
  591   2HB   GLU  75          2HB       GLU  75   6.951   2.937  11.140
  592   1HG   GLU  75          1HG       GLU  75   7.673   5.156  11.475
  593   2HG   GLU  75          2HG       GLU  75   6.608   5.370  12.863
  594    H    ALA  76           H        ALA  76   4.922   2.714   8.989
  595    HA   ALA  76           HA       ALA  76   6.435   4.420   7.339
  596   1HB   ALA  76          1HB       ALA  76   4.544   2.165   6.843
  597   2HB   ALA  76          2HB       ALA  76   5.109   3.144   5.488
  598   3HB   ALA  76          3HB       ALA  76   6.270   2.284   6.499
  599    H    ARG  77           H        ARG  77   3.283   4.732   8.555
  600    HA   ARG  77           HA       ARG  77   2.059   6.136   6.421
  601   1HB   ARG  77          1HB       ARG  77   0.730   5.134   8.194
  602   2HB   ARG  77          2HB       ARG  77   1.487   6.179   9.388
  603   1HG   ARG  77          1HG       ARG  77   0.167   7.923   8.890
  604   2HG   ARG  77          2HG       ARG  77   0.196   7.583   7.159
  605   1HD   ARG  77          1HD       ARG  77  -1.951   6.994   7.496
  606   2HD   ARG  77          2HD       ARG  77  -1.240   5.478   8.049
  607    HE   ARG  77           HE       ARG  77  -1.347   7.140  10.254
  608   1HH1  ARG  77          1HH1      ARG  77  -3.597   5.707   8.017
  609   2HH1  ARG  77          2HH1      ARG  77  -4.890   5.625   9.167
  610   1HH2  ARG  77          1HH2      ARG  77  -3.042   7.038  11.777
  611   2HH2  ARG  77          2HH2      ARG  77  -4.573   6.383  11.305
  612    H    ALA  78           H        ALA  78   4.457   7.008   8.684
  613    HA   ALA  78           HA       ALA  78   4.074   9.861   8.047
  614   1HB   ALA  78          1HB       ALA  78   3.963  10.043  10.283
  615   2HB   ALA  78          2HB       ALA  78   4.746   8.486  10.554
  616   3HB   ALA  78          3HB       ALA  78   5.720   9.914  10.198
  617    H    TYR  79           H        TYR  79   6.355   7.205   8.284
  618    HA   TYR  79           HA       TYR  79   8.588   8.854   7.448
  619   1HB   TYR  79          1HB       TYR  79   9.244   7.189   8.960
  620   2HB   TYR  79          2HB       TYR  79   8.264   5.956   8.174
  621    HD1  TYR  79           HD1      TYR  79  10.757   8.323   6.728
  622    HD2  TYR  79           HD2      TYR  79   9.740   4.274   7.548
  623    HE1  TYR  79           HE1      TYR  79  12.726   7.577   5.456
  624    HE2  TYR  79           HE2      TYR  79  11.707   3.517   6.279
  625    HH   TYR  79           HH       TYR  79  13.929   4.444   5.601
  626    H    SER  80           H        SER  80   6.663   6.181   6.124
  627    HA   SER  80           HA       SER  80   6.264   5.502   3.990
  628   1HB   SER  80          1HB       SER  80   7.417   7.867   2.666
  629   2HB   SER  80          2HB       SER  80   5.809   7.159   2.513
  630    HG   SER  80           HG       SER  80   5.087   8.435   4.047
  631    H    MET  81           H        MET  81   7.615   5.850   1.613
  632    HA   MET  81           HA       MET  81   9.887   4.172   2.019
  633   1HB   MET  81          1HB       MET  81   9.292   5.586  -0.563
  634   2HB   MET  81          2HB       MET  81  10.000   3.996  -0.315
  635   1HG   MET  81          1HG       MET  81   7.985   3.191  -0.776
  636   2HG   MET  81          2HG       MET  81   7.523   3.742   0.833
  637   1HE   MET  81          1HE       MET  81   5.457   4.147   0.889
  638   2HE   MET  81          2HE       MET  81   5.340   5.906   0.956
  639   3HE   MET  81          3HE       MET  81   4.398   5.004  -0.232
  640    H    LYS  82           H        LYS  82  11.774   4.987   0.235
  641    HA   LYS  82           HA       LYS  82  13.103   7.067   1.716
  642   1HB   LYS  82          1HB       LYS  82  13.843   5.158  -0.443
  643   2HB   LYS  82          2HB       LYS  82  14.801   6.626  -0.300
  644   1HG   LYS  82          1HG       LYS  82  14.363   5.296   2.253
  645   2HG   LYS  82          2HG       LYS  82  15.214   4.293   1.076
  646   1HD   LYS  82          1HD       LYS  82  16.947   5.880   0.832
  647   2HD   LYS  82          2HD       LYS  82  16.017   7.134   1.655
  648   1HE   LYS  82          1HE       LYS  82  16.098   5.264   3.589
  649   2HE   LYS  82          2HE       LYS  82  17.614   4.910   2.762
  650   1HZ   LYS  82          1HZ       LYS  82  18.443   6.540   4.011
  651   2HZ   LYS  82          2HZ       LYS  82  16.919   7.143   4.429
  652   3HZ   LYS  82          3HZ       LYS  82  17.642   7.609   2.973
  653    H    GLU  83           H        GLU  83  12.872   9.159   1.326
  654    HA   GLU  83           HA       GLU  83  11.478  10.200  -0.888
  655   1HB   GLU  83          1HB       GLU  83  13.404  11.757   0.832
  656   2HB   GLU  83          2HB       GLU  83  11.989  12.359  -0.022
  657   1HG   GLU  83          1HG       GLU  83  10.966  10.411   1.645
  658   2HG   GLU  83          2HG       GLU  83  12.211  11.191   2.619
  659    H    ASP  84           H        ASP  84  14.892   9.704  -0.260
  660    HA   ASP  84           HA       ASP  84  15.887  11.250  -2.410
  661   1HB   ASP  84          1HB       ASP  84  16.977   9.722  -0.321
  662   2HB   ASP  84          2HB       ASP  84  17.581   8.988  -1.805
  663    H    THR  85           H        THR  85  14.841   7.904  -2.130
  664    HA   THR  85           HA       THR  85  15.527   7.412  -4.933
  665    HB   THR  85           HB       THR  85  14.263   5.143  -3.763
  666    HG1  THR  85           HG1      THR  85  16.407   6.173  -2.190
  667   1HG2  THR  85          1HG2      THR  85  16.178   4.034  -4.462
  668   2HG2  THR  85          2HG2      THR  85  17.223   5.414  -4.127
  669   3HG2  THR  85          3HG2      THR  85  16.152   5.439  -5.527
  670    H    ARG  86           H        ARG  86  13.090   8.874  -3.500
  671    HA   ARG  86           HA       ARG  86  10.858   7.448  -4.660
  672   1HB   ARG  86          1HB       ARG  86  11.144   9.231  -2.554
  673   2HB   ARG  86          2HB       ARG  86  10.316  10.174  -3.786
  674   1HG   ARG  86          1HG       ARG  86   8.401   9.048  -3.533
  675   2HG   ARG  86          2HG       ARG  86   9.221   7.491  -3.403
  676   1HD   ARG  86          1HD       ARG  86   8.256   7.783  -1.303
  677   2HD   ARG  86          2HD       ARG  86   9.929   8.289  -1.067
  678    HE   ARG  86           HE       ARG  86   8.273  10.493  -1.754
  679   1HH1  ARG  86          1HH1      ARG  86   9.120   8.375   0.876
  680   2HH1  ARG  86          2HH1      ARG  86   8.733   9.532   2.106
  681   1HH2  ARG  86          1HH2      ARG  86   7.759  12.025  -0.144
  682   2HH2  ARG  86          2HH2      ARG  86   7.957  11.608   1.524
  683    H    LEU  87           H        LEU  87   9.825   7.904  -6.525
  684    HA   LEU  87           HA       LEU  87  11.053   9.901  -8.269
  685   1HB   LEU  87          1HB       LEU  87  10.035   7.310  -8.659
  686   2HB   LEU  87          2HB       LEU  87   8.948   8.401  -9.516
  687    HG   LEU  87           HG       LEU  87  11.903   8.021  -9.962
  688   1HD1  LEU  87          1HD1      LEU  87  10.971   7.607 -12.319
  689   2HD1  LEU  87          2HD1      LEU  87   9.416   7.404 -11.514
  690   3HD1  LEU  87          3HD1      LEU  87  10.764   6.344 -11.105
  691   1HD2  LEU  87          1HD2      LEU  87  11.544  10.361 -10.150
  692   2HD2  LEU  87          2HD2      LEU  87  10.035  10.126 -11.032
  693   3HD2  LEU  87          3HD2      LEU  87  11.574   9.713 -11.790
  694    H    GLU  88           H        GLU  88   7.780   8.851  -7.320
  695    HA   GLU  88           HA       GLU  88   6.901  11.640  -7.598
  696   1HB   GLU  88          1HB       GLU  88   6.220   9.716  -9.422
  697   2HB   GLU  88          2HB       GLU  88   4.872   9.633  -8.296
  698   1HG   GLU  88          1HG       GLU  88   4.292  11.148 -10.032
  699   2HG   GLU  88          2HG       GLU  88   4.575  12.085  -8.566
  700    H    GLY  89           H        GLY  89   4.577  11.835  -6.631
  701   1HA   GLY  89          1HA       GLY  89   3.050  11.254  -4.926
  702   2HA   GLY  89          2HA       GLY  89   4.198  10.061  -4.336
  703    HA   PRO  90           HA       PRO  90   3.511   9.828  -2.394
  704   1HB   PRO  90          1HB       PRO  90   2.047  10.613  -0.247
  705   2HB   PRO  90          2HB       PRO  90   3.751  10.158  -0.133
  706   1HG   PRO  90          1HG       PRO  90   2.524  12.885  -0.268
  707   2HG   PRO  90          2HG       PRO  90   3.843  12.302   0.763
  708   1HD   PRO  90          1HD       PRO  90   4.280  13.749  -1.484
  709   2HD   PRO  90          2HD       PRO  90   5.411  12.505  -0.914
  710    H    TRP  91           H        TRP  91   1.171   9.196  -2.141
  711    HA   TRP  91           HA       TRP  91  -0.690  11.152  -3.275
  712   1HB   TRP  91          1HB       TRP  91   0.001   8.469  -4.457
  713   2HB   TRP  91          2HB       TRP  91  -1.551   9.241  -4.772
  714    HD1  TRP  91           HD1      TRP  91  -0.469  12.243  -5.108
  715    HE1  TRP  91           HE1      TRP  91   0.845  12.860  -7.234
  716    HE3  TRP  91           HE3      TRP  91   1.021   7.563  -6.528
  717    HZ2  TRP  91           HZ2      TRP  91   2.318  11.537  -9.246
  718    HZ3  TRP  91           HZ3      TRP  91   2.380   7.326  -8.566
  719    HH2  TRP  91           HH2      TRP  91   3.014   9.273  -9.896
  720    H    GLU  92           H        GLU  92  -2.610  11.120  -2.292
  721    HA   GLU  92           HA       GLU  92  -3.295   8.751  -0.678
  722   1HB   GLU  92          1HB       GLU  92  -3.579  11.680  -0.104
  723   2HB   GLU  92          2HB       GLU  92  -4.670  10.527   0.652
  724   1HG   GLU  92          1HG       GLU  92  -2.768   9.356   1.628
  725   2HG   GLU  92          2HG       GLU  92  -1.667  10.497   0.859
  726    H    TYR  93           H        TYR  93  -5.294   7.888  -0.888
  727    HA   TYR  93           HA       TYR  93  -7.327   9.344  -2.403
  728   1HB   TYR  93          1HB       TYR  93  -6.335   6.578  -3.119
  729   2HB   TYR  93          2HB       TYR  93  -7.776   7.329  -3.796
  730    HD1  TYR  93           HD1      TYR  93  -7.507   9.450  -5.151
  731    HD2  TYR  93           HD2      TYR  93  -4.204   7.020  -4.016
  732    HE1  TYR  93           HE1      TYR  93  -6.140  10.500  -6.905
  733    HE2  TYR  93           HE2      TYR  93  -2.827   8.065  -5.766
  734    HH   TYR  93           HH       TYR  93  -4.151  10.598  -7.878
  735    H    GLY  94           H        GLY  94  -9.474   8.362  -2.238
  736   1HA   GLY  94          1HA       GLY  94 -11.036   6.909  -1.207
  737   2HA   GLY  94          2HA       GLY  94  -9.795   6.432  -0.057
  738    H    GLU  95           H        GLU  95 -11.164   6.778   1.711
  739    HA   GLU  95           HA       GLU  95 -12.702   9.004   2.252
  740   1HB   GLU  95          1HB       GLU  95 -12.867   7.088   3.669
  741   2HB   GLU  95          2HB       GLU  95 -11.170   7.195   4.117
  742   1HG   GLU  95          1HG       GLU  95 -11.559   8.696   5.724
  743   2HG   GLU  95          2HG       GLU  95 -12.720   9.592   4.745
  Start of MODEL    5
    1   1H    ALA   2          1H        ALA   2 -13.963   2.121  19.792
    2    HA   ALA   2           HA       ALA   2 -14.129  -0.286  18.125
    3   1HB   ALA   2          1HB       ALA   2 -13.015   2.087  16.861
    4   2HB   ALA   2          2HB       ALA   2 -14.361   1.062  16.362
    5   3HB   ALA   2          3HB       ALA   2 -14.623   2.354  17.534
    6    H    ARG   3           H        ARG   3 -12.259  -0.949  16.886
    7    HA   ARG   3           HA       ARG   3  -9.732  -0.356  18.281
    8   1HB   ARG   3          1HB       ARG   3 -11.022  -2.832  17.793
    9   2HB   ARG   3          2HB       ARG   3  -9.587  -2.791  16.778
   10   1HG   ARG   3          1HG       ARG   3  -8.900  -1.840  19.375
   11   2HG   ARG   3          2HG       ARG   3  -9.768  -3.369  19.530
   12   1HD   ARG   3          1HD       ARG   3  -7.743  -3.292  17.401
   13   2HD   ARG   3          2HD       ARG   3  -7.108  -3.147  19.039
   14    HE   ARG   3           HE       ARG   3  -8.300  -5.476  17.835
   15   1HH1  ARG   3          1HH1      ARG   3  -7.511  -3.860  20.816
   16   2HH1  ARG   3          2HH1      ARG   3  -7.502  -5.316  21.755
   17   1HH2  ARG   3          1HH2      ARG   3  -8.290  -7.400  19.060
   18   2HH2  ARG   3          2HH2      ARG   3  -7.944  -7.329  20.755
   19    H    GLN   4           H        GLN   4  -7.837  -0.144  17.053
   20    HA   GLN   4           HA       GLN   4  -8.315   0.743  14.315
   21   1HB   GLN   4          1HB       GLN   4  -6.274   1.284  16.393
   22   2HB   GLN   4          2HB       GLN   4  -5.711   1.306  14.727
   23   1HG   GLN   4          1HG       GLN   4  -8.173   2.781  15.018
   24   2HG   GLN   4          2HG       GLN   4  -6.928   3.377  16.115
   25   1HE2  GLN   4          1HE2      GLN   4  -6.566   5.282  15.063
   26   2HE2  GLN   4          2HE2      GLN   4  -5.852   5.382  13.493
   27    H    VAL   5           H        VAL   5  -7.086   0.018  12.544
   28    HA   VAL   5           HA       VAL   5  -5.948  -2.671  12.917
   29    HB   VAL   5           HB       VAL   5  -6.441  -3.094  10.571
   30   1HG1  VAL   5          1HG1      VAL   5  -9.078  -2.380  10.905
   31   2HG1  VAL   5          2HG1      VAL   5  -8.321  -3.858  11.505
   32   3HG1  VAL   5          3HG1      VAL   5  -8.469  -2.451  12.559
   33   1HG2  VAL   5          1HG2      VAL   5  -6.782  -1.470   9.093
   34   2HG2  VAL   5          2HG2      VAL   5  -8.152  -0.854  10.016
   35   3HG2  VAL   5          3HG2      VAL   5  -6.519  -0.296  10.382
   36    H    ILE   6           H        ILE   6  -4.127  -3.267  11.559
   37    HA   ILE   6           HA       ILE   6  -2.205  -1.099  11.388
   38    HB   ILE   6           HB       ILE   6  -1.786  -4.031  10.804
   39   1HG1  ILE   6          1HG1      ILE   6  -0.587  -3.700  13.168
   40   2HG1  ILE   6          2HG1      ILE   6  -1.835  -2.470  13.340
   41   1HG2  ILE   6          1HG2      ILE   6   0.610  -3.214  11.533
   42   2HG2  ILE   6          2HG2      ILE   6   0.048  -3.036   9.872
   43   3HG2  ILE   6          3HG2      ILE   6  -0.001  -1.659  10.971
   44   1HD1  ILE   6          1HD1      ILE   6  -3.552  -4.030  13.251
   45   2HD1  ILE   6          2HD1      ILE   6  -2.522  -5.263  12.521
   46   3HD1  ILE   6          3HD1      ILE   6  -2.308  -4.827  14.216
   47    H    CYS   7           H        CYS   7  -1.017  -0.569   9.524
   48    HA   CYS   7           HA       CYS   7  -2.534  -0.724   7.090
   49   1HB   CYS   7          1HB       CYS   7  -1.021   0.850   6.211
   50   2HB   CYS   7          2HB       CYS   7  -1.140   1.265   7.917
   51    HG   CYS   7           HG       CYS   7   1.493   0.106   6.174
   52    H    TRP   8           H        TRP   8  -1.678  -1.477   5.049
   53    HA   TRP   8           HA       TRP   8   0.014  -3.855   5.404
   54   1HB   TRP   8          1HB       TRP   8  -2.048  -3.174   3.301
   55   2HB   TRP   8          2HB       TRP   8  -0.992  -4.581   3.212
   56    HD1  TRP   8           HD1      TRP   8  -3.499  -3.123   5.808
   57    HE1  TRP   8           HE1      TRP   8  -4.797  -5.094   6.836
   58    HE3  TRP   8           HE3      TRP   8  -1.207  -6.974   3.349
   59    HZ2  TRP   8           HZ2      TRP   8  -4.843  -7.909   6.631
   60    HZ3  TRP   8           HZ3      TRP   8  -1.936  -9.276   3.823
   61    HH2  TRP   8           HH2      TRP   8  -3.716  -9.731   5.430
   62    H    CYS   9           H        CYS   9   2.057  -3.596   4.810
   63    HA   CYS   9           HA       CYS   9   2.741  -1.583   2.807
   64   1HB   CYS   9          1HB       CYS   9   4.658  -3.249   4.437
   65   2HB   CYS   9          2HB       CYS   9   4.985  -1.735   3.601
   66    HG   CYS   9           HG       CYS   9   3.547  -2.255   6.607
   67    H    PHE  10           H        PHE  10   2.939  -2.163   0.758
   68    HA   PHE  10           HA       PHE  10   4.108  -4.778   0.126
   69   1HB   PHE  10          1HB       PHE  10   2.420  -5.408  -1.335
   70   2HB   PHE  10          2HB       PHE  10   1.502  -4.631  -0.050
   71    HD1  PHE  10           HD2      PHE  10   1.028  -2.087  -0.388
   72    HD2  PHE  10           HD1      PHE  10   2.058  -4.780  -3.519
   73    HE1  PHE  10           HE2      PHE  10   0.024  -0.555  -2.031
   74    HE2  PHE  10           HE1      PHE  10   1.056  -3.252  -5.167
   75    HZ   PHE  10           HZ       PHE  10   0.037  -1.137  -4.424
   76    H    THR  11           H        THR  11   4.829  -4.913  -2.167
   77    HA   THR  11           HA       THR  11   5.563  -2.276  -3.252
   78    HB   THR  11           HB       THR  11   7.456  -4.604  -3.410
   79    HG1  THR  11           HG1      THR  11   8.445  -3.838  -1.523
   80   1HG2  THR  11          1HG2      THR  11   8.800  -2.163  -3.185
   81   2HG2  THR  11          2HG2      THR  11   7.429  -1.841  -4.246
   82   3HG2  THR  11          3HG2      THR  11   8.573  -3.121  -4.648
   83    H    LEU  12           H        LEU  12   4.965  -2.032  -5.298
   84    HA   LEU  12           HA       LEU  12   4.406  -4.439  -6.894
   85   1HB   LEU  12          1HB       LEU  12   2.596  -2.687  -6.353
   86   2HB   LEU  12          2HB       LEU  12   3.423  -1.682  -7.541
   87    HG   LEU  12           HG       LEU  12   2.967  -3.307  -9.280
   88   1HD1  LEU  12          1HD1      LEU  12   3.093  -5.366  -8.085
   89   2HD1  LEU  12          2HD1      LEU  12   1.471  -5.241  -8.766
   90   3HD1  LEU  12          3HD1      LEU  12   1.735  -4.917  -7.053
   91   1HD2  LEU  12          1HD2      LEU  12   0.551  -2.575  -7.632
   92   2HD2  LEU  12          2HD2      LEU  12   0.488  -3.168  -9.293
   93   3HD2  LEU  12          3HD2      LEU  12   1.280  -1.633  -8.932
   94    H    ASN  13           H        ASN  13   5.838  -4.914  -8.411
   95    HA   ASN  13           HA       ASN  13   7.525  -2.764  -9.492
   96   1HB   ASN  13          1HB       ASN  13   9.033  -4.627 -10.214
   97   2HB   ASN  13          2HB       ASN  13   8.823  -4.517  -8.469
   98   1HD2  ASN  13          1HD2      ASN  13   8.151  -6.253  -7.397
   99   2HD2  ASN  13          2HD2      ASN  13   7.583  -7.715  -8.123
  100    H    ASN  14           H        ASN  14   7.464  -2.241 -11.598
  101    HA   ASN  14           HA       ASN  14   6.617  -2.069 -13.709
  102   1HB   ASN  14          1HB       ASN  14   8.169  -4.161 -13.722
  103   2HB   ASN  14          2HB       ASN  14   6.665  -5.068 -13.859
  104   1HD2  ASN  14          1HD2      ASN  14   7.249  -5.809 -15.905
  105   2HD2  ASN  14          2HD2      ASN  14   7.180  -4.788 -17.297
  106    HA   PRO  15           HA       PRO  15   2.351  -3.382 -12.251
  107   1HB   PRO  15          1HB       PRO  15   1.338  -0.871 -12.055
  108   2HB   PRO  15          2HB       PRO  15   2.171  -1.678 -10.721
  109   1HG   PRO  15          1HG       PRO  15   3.218   0.349 -12.659
  110   2HG   PRO  15          2HG       PRO  15   3.468   0.243 -10.907
  111   1HD   PRO  15          1HD       PRO  15   5.321  -0.592 -12.696
  112   2HD   PRO  15          2HD       PRO  15   5.107  -1.363 -11.111
  113    H    LEU  16           H        LEU  16   0.651  -3.623 -13.625
  114    HA   LEU  16           HA       LEU  16   1.008  -2.724 -16.349
  115   1HB   LEU  16          1HB       LEU  16   0.196  -5.030 -15.572
  116   2HB   LEU  16          2HB       LEU  16  -1.355  -4.242 -15.293
  117    HG   LEU  16           HG       LEU  16  -0.876  -3.507 -17.854
  118   1HD1  LEU  16          1HD1      LEU  16   0.286  -5.028 -19.075
  119   2HD1  LEU  16          2HD1      LEU  16  -0.061  -6.354 -17.965
  120   3HD1  LEU  16          3HD1      LEU  16   1.176  -5.165 -17.559
  121   1HD2  LEU  16          1HD2      LEU  16  -2.941  -4.461 -16.993
  122   2HD2  LEU  16          2HD2      LEU  16  -2.188  -6.053 -16.907
  123   3HD2  LEU  16          3HD2      LEU  16  -2.448  -5.284 -18.473
  124    H    SER  17           H        SER  17  -0.332  -1.385 -13.648
  125    HA   SER  17           HA       SER  17  -1.482   0.787 -14.973
  126   1HB   SER  17          1HB       SER  17  -3.677   0.323 -15.249
  127   2HB   SER  17          2HB       SER  17  -3.176  -1.365 -15.157
  128    HG   SER  17           HG       SER  17  -4.916  -0.433 -13.659
  129    HA   PRO  18           HA       PRO  18  -1.278   2.509 -10.944
  130   1HB   PRO  18          1HB       PRO  18  -3.272   4.351 -10.991
  131   2HB   PRO  18          2HB       PRO  18  -1.763   4.545 -11.892
  132   1HG   PRO  18          1HG       PRO  18  -4.438   3.606 -12.855
  133   2HG   PRO  18          2HG       PRO  18  -3.299   4.724 -13.629
  134   1HD   PRO  18          1HD       PRO  18  -3.512   2.125 -14.358
  135   2HD   PRO  18          2HD       PRO  18  -1.980   3.016 -14.440
  136    H    LEU  19           H        LEU  19  -2.198   2.486  -8.881
  137    HA   LEU  19           HA       LEU  19  -4.251   0.512  -8.489
  138   1HB   LEU  19          1HB       LEU  19  -3.099   2.271  -6.350
  139   2HB   LEU  19          2HB       LEU  19  -3.748   0.639  -6.201
  140    HG   LEU  19           HG       LEU  19  -1.207   1.257  -7.693
  141   1HD1  LEU  19          1HD1      LEU  19   0.054   0.782  -5.768
  142   2HD1  LEU  19          2HD1      LEU  19  -1.361   0.220  -4.878
  143   3HD1  LEU  19          3HD1      LEU  19  -1.174   1.935  -5.245
  144   1HD2  LEU  19          1HD2      LEU  19  -2.820  -1.071  -7.340
  145   2HD2  LEU  19          2HD2      LEU  19  -1.267  -1.319  -6.541
  146   3HD2  LEU  19          3HD2      LEU  19  -1.321  -0.886  -8.251
  147    H    SER  20           H        SER  20  -6.053   0.961  -6.903
  148    HA   SER  20           HA       SER  20  -7.071   3.684  -6.947
  149   1HB   SER  20          1HB       SER  20  -9.263   2.958  -7.885
  150   2HB   SER  20          2HB       SER  20  -7.940   2.818  -9.042
  151    HG   SER  20           HG       SER  20  -9.025   0.707  -7.482
  152    H    LEU  21           H        LEU  21  -8.994   3.946  -5.586
  153    HA   LEU  21           HA       LEU  21  -8.708   2.746  -3.088
  154   1HB   LEU  21          1HB       LEU  21  -9.778   4.833  -3.171
  155   2HB   LEU  21          2HB       LEU  21 -10.949   4.279  -4.366
  156    HG   LEU  21           HG       LEU  21 -11.910   2.797  -2.561
  157   1HD1  LEU  21          1HD1      LEU  21  -9.630   3.562  -1.182
  158   2HD1  LEU  21          2HD1      LEU  21 -11.024   2.704  -0.526
  159   3HD1  LEU  21          3HD1      LEU  21 -10.934   4.461  -0.407
  160   1HD2  LEU  21          1HD2      LEU  21 -13.388   4.459  -2.703
  161   2HD2  LEU  21          2HD2      LEU  21 -12.124   5.672  -2.907
  162   3HD2  LEU  21          3HD2      LEU  21 -12.593   5.151  -1.288
  163    H    HIS  22           H        HIS  22 -10.011   1.257  -1.945
  164    HA   HIS  22           HA       HIS  22 -11.476  -0.623  -3.679
  165   1HB   HIS  22          1HB       HIS  22  -9.274  -1.380  -2.570
  166   2HB   HIS  22          2HB       HIS  22 -10.192  -1.390  -1.067
  167    HD1  HIS  22           HD1      HIS  22 -10.391  -3.844  -0.635
  168    HD2  HIS  22           HD2      HIS  22 -11.482  -2.825  -4.512
  169    HE1  HIS  22           HE1      HIS  22 -11.340  -5.945  -1.640
  170    H    ASP  23           H        ASP  23 -13.490  -1.259  -3.093
  171    HA   ASP  23           HA       ASP  23 -14.979   0.336  -1.321
  172   1HB   ASP  23          1HB       ASP  23 -15.549  -2.282  -2.695
  173   2HB   ASP  23          2HB       ASP  23 -16.723  -1.531  -1.618
  174    H    SER  24           H        SER  24 -13.099  -2.508  -0.823
  175    HA   SER  24           HA       SER  24 -14.373  -3.193   1.686
  176   1HB   SER  24          1HB       SER  24 -11.756  -4.303   0.684
  177   2HB   SER  24          2HB       SER  24 -12.935  -5.067   1.750
  178    HG   SER  24           HG       SER  24 -14.113  -5.629   0.072
  179    H    MET  25           H        MET  25 -11.367  -1.702   0.582
  180    HA   MET  25           HA       MET  25 -10.242  -1.439   3.190
  181   1HB   MET  25          1HB       MET  25  -8.464  -0.334   2.163
  182   2HB   MET  25          2HB       MET  25  -9.044  -1.413   0.902
  183   1HG   MET  25          1HG       MET  25 -10.133   0.359  -0.235
  184   2HG   MET  25          2HG       MET  25  -9.887   1.461   1.118
  185   1HE   MET  25          1HE       MET  25  -6.389  -0.394  -1.110
  186   2HE   MET  25          2HE       MET  25  -7.944  -1.131  -0.721
  187   3HE   MET  25          3HE       MET  25  -7.782  -0.118  -2.157
  188    H    LYS  26           H        LYS  26  -9.429   1.039   3.606
  189    HA   LYS  26           HA       LYS  26 -11.869   2.690   3.645
  190   1HB   LYS  26          1HB       LYS  26 -10.413   1.624   5.852
  191   2HB   LYS  26          2HB       LYS  26 -10.191   3.369   5.847
  192   1HG   LYS  26          1HG       LYS  26 -12.077   3.165   7.126
  193   2HG   LYS  26          2HG       LYS  26 -12.782   3.407   5.526
  194   1HD   LYS  26          1HD       LYS  26 -12.414   0.671   5.672
  195   2HD   LYS  26          2HD       LYS  26 -12.931   1.109   7.302
  196   1HE   LYS  26          1HE       LYS  26 -14.387   2.145   4.897
  197   2HE   LYS  26          2HE       LYS  26 -14.722   0.534   5.528
  198   1HZ   LYS  26          1HZ       LYS  26 -14.924   3.064   7.071
  199   2HZ   LYS  26          2HZ       LYS  26 -15.263   1.516   7.664
  200   3HZ   LYS  26          3HZ       LYS  26 -16.229   2.186   6.448
  201    H    TYR  27           H        TYR  27  -8.340   2.634   3.650
  202    HA   TYR  27           HA       TYR  27  -8.368   5.258   2.338
  203   1HB   TYR  27          1HB       TYR  27  -7.729   5.198   4.908
  204   2HB   TYR  27          2HB       TYR  27  -6.172   4.675   4.276
  205    HD1  TYR  27           HD1      TYR  27  -8.729   7.344   3.723
  206    HD2  TYR  27           HD2      TYR  27  -4.607   6.290   3.748
  207    HE1  TYR  27           HE1      TYR  27  -8.133   9.687   3.270
  208    HE2  TYR  27           HE2      TYR  27  -4.000   8.630   3.296
  209    HH   TYR  27           HH       TYR  27  -5.301  10.998   3.789
  210    H    LEU  28           H        LEU  28  -6.685   5.621   0.878
  211    HA   LEU  28           HA       LEU  28  -4.996   3.283   0.282
  212   1HB   LEU  28          1HB       LEU  28  -6.760   3.405  -1.358
  213   2HB   LEU  28          2HB       LEU  28  -6.413   5.107  -1.653
  214    HG   LEU  28           HG       LEU  28  -4.330   4.556  -2.717
  215   1HD1  LEU  28          1HD1      LEU  28  -4.684   2.052  -1.312
  216   2HD1  LEU  28          2HD1      LEU  28  -3.226   2.763  -2.005
  217   3HD1  LEU  28          3HD1      LEU  28  -4.305   1.802  -3.016
  218   1HD2  LEU  28          1HD2      LEU  28  -6.564   4.328  -3.940
  219   2HD2  LEU  28          2HD2      LEU  28  -6.312   2.587  -3.814
  220   3HD2  LEU  28          3HD2      LEU  28  -5.147   3.587  -4.683
  221    H    VAL  29           H        VAL  29  -2.887   3.689   0.230
  222    HA   VAL  29           HA       VAL  29  -1.953   6.384  -0.446
  223    HB   VAL  29           HB       VAL  29  -1.073   4.848   2.002
  224   1HG1  VAL  29          1HG1      VAL  29   0.168   7.167   2.298
  225   2HG1  VAL  29          2HG1      VAL  29   0.900   5.829   1.410
  226   3HG1  VAL  29          3HG1      VAL  29   0.113   7.143   0.536
  227   1HG2  VAL  29          1HG2      VAL  29  -1.803   7.343   2.822
  228   2HG2  VAL  29          2HG2      VAL  29  -2.970   7.032   1.537
  229   3HG2  VAL  29          3HG2      VAL  29  -2.835   5.915   2.895
  230    H    TYR  30           H        TYR  30  -0.491   6.246  -2.004
  231    HA   TYR  30           HA       TYR  30   1.591   4.239  -1.917
  232   1HB   TYR  30          1HB       TYR  30   1.099   3.104  -3.889
  233   2HB   TYR  30          2HB       TYR  30  -0.491   3.295  -3.159
  234    HD1  TYR  30           HD1      TYR  30   1.727   4.380  -5.870
  235    HD2  TYR  30           HD2      TYR  30  -2.140   4.774  -4.140
  236    HE1  TYR  30           HE1      TYR  30   0.930   5.486  -7.918
  237    HE2  TYR  30           HE2      TYR  30  -2.948   5.879  -6.183
  238    HH   TYR  30           HH       TYR  30  -0.800   6.392  -8.967
  239    H    GLN  31           H        GLN  31   3.278   4.627  -3.511
  240    HA   GLN  31           HA       GLN  31   3.197   7.240  -4.820
  241   1HB   GLN  31          1HB       GLN  31   5.199   8.028  -3.838
  242   2HB   GLN  31          2HB       GLN  31   4.215   7.443  -2.503
  243   1HG   GLN  31          1HG       GLN  31   5.529   5.515  -2.238
  244   2HG   GLN  31          2HG       GLN  31   6.319   5.744  -3.798
  245   1HE2  GLN  31          1HE2      GLN  31   5.708   8.098  -1.241
  246   2HE2  GLN  31          2HE2      GLN  31   7.368   8.465  -0.935
  247    H    THR  32           H        THR  32   4.805   7.515  -6.464
  248    HA   THR  32           HA       THR  32   5.583   4.965  -7.661
  249    HB   THR  32           HB       THR  32   5.515   7.755  -8.822
  250    HG1  THR  32           HG1      THR  32   3.761   6.880 -10.008
  251   1HG2  THR  32          1HG2      THR  32   6.212   5.126 -10.137
  252   2HG2  THR  32          2HG2      THR  32   7.309   6.479  -9.856
  253   3HG2  THR  32          3HG2      THR  32   5.964   6.653 -10.983
  254    H    GLU  33           H        GLU  33   7.574   4.232  -7.363
  255    HA   GLU  33           HA       GLU  33   9.730   6.168  -6.842
  256   1HB   GLU  33          1HB       GLU  33   9.182   3.409  -5.862
  257   2HB   GLU  33          2HB       GLU  33  10.861   3.889  -6.062
  258   1HG   GLU  33          1HG       GLU  33  10.166   5.969  -4.682
  259   2HG   GLU  33          2HG       GLU  33   8.795   4.971  -4.200
  260    H    GLN  34           H        GLN  34  11.896   5.541  -7.648
  261    HA   GLN  34           HA       GLN  34  11.694   4.725 -10.421
  262   1HB   GLN  34          1HB       GLN  34  13.315   6.509  -9.001
  263   2HB   GLN  34          2HB       GLN  34  14.394   5.211  -9.496
  264   1HG   GLN  34          1HG       GLN  34  12.870   5.763 -11.754
  265   2HG   GLN  34          2HG       GLN  34  13.235   7.339 -11.053
  266   1HE2  GLN  34          1HE2      GLN  34  14.197   6.221 -13.528
  267   2HE2  GLN  34          2HE2      GLN  34  15.919   6.159 -13.411
  268    H    GLY  35           H        GLY  35  12.189   2.777 -11.196
  269   1HA   GLY  35          1HA       GLY  35  13.956   1.031  -9.621
  270   2HA   GLY  35          2HA       GLY  35  12.373   0.438 -10.100
  271    H    GLU  36           H        GLU  36  12.671  -1.030 -11.643
  272    HA   GLU  36           HA       GLU  36  14.801  -1.425 -13.284
  273   1HB   GLU  36          1HB       GLU  36  13.058  -2.382 -14.943
  274   2HB   GLU  36          2HB       GLU  36  13.198  -3.109 -13.348
  275   1HG   GLU  36          1HG       GLU  36  11.257  -1.889 -12.584
  276   2HG   GLU  36          2HG       GLU  36  11.140  -1.058 -14.134
  277    H    ALA  37           H        ALA  37  15.760  -0.337 -14.864
  278    HA   ALA  37           HA       ALA  37  15.120   2.189 -15.705
  279   1HB   ALA  37          1HB       ALA  37  16.453   0.247 -17.564
  280   2HB   ALA  37          2HB       ALA  37  16.759   1.972 -17.357
  281   3HB   ALA  37          3HB       ALA  37  17.254   0.832 -16.106
  282    H    GLY  38           H        GLY  38  13.665   3.081 -17.030
  283   1HA   GLY  38          1HA       GLY  38  12.372   3.185 -19.020
  284   2HA   GLY  38          2HA       GLY  38  12.410   1.430 -19.103
  285    H    ASN  39           H        ASN  39  11.677   1.094 -16.293
  286    HA   ASN  39           HA       ASN  39   8.877   2.004 -16.405
  287   1HB   ASN  39          1HB       ASN  39   9.429  -0.548 -15.014
  288   2HB   ASN  39          2HB       ASN  39   8.066  -0.090 -16.031
  289   1HD2  ASN  39          1HD2      ASN  39  11.410  -1.149 -16.054
  290   2HD2  ASN  39          2HD2      ASN  39  11.377  -1.837 -17.638
  291    H    ILE  40           H        ILE  40   7.823   1.569 -14.134
  292    HA   ILE  40           HA       ILE  40   9.709   2.295 -12.005
  293    HB   ILE  40           HB       ILE  40   7.560   3.750 -11.252
  294   1HG1  ILE  40          1HG1      ILE  40   7.727   4.062 -14.257
  295   2HG1  ILE  40          2HG1      ILE  40   6.410   3.265 -13.404
  296   1HG2  ILE  40          1HG2      ILE  40  10.188   4.221 -12.187
  297   2HG2  ILE  40          2HG2      ILE  40   9.138   5.434 -12.918
  298   3HG2  ILE  40          3HG2      ILE  40   9.188   5.254 -11.164
  299   1HD1  ILE  40          1HD1      ILE  40   6.025   5.653 -14.132
  300   2HD1  ILE  40          2HD1      ILE  40   5.682   5.278 -12.443
  301   3HD1  ILE  40          3HD1      ILE  40   7.172   6.116 -12.875
  302    H    HIS  41           H        HIS  41   8.661   2.147  -9.811
  303    HA   HIS  41           HA       HIS  41   6.649  -0.005  -9.759
  304   1HB   HIS  41          1HB       HIS  41   7.857  -0.688  -7.576
  305   2HB   HIS  41          2HB       HIS  41   8.598  -1.126  -9.112
  306    HD1  HIS  41           HD1      HIS  41  10.977  -1.188  -8.188
  307    HD2  HIS  41           HD2      HIS  41   9.079   2.467  -7.634
  308    HE1  HIS  41           HE1      HIS  41  12.781   0.402  -7.450
  309    H    PHE  42           H        PHE  42   5.328  -0.088  -7.831
  310    HA   PHE  42           HA       PHE  42   4.927   2.589  -6.686
  311   1HB   PHE  42          1HB       PHE  42   3.009   0.264  -6.947
  312   2HB   PHE  42          2HB       PHE  42   2.625   1.799  -6.175
  313    HD1  PHE  42           HD1      PHE  42   4.139   3.547  -8.172
  314    HD2  PHE  42           HD2      PHE  42   1.375   0.346  -8.659
  315    HE1  PHE  42           HE1      PHE  42   3.458   4.470 -10.349
  316    HE2  PHE  42           HE2      PHE  42   0.691   1.263 -10.836
  317    HZ   PHE  42           HZ       PHE  42   1.733   3.327 -11.685
  318    H    GLN  43           H        GLN  43   4.772   2.899  -4.491
  319    HA   GLN  43           HA       GLN  43   5.009   0.597  -2.717
  320   1HB   GLN  43          1HB       GLN  43   7.144   2.570  -3.239
  321   2HB   GLN  43          2HB       GLN  43   6.836   2.219  -1.544
  322   1HG   GLN  43          1HG       GLN  43   8.281   0.548  -1.854
  323   2HG   GLN  43          2HG       GLN  43   6.907  -0.280  -2.584
  324   1HE2  GLN  43          1HE2      GLN  43   9.935  -0.194  -3.029
  325   2HE2  GLN  43          2HE2      GLN  43  10.084  -0.028  -4.742
  326    H    GLY  44           H        GLY  44   4.080   0.898  -0.740
  327   1HA   GLY  44          1HA       GLY  44   3.693   3.241   0.655
  328   2HA   GLY  44          2HA       GLY  44   2.325   3.133  -0.443
  329    H    TYR  45           H        TYR  45   1.221   3.121   1.727
  330    HA   TYR  45           HA       TYR  45   0.990   0.343   2.685
  331   1HB   TYR  45          1HB       TYR  45   0.242   1.449   4.883
  332   2HB   TYR  45          2HB       TYR  45   1.960   1.475   4.501
  333    HD1  TYR  45           HD1      TYR  45  -1.095   3.496   4.765
  334    HD2  TYR  45           HD2      TYR  45   3.088   3.548   3.989
  335    HE1  TYR  45           HE1      TYR  45  -1.086   5.943   5.010
  336    HE2  TYR  45           HE2      TYR  45   3.109   5.995   4.233
  337    HH   TYR  45           HH       TYR  45   1.912   7.782   4.972
  338    H    ILE  46           H        ILE  46  -1.031  -0.492   2.903
  339    HA   ILE  46           HA       ILE  46  -3.298   1.287   2.291
  340    HB   ILE  46           HB       ILE  46  -2.985  -1.562   1.338
  341   1HG1  ILE  46          1HG1      ILE  46  -2.980   0.972  -0.309
  342   2HG1  ILE  46          2HG1      ILE  46  -1.511   0.152   0.210
  343   1HG2  ILE  46          1HG2      ILE  46  -5.117   0.470   0.693
  344   2HG2  ILE  46          2HG2      ILE  46  -5.034  -1.194   0.117
  345   3HG2  ILE  46          3HG2      ILE  46  -5.304  -0.867   1.828
  346   1HD1  ILE  46          1HD1      ILE  46  -2.216  -0.362  -2.113
  347   2HD1  ILE  46          2HD1      ILE  46  -2.059  -1.780  -1.075
  348   3HD1  ILE  46          3HD1      ILE  46  -3.656  -1.137  -1.454
  349    H    GLU  47           H        GLU  47  -4.896   1.241   3.730
  350    HA   GLU  47           HA       GLU  47  -4.872  -0.878   5.761
  351   1HB   GLU  47          1HB       GLU  47  -6.261   1.806   5.827
  352   2HB   GLU  47          2HB       GLU  47  -6.161   0.656   7.153
  353   1HG   GLU  47          1HG       GLU  47  -3.989   1.160   7.617
  354   2HG   GLU  47          2HG       GLU  47  -3.626   1.629   5.957
  355    H    MET  48           H        MET  48  -6.324  -2.442   5.602
  356    HA   MET  48           HA       MET  48  -8.553  -2.220   3.790
  357   1HB   MET  48          1HB       MET  48  -7.592  -4.432   5.603
  358   2HB   MET  48          2HB       MET  48  -9.034  -4.571   4.606
  359   1HG   MET  48          1HG       MET  48  -6.731  -3.679   3.089
  360   2HG   MET  48          2HG       MET  48  -6.460  -5.231   3.878
  361   1HE   MET  48          1HE       MET  48  -9.791  -3.799   1.459
  362   2HE   MET  48          2HE       MET  48  -8.186  -3.078   1.578
  363   3HE   MET  48          3HE       MET  48  -8.576  -4.145   0.228
  364    H    LYS  49           H        LYS  49 -10.665  -3.386   4.758
  365    HA   LYS  49           HA       LYS  49 -11.951  -1.518   6.345
  366   1HB   LYS  49          1HB       LYS  49 -12.681  -3.821   5.001
  367   2HB   LYS  49          2HB       LYS  49 -13.019  -4.217   6.681
  368   1HG   LYS  49          1HG       LYS  49 -14.632  -2.587   6.884
  369   2HG   LYS  49          2HG       LYS  49 -13.974  -1.623   5.560
  370   1HD   LYS  49          1HD       LYS  49 -16.023  -2.621   4.817
  371   2HD   LYS  49          2HD       LYS  49 -14.686  -3.420   3.986
  372   1HE   LYS  49          1HE       LYS  49 -16.070  -5.180   4.639
  373   2HE   LYS  49          2HE       LYS  49 -14.812  -5.154   5.874
  374   1HZ   LYS  49          1HZ       LYS  49 -17.450  -3.832   6.183
  375   2HZ   LYS  49          2HZ       LYS  49 -16.273  -4.057   7.376
  376   3HZ   LYS  49          3HZ       LYS  49 -17.107  -5.389   6.750
  377    H    LYS  50           H        LYS  50 -10.913  -4.775   7.376
  378    HA   LYS  50           HA       LYS  50  -9.730  -3.976   9.772
  379   1HB   LYS  50          1HB       LYS  50 -12.609  -4.031   9.865
  380   2HB   LYS  50          2HB       LYS  50 -11.952  -5.256  10.942
  381   1HG   LYS  50          1HG       LYS  50 -10.711  -3.635  12.161
  382   2HG   LYS  50          2HG       LYS  50 -11.072  -2.380  10.972
  383   1HD   LYS  50          1HD       LYS  50 -13.557  -2.949  11.584
  384   2HD   LYS  50          2HD       LYS  50 -12.831  -3.586  13.062
  385   1HE   LYS  50          1HE       LYS  50 -12.583  -1.535  13.882
  386   2HE   LYS  50          2HE       LYS  50 -11.708  -1.018  12.441
  387   1HZ   LYS  50          1HZ       LYS  50 -14.100  -0.064  13.198
  388   2HZ   LYS  50          2HZ       LYS  50 -14.564  -1.253  12.089
  389   3HZ   LYS  50          3HZ       LYS  50 -13.512  -0.017  11.612
  390    H    ARG  51           H        ARG  51 -12.101  -6.582   9.287
  391    HA   ARG  51           HA       ARG  51 -10.054  -8.539   9.941
  392   1HB   ARG  51          1HB       ARG  51 -12.545  -8.475  10.759
  393   2HB   ARG  51          2HB       ARG  51 -12.869  -9.258   9.218
  394   1HG   ARG  51          1HG       ARG  51 -11.994 -11.216   9.880
  395   2HG   ARG  51          2HG       ARG  51 -10.685 -10.446  10.780
  396   1HD   ARG  51          1HD       ARG  51 -13.330 -10.005  11.941
  397   2HD   ARG  51          2HD       ARG  51 -12.861 -11.703  11.879
  398    HE   ARG  51           HE       ARG  51 -10.795 -10.019  12.923
  399   1HH1  ARG  51          1HH1      ARG  51 -13.719 -11.736  13.712
  400   2HH1  ARG  51          2HH1      ARG  51 -13.325 -11.897  15.392
  401   1HH2  ARG  51          1HH2      ARG  51 -10.266 -10.224  15.132
  402   2HH2  ARG  51          2HH2      ARG  51 -11.361 -11.036  16.198
  403    H    THR  52           H        THR  52  -9.362  -7.407   7.609
  404    HA   THR  52           HA       THR  52 -10.189  -9.332   5.538
  405    HB   THR  52           HB       THR  52  -8.700  -6.891   4.746
  406    HG1  THR  52           HG1      THR  52 -11.481  -6.727   5.293
  407   1HG2  THR  52          1HG2      THR  52  -9.402  -8.443   3.045
  408   2HG2  THR  52          2HG2      THR  52 -10.367  -6.975   2.893
  409   3HG2  THR  52          3HG2      THR  52 -11.061  -8.413   3.642
  410    H    SER  53           H        SER  53  -8.762 -10.894   5.198
  411    HA   SER  53           HA       SER  53  -6.035 -10.679   6.063
  412   1HB   SER  53          1HB       SER  53  -5.956 -12.975   4.762
  413   2HB   SER  53          2HB       SER  53  -6.794 -12.851   6.309
  414    HG   SER  53           HG       SER  53  -7.795 -13.330   3.804
  415    H    LEU  54           H        LEU  54  -4.379 -11.707   4.359
  416    HA   LEU  54           HA       LEU  54  -3.751  -9.729   2.539
  417   1HB   LEU  54          1HB       LEU  54  -2.186 -11.444   3.334
  418   2HB   LEU  54          2HB       LEU  54  -3.034 -12.653   2.373
  419    HG   LEU  54           HG       LEU  54  -2.337 -11.531   0.324
  420   1HD1  LEU  54          1HD1      LEU  54  -2.279  -9.240   1.301
  421   2HD1  LEU  54          2HD1      LEU  54  -0.871  -9.644   0.321
  422   3HD1  LEU  54          3HD1      LEU  54  -0.755  -9.664   2.081
  423   1HD2  LEU  54          1HD2      LEU  54   0.092 -11.960   0.506
  424   2HD2  LEU  54          2HD2      LEU  54  -0.892 -13.257   1.185
  425   3HD2  LEU  54          3HD2      LEU  54  -0.092 -12.103   2.254
  426    H    ALA  55           H        ALA  55  -5.871 -12.471   2.169
  427    HA   ALA  55           HA       ALA  55  -6.044 -12.683  -0.588
  428   1HB   ALA  55          1HB       ALA  55  -8.180 -13.716  -0.262
  429   2HB   ALA  55          2HB       ALA  55  -7.122 -14.199   1.064
  430   3HB   ALA  55          3HB       ALA  55  -8.355 -12.965   1.324
  431    H    GLY  56           H        GLY  56  -7.444 -10.299   1.568
  432   1HA   GLY  56          1HA       GLY  56  -9.268  -9.184  -0.313
  433   2HA   GLY  56          2HA       GLY  56  -8.712  -8.421   1.169
  434    H    MET  57           H        MET  57  -6.000  -8.241   0.720
  435    HA   MET  57           HA       MET  57  -5.889  -5.976  -1.008
  436   1HB   MET  57          1HB       MET  57  -3.660  -7.498   0.355
  437   2HB   MET  57          2HB       MET  57  -3.489  -5.932  -0.426
  438   1HG   MET  57          1HG       MET  57  -5.573  -6.131   1.650
  439   2HG   MET  57          2HG       MET  57  -3.903  -6.249   2.199
  440   1HE   MET  57          1HE       MET  57  -5.350  -3.549  -0.791
  441   2HE   MET  57          2HE       MET  57  -6.453  -4.503   0.201
  442   3HE   MET  57          3HE       MET  57  -6.223  -2.787   0.539
  443    H    LYS  58           H        LYS  58  -4.481  -9.237  -1.153
  444    HA   LYS  58           HA       LYS  58  -3.107  -8.974  -3.561
  445   1HB   LYS  58          1HB       LYS  58  -3.414 -10.971  -1.761
  446   2HB   LYS  58          2HB       LYS  58  -4.419 -11.580  -3.070
  447   1HG   LYS  58          1HG       LYS  58  -2.538 -11.411  -4.609
  448   2HG   LYS  58          2HG       LYS  58  -1.527 -10.772  -3.310
  449   1HD   LYS  58          1HD       LYS  58  -2.887 -13.458  -3.187
  450   2HD   LYS  58          2HD       LYS  58  -1.246 -13.228  -3.794
  451   1HE   LYS  58          1HE       LYS  58  -0.968 -11.955  -1.489
  452   2HE   LYS  58          2HE       LYS  58  -2.305 -13.006  -1.024
  453   1HZ   LYS  58          1HZ       LYS  58  -0.854 -14.632  -0.735
  454   2HZ   LYS  58          2HZ       LYS  58   0.421 -13.641  -1.241
  455   3HZ   LYS  58          3HZ       LYS  58  -0.431 -14.568  -2.372
  456    H    LYS  59           H        LYS  59  -6.501  -9.446  -2.932
  457    HA   LYS  59           HA       LYS  59  -7.334 -10.381  -5.434
  458   1HB   LYS  59          1HB       LYS  59  -8.761 -10.317  -3.410
  459   2HB   LYS  59          2HB       LYS  59  -8.841  -8.565  -3.542
  460   1HG   LYS  59          1HG       LYS  59  -9.611  -9.801  -6.023
  461   2HG   LYS  59          2HG       LYS  59 -10.567 -10.434  -4.681
  462   1HD   LYS  59          1HD       LYS  59 -10.834  -7.951  -4.009
  463   2HD   LYS  59          2HD       LYS  59 -10.322  -7.613  -5.665
  464   1HE   LYS  59          1HE       LYS  59 -12.199  -9.488  -6.123
  465   2HE   LYS  59          2HE       LYS  59 -12.842  -8.768  -4.647
  466   1HZ   LYS  59          1HZ       LYS  59 -11.984  -6.772  -6.483
  467   2HZ   LYS  59          2HZ       LYS  59 -13.502  -6.988  -5.768
  468   3HZ   LYS  59          3HZ       LYS  59 -13.119  -7.801  -7.201
  469    H    LEU  60           H        LEU  60  -6.523  -7.167  -4.321
  470    HA   LEU  60           HA       LEU  60  -7.581  -5.846  -6.649
  471   1HB   LEU  60          1HB       LEU  60  -5.924  -4.977  -4.307
  472   2HB   LEU  60          2HB       LEU  60  -6.186  -3.908  -5.684
  473    HG   LEU  60           HG       LEU  60  -8.707  -4.363  -5.212
  474   1HD1  LEU  60          1HD1      LEU  60  -9.138  -5.684  -3.484
  475   2HD1  LEU  60          2HD1      LEU  60  -8.461  -4.442  -2.431
  476   3HD1  LEU  60          3HD1      LEU  60  -7.434  -5.742  -3.034
  477   1HD2  LEU  60          1HD2      LEU  60  -7.747  -2.684  -3.041
  478   2HD2  LEU  60          2HD2      LEU  60  -8.704  -2.262  -4.461
  479   3HD2  LEU  60          3HD2      LEU  60  -6.945  -2.343  -4.574
  480    H    ILE  61           H        ILE  61  -4.420  -6.922  -5.518
  481    HA   ILE  61           HA       ILE  61  -3.403  -6.589  -8.247
  482    HB   ILE  61           HB       ILE  61  -1.873  -5.731  -5.788
  483   1HG1  ILE  61          1HG1      ILE  61  -2.009  -3.512  -7.289
  484   2HG1  ILE  61          2HG1      ILE  61  -3.522  -4.265  -7.780
  485   1HG2  ILE  61          1HG2      ILE  61  -0.104  -6.183  -7.078
  486   2HG2  ILE  61          2HG2      ILE  61  -1.091  -6.339  -8.530
  487   3HG2  ILE  61          3HG2      ILE  61  -0.567  -4.745  -7.988
  488   1HD1  ILE  61          1HD1      ILE  61  -3.733  -4.517  -5.121
  489   2HD1  ILE  61          2HD1      ILE  61  -2.752  -3.054  -5.213
  490   3HD1  ILE  61          3HD1      ILE  61  -4.318  -3.118  -6.021
  491    HA   PRO  62           HA       PRO  62  -2.484 -10.780  -6.498
  492   1HB   PRO  62          1HB       PRO  62  -3.186 -12.121  -8.751
  493   2HB   PRO  62          2HB       PRO  62  -4.350 -11.669  -7.500
  494   1HG   PRO  62          1HG       PRO  62  -3.751 -10.323 -10.107
  495   2HG   PRO  62          2HG       PRO  62  -5.322 -10.645  -9.348
  496   1HD   PRO  62          1HD       PRO  62  -4.123  -8.219  -9.245
  497   2HD   PRO  62          2HD       PRO  62  -5.151  -8.832  -7.934
  498    H    GLY  63           H        GLY  63  -0.276 -10.668  -6.461
  499   1HA   GLY  63          1HA       GLY  63   1.533 -11.875  -7.739
  500   2HA   GLY  63          2HA       GLY  63   1.109 -10.805  -9.067
  501    H    ALA  64           H        ALA  64   1.233  -9.821  -5.699
  502    HA   ALA  64           HA       ALA  64   3.697  -8.312  -6.265
  503   1HB   ALA  64          1HB       ALA  64   1.124  -7.220  -5.860
  504   2HB   ALA  64          2HB       ALA  64   2.081  -6.853  -4.424
  505   3HB   ALA  64          3HB       ALA  64   2.660  -6.367  -6.018
  506    H    HIS  65           H        HIS  65   4.673  -7.437  -4.178
  507    HA   HIS  65           HA       HIS  65   4.731  -9.628  -2.246
  508   1HB   HIS  65          1HB       HIS  65   6.819  -8.582  -3.350
  509   2HB   HIS  65          2HB       HIS  65   6.569  -7.245  -2.232
  510    HD1  HIS  65           HD1      HIS  65   7.998  -7.467  -0.242
  511    HD2  HIS  65           HD2      HIS  65   6.791 -11.174  -1.679
  512    HE1  HIS  65           HE1      HIS  65   9.040  -9.158   1.301
  513    H    PHE  66           H        PHE  66   3.372  -9.467  -0.591
  514    HA   PHE  66           HA       PHE  66   2.877  -6.806   0.569
  515   1HB   PHE  66          1HB       PHE  66   1.135  -9.145   0.073
  516   2HB   PHE  66          2HB       PHE  66   0.888  -8.319   1.608
  517    HD1  PHE  66           HD1      PHE  66   0.989  -7.805  -2.056
  518    HD2  PHE  66           HD2      PHE  66  -0.292  -6.302   1.715
  519    HE1  PHE  66           HE1      PHE  66  -0.362  -6.095  -3.200
  520    HE2  PHE  66           HE2      PHE  66  -1.646  -4.591   0.577
  521    HZ   PHE  66           HZ       PHE  66  -1.683  -4.487  -1.883
  522    H    GLU  67           H        GLU  67   2.588  -6.707   2.901
  523    HA   GLU  67           HA       GLU  67   3.619  -8.915   4.472
  524   1HB   GLU  67          1HB       GLU  67   5.262  -6.643   3.717
  525   2HB   GLU  67          2HB       GLU  67   5.108  -6.777   5.463
  526   1HG   GLU  67          1HG       GLU  67   5.954  -9.023   5.422
  527   2HG   GLU  67          2HG       GLU  67   5.967  -9.026   3.659
  528    H    LYS  68           H        LYS  68   2.141  -9.071   6.017
  529    HA   LYS  68           HA       LYS  68   0.974  -6.613   7.129
  530   1HB   LYS  68          1HB       LYS  68  -0.530  -8.388   6.128
  531   2HB   LYS  68          2HB       LYS  68  -0.057  -9.431   7.463
  532   1HG   LYS  68          1HG       LYS  68  -0.837  -7.116   8.728
  533   2HG   LYS  68          2HG       LYS  68  -1.974  -7.250   7.385
  534   1HD   LYS  68          1HD       LYS  68  -2.702  -9.387   8.091
  535   2HD   LYS  68          2HD       LYS  68  -1.358  -9.552   9.223
  536   1HE   LYS  68          1HE       LYS  68  -3.165  -7.237   9.604
  537   2HE   LYS  68          2HE       LYS  68  -3.820  -8.830   9.977
  538   1HZ   LYS  68          1HZ       LYS  68  -1.540  -7.436  11.226
  539   2HZ   LYS  68          2HZ       LYS  68  -1.675  -9.120  11.318
  540   3HZ   LYS  68          3HZ       LYS  68  -2.891  -8.137  11.966
  541    H    ARG  69           H        ARG  69   3.584  -8.069   7.801
  542    HA   ARG  69           HA       ARG  69   3.221  -9.029  10.480
  543   1HB   ARG  69          1HB       ARG  69   5.341  -8.948   8.535
  544   2HB   ARG  69          2HB       ARG  69   5.931  -8.358  10.083
  545   1HG   ARG  69          1HG       ARG  69   4.856 -10.466  11.073
  546   2HG   ARG  69          2HG       ARG  69   4.800 -11.045   9.406
  547   1HD   ARG  69          1HD       ARG  69   7.339 -10.243   9.470
  548   2HD   ARG  69          2HD       ARG  69   7.125 -10.581  11.187
  549    HE   ARG  69           HE       ARG  69   6.152 -12.752   9.694
  550   1HH1  ARG  69          1HH1      ARG  69   9.152 -11.191  10.519
  551   2HH1  ARG  69          2HH1      ARG  69  10.094 -12.639  10.384
  552   1HH2  ARG  69          1HH2      ARG  69   7.381 -14.665   9.513
  553   2HH2  ARG  69          2HH2      ARG  69   9.085 -14.615   9.811
  554    H    ARG  70           H        ARG  70   3.051  -6.007   9.235
  555    HA   ARG  70           HA       ARG  70   3.022  -3.932  10.171
  556   1HB   ARG  70          1HB       ARG  70   3.709  -5.178  12.824
  557   2HB   ARG  70          2HB       ARG  70   2.819  -3.694  12.514
  558   1HG   ARG  70          1HG       ARG  70   0.970  -4.885  12.803
  559   2HG   ARG  70          2HG       ARG  70   1.320  -5.639  11.246
  560   1HD   ARG  70          1HD       ARG  70   2.033  -7.570  12.189
  561   2HD   ARG  70          2HD       ARG  70   2.736  -6.753  13.584
  562    HE   ARG  70           HE       ARG  70  -0.132  -6.702  13.566
  563   1HH1  ARG  70          1HH1      ARG  70   2.680  -8.566  14.428
  564   2HH1  ARG  70          2HH1      ARG  70   1.861  -9.475  15.654
  565   1HH2  ARG  70          1HH2      ARG  70  -1.220  -7.893  15.179
  566   2HH2  ARG  70          2HH2      ARG  70  -0.357  -9.093  16.080
  567    H    GLY  71           H        GLY  71   5.250  -4.447   8.851
  568   1HA   GLY  71          1HA       GLY  71   7.629  -4.207  10.434
  569   2HA   GLY  71          2HA       GLY  71   7.522  -4.069   8.685
  570    H    THR  72           H        THR  72   5.259  -2.003   9.746
  571    HA   THR  72           HA       THR  72   6.899   0.199  10.588
  572    HB   THR  72           HB       THR  72   5.555   1.014   8.127
  573    HG1  THR  72           HG1      THR  72   6.374  -1.182   7.637
  574   1HG2  THR  72          1HG2      THR  72   8.131   1.446   9.539
  575   2HG2  THR  72          2HG2      THR  72   6.999   2.618   8.865
  576   3HG2  THR  72          3HG2      THR  72   8.099   1.742   7.801
  577    H    GLN  73           H        GLN  73   4.488  -1.219  11.437
  578    HA   GLN  73           HA       GLN  73   2.127   0.148  10.911
  579   1HB   GLN  73          1HB       GLN  73   2.033  -1.917  12.102
  580   2HB   GLN  73          2HB       GLN  73   3.066  -1.301  13.384
  581   1HG   GLN  73          1HG       GLN  73   0.601   0.224  12.972
  582   2HG   GLN  73          2HG       GLN  73   0.360  -1.442  13.494
  583   1HE2  GLN  73          1HE2      GLN  73   0.190   1.363  14.752
  584   2HE2  GLN  73          2HE2      GLN  73   0.992   1.162  16.269
  585    H    GLY  74           H        GLY  74   2.141   2.337  10.897
  586   1HA   GLY  74          1HA       GLY  74   1.646   4.305  12.133
  587   2HA   GLY  74          2HA       GLY  74   2.550   3.648  13.489
  588    H    GLU  75           H        GLU  75   4.766   2.866  11.624
  589    HA   GLU  75           HA       GLU  75   6.226   5.334  11.832
  590   1HB   GLU  75          1HB       GLU  75   6.848   2.509  11.246
  591   2HB   GLU  75          2HB       GLU  75   7.894   3.685  10.463
  592   1HG   GLU  75          1HG       GLU  75   8.985   4.094  12.346
  593   2HG   GLU  75          2HG       GLU  75   7.486   4.343  13.240
  594    H    ALA  76           H        ALA  76   4.586   3.572   9.329
  595    HA   ALA  76           HA       ALA  76   5.841   4.793   7.098
  596   1HB   ALA  76          1HB       ALA  76   3.022   3.838   6.953
  597   2HB   ALA  76          2HB       ALA  76   4.340   3.646   5.796
  598   3HB   ALA  76          3HB       ALA  76   4.309   2.673   7.266
  599    H    ARG  77           H        ARG  77   3.747   6.021   9.426
  600    HA   ARG  77           HA       ARG  77   2.247   7.831   7.813
  601   1HB   ARG  77          1HB       ARG  77   2.084   6.977  10.409
  602   2HB   ARG  77          2HB       ARG  77   2.711   8.608  10.608
  603   1HG   ARG  77          1HG       ARG  77   0.574   9.235  10.546
  604   2HG   ARG  77          2HG       ARG  77   0.699   8.990   8.803
  605   1HD   ARG  77          1HD       ARG  77  -0.343   6.916   8.894
  606   2HD   ARG  77          2HD       ARG  77   0.007   6.707  10.609
  607    HE   ARG  77           HE       ARG  77  -1.672   8.903  10.386
  608   1HH1  ARG  77          1HH1      ARG  77  -1.775   5.488   9.719
  609   2HH1  ARG  77          2HH1      ARG  77  -3.482   5.354   9.985
  610   1HH2  ARG  77          1HH2      ARG  77  -3.920   8.740  10.740
  611   2HH2  ARG  77          2HH2      ARG  77  -4.701   7.205  10.565
  612    H    ALA  78           H        ALA  78   5.454   7.796   8.973
  613    HA   ALA  78           HA       ALA  78   5.746  10.661   8.341
  614   1HB   ALA  78          1HB       ALA  78   6.908   9.000  10.500
  615   2HB   ALA  78          2HB       ALA  78   7.945  10.234   9.780
  616   3HB   ALA  78          3HB       ALA  78   6.407  10.692  10.512
  617    H    TYR  79           H        TYR  79   7.774   7.728   8.534
  618    HA   TYR  79           HA       TYR  79   9.636   8.619   6.609
  619   1HB   TYR  79          1HB       TYR  79  10.252   6.918   8.215
  620   2HB   TYR  79          2HB       TYR  79   9.007   5.834   7.606
  621    HD1  TYR  79           HD1      TYR  79  11.266   7.893   5.519
  622    HD2  TYR  79           HD2      TYR  79  10.371   4.000   6.983
  623    HE1  TYR  79           HE1      TYR  79  12.885   6.932   3.936
  624    HE2  TYR  79           HE2      TYR  79  11.988   3.028   5.405
  625    HH   TYR  79           HH       TYR  79  13.961   3.711   4.137
  626    H    SER  80           H        SER  80   6.965   6.277   6.379
  627    HA   SER  80           HA       SER  80   5.760   5.507   4.610
  628   1HB   SER  80          1HB       SER  80   6.722   8.125   3.451
  629   2HB   SER  80          2HB       SER  80   5.616   7.052   2.595
  630    HG   SER  80           HG       SER  80   5.022   8.854   4.426
  631    H    MET  81           H        MET  81   8.017   7.096   2.453
  632    HA   MET  81           HA       MET  81   9.227   4.487   1.825
  633   1HB   MET  81          1HB       MET  81   7.759   6.337   0.069
  634   2HB   MET  81          2HB       MET  81   9.297   5.782  -0.578
  635   1HG   MET  81          1HG       MET  81   7.549   4.335  -1.341
  636   2HG   MET  81          2HG       MET  81   8.578   3.456  -0.213
  637   1HE   MET  81          1HE       MET  81   5.859   5.927  -0.314
  638   2HE   MET  81          2HE       MET  81   4.453   4.868  -0.200
  639   3HE   MET  81          3HE       MET  81   5.043   5.709   1.235
  640    H    LYS  82           H        LYS  82  11.119   5.047   0.099
  641    HA   LYS  82           HA       LYS  82  12.964   6.679   1.622
  642   1HB   LYS  82          1HB       LYS  82  13.596   5.302  -0.976
  643   2HB   LYS  82          2HB       LYS  82  14.682   5.691   0.351
  644   1HG   LYS  82          1HG       LYS  82  12.823   4.021   1.515
  645   2HG   LYS  82          2HG       LYS  82  13.054   3.332  -0.093
  646   1HD   LYS  82          1HD       LYS  82  15.618   3.976   0.769
  647   2HD   LYS  82          2HD       LYS  82  14.823   3.314   2.199
  648   1HE   LYS  82          1HE       LYS  82  14.021   1.551   0.307
  649   2HE   LYS  82          2HE       LYS  82  15.607   2.002  -0.318
  650   1HZ   LYS  82          1HZ       LYS  82  15.330   0.064   1.398
  651   2HZ   LYS  82          2HZ       LYS  82  15.374   1.327   2.523
  652   3HZ   LYS  82          3HZ       LYS  82  16.671   1.094   1.463
  653    H    GLU  83           H        GLU  83  13.097   8.792   1.286
  654    HA   GLU  83           HA       GLU  83  12.005  10.125  -0.941
  655   1HB   GLU  83          1HB       GLU  83  13.887  10.972   1.247
  656   2HB   GLU  83          2HB       GLU  83  13.436  12.074  -0.046
  657   1HG   GLU  83          1HG       GLU  83  11.750  12.653   1.283
  658   2HG   GLU  83          2HG       GLU  83  11.008  11.140   0.768
  659    H    ASP  84           H        ASP  84  15.235   8.957  -0.228
  660    HA   ASP  84           HA       ASP  84  16.674  10.311  -2.198
  661   1HB   ASP  84          1HB       ASP  84  17.066   7.941  -0.524
  662   2HB   ASP  84          2HB       ASP  84  17.900   7.845  -2.072
  663    H    THR  85           H        THR  85  14.699   7.410  -2.386
  664    HA   THR  85           HA       THR  85  15.245   7.253  -5.274
  665    HB   THR  85           HB       THR  85  13.815   5.085  -3.782
  666    HG1  THR  85           HG1      THR  85  15.655   5.323  -2.548
  667   1HG2  THR  85          1HG2      THR  85  15.741   5.052  -6.110
  668   2HG2  THR  85          2HG2      THR  85  13.982   5.007  -6.240
  669   3HG2  THR  85          3HG2      THR  85  14.845   3.672  -5.476
  670    H    ARG  86           H        ARG  86  13.163   8.756  -3.395
  671    HA   ARG  86           HA       ARG  86  10.624   7.883  -4.340
  672   1HB   ARG  86          1HB       ARG  86  10.870   9.132  -2.246
  673   2HB   ARG  86          2HB       ARG  86  11.449  10.532  -3.139
  674   1HG   ARG  86          1HG       ARG  86   9.331  10.893  -4.129
  675   2HG   ARG  86          2HG       ARG  86   8.733   9.327  -3.579
  676   1HD   ARG  86          1HD       ARG  86   8.241  10.099  -1.527
  677   2HD   ARG  86          2HD       ARG  86   9.708  11.073  -1.437
  678    HE   ARG  86           HE       ARG  86   7.102  11.932  -2.314
  679   1HH1  ARG  86          1HH1      ARG  86  10.525  12.556  -2.408
  680   2HH1  ARG  86          2HH1      ARG  86  10.341  14.240  -2.771
  681   1HH2  ARG  86          1HH2      ARG  86   6.845  14.147  -2.792
  682   2HH2  ARG  86          2HH2      ARG  86   8.247  15.144  -2.989
  683    H    LEU  87           H        LEU  87   9.788   8.161  -6.292
  684    HA   LEU  87           HA       LEU  87  10.956  10.159  -8.078
  685   1HB   LEU  87          1HB       LEU  87   9.968   7.526  -8.408
  686   2HB   LEU  87          2HB       LEU  87   8.930   8.601  -9.342
  687    HG   LEU  87           HG       LEU  87  11.904   8.211  -9.639
  688   1HD1  LEU  87          1HD1      LEU  87  10.757   6.468 -10.725
  689   2HD1  LEU  87          2HD1      LEU  87  11.147   7.634 -11.988
  690   3HD1  LEU  87          3HD1      LEU  87   9.511   7.558 -11.335
  691   1HD2  LEU  87          1HD2      LEU  87  11.552  10.531  -9.954
  692   2HD2  LEU  87          2HD2      LEU  87  10.066  10.256 -10.863
  693   3HD2  LEU  87          3HD2      LEU  87  11.623   9.816 -11.565
  694    H    GLU  88           H        GLU  88   7.779   9.087  -6.904
  695    HA   GLU  88           HA       GLU  88   6.790  11.814  -7.269
  696   1HB   GLU  88          1HB       GLU  88   6.175   9.862  -9.109
  697   2HB   GLU  88          2HB       GLU  88   4.806   9.789  -8.009
  698   1HG   GLU  88          1HG       GLU  88   4.257  11.288  -9.768
  699   2HG   GLU  88          2HG       GLU  88   4.515  12.240  -8.307
  700    H    GLY  89           H        GLY  89   4.441  11.917  -6.332
  701   1HA   GLY  89          1HA       GLY  89   2.924  11.320  -4.639
  702   2HA   GLY  89          2HA       GLY  89   4.053  10.091  -4.090
  703    HA   PRO  90           HA       PRO  90   3.361   9.784  -2.164
  704   1HB   PRO  90          1HB       PRO  90   1.895  10.493   0.009
  705   2HB   PRO  90          2HB       PRO  90   3.595  10.019   0.110
  706   1HG   PRO  90          1HG       PRO  90   2.391  12.759   0.082
  707   2HG   PRO  90          2HG       PRO  90   3.702  12.123   1.093
  708   1HD   PRO  90          1HD       PRO  90   4.160  13.658  -1.090
  709   2HD   PRO  90          2HD       PRO  90   5.278  12.382  -0.568
  710    H    TRP  91           H        TRP  91   1.009   9.168  -1.929
  711    HA   TRP  91           HA       TRP  91  -0.835  11.182  -2.979
  712   1HB   TRP  91          1HB       TRP  91  -0.155   8.563  -4.303
  713   2HB   TRP  91          2HB       TRP  91  -1.695   9.370  -4.589
  714    HD1  TRP  91           HD1      TRP  91  -0.581  12.372  -4.753
  715    HE1  TRP  91           HE1      TRP  91   0.762  13.090  -6.828
  716    HE3  TRP  91           HE3      TRP  91   0.883   7.761  -6.407
  717    HZ2  TRP  91           HZ2      TRP  91   2.245  11.864  -8.893
  718    HZ3  TRP  91           HZ3      TRP  91   2.262   7.621  -8.440
  719    HH2  TRP  91           HH2      TRP  91   2.927   9.631  -9.656
  720    H    GLU  92           H        GLU  92  -2.770  11.093  -2.025
  721    HA   GLU  92           HA       GLU  92  -3.453   8.651  -0.523
  722   1HB   GLU  92          1HB       GLU  92  -3.846  11.554   0.152
  723   2HB   GLU  92          2HB       GLU  92  -4.839  10.308   0.894
  724   1HG   GLU  92          1HG       GLU  92  -2.838   9.231   1.780
  725   2HG   GLU  92          2HG       GLU  92  -1.837  10.472   1.030
  726    H    TYR  93           H        TYR  93  -5.443   7.778  -0.786
  727    HA   TYR  93           HA       TYR  93  -7.467   9.269  -2.280
  728   1HB   TYR  93          1HB       TYR  93  -6.463   6.526  -3.068
  729   2HB   TYR  93          2HB       TYR  93  -7.880   7.313  -3.754
  730    HD1  TYR  93           HD1      TYR  93  -7.543   9.517  -4.987
  731    HD2  TYR  93           HD2      TYR  93  -4.324   6.938  -3.940
  732    HE1  TYR  93           HE1      TYR  93  -6.124  10.614  -6.670
  733    HE2  TYR  93           HE2      TYR  93  -2.896   8.029  -5.619
  734    HH   TYR  93           HH       TYR  93  -2.892   9.422  -7.407
  735    H    GLY  94           H        GLY  94  -9.610   8.300  -2.154
  736   1HA   GLY  94          1HA       GLY  94 -11.174   6.790  -1.199
  737   2HA   GLY  94          2HA       GLY  94  -9.946   6.290  -0.045
  738    H    GLU  95           H        GLU  95 -11.327   6.577   1.719
  739    HA   GLU  95           HA       GLU  95 -12.903   8.765   2.301
  740   1HB   GLU  95          1HB       GLU  95 -13.050   6.813   3.670
  741   2HB   GLU  95          2HB       GLU  95 -11.359   6.934   4.134
  742   1HG   GLU  95          1HG       GLU  95 -11.753   8.514   5.702
  743   2HG   GLU  95          2HG       GLU  95 -13.086   9.235   4.802
  Start of MODEL    6
    1   1H    ALA   2          1H        ALA   2 -12.361   2.070  21.122
    2    HA   ALA   2           HA       ALA   2 -13.239   1.389  19.020
    3   1HB   ALA   2          1HB       ALA   2 -12.553   2.602  16.966
    4   2HB   ALA   2          2HB       ALA   2 -13.435   3.607  18.116
    5   3HB   ALA   2          3HB       ALA   2 -11.683   3.753  17.981
    6    H    ARG   3           H        ARG   3 -12.249   0.050  17.389
    7    HA   ARG   3           HA       ARG   3  -9.555  -0.779  18.175
    8   1HB   ARG   3          1HB       ARG   3 -11.862  -2.214  17.612
    9   2HB   ARG   3          2HB       ARG   3 -10.880  -2.426  16.169
   10   1HG   ARG   3          1HG       ARG   3  -9.896  -4.089  17.266
   11   2HG   ARG   3          2HG       ARG   3  -9.081  -2.837  18.206
   12   1HD   ARG   3          1HD       ARG   3 -11.035  -2.887  19.781
   13   2HD   ARG   3          2HD       ARG   3 -11.621  -4.299  18.903
   14    HE   ARG   3           HE       ARG   3  -9.448  -4.202  20.783
   15   1HH1  ARG   3          1HH1      ARG   3 -10.828  -5.912  18.082
   16   2HH1  ARG   3          2HH1      ARG   3 -10.057  -7.414  18.472
   17   1HH2  ARG   3          1HH2      ARG   3  -8.427  -6.174  21.306
   18   2HH2  ARG   3          2HH2      ARG   3  -8.692  -7.562  20.306
   19    H    GLN   4           H        GLN   4  -7.862  -0.196  17.000
   20    HA   GLN   4           HA       GLN   4  -8.291   0.804  14.283
   21   1HB   GLN   4          1HB       GLN   4  -6.432   1.412  16.447
   22   2HB   GLN   4          2HB       GLN   4  -5.623   1.210  14.899
   23   1HG   GLN   4          1HG       GLN   4  -7.604   2.795  14.107
   24   2HG   GLN   4          2HG       GLN   4  -7.519   3.294  15.796
   25   1HE2  GLN   4          1HE2      GLN   4  -5.845   4.526  16.479
   26   2HE2  GLN   4          2HE2      GLN   4  -4.597   5.122  15.444
   27    H    VAL   5           H        VAL   5  -7.117   0.053  12.512
   28    HA   VAL   5           HA       VAL   5  -5.996  -2.644  12.864
   29    HB   VAL   5           HB       VAL   5  -6.455  -3.022  10.507
   30   1HG1  VAL   5          1HG1      VAL   5  -8.509  -2.354  12.457
   31   2HG1  VAL   5          2HG1      VAL   5  -9.080  -2.245  10.791
   32   3HG1  VAL   5          3HG1      VAL   5  -8.375  -3.749  11.387
   33   1HG2  VAL   5          1HG2      VAL   5  -8.097  -0.745   9.930
   34   2HG2  VAL   5          2HG2      VAL   5  -6.472  -0.214  10.362
   35   3HG2  VAL   5          3HG2      VAL   5  -6.703  -1.365   9.046
   36    H    ILE   6           H        ILE   6  -4.161  -3.248  11.525
   37    HA   ILE   6           HA       ILE   6  -2.195  -1.116  11.441
   38    HB   ILE   6           HB       ILE   6  -1.829  -4.042  10.788
   39   1HG1  ILE   6          1HG1      ILE   6  -0.626  -3.643  13.207
   40   2HG1  ILE   6          2HG1      ILE   6  -2.028  -2.587  13.344
   41   1HG2  ILE   6          1HG2      ILE   6  -0.035  -1.705  10.906
   42   2HG2  ILE   6          2HG2      ILE   6   0.568  -3.184  11.651
   43   3HG2  ILE   6          3HG2      ILE   6   0.086  -3.185   9.955
   44   1HD1  ILE   6          1HD1      ILE   6  -3.513  -4.425  12.929
   45   2HD1  ILE   6          2HD1      ILE   6  -2.151  -5.501  12.613
   46   3HD1  ILE   6          3HD1      ILE   6  -2.406  -4.854  14.233
   47    H    CYS   7           H        CYS   7  -0.954  -0.574   9.612
   48    HA   CYS   7           HA       CYS   7  -2.432  -0.610   7.152
   49   1HB   CYS   7          1HB       CYS   7  -0.786   0.888   6.315
   50   2HB   CYS   7          2HB       CYS   7  -1.030   1.324   8.002
   51    HG   CYS   7           HG       CYS   7   1.602  -0.494   6.784
   52    H    TRP   8           H        TRP   8  -1.601  -1.358   5.110
   53    HA   TRP   8           HA       TRP   8   0.031  -3.786   5.419
   54   1HB   TRP   8          1HB       TRP   8  -2.047  -3.025   3.362
   55   2HB   TRP   8          2HB       TRP   8  -1.006  -4.438   3.207
   56    HD1  TRP   8           HD1      TRP   8  -3.496  -3.036   5.847
   57    HE1  TRP   8           HE1      TRP   8  -4.775  -5.030   6.854
   58    HE3  TRP   8           HE3      TRP   8  -1.176  -6.839   3.339
   59    HZ2  TRP   8           HZ2      TRP   8  -4.797  -7.843   6.617
   60    HZ3  TRP   8           HZ3      TRP   8  -1.885  -9.152   3.787
   61    HH2  TRP   8           HH2      TRP   8  -3.658  -9.642   5.392
   62    H    CYS   9           H        CYS   9   2.072  -3.581   4.802
   63    HA   CYS   9           HA       CYS   9   2.783  -1.557   2.815
   64   1HB   CYS   9          1HB       CYS   9   5.124  -2.031   3.536
   65   2HB   CYS   9          2HB       CYS   9   4.084  -1.482   4.845
   66    HG   CYS   9           HG       CYS   9   5.913  -3.502   5.695
   67    H    PHE  10           H        PHE  10   3.064  -2.108   0.767
   68    HA   PHE  10           HA       PHE  10   4.158  -4.749   0.127
   69   1HB   PHE  10          1HB       PHE  10   2.460  -5.358  -1.324
   70   2HB   PHE  10          2HB       PHE  10   1.548  -4.541  -0.059
   71    HD1  PHE  10           HD2      PHE  10   1.118  -2.001  -0.435
   72    HD2  PHE  10           HD1      PHE  10   2.153  -4.743  -3.521
   73    HE1  PHE  10           HE2      PHE  10   0.167  -0.470  -2.109
   74    HE2  PHE  10           HE1      PHE  10   1.205  -3.215  -5.201
   75    HZ   PHE  10           HZ       PHE  10   0.209  -1.076  -4.496
   76    H    THR  11           H        THR  11   4.900  -4.886  -2.152
   77    HA   THR  11           HA       THR  11   5.614  -2.266  -3.278
   78    HB   THR  11           HB       THR  11   7.603  -4.515  -3.300
   79    HG1  THR  11           HG1      THR  11   8.526  -3.248  -1.442
   80   1HG2  THR  11          1HG2      THR  11   8.656  -3.003  -4.567
   81   2HG2  THR  11          2HG2      THR  11   8.876  -2.059  -3.094
   82   3HG2  THR  11          3HG2      THR  11   7.499  -1.741  -4.148
   83    H    LEU  12           H        LEU  12   5.014  -2.127  -5.331
   84    HA   LEU  12           HA       LEU  12   4.662  -4.611  -6.867
   85   1HB   LEU  12          1HB       LEU  12   2.611  -3.392  -6.620
   86   2HB   LEU  12          2HB       LEU  12   3.382  -1.900  -7.155
   87    HG   LEU  12           HG       LEU  12   3.454  -2.617  -9.396
   88   1HD1  LEU  12          1HD1      LEU  12   3.237  -5.304  -8.201
   89   2HD1  LEU  12          2HD1      LEU  12   4.149  -4.752  -9.605
   90   3HD1  LEU  12          3HD1      LEU  12   2.421  -5.070  -9.747
   91   1HD2  LEU  12          1HD2      LEU  12   0.902  -3.178  -7.966
   92   2HD2  LEU  12          2HD2      LEU  12   1.017  -3.561  -9.685
   93   3HD2  LEU  12          3HD2      LEU  12   1.292  -1.909  -9.128
   94    H    ASN  13           H        ASN  13   5.997  -5.003  -8.500
   95    HA   ASN  13           HA       ASN  13   7.658  -2.794  -9.507
   96   1HB   ASN  13          1HB       ASN  13   9.172  -4.644 -10.315
   97   2HB   ASN  13          2HB       ASN  13   9.024  -4.517  -8.565
   98   1HD2  ASN  13          1HD2      ASN  13   8.734  -6.523 -11.257
   99   2HD2  ASN  13          2HD2      ASN  13   8.034  -7.893 -10.472
  100    H    ASN  14           H        ASN  14   7.630  -2.245 -11.615
  101    HA   ASN  14           HA       ASN  14   6.793  -2.032 -13.726
  102   1HB   ASN  14          1HB       ASN  14   8.319  -4.106 -13.819
  103   2HB   ASN  14          2HB       ASN  14   6.826  -5.041 -13.858
  104   1HD2  ASN  14          1HD2      ASN  14   9.149  -3.988 -15.764
  105   2HD2  ASN  14          2HD2      ASN  14   8.280  -3.705 -17.230
  106    HA   PRO  15           HA       PRO  15   2.497  -3.233 -12.294
  107   1HB   PRO  15          1HB       PRO  15   1.537  -0.697 -12.169
  108   2HB   PRO  15          2HB       PRO  15   2.345  -1.487 -10.810
  109   1HG   PRO  15          1HG       PRO  15   3.446   0.467 -12.793
  110   2HG   PRO  15          2HG       PRO  15   3.685   0.401 -11.037
  111   1HD   PRO  15          1HD       PRO  15   5.528  -0.521 -12.793
  112   2HD   PRO  15          2HD       PRO  15   5.290  -1.246 -11.191
  113    H    LEU  16           H        LEU  16   0.421  -2.640 -13.397
  114    HA   LEU  16           HA       LEU  16   0.919  -2.023 -16.234
  115   1HB   LEU  16          1HB       LEU  16  -1.061  -3.873 -14.932
  116   2HB   LEU  16          2HB       LEU  16  -1.207  -3.355 -16.610
  117    HG   LEU  16           HG       LEU  16   1.314  -4.312 -16.630
  118   1HD1  LEU  16          1HD1      LEU  16   1.597  -5.215 -14.550
  119   2HD1  LEU  16          2HD1      LEU  16   0.923  -6.604 -15.401
  120   3HD1  LEU  16          3HD1      LEU  16  -0.111  -5.617 -14.368
  121   1HD2  LEU  16          1HD2      LEU  16  -1.240  -5.871 -17.003
  122   2HD2  LEU  16          2HD2      LEU  16   0.345  -6.367 -17.595
  123   3HD2  LEU  16          3HD2      LEU  16  -0.409  -4.899 -18.217
  124    H    SER  17           H        SER  17  -0.407  -0.808 -13.466
  125    HA   SER  17           HA       SER  17  -1.599   1.399 -14.692
  126   1HB   SER  17          1HB       SER  17  -3.351  -0.926 -14.393
  127   2HB   SER  17          2HB       SER  17  -3.992   0.526 -13.624
  128    HG   SER  17           HG       SER  17  -2.945   0.671 -16.227
  129    HA   PRO  18           HA       PRO  18  -1.373   2.966 -10.602
  130   1HB   PRO  18          1HB       PRO  18  -3.396   4.775 -10.551
  131   2HB   PRO  18          2HB       PRO  18  -1.903   5.029 -11.462
  132   1HG   PRO  18          1HG       PRO  18  -4.575   4.085 -12.429
  133   2HG   PRO  18          2HG       PRO  18  -3.464   5.251 -13.172
  134   1HD   PRO  18          1HD       PRO  18  -3.646   2.679 -14.001
  135   2HD   PRO  18          2HD       PRO  18  -2.128   3.599 -14.066
  136    H    LEU  19           H        LEU  19  -2.278   2.866  -8.528
  137    HA   LEU  19           HA       LEU  19  -4.175   0.783  -8.121
  138   1HB   LEU  19          1HB       LEU  19  -3.120   2.786  -6.131
  139   2HB   LEU  19          2HB       LEU  19  -3.911   1.255  -5.760
  140    HG   LEU  19           HG       LEU  19  -1.188   1.653  -6.989
  141   1HD1  LEU  19          1HD1      LEU  19  -0.320   0.798  -4.996
  142   2HD1  LEU  19          2HD1      LEU  19  -1.886   0.183  -4.470
  143   3HD1  LEU  19          3HD1      LEU  19  -1.579   1.919  -4.477
  144   1HD2  LEU  19          1HD2      LEU  19  -1.497  -1.029  -6.389
  145   2HD2  LEU  19          2HD2      LEU  19  -1.497  -0.309  -7.999
  146   3HD2  LEU  19          3HD2      LEU  19  -3.022  -0.588  -7.158
  147    H    SER  20           H        SER  20  -6.073   1.111  -6.601
  148    HA   SER  20           HA       SER  20  -7.392   3.691  -6.852
  149   1HB   SER  20          1HB       SER  20  -8.592   1.153  -7.988
  150   2HB   SER  20          2HB       SER  20  -9.444   2.687  -7.815
  151    HG   SER  20           HG       SER  20  -8.688   2.985  -9.766
  152    H    LEU  21           H        LEU  21  -9.337   3.845  -5.536
  153    HA   LEU  21           HA       LEU  21  -9.001   2.747  -2.979
  154   1HB   LEU  21          1HB       LEU  21 -10.145   4.799  -3.157
  155   2HB   LEU  21          2HB       LEU  21 -11.301   4.143  -4.314
  156    HG   LEU  21           HG       LEU  21 -12.195   2.711  -2.448
  157   1HD1  LEU  21          1HD1      LEU  21 -11.285   4.438  -0.337
  158   2HD1  LEU  21          2HD1      LEU  21  -9.921   3.641  -1.120
  159   3HD1  LEU  21          3HD1      LEU  21 -11.237   2.679  -0.448
  160   1HD2  LEU  21          1HD2      LEU  21 -13.648   4.405  -2.826
  161   2HD2  LEU  21          2HD2      LEU  21 -12.408   5.651  -2.682
  162   3HD2  LEU  21          3HD2      LEU  21 -13.095   4.918  -1.231
  163    H    HIS  22           H        HIS  22 -10.270   1.245  -1.811
  164    HA   HIS  22           HA       HIS  22 -11.684  -0.709  -3.506
  165   1HB   HIS  22          1HB       HIS  22  -9.423  -1.384  -2.454
  166   2HB   HIS  22          2HB       HIS  22 -10.305  -1.432  -0.930
  167    HD1  HIS  22           HD1      HIS  22 -10.432  -3.885  -0.492
  168    HD2  HIS  22           HD2      HIS  22 -11.595  -2.910  -4.359
  169    HE1  HIS  22           HE1      HIS  22 -11.320  -6.018  -1.484
  170    H    ASP  23           H        ASP  23 -13.713  -1.214  -2.958
  171    HA   ASP  23           HA       ASP  23 -15.167   0.272  -1.105
  172   1HB   ASP  23          1HB       ASP  23 -15.852  -2.465  -2.199
  173   2HB   ASP  23          2HB       ASP  23 -16.984  -1.322  -1.482
  174    H    SER  24           H        SER  24 -13.231  -2.546  -0.673
  175    HA   SER  24           HA       SER  24 -14.435  -3.282   1.853
  176   1HB   SER  24          1HB       SER  24 -12.923  -4.640  -0.039
  177   2HB   SER  24          2HB       SER  24 -11.809  -4.436   1.314
  178    HG   SER  24           HG       SER  24 -14.197  -5.872   1.164
  179    H    MET  25           H        MET  25 -11.460  -1.738   0.722
  180    HA   MET  25           HA       MET  25 -10.334  -1.445   3.327
  181   1HB   MET  25          1HB       MET  25  -8.569  -0.327   2.289
  182   2HB   MET  25          2HB       MET  25  -9.137  -1.424   1.038
  183   1HG   MET  25          1HG       MET  25 -10.252   0.326  -0.111
  184   2HG   MET  25          2HG       MET  25 -10.009   1.443   1.230
  185   1HE   MET  25          1HE       MET  25  -6.519  -0.397  -1.026
  186   2HE   MET  25          2HE       MET  25  -8.064  -1.143  -0.618
  187   3HE   MET  25          3HE       MET  25  -7.926  -0.127  -2.054
  188    H    LYS  26           H        LYS  26  -9.543   1.050   3.711
  189    HA   LYS  26           HA       LYS  26 -12.007   2.666   3.758
  190   1HB   LYS  26          1HB       LYS  26 -10.497   1.655   5.956
  191   2HB   LYS  26          2HB       LYS  26 -10.314   3.404   5.926
  192   1HG   LYS  26          1HG       LYS  26 -12.178   3.184   7.231
  193   2HG   LYS  26          2HG       LYS  26 -12.913   3.372   5.637
  194   1HD   LYS  26          1HD       LYS  26 -13.158   0.959   5.445
  195   2HD   LYS  26          2HD       LYS  26 -12.362   0.738   7.005
  196   1HE   LYS  26          1HE       LYS  26 -14.687   2.551   6.990
  197   2HE   LYS  26          2HE       LYS  26 -15.039   0.852   6.677
  198   1HZ   LYS  26          1HZ       LYS  26 -14.223   2.140   9.121
  199   2HZ   LYS  26          2HZ       LYS  26 -13.357   0.727   8.781
  200   3HZ   LYS  26          3HZ       LYS  26 -15.045   0.679   8.890
  201    H    TYR  27           H        TYR  27  -8.480   2.661   3.699
  202    HA   TYR  27           HA       TYR  27  -8.567   5.267   2.356
  203   1HB   TYR  27          1HB       TYR  27  -7.920   5.314   4.898
  204   2HB   TYR  27          2HB       TYR  27  -6.371   4.713   4.317
  205    HD1  TYR  27           HD1      TYR  27  -8.804   7.333   3.205
  206    HD2  TYR  27           HD2      TYR  27  -4.771   6.353   4.139
  207    HE1  TYR  27           HE1      TYR  27  -8.125   9.633   2.657
  208    HE2  TYR  27           HE2      TYR  27  -4.080   8.650   3.595
  209    HH   TYR  27           HH       TYR  27  -6.116  11.181   3.381
  210    H    LEU  28           H        LEU  28  -6.891   5.644   0.883
  211    HA   LEU  28           HA       LEU  28  -5.172   3.325   0.299
  212   1HB   LEU  28          1HB       LEU  28  -6.778   3.226  -1.388
  213   2HB   LEU  28          2HB       LEU  28  -6.855   4.979  -1.544
  214    HG   LEU  28           HG       LEU  28  -4.761   5.030  -2.711
  215   1HD1  LEU  28          1HD1      LEU  28  -4.427   2.420  -1.501
  216   2HD1  LEU  28          2HD1      LEU  28  -3.220   3.524  -2.160
  217   3HD1  LEU  28          3HD1      LEU  28  -4.064   2.402  -3.227
  218   1HD2  LEU  28          1HD2      LEU  28  -6.319   2.728  -3.862
  219   2HD2  LEU  28          2HD2      LEU  28  -5.370   3.941  -4.723
  220   3HD2  LEU  28          3HD2      LEU  28  -6.879   4.399  -3.930
  221    H    VAL  29           H        VAL  29  -3.074   3.778   0.226
  222    HA   VAL  29           HA       VAL  29  -2.203   6.469  -0.538
  223    HB   VAL  29           HB       VAL  29  -1.274   5.040   1.957
  224   1HG1  VAL  29          1HG1      VAL  29   0.664   6.079   1.470
  225   2HG1  VAL  29          2HG1      VAL  29  -0.101   7.208   0.351
  226   3HG1  VAL  29          3HG1      VAL  29  -0.171   7.503   2.088
  227   1HG2  VAL  29          1HG2      VAL  29  -3.188   7.221   1.430
  228   2HG2  VAL  29          2HG2      VAL  29  -3.125   6.061   2.757
  229   3HG2  VAL  29          3HG2      VAL  29  -2.074   7.478   2.773
  230    H    TYR  30           H        TYR  30  -0.719   6.324  -2.075
  231    HA   TYR  30           HA       TYR  30   1.380   4.335  -1.933
  232   1HB   TYR  30          1HB       TYR  30   0.941   3.232  -3.964
  233   2HB   TYR  30          2HB       TYR  30  -0.625   3.307  -3.164
  234    HD1  TYR  30           HD1      TYR  30   1.407   4.613  -5.928
  235    HD2  TYR  30           HD2      TYR  30  -2.410   4.673  -4.050
  236    HE1  TYR  30           HE1      TYR  30   0.454   5.708  -7.914
  237    HE2  TYR  30           HE2      TYR  30  -3.374   5.767  -6.031
  238    HH   TYR  30           HH       TYR  30  -2.477   5.759  -8.757
  239    H    GLN  31           H        GLN  31   3.054   4.689  -3.584
  240    HA   GLN  31           HA       GLN  31   2.984   7.260  -4.946
  241   1HB   GLN  31          1HB       GLN  31   4.876   8.184  -3.898
  242   2HB   GLN  31          2HB       GLN  31   3.892   7.570  -2.577
  243   1HG   GLN  31          1HG       GLN  31   5.302   5.676  -2.301
  244   2HG   GLN  31          2HG       GLN  31   6.183   6.044  -3.783
  245   1HE2  GLN  31          1HE2      GLN  31   8.152   6.676  -3.299
  246   2HE2  GLN  31          2HE2      GLN  31   8.592   7.765  -2.031
  247    H    THR  32           H        THR  32   4.712   7.526  -6.491
  248    HA   THR  32           HA       THR  32   5.564   4.955  -7.581
  249    HB   THR  32           HB       THR  32   5.753   7.710  -8.816
  250    HG1  THR  32           HG1      THR  32   3.962   6.768 -10.109
  251   1HG2  THR  32          1HG2      THR  32   5.979   5.004 -10.135
  252   2HG2  THR  32          2HG2      THR  32   7.363   5.993  -9.670
  253   3HG2  THR  32          3HG2      THR  32   6.224   6.583 -10.881
  254    H    GLU  33           H        GLU  33   7.641   4.302  -7.741
  255    HA   GLU  33           HA       GLU  33   9.738   6.183  -6.884
  256   1HB   GLU  33          1HB       GLU  33   9.180   3.396  -5.949
  257   2HB   GLU  33          2HB       GLU  33  10.841   3.971  -5.988
  258   1HG   GLU  33          1HG       GLU  33   9.583   6.029  -4.732
  259   2HG   GLU  33          2HG       GLU  33   8.657   4.641  -4.163
  260    H    GLN  34           H        GLN  34  11.918   5.588  -7.616
  261    HA   GLN  34           HA       GLN  34  11.823   4.659 -10.365
  262   1HB   GLN  34          1HB       GLN  34  13.418   6.501  -8.882
  263   2HB   GLN  34          2HB       GLN  34  14.482   5.276  -9.561
  264   1HG   GLN  34          1HG       GLN  34  12.756   5.940 -11.635
  265   2HG   GLN  34          2HG       GLN  34  13.139   7.473 -10.854
  266   1HE2  GLN  34          1HE2      GLN  34  13.930   6.142 -13.456
  267   2HE2  GLN  34          2HE2      GLN  34  15.651   6.292 -13.496
  268    H    GLY  35           H        GLY  35  12.495   2.726 -11.061
  269   1HA   GLY  35          1HA       GLY  35  14.297   1.144  -9.371
  270   2HA   GLY  35          2HA       GLY  35  12.743   0.449  -9.807
  271    H    GLU  36           H        GLU  36  12.968  -1.009 -11.357
  272    HA   GLU  36           HA       GLU  36  15.118  -1.528 -12.928
  273   1HB   GLU  36          1HB       GLU  36  13.350  -2.398 -14.638
  274   2HB   GLU  36          2HB       GLU  36  13.469  -3.146 -13.052
  275   1HG   GLU  36          1HG       GLU  36  11.618  -0.899 -13.126
  276   2HG   GLU  36          2HG       GLU  36  11.178  -2.210 -14.220
  277    H    ALA  37           H        ALA  37  16.179  -0.512 -14.490
  278    HA   ALA  37           HA       ALA  37  15.668   2.026 -15.398
  279   1HB   ALA  37          1HB       ALA  37  17.778   0.624 -15.667
  280   2HB   ALA  37          2HB       ALA  37  17.028  -0.016 -17.130
  281   3HB   ALA  37          3HB       ALA  37  17.361   1.711 -16.992
  282    H    GLY  38           H        GLY  38  14.144   2.889 -16.639
  283   1HA   GLY  38          1HA       GLY  38  12.969   3.034 -18.717
  284   2HA   GLY  38          2HA       GLY  38  13.015   1.280 -18.826
  285    H    ASN  39           H        ASN  39  12.155   0.823 -16.105
  286    HA   ASN  39           HA       ASN  39   9.353   1.709 -16.328
  287   1HB   ASN  39          1HB       ASN  39   9.937  -0.787 -14.841
  288   2HB   ASN  39          2HB       ASN  39   8.589  -0.397 -15.905
  289   1HD2  ASN  39          1HD2      ASN  39  11.951  -1.377 -15.801
  290   2HD2  ASN  39          2HD2      ASN  39  11.987  -2.092 -17.373
  291    H    ILE  40           H        ILE  40   8.204   1.320 -14.100
  292    HA   ILE  40           HA       ILE  40   9.965   2.172 -11.909
  293    HB   ILE  40           HB       ILE  40   8.022   3.690 -11.180
  294   1HG1  ILE  40          1HG1      ILE  40   7.390   3.375 -14.122
  295   2HG1  ILE  40          2HG1      ILE  40   6.360   2.895 -12.777
  296   1HG2  ILE  40          1HG2      ILE  40   8.981   5.555 -12.280
  297   2HG2  ILE  40          2HG2      ILE  40  10.279   4.382 -12.065
  298   3HG2  ILE  40          3HG2      ILE  40   9.511   4.567 -13.641
  299   1HD1  ILE  40          1HD1      ILE  40   6.992   5.635 -12.453
  300   2HD1  ILE  40          2HD1      ILE  40   6.475   5.380 -14.120
  301   3HD1  ILE  40          3HD1      ILE  40   5.428   4.893 -12.787
  302    H    HIS  41           H        HIS  41   8.827   2.049  -9.761
  303    HA   HIS  41           HA       HIS  41   6.879  -0.161  -9.729
  304   1HB   HIS  41          1HB       HIS  41   8.029  -0.751  -7.482
  305   2HB   HIS  41          2HB       HIS  41   8.819  -1.224  -8.983
  306    HD1  HIS  41           HD1      HIS  41  11.154  -1.230  -7.910
  307    HD2  HIS  41           HD2      HIS  41   9.216   2.439  -7.696
  308    HE1  HIS  41           HE1      HIS  41  12.914   0.420  -7.199
  309    H    PHE  42           H        PHE  42   5.441  -0.208  -7.916
  310    HA   PHE  42           HA       PHE  42   4.970   2.470  -6.805
  311   1HB   PHE  42          1HB       PHE  42   3.164   0.171  -7.471
  312   2HB   PHE  42          2HB       PHE  42   2.661   1.361  -6.275
  313    HD1  PHE  42           HD1      PHE  42   4.612   1.920  -9.379
  314    HD2  PHE  42           HD2      PHE  42   0.915   2.472  -7.344
  315    HE1  PHE  42           HE1      PHE  42   3.843   3.403 -11.186
  316    HE2  PHE  42           HE2      PHE  42   0.140   3.954  -9.147
  317    HZ   PHE  42           HZ       PHE  42   1.603   4.421 -11.072
  318    H    GLN  43           H        GLN  43   4.727   2.801  -4.627
  319    HA   GLN  43           HA       GLN  43   4.842   0.521  -2.816
  320   1HB   GLN  43          1HB       GLN  43   7.098   2.256  -3.385
  321   2HB   GLN  43          2HB       GLN  43   6.660   2.306  -1.682
  322   1HG   GLN  43          1HG       GLN  43   7.351   0.205  -1.303
  323   2HG   GLN  43          2HG       GLN  43   6.783  -0.378  -2.866
  324   1HE2  GLN  43          1HE2      GLN  43   8.083   0.451  -4.761
  325   2HE2  GLN  43          2HE2      GLN  43   9.800   0.466  -4.573
  326    H    GLY  44           H        GLY  44   3.996   0.923  -0.781
  327   1HA   GLY  44          1HA       GLY  44   3.549   3.323   0.476
  328   2HA   GLY  44          2HA       GLY  44   2.186   3.136  -0.617
  329    H    TYR  45           H        TYR  45   1.091   3.226   1.564
  330    HA   TYR  45           HA       TYR  45   0.889   0.497   2.656
  331   1HB   TYR  45          1HB       TYR  45   0.152   1.677   4.805
  332   2HB   TYR  45          2HB       TYR  45   1.863   1.752   4.398
  333    HD1  TYR  45           HD2      TYR  45   2.845   3.852   3.551
  334    HD2  TYR  45           HD1      TYR  45  -1.203   3.654   4.847
  335    HE1  TYR  45           HE2      TYR  45   2.774   6.307   3.689
  336    HE2  TYR  45           HE1      TYR  45  -1.285   6.108   4.987
  337    HH   TYR  45           HH       TYR  45   1.580   8.084   4.293
  338    H    ILE  46           H        ILE  46  -1.140  -0.317   3.030
  339    HA   ILE  46           HA       ILE  46  -3.427   1.401   2.344
  340    HB   ILE  46           HB       ILE  46  -3.079  -1.451   1.412
  341   1HG1  ILE  46          1HG1      ILE  46  -3.138   1.060  -0.265
  342   2HG1  ILE  46          2HG1      ILE  46  -1.646   0.289   0.261
  343   1HG2  ILE  46          1HG2      ILE  46  -5.404  -0.782   1.922
  344   2HG2  ILE  46          2HG2      ILE  46  -5.247   0.541   0.767
  345   3HG2  ILE  46          3HG2      ILE  46  -5.146  -1.130   0.213
  346   1HD1  ILE  46          1HD1      ILE  46  -2.119  -0.393  -1.975
  347   2HD1  ILE  46          2HD1      ILE  46  -2.378  -1.774  -0.908
  348   3HD1  ILE  46          3HD1      ILE  46  -3.758  -0.873  -1.535
  349    H    GLU  47           H        GLU  47  -5.015   1.339   3.794
  350    HA   GLU  47           HA       GLU  47  -4.936  -0.757   5.848
  351   1HB   GLU  47          1HB       GLU  47  -6.524   1.799   5.979
  352   2HB   GLU  47          2HB       GLU  47  -6.058   0.742   7.304
  353   1HG   GLU  47          1HG       GLU  47  -3.659   1.528   6.128
  354   2HG   GLU  47          2HG       GLU  47  -4.659   2.979   6.160
  355    H    MET  48           H        MET  48  -6.344  -2.359   5.685
  356    HA   MET  48           HA       MET  48  -8.606  -2.181   3.908
  357   1HB   MET  48          1HB       MET  48  -7.590  -4.385   5.704
  358   2HB   MET  48          2HB       MET  48  -9.014  -4.546   4.684
  359   1HG   MET  48          1HG       MET  48  -6.732  -3.583   3.193
  360   2HG   MET  48          2HG       MET  48  -6.398  -5.117   3.993
  361   1HE   MET  48          1HE       MET  48  -9.766  -3.827   1.568
  362   2HE   MET  48          2HE       MET  48  -8.180  -3.059   1.647
  363   3HE   MET  48          3HE       MET  48  -8.564  -4.158   0.321
  364    H    LYS  49           H        LYS  49 -10.676  -3.395   4.892
  365    HA   LYS  49           HA       LYS  49 -11.957  -1.564   6.543
  366   1HB   LYS  49          1HB       LYS  49 -12.681  -3.854   5.141
  367   2HB   LYS  49          2HB       LYS  49 -13.046  -4.250   6.816
  368   1HG   LYS  49          1HG       LYS  49 -14.602  -2.534   7.013
  369   2HG   LYS  49          2HG       LYS  49 -13.966  -1.668   5.613
  370   1HD   LYS  49          1HD       LYS  49 -14.762  -3.519   4.167
  371   2HD   LYS  49          2HD       LYS  49 -15.485  -4.277   5.588
  372   1HE   LYS  49          1HE       LYS  49 -16.583  -1.868   5.826
  373   2HE   LYS  49          2HE       LYS  49 -16.318  -1.856   4.084
  374   1HZ   LYS  49          1HZ       LYS  49 -18.505  -2.824   5.133
  375   2HZ   LYS  49          2HZ       LYS  49 -17.566  -4.225   5.264
  376   3HZ   LYS  49          3HZ       LYS  49 -17.817  -3.514   3.750
  377    H    LYS  50           H        LYS  50 -10.950  -4.866   7.455
  378    HA   LYS  50           HA       LYS  50  -9.723  -4.159   9.860
  379   1HB   LYS  50          1HB       LYS  50 -12.600  -4.177   9.986
  380   2HB   LYS  50          2HB       LYS  50 -11.949  -5.448  11.013
  381   1HG   LYS  50          1HG       LYS  50 -10.674  -3.889  12.274
  382   2HG   LYS  50          2HG       LYS  50 -11.022  -2.590  11.132
  383   1HD   LYS  50          1HD       LYS  50 -13.494  -3.677  12.024
  384   2HD   LYS  50          2HD       LYS  50 -12.488  -3.361  13.439
  385   1HE   LYS  50          1HE       LYS  50 -12.047  -1.072  12.367
  386   2HE   LYS  50          2HE       LYS  50 -13.422  -1.442  11.328
  387   1HZ   LYS  50          1HZ       LYS  50 -14.262  -0.228  13.142
  388   2HZ   LYS  50          2HZ       LYS  50 -13.402  -1.144  14.274
  389   3HZ   LYS  50          3HZ       LYS  50 -14.700  -1.835  13.439
  390    H    ARG  51           H        ARG  51 -12.129  -6.714   9.266
  391    HA   ARG  51           HA       ARG  51 -10.126  -8.725   9.884
  392   1HB   ARG  51          1HB       ARG  51 -12.559  -8.726  10.714
  393   2HB   ARG  51          2HB       ARG  51 -12.980  -9.258   9.092
  394   1HG   ARG  51          1HG       ARG  51 -12.484 -11.348   9.613
  395   2HG   ARG  51          2HG       ARG  51 -10.848 -10.877  10.076
  396   1HD   ARG  51          1HD       ARG  51 -13.183 -10.475  11.917
  397   2HD   ARG  51          2HD       ARG  51 -12.322 -12.012  11.841
  398    HE   ARG  51           HE       ARG  51 -10.460  -9.944  12.194
  399   1HH1  ARG  51          1HH1      ARG  51 -13.011 -11.569  13.918
  400   2HH1  ARG  51          2HH1      ARG  51 -12.317 -11.282  15.479
  401   1HH2  ARG  51          1HH2      ARG  51  -9.536  -9.560  14.244
  402   2HH2  ARG  51          2HH2      ARG  51 -10.341 -10.138  15.663
  403    H    THR  52           H        THR  52  -9.353  -7.505   7.622
  404    HA   THR  52           HA       THR  52 -10.124  -9.353   5.459
  405    HB   THR  52           HB       THR  52  -8.644  -6.894   4.746
  406    HG1  THR  52           HG1      THR  52 -11.305  -6.860   5.757
  407   1HG2  THR  52          1HG2      THR  52 -10.386  -6.897   2.936
  408   2HG2  THR  52          2HG2      THR  52 -11.021  -8.386   3.638
  409   3HG2  THR  52          3HG2      THR  52  -9.380  -8.344   2.993
  410    H    SER  53           H        SER  53  -8.667 -10.881   5.095
  411    HA   SER  53           HA       SER  53  -5.949 -10.626   6.006
  412   1HB   SER  53          1HB       SER  53  -5.822 -12.922   4.712
  413   2HB   SER  53          2HB       SER  53  -6.673 -12.810   6.252
  414    HG   SER  53           HG       SER  53  -8.420 -13.358   5.243
  415    H    LEU  54           H        LEU  54  -4.265 -11.622   4.314
  416    HA   LEU  54           HA       LEU  54  -3.671  -9.636   2.489
  417   1HB   LEU  54          1HB       LEU  54  -2.035 -11.250   3.265
  418   2HB   LEU  54          2HB       LEU  54  -2.883 -12.545   2.422
  419    HG   LEU  54           HG       LEU  54  -2.281 -11.573   0.277
  420   1HD1  LEU  54          1HD1      LEU  54  -0.871  -9.639   0.086
  421   2HD1  LEU  54          2HD1      LEU  54  -0.761  -9.493   1.839
  422   3HD1  LEU  54          3HD1      LEU  54  -2.300  -9.211   1.026
  423   1HD2  LEU  54          1HD2      LEU  54   0.368 -11.533   0.894
  424   2HD2  LEU  54          2HD2      LEU  54  -0.585 -12.995   0.638
  425   3HD2  LEU  54          3HD2      LEU  54  -0.303 -12.401   2.275
  426    H    ALA  55           H        ALA  55  -5.720 -12.432   2.119
  427    HA   ALA  55           HA       ALA  55  -5.872 -12.652  -0.641
  428   1HB   ALA  55          1HB       ALA  55  -6.913 -14.198   1.009
  429   2HB   ALA  55          2HB       ALA  55  -8.184 -13.000   1.261
  430   3HB   ALA  55          3HB       ALA  55  -7.979 -13.748  -0.323
  431    H    GLY  56           H        GLY  56  -7.365 -10.316   1.510
  432   1HA   GLY  56          1HA       GLY  56  -9.191  -9.251  -0.404
  433   2HA   GLY  56          2HA       GLY  56  -8.703  -8.487   1.102
  434    H    MET  57           H        MET  57  -5.942  -8.304   0.651
  435    HA   MET  57           HA       MET  57  -5.861  -5.956  -0.965
  436   1HB   MET  57          1HB       MET  57  -3.692  -7.547   0.406
  437   2HB   MET  57          2HB       MET  57  -3.391  -6.049  -0.464
  438   1HG   MET  57          1HG       MET  57  -5.485  -6.014   1.628
  439   2HG   MET  57          2HG       MET  57  -3.806  -6.125   2.151
  440   1HE   MET  57          1HE       MET  57  -5.508  -3.454  -0.833
  441   2HE   MET  57          2HE       MET  57  -6.439  -4.490   0.248
  442   3HE   MET  57          3HE       MET  57  -6.235  -2.779   0.626
  443    H    LYS  58           H        LYS  58  -4.434  -9.198  -1.285
  444    HA   LYS  58           HA       LYS  58  -3.111  -8.805  -3.706
  445   1HB   LYS  58          1HB       LYS  58  -2.920 -11.146  -3.846
  446   2HB   LYS  58          2HB       LYS  58  -2.989 -10.807  -2.122
  447   1HG   LYS  58          1HG       LYS  58  -5.349 -11.418  -2.088
  448   2HG   LYS  58          2HG       LYS  58  -5.293 -11.743  -3.822
  449   1HD   LYS  58          1HD       LYS  58  -5.118 -13.809  -2.526
  450   2HD   LYS  58          2HD       LYS  58  -3.642 -13.504  -3.444
  451   1HE   LYS  58          1HE       LYS  58  -2.407 -13.058  -1.570
  452   2HE   LYS  58          2HE       LYS  58  -3.799 -12.478  -0.658
  453   1HZ   LYS  58          1HZ       LYS  58  -3.838 -15.291  -1.378
  454   2HZ   LYS  58          2HZ       LYS  58  -4.293 -14.536   0.066
  455   3HZ   LYS  58          3HZ       LYS  58  -2.659 -14.843  -0.250
  456    H    LYS  59           H        LYS  59  -6.481  -9.418  -3.027
  457    HA   LYS  59           HA       LYS  59  -7.366 -10.255  -5.531
  458   1HB   LYS  59          1HB       LYS  59  -8.543  -9.295  -3.092
  459   2HB   LYS  59          2HB       LYS  59  -9.359  -8.557  -4.464
  460   1HG   LYS  59          1HG       LYS  59  -9.624 -10.870  -5.414
  461   2HG   LYS  59          2HG       LYS  59  -9.049 -11.486  -3.863
  462   1HD   LYS  59          1HD       LYS  59 -10.981 -10.987  -2.803
  463   2HD   LYS  59          2HD       LYS  59 -11.218  -9.495  -3.717
  464   1HE   LYS  59          1HE       LYS  59 -11.468 -11.703  -5.498
  465   2HE   LYS  59          2HE       LYS  59 -12.472 -12.011  -4.082
  466   1HZ   LYS  59          1HZ       LYS  59 -13.722 -10.111  -4.458
  467   2HZ   LYS  59          2HZ       LYS  59 -13.479 -10.712  -6.020
  468   3HZ   LYS  59          3HZ       LYS  59 -12.560  -9.405  -5.465
  469    H    LEU  60           H        LEU  60  -6.541  -7.063  -4.363
  470    HA   LEU  60           HA       LEU  60  -7.639  -5.710  -6.660
  471   1HB   LEU  60          1HB       LEU  60  -6.002  -4.855  -4.299
  472   2HB   LEU  60          2HB       LEU  60  -6.290  -3.764  -5.653
  473    HG   LEU  60           HG       LEU  60  -8.798  -4.272  -5.192
  474   1HD1  LEU  60          1HD1      LEU  60  -8.550  -4.436  -2.413
  475   2HD1  LEU  60          2HD1      LEU  60  -7.508  -5.703  -3.060
  476   3HD1  LEU  60          3HD1      LEU  60  -9.213  -5.651  -3.506
  477   1HD2  LEU  60          1HD2      LEU  60  -7.871  -2.647  -2.966
  478   2HD2  LEU  60          2HD2      LEU  60  -8.832  -2.197  -4.375
  479   3HD2  LEU  60          3HD2      LEU  60  -7.072  -2.243  -4.486
  480    H    ILE  61           H        ILE  61  -4.465  -6.758  -5.544
  481    HA   ILE  61           HA       ILE  61  -3.443  -6.334  -8.259
  482    HB   ILE  61           HB       ILE  61  -1.938  -5.532  -5.766
  483   1HG1  ILE  61          1HG1      ILE  61  -2.097  -3.290  -7.279
  484   2HG1  ILE  61          2HG1      ILE  61  -3.634  -4.047  -7.683
  485   1HG2  ILE  61          1HG2      ILE  61  -1.129  -6.049  -8.522
  486   2HG2  ILE  61          2HG2      ILE  61  -0.617  -4.475  -7.917
  487   3HG2  ILE  61          3HG2      ILE  61  -0.157  -5.943  -7.055
  488   1HD1  ILE  61          1HD1      ILE  61  -2.793  -2.704  -5.250
  489   2HD1  ILE  61          2HD1      ILE  61  -4.412  -3.039  -5.863
  490   3HD1  ILE  61          3HD1      ILE  61  -3.541  -4.272  -4.952
  491    HA   PRO  62           HA       PRO  62  -2.483 -10.568  -6.640
  492   1HB   PRO  62          1HB       PRO  62  -3.154 -11.843  -8.941
  493   2HB   PRO  62          2HB       PRO  62  -4.332 -11.445  -7.685
  494   1HG   PRO  62          1HG       PRO  62  -3.732 -10.009 -10.242
  495   2HG   PRO  62          2HG       PRO  62  -5.303 -10.373  -9.505
  496   1HD   PRO  62          1HD       PRO  62  -4.135  -7.938  -9.315
  497   2HD   PRO  62          2HD       PRO  62  -5.164  -8.606  -8.032
  498    H    GLY  63           H        GLY  63  -0.292 -10.563  -6.587
  499   1HA   GLY  63          1HA       GLY  63   1.549 -11.655  -7.870
  500   2HA   GLY  63          2HA       GLY  63   1.114 -10.576  -9.188
  501    H    ALA  64           H        ALA  64   1.338  -9.777  -5.752
  502    HA   ALA  64           HA       ALA  64   3.740  -8.181  -6.308
  503   1HB   ALA  64          1HB       ALA  64   2.419  -6.363  -6.322
  504   2HB   ALA  64          2HB       ALA  64   1.093  -7.192  -5.505
  505   3HB   ALA  64          3HB       ALA  64   2.446  -6.556  -4.569
  506    H    HIS  65           H        HIS  65   4.719  -7.347  -4.216
  507    HA   HIS  65           HA       HIS  65   4.761  -9.556  -2.306
  508   1HB   HIS  65          1HB       HIS  65   6.856  -8.505  -3.398
  509   2HB   HIS  65          2HB       HIS  65   6.611  -7.184  -2.259
  510    HD1  HIS  65           HD1      HIS  65   8.245 -10.381  -2.573
  511    HD2  HIS  65           HD2      HIS  65   6.608  -8.172   0.543
  512    HE1  HIS  65           HE1      HIS  65   9.225 -11.354  -0.472
  513    H    PHE  66           H        PHE  66   3.410  -9.408  -0.646
  514    HA   PHE  66           HA       PHE  66   2.923  -6.755   0.539
  515   1HB   PHE  66          1HB       PHE  66   1.170  -9.082   0.021
  516   2HB   PHE  66          2HB       PHE  66   0.924  -8.265   1.561
  517    HD1  PHE  66           HD1      PHE  66   1.036  -7.727  -2.100
  518    HD2  PHE  66           HD2      PHE  66  -0.247  -6.244   1.677
  519    HE1  PHE  66           HE1      PHE  66  -0.303  -6.004  -3.236
  520    HE2  PHE  66           HE2      PHE  66  -1.589  -4.519   0.548
  521    HZ   PHE  66           HZ       PHE  66  -1.619  -4.398  -1.912
  522    H    GLU  67           H        GLU  67   2.640  -6.674   2.870
  523    HA   GLU  67           HA       GLU  67   3.653  -8.905   4.421
  524   1HB   GLU  67          1HB       GLU  67   5.312  -6.636   3.689
  525   2HB   GLU  67          2HB       GLU  67   5.158  -6.790   5.433
  526   1HG   GLU  67          1HG       GLU  67   5.670  -9.340   4.824
  527   2HG   GLU  67          2HG       GLU  67   6.497  -8.551   3.481
  528    H    LYS  68           H        LYS  68   2.163  -9.065   5.955
  529    HA   LYS  68           HA       LYS  68   1.014  -6.610   7.090
  530   1HB   LYS  68          1HB       LYS  68  -0.488  -8.389   6.073
  531   2HB   LYS  68          2HB       LYS  68  -0.034  -9.420   7.423
  532   1HG   LYS  68          1HG       LYS  68  -0.807  -7.146   8.705
  533   2HG   LYS  68          2HG       LYS  68  -1.895  -7.169   7.316
  534   1HD   LYS  68          1HD       LYS  68  -2.816  -9.228   7.923
  535   2HD   LYS  68          2HD       LYS  68  -1.465  -9.622   8.989
  536   1HE   LYS  68          1HE       LYS  68  -2.238  -7.553  10.335
  537   2HE   LYS  68          2HE       LYS  68  -3.748  -7.735   9.443
  538   1HZ   LYS  68          1HZ       LYS  68  -2.804 -10.199  10.569
  539   2HZ   LYS  68          2HZ       LYS  68  -4.332  -9.480  10.672
  540   3HZ   LYS  68          3HZ       LYS  68  -3.107  -9.020  11.744
  541    H    ARG  69           H        ARG  69   3.621  -8.057   7.754
  542    HA   ARG  69           HA       ARG  69   3.277  -9.078  10.405
  543   1HB   ARG  69          1HB       ARG  69   5.424  -8.824   8.486
  544   2HB   ARG  69          2HB       ARG  69   5.961  -8.327  10.085
  545   1HG   ARG  69          1HG       ARG  69   5.155 -10.475  10.990
  546   2HG   ARG  69          2HG       ARG  69   4.721 -10.970   9.352
  547   1HD   ARG  69          1HD       ARG  69   7.130 -10.555   8.722
  548   2HD   ARG  69          2HD       ARG  69   7.464 -10.386  10.445
  549    HE   ARG  69           HE       ARG  69   6.117 -12.804  10.037
  550   1HH1  ARG  69          1HH1      ARG  69   9.179 -11.314   9.313
  551   2HH1  ARG  69          2HH1      ARG  69  10.051 -12.811   9.293
  552   1HH2  ARG  69          1HH2      ARG  69   7.253 -14.782  10.014
  553   2HH2  ARG  69          2HH2      ARG  69   8.954 -14.783   9.692
  554    H    ARG  70           H        ARG  70   3.042  -6.022   9.229
  555    HA   ARG  70           HA       ARG  70   2.952  -3.970  10.210
  556   1HB   ARG  70          1HB       ARG  70   3.544  -5.304  12.847
  557   2HB   ARG  70          2HB       ARG  70   2.684  -3.797  12.563
  558   1HG   ARG  70          1HG       ARG  70   0.777  -4.913  12.608
  559   2HG   ARG  70          2HG       ARG  70   1.283  -5.796  11.166
  560   1HD   ARG  70          1HD       ARG  70   2.673  -7.064  13.158
  561   2HD   ARG  70          2HD       ARG  70   1.153  -6.660  13.955
  562    HE   ARG  70           HE       ARG  70   0.458  -7.756  11.527
  563   1HH1  ARG  70          1HH1      ARG  70   2.239  -8.768  14.342
  564   2HH1  ARG  70          2HH1      ARG  70   1.834 -10.443  14.156
  565   1HH2  ARG  70          1HH2      ARG  70  -0.082  -9.957  11.272
  566   2HH2  ARG  70          2HH2      ARG  70   0.515 -11.118  12.409
  567    H    GLY  71           H        GLY  71   5.329  -4.698   9.035
  568   1HA   GLY  71          1HA       GLY  71   7.593  -4.342  10.713
  569   2HA   GLY  71          2HA       GLY  71   7.575  -4.211   8.961
  570    H    THR  72           H        THR  72   5.273  -2.141   9.668
  571    HA   THR  72           HA       THR  72   6.842   0.077  10.662
  572    HB   THR  72           HB       THR  72   6.205   1.456   8.574
  573    HG1  THR  72           HG1      THR  72   5.978  -1.210   7.607
  574   1HG2  THR  72          1HG2      THR  72   8.298  -0.546   7.884
  575   2HG2  THR  72          2HG2      THR  72   8.515   0.417   9.345
  576   3HG2  THR  72          3HG2      THR  72   8.342   1.213   7.781
  577    H    GLN  73           H        GLN  73   4.472  -1.251  11.541
  578    HA   GLN  73           HA       GLN  73   2.079  -0.040  10.831
  579   1HB   GLN  73          1HB       GLN  73   1.348  -0.615  13.178
  580   2HB   GLN  73          2HB       GLN  73   2.007  -1.950  12.242
  581   1HG   GLN  73          1HG       GLN  73   3.610  -2.308  13.727
  582   2HG   GLN  73          2HG       GLN  73   4.077  -0.608  13.732
  583   1HE2  GLN  73          1HE2      GLN  73   2.298  -3.090  15.316
  584   2HE2  GLN  73          2HE2      GLN  73   1.824  -2.170  16.699
  585    H    GLY  74           H        GLY  74   2.007   2.132  10.569
  586   1HA   GLY  74          1HA       GLY  74   1.499   4.249  11.439
  587   2HA   GLY  74          2HA       GLY  74   2.154   3.745  12.990
  588    H    GLU  75           H        GLU  75   4.531   2.728  11.222
  589    HA   GLU  75           HA       GLU  75   6.132   5.077  11.651
  590   1HB   GLU  75          1HB       GLU  75   6.812   2.586  11.916
  591   2HB   GLU  75          2HB       GLU  75   7.066   2.633  10.178
  592   1HG   GLU  75          1HG       GLU  75   9.164   3.046  11.125
  593   2HG   GLU  75          2HG       GLU  75   8.577   4.620  10.589
  594    H    ALA  76           H        ALA  76   4.551   3.552   8.960
  595    HA   ALA  76           HA       ALA  76   6.023   4.812   6.884
  596   1HB   ALA  76          1HB       ALA  76   4.562   2.763   6.671
  597   2HB   ALA  76          2HB       ALA  76   3.178   3.857   6.685
  598   3HB   ALA  76          3HB       ALA  76   4.382   3.976   5.402
  599    H    ARG  77           H        ARG  77   3.836   6.027   9.132
  600    HA   ARG  77           HA       ARG  77   2.558   8.003   7.513
  601   1HB   ARG  77          1HB       ARG  77   1.895   7.018   9.860
  602   2HB   ARG  77          2HB       ARG  77   2.901   8.326  10.467
  603   1HG   ARG  77          1HG       ARG  77   1.025   9.532  10.394
  604   2HG   ARG  77          2HG       ARG  77   1.336   9.630   8.660
  605   1HD   ARG  77          1HD       ARG  77  -0.258   8.055   8.148
  606   2HD   ARG  77          2HD       ARG  77  -0.148   7.277   9.727
  607    HE   ARG  77           HE       ARG  77  -1.193   9.917   9.927
  608   1HH1  ARG  77          1HH1      ARG  77  -2.024   6.647   9.072
  609   2HH1  ARG  77          2HH1      ARG  77  -3.705   6.837   9.448
  610   1HH2  ARG  77          1HH2      ARG  77  -3.403  10.180  10.425
  611   2HH2  ARG  77          2HH2      ARG  77  -4.488   8.848  10.217
  612    H    ALA  78           H        ALA  78   5.649   7.720   8.917
  613    HA   ALA  78           HA       ALA  78   6.124  10.607   8.555
  614   1HB   ALA  78          1HB       ALA  78   8.109  10.196  10.097
  615   2HB   ALA  78          2HB       ALA  78   6.504  10.156  10.827
  616   3HB   ALA  78          3HB       ALA  78   7.350   8.649  10.475
  617    H    TYR  79           H        TYR  79   7.672   7.412   8.286
  618    HA   TYR  79           HA       TYR  79   9.715   8.476   6.526
  619   1HB   TYR  79          1HB       TYR  79  10.481   6.821   8.054
  620   2HB   TYR  79          2HB       TYR  79   9.168   5.725   7.639
  621    HD1  TYR  79           HD1      TYR  79  11.434   7.627   5.377
  622    HD2  TYR  79           HD2      TYR  79  10.239   3.814   6.838
  623    HE1  TYR  79           HE1      TYR  79  12.876   6.542   3.706
  624    HE2  TYR  79           HE2      TYR  79  11.678   2.718   5.171
  625    HH   TYR  79           HH       TYR  79  12.627   3.432   2.807
  626    H    SER  80           H        SER  80   6.825   6.489   6.325
  627    HA   SER  80           HA       SER  80   5.690   5.585   4.563
  628   1HB   SER  80          1HB       SER  80   5.873   7.210   2.454
  629   2HB   SER  80          2HB       SER  80   4.945   7.649   3.888
  630    HG   SER  80           HG       SER  80   6.296   9.212   4.240
  631    H    MET  81           H        MET  81   7.879   7.089   2.307
  632    HA   MET  81           HA       MET  81   8.998   4.437   1.673
  633   1HB   MET  81          1HB       MET  81   7.731   6.473  -0.044
  634   2HB   MET  81          2HB       MET  81   9.215   5.778  -0.681
  635   1HG   MET  81          1HG       MET  81   7.215   4.599  -1.457
  636   2HG   MET  81          2HG       MET  81   8.293   3.559  -0.530
  637   1HE   MET  81          1HE       MET  81   4.553   5.170  -0.530
  638   2HE   MET  81          2HE       MET  81   4.501   5.473   1.207
  639   3HE   MET  81          3HE       MET  81   5.729   6.255   0.211
  640    H    LYS  82           H        LYS  82  10.986   4.862   0.068
  641    HA   LYS  82           HA       LYS  82  12.868   6.401   1.652
  642   1HB   LYS  82          1HB       LYS  82  13.034   4.031   0.213
  643   2HB   LYS  82          2HB       LYS  82  13.933   5.180  -0.770
  644   1HG   LYS  82          1HG       LYS  82  14.544   5.262   2.100
  645   2HG   LYS  82          2HG       LYS  82  14.980   3.762   1.279
  646   1HD   LYS  82          1HD       LYS  82  16.730   4.734   0.303
  647   2HD   LYS  82          2HD       LYS  82  15.722   6.044  -0.316
  648   1HE   LYS  82          1HE       LYS  82  16.395   7.457   1.283
  649   2HE   LYS  82          2HE       LYS  82  16.231   6.240   2.548
  650   1HZ   LYS  82          1HZ       LYS  82  18.550   6.740   0.782
  651   2HZ   LYS  82          2HZ       LYS  82  18.376   5.289   1.634
  652   3HZ   LYS  82          3HZ       LYS  82  18.495   6.754   2.473
  653    H    GLU  83           H        GLU  83  13.488   8.401   1.181
  654    HA   GLU  83           HA       GLU  83  12.464   9.842  -1.009
  655   1HB   GLU  83          1HB       GLU  83  14.642  10.404   0.989
  656   2HB   GLU  83          2HB       GLU  83  14.284  11.532  -0.311
  657   1HG   GLU  83          1HG       GLU  83  12.537  12.350   0.775
  658   2HG   GLU  83          2HG       GLU  83  11.876  10.740   1.056
  659    H    ASP  84           H        ASP  84  15.489   8.140  -0.506
  660    HA   ASP  84           HA       ASP  84  16.963   9.168  -2.644
  661   1HB   ASP  84          1HB       ASP  84  17.749   7.619  -0.767
  662   2HB   ASP  84          2HB       ASP  84  17.106   6.296  -1.737
  663    H    THR  85           H        THR  85  14.519   6.646  -2.533
  664    HA   THR  85           HA       THR  85  14.782   6.293  -5.443
  665    HB   THR  85           HB       THR  85  13.230   4.260  -4.937
  666    HG1  THR  85           HG1      THR  85  14.517   4.224  -2.449
  667   1HG2  THR  85          1HG2      THR  85  16.159   4.549  -4.504
  668   2HG2  THR  85          2HG2      THR  85  15.283   3.623  -5.723
  669   3HG2  THR  85          3HG2      THR  85  15.405   3.015  -4.072
  670    H    ARG  86           H        ARG  86  13.158   8.209  -3.495
  671    HA   ARG  86           HA       ARG  86  10.439   7.752  -4.252
  672   1HB   ARG  86          1HB       ARG  86  11.165   8.950  -2.171
  673   2HB   ARG  86          2HB       ARG  86  11.666  10.297  -3.184
  674   1HG   ARG  86          1HG       ARG  86   9.550  10.990  -3.552
  675   2HG   ARG  86          2HG       ARG  86   8.895   9.351  -3.544
  676   1HD   ARG  86          1HD       ARG  86   8.066   9.915  -1.539
  677   2HD   ARG  86          2HD       ARG  86   9.707   9.626  -0.962
  678    HE   ARG  86           HE       ARG  86   9.975  11.889  -0.664
  679   1HH1  ARG  86          1HH1      ARG  86   7.089  11.284  -2.515
  680   2HH1  ARG  86          2HH1      ARG  86   6.527  12.920  -2.418
  681   1HH2  ARG  86          1HH2      ARG  86   9.245  14.046  -0.529
  682   2HH2  ARG  86          2HH2      ARG  86   7.754  14.490  -1.289
  683    H    LEU  87           H        LEU  87   9.556   8.181  -6.155
  684    HA   LEU  87           HA       LEU  87  10.871  10.133  -7.917
  685   1HB   LEU  87          1HB       LEU  87   9.906   7.520  -8.350
  686   2HB   LEU  87          2HB       LEU  87   8.838   8.608  -9.235
  687    HG   LEU  87           HG       LEU  87  11.814   8.277  -9.579
  688   1HD1  LEU  87          1HD1      LEU  87  11.199   7.614 -11.842
  689   2HD1  LEU  87          2HD1      LEU  87   9.493   7.830 -11.452
  690   3HD1  LEU  87          3HD1      LEU  87  10.429   6.571 -10.645
  691   1HD2  LEU  87          1HD2      LEU  87  11.448   9.949 -11.458
  692   2HD2  LEU  87          2HD2      LEU  87  11.473  10.593  -9.816
  693   3HD2  LEU  87          3HD2      LEU  87   9.936  10.365 -10.651
  694    H    GLU  88           H        GLU  88   7.566   8.933  -7.287
  695    HA   GLU  88           HA       GLU  88   6.628  11.718  -7.501
  696   1HB   GLU  88          1HB       GLU  88   6.003   9.653  -9.246
  697   2HB   GLU  88          2HB       GLU  88   4.615   9.719  -8.168
  698   1HG   GLU  88          1HG       GLU  88   4.066  11.880  -8.795
  699   2HG   GLU  88          2HG       GLU  88   5.680  12.214  -9.421
  700    H    GLY  89           H        GLY  89   4.278  11.847  -6.571
  701   1HA   GLY  89          1HA       GLY  89   2.759  11.307  -4.863
  702   2HA   GLY  89          2HA       GLY  89   3.887  10.095  -4.273
  703    HA   PRO  90           HA       PRO  90   3.189   9.850  -2.339
  704   1HB   PRO  90          1HB       PRO  90   1.720  10.630  -0.194
  705   2HB   PRO  90          2HB       PRO  90   3.419  10.157  -0.074
  706   1HG   PRO  90          1HG       PRO  90   2.219  12.897  -0.191
  707   2HG   PRO  90          2HG       PRO  90   3.526  12.292   0.843
  708   1HD   PRO  90          1HD       PRO  90   3.991  13.755  -1.388
  709   2HD   PRO  90          2HD       PRO  90   5.107  12.495  -0.823
  710    H    TRP  91           H        TRP  91   0.803   9.288  -2.001
  711    HA   TRP  91           HA       TRP  91  -1.018  11.257  -3.161
  712   1HB   TRP  91          1HB       TRP  91  -0.331   8.593  -4.380
  713   2HB   TRP  91          2HB       TRP  91  -1.898   9.345  -4.667
  714    HD1  TRP  91           HD1      TRP  91  -0.960  12.352  -5.041
  715    HE1  TRP  91           HE1      TRP  91   0.356  13.020  -7.150
  716    HE3  TRP  91           HE3      TRP  91   0.809   7.748  -6.388
  717    HZ2  TRP  91           HZ2      TRP  91   1.934  11.762  -9.123
  718    HZ3  TRP  91           HZ3      TRP  91   2.214   7.567  -8.399
  719    HH2  TRP  91           HH2      TRP  91   2.764   9.533  -9.738
  720    H    GLU  92           H        GLU  92  -3.026  11.161  -2.325
  721    HA   GLU  92           HA       GLU  92  -3.667   8.847  -0.615
  722   1HB   GLU  92          1HB       GLU  92  -4.090  11.785  -0.208
  723   2HB   GLU  92          2HB       GLU  92  -5.184  10.636   0.550
  724   1HG   GLU  92          1HG       GLU  92  -3.484   9.707   1.861
  725   2HG   GLU  92          2HG       GLU  92  -2.213  10.433   0.879
  726    H    TYR  93           H        TYR  93  -5.617   7.882  -0.849
  727    HA   TYR  93           HA       TYR  93  -7.647   9.154  -2.525
  728   1HB   TYR  93          1HB       TYR  93  -6.478   6.415  -3.044
  729   2HB   TYR  93          2HB       TYR  93  -7.950   7.019  -3.795
  730    HD1  TYR  93           HD1      TYR  93  -7.808   9.029  -5.304
  731    HD2  TYR  93           HD2      TYR  93  -4.350   6.991  -3.893
  732    HE1  TYR  93           HE1      TYR  93  -6.475  10.066  -7.092
  733    HE2  TYR  93           HE2      TYR  93  -3.007   8.023  -5.677
  734    HH   TYR  93           HH       TYR  93  -3.066   9.968  -7.135
  735    H    GLY  94           H        GLY  94  -9.751   8.055  -2.404
  736   1HA   GLY  94          1HA       GLY  94 -11.327   6.671  -1.343
  737   2HA   GLY  94          2HA       GLY  94 -10.097   6.200  -0.180
  738    H    GLU  95           H        GLU  95 -11.469   6.552   1.580
  739    HA   GLU  95           HA       GLU  95 -13.026   8.769   2.099
  740   1HB   GLU  95          1HB       GLU  95 -13.182   6.862   3.529
  741   2HB   GLU  95          2HB       GLU  95 -11.488   6.985   3.983
  742   1HG   GLU  95          1HG       GLU  95 -11.859   8.812   5.366
  743   2HG   GLU  95          2HG       GLU  95 -13.401   9.197   4.604
  Start of MODEL    7
    1   1H    ALA   2          1H        ALA   2 -10.949  -0.618  22.222
    2    HA   ALA   2           HA       ALA   2  -9.290  -0.117  20.196
    3   1HB   ALA   2          1HB       ALA   2  -9.811  -2.996  20.840
    4   2HB   ALA   2          2HB       ALA   2  -8.277  -2.184  20.522
    5   3HB   ALA   2          3HB       ALA   2  -9.123  -1.905  22.044
    6    H    ARG   3           H        ARG   3 -10.142   0.453  18.233
    7    HA   ARG   3           HA       ARG   3 -11.166  -1.762  16.607
    8   1HB   ARG   3          1HB       ARG   3 -12.843  -0.285  15.580
    9   2HB   ARG   3          2HB       ARG   3 -13.126  -0.491  17.303
   10   1HG   ARG   3          1HG       ARG   3 -12.907   1.686  17.705
   11   2HG   ARG   3          2HG       ARG   3 -11.452   1.809  16.713
   12   1HD   ARG   3          1HD       ARG   3 -13.020   1.693  14.704
   13   2HD   ARG   3          2HD       ARG   3 -14.326   1.985  15.852
   14    HE   ARG   3           HE       ARG   3 -13.643   4.171  16.034
   15   1HH1  ARG   3          1HH1      ARG   3 -11.196   2.316  14.393
   16   2HH1  ARG   3          2HH1      ARG   3 -10.270   3.704  13.929
   17   1HH2  ARG   3          1HH2      ARG   3 -12.432   6.007  15.429
   18   2HH2  ARG   3          2HH2      ARG   3 -10.973   5.803  14.519
   19    H    GLN   4           H        GLN   4  -8.559  -0.915  16.592
   20    HA   GLN   4           HA       GLN   4  -8.359   0.642  14.099
   21   1HB   GLN   4          1HB       GLN   4  -6.164   1.355  14.790
   22   2HB   GLN   4          2HB       GLN   4  -7.300   1.693  16.089
   23   1HG   GLN   4          1HG       GLN   4  -6.554  -0.355  17.236
   24   2HG   GLN   4          2HG       GLN   4  -5.368  -0.610  15.958
   25   1HE2  GLN   4          1HE2      GLN   4  -4.021  -0.572  17.998
   26   2HE2  GLN   4          2HE2      GLN   4  -3.368   0.959  18.462
   27    H    VAL   5           H        VAL   5  -6.830  -0.027  12.527
   28    HA   VAL   5           HA       VAL   5  -5.916  -2.814  12.807
   29    HB   VAL   5           HB       VAL   5  -6.412  -3.223  10.461
   30   1HG1  VAL   5          1HG1      VAL   5  -8.291  -3.992  11.393
   31   2HG1  VAL   5          2HG1      VAL   5  -8.446  -2.585  12.447
   32   3HG1  VAL   5          3HG1      VAL   5  -9.049  -2.518  10.790
   33   1HG2  VAL   5          1HG2      VAL   5  -6.503  -0.419  10.297
   34   2HG2  VAL   5          2HG2      VAL   5  -6.733  -1.585   8.993
   35   3HG2  VAL   5          3HG2      VAL   5  -8.124  -0.992   9.902
   36    H    ILE   6           H        ILE   6  -4.091  -3.388  11.446
   37    HA   ILE   6           HA       ILE   6  -2.182  -1.207  11.292
   38    HB   ILE   6           HB       ILE   6  -1.744  -4.131  10.677
   39   1HG1  ILE   6          1HG1      ILE   6  -0.553  -3.809  13.052
   40   2HG1  ILE   6          2HG1      ILE   6  -1.826  -2.606  13.232
   41   1HG2  ILE   6          1HG2      ILE   6   0.130  -3.215   9.807
   42   2HG2  ILE   6          2HG2      ILE   6  -0.014  -1.742  10.765
   43   3HG2  ILE   6          3HG2      ILE   6   0.637  -3.209  11.496
   44   1HD1  ILE   6          1HD1      ILE   6  -3.105  -4.867  12.236
   45   2HD1  ILE   6          2HD1      ILE   6  -1.964  -5.467  13.440
   46   3HD1  ILE   6          3HD1      ILE   6  -3.155  -4.246  13.885
   47    H    CYS   7           H        CYS   7  -0.993  -0.661   9.432
   48    HA   CYS   7           HA       CYS   7  -2.511  -0.795   6.998
   49   1HB   CYS   7          1HB       CYS   7  -0.954   0.758   6.113
   50   2HB   CYS   7          2HB       CYS   7  -1.157   1.201   7.804
   51    HG   CYS   7           HG       CYS   7   1.498   1.587   7.335
   52    H    TRP   8           H        TRP   8  -1.672  -1.541   4.954
   53    HA   TRP   8           HA       TRP   8   0.039  -3.910   5.283
   54   1HB   TRP   8          1HB       TRP   8  -2.057  -3.240   3.212
   55   2HB   TRP   8          2HB       TRP   8  -0.988  -4.635   3.098
   56    HD1  TRP   8           HD1      TRP   8  -3.484  -3.217   5.726
   57    HE1  TRP   8           HE1      TRP   8  -4.742  -5.208   6.766
   58    HE3  TRP   8           HE3      TRP   8  -1.158  -7.032   3.243
   59    HZ2  TRP   8           HZ2      TRP   8  -4.746  -8.023   6.561
   60    HZ3  TRP   8           HZ3      TRP   8  -1.847  -9.345   3.723
   61    HH2  TRP   8           HH2      TRP   8  -3.604  -9.828   5.348
   62    H    CYS   9           H        CYS   9   2.071  -3.643   4.658
   63    HA   CYS   9           HA       CYS   9   2.710  -1.626   2.641
   64   1HB   CYS   9          1HB       CYS   9   5.069  -2.023   3.357
   65   2HB   CYS   9          2HB       CYS   9   4.018  -1.481   4.660
   66    HG   CYS   9           HG       CYS   9   5.438  -3.269   6.012
   67    H    PHE  10           H        PHE  10   3.015  -2.189   0.599
   68    HA   PHE  10           HA       PHE  10   4.167  -4.813  -0.010
   69   1HB   PHE  10          1HB       PHE  10   2.499  -5.445  -1.500
   70   2HB   PHE  10          2HB       PHE  10   1.569  -4.692  -0.209
   71    HD1  PHE  10           HD2      PHE  10   1.076  -2.146  -0.521
   72    HD2  PHE  10           HD1      PHE  10   2.129  -4.800  -3.677
   73    HE1  PHE  10           HE2      PHE  10   0.061  -0.606  -2.149
   74    HE2  PHE  10           HE1      PHE  10   1.116  -3.264  -5.311
   75    HZ   PHE  10           HZ       PHE  10   0.079  -1.165  -4.548
   76    H    THR  11           H        THR  11   4.900  -4.956  -2.302
   77    HA   THR  11           HA       THR  11   5.643  -2.322  -3.388
   78    HB   THR  11           HB       THR  11   7.540  -4.646  -3.539
   79    HG1  THR  11           HG1      THR  11   7.273  -2.758  -1.422
   80   1HG2  THR  11          1HG2      THR  11   7.519  -1.863  -4.329
   81   2HG2  THR  11          2HG2      THR  11   8.648  -3.145  -4.765
   82   3HG2  THR  11          3HG2      THR  11   8.891  -2.222  -3.282
   83    H    LEU  12           H        LEU  12   5.052  -2.083  -5.436
   84    HA   LEU  12           HA       LEU  12   4.520  -4.495  -7.034
   85   1HB   LEU  12          1HB       LEU  12   2.572  -3.088  -6.656
   86   2HB   LEU  12          2HB       LEU  12   3.431  -1.697  -7.313
   87    HG   LEU  12           HG       LEU  12   3.324  -2.543  -9.512
   88   1HD1  LEU  12          1HD1      LEU  12   3.829  -4.750  -9.579
   89   2HD1  LEU  12          2HD1      LEU  12   2.076  -4.889  -9.705
   90   3HD1  LEU  12          3HD1      LEU  12   2.870  -5.130  -8.149
   91   1HD2  LEU  12          1HD2      LEU  12   0.755  -2.995  -8.016
   92   2HD2  LEU  12          2HD2      LEU  12   0.863  -3.082  -9.774
   93   3HD2  LEU  12          3HD2      LEU  12   1.249  -1.576  -8.939
   94    H    ASN  13           H        ASN  13   5.810  -4.921  -8.694
   95    HA   ASN  13           HA       ASN  13   7.575  -2.783  -9.676
   96   1HB   ASN  13          1HB       ASN  13   7.888  -5.778  -9.575
   97   2HB   ASN  13          2HB       ASN  13   8.909  -4.774 -10.600
   98   1HD2  ASN  13          1HD2      ASN  13   8.011  -5.536  -7.317
   99   2HD2  ASN  13          2HD2      ASN  13   9.402  -4.839  -6.567
  100    H    ASN  14           H        ASN  14   7.524  -2.170 -11.762
  101    HA   ASN  14           HA       ASN  14   6.662  -1.864 -13.852
  102   1HB   ASN  14          1HB       ASN  14   8.125  -3.907 -14.122
  103   2HB   ASN  14          2HB       ASN  14   6.666  -4.883 -13.979
  104   1HD2  ASN  14          1HD2      ASN  14   8.374  -4.863 -16.207
  105   2HD2  ASN  14          2HD2      ASN  14   7.491  -4.243 -17.557
  106    HA   PRO  15           HA       PRO  15   2.346  -2.949 -12.381
  107   1HB   PRO  15          1HB       PRO  15   1.487  -0.385 -12.147
  108   2HB   PRO  15          2HB       PRO  15   2.286  -1.254 -10.832
  109   1HG   PRO  15          1HG       PRO  15   3.429   0.728 -12.763
  110   2HG   PRO  15          2HG       PRO  15   3.693   0.589 -11.015
  111   1HD   PRO  15          1HD       PRO  15   5.471  -0.337 -12.836
  112   2HD   PRO  15          2HD       PRO  15   5.231  -1.111 -11.256
  113    H    LEU  16           H        LEU  16   0.407  -2.703 -13.570
  114    HA   LEU  16           HA       LEU  16   0.840  -1.833 -16.337
  115   1HB   LEU  16          1HB       LEU  16  -1.175  -3.681 -15.083
  116   2HB   LEU  16          2HB       LEU  16  -1.278  -3.140 -16.757
  117    HG   LEU  16           HG       LEU  16   1.297  -4.345 -16.036
  118   1HD1  LEU  16          1HD1      LEU  16   0.659  -6.461 -15.534
  119   2HD1  LEU  16          2HD1      LEU  16  -0.866  -6.331 -16.410
  120   3HD1  LEU  16          3HD1      LEU  16  -0.704  -5.606 -14.810
  121   1HD2  LEU  16          1HD2      LEU  16   1.196  -5.183 -18.193
  122   2HD2  LEU  16          2HD2      LEU  16   0.305  -3.667 -18.329
  123   3HD2  LEU  16          3HD2      LEU  16  -0.567  -5.196 -18.216
  124    H    SER  17           H        SER  17  -0.432  -0.658 -13.537
  125    HA   SER  17           HA       SER  17  -1.626   1.578 -14.707
  126   1HB   SER  17          1HB       SER  17  -3.654   0.808 -15.295
  127   2HB   SER  17          2HB       SER  17  -3.378  -0.732 -14.482
  128    HG   SER  17           HG       SER  17  -5.102   0.896 -13.716
  129    HA   PRO  18           HA       PRO  18  -1.308   3.082 -10.599
  130   1HB   PRO  18          1HB       PRO  18  -3.317   4.905 -10.480
  131   2HB   PRO  18          2HB       PRO  18  -1.840   5.162 -11.417
  132   1HG   PRO  18          1HG       PRO  18  -4.538   4.252 -12.343
  133   2HG   PRO  18          2HG       PRO  18  -3.434   5.420 -13.091
  134   1HD   PRO  18          1HD       PRO  18  -3.651   2.863 -13.955
  135   2HD   PRO  18          2HD       PRO  18  -2.129   3.773 -14.037
  136    H    LEU  19           H        LEU  19  -2.213   3.023  -8.504
  137    HA   LEU  19           HA       LEU  19  -4.052   0.905  -8.057
  138   1HB   LEU  19          1HB       LEU  19  -3.084   2.991  -6.110
  139   2HB   LEU  19          2HB       LEU  19  -3.821   1.442  -5.707
  140    HG   LEU  19           HG       LEU  19  -1.108   1.903  -6.939
  141   1HD1  LEU  19          1HD1      LEU  19  -0.213   1.455  -4.913
  142   2HD1  LEU  19          2HD1      LEU  19  -1.510   0.350  -4.459
  143   3HD1  LEU  19          3HD1      LEU  19  -1.759   2.092  -4.351
  144   1HD2  LEU  19          1HD2      LEU  19  -1.307  -0.762  -6.251
  145   2HD2  LEU  19          2HD2      LEU  19  -1.358  -0.100  -7.885
  146   3HD2  LEU  19          3HD2      LEU  19  -2.859  -0.413  -7.013
  147    H    SER  20           H        SER  20  -5.994   1.171  -6.620
  148    HA   SER  20           HA       SER  20  -7.389   3.710  -6.895
  149   1HB   SER  20          1HB       SER  20  -9.407   2.565  -7.858
  150   2HB   SER  20          2HB       SER  20  -8.030   2.639  -8.957
  151    HG   SER  20           HG       SER  20  -7.777   0.525  -8.815
  152    H    LEU  21           H        LEU  21  -9.287   3.860  -5.566
  153    HA   LEU  21           HA       LEU  21  -8.992   2.728  -3.028
  154   1HB   LEU  21          1HB       LEU  21 -10.151   4.772  -3.204
  155   2HB   LEU  21          2HB       LEU  21 -11.289   4.114  -4.378
  156    HG   LEU  21           HG       LEU  21 -12.185   2.657  -2.528
  157   1HD1  LEU  21          1HD1      LEU  21 -11.249   2.631  -0.517
  158   2HD1  LEU  21          2HD1      LEU  21 -11.322   4.389  -0.401
  159   3HD1  LEU  21          3HD1      LEU  21  -9.938   3.614  -1.172
  160   1HD2  LEU  21          1HD2      LEU  21 -13.639   4.351  -2.950
  161   2HD2  LEU  21          2HD2      LEU  21 -12.423   5.606  -2.715
  162   3HD2  LEU  21          3HD2      LEU  21 -13.157   4.816  -1.319
  163    H    HIS  22           H        HIS  22 -10.253   1.199  -1.891
  164    HA   HIS  22           HA       HIS  22 -11.632  -0.749  -3.621
  165   1HB   HIS  22          1HB       HIS  22  -9.374  -1.407  -2.544
  166   2HB   HIS  22          2HB       HIS  22 -10.282  -1.493  -1.037
  167    HD1  HIS  22           HD1      HIS  22 -10.442  -3.942  -0.624
  168    HD2  HIS  22           HD2      HIS  22 -11.434  -2.942  -4.532
  169    HE1  HIS  22           HE1      HIS  22 -11.270  -6.072  -1.674
  170    H    ASP  23           H        ASP  23 -13.664  -1.275  -3.101
  171    HA   ASP  23           HA       ASP  23 -15.145   0.178  -1.240
  172   1HB   ASP  23          1HB       ASP  23 -15.635  -2.314  -2.817
  173   2HB   ASP  23          2HB       ASP  23 -16.773  -1.883  -1.543
  174    H    SER  24           H        SER  24 -13.196  -2.634  -0.835
  175    HA   SER  24           HA       SER  24 -14.423  -3.403   1.675
  176   1HB   SER  24          1HB       SER  24 -11.796  -4.457   0.656
  177   2HB   SER  24          2HB       SER  24 -13.003  -5.272   1.651
  178    HG   SER  24           HG       SER  24 -13.988  -5.890  -0.096
  179    H    MET  25           H        MET  25 -11.452  -1.850   0.560
  180    HA   MET  25           HA       MET  25 -10.297  -1.625   3.159
  181   1HB   MET  25          1HB       MET  25  -8.540  -0.495   2.130
  182   2HB   MET  25          2HB       MET  25  -9.135  -1.538   0.846
  183   1HG   MET  25          1HG       MET  25 -10.230   0.257  -0.233
  184   2HG   MET  25          2HG       MET  25 -10.004   1.318   1.156
  185   1HE   MET  25          1HE       MET  25  -7.985  -1.187  -0.739
  186   2HE   MET  25          2HE       MET  25  -7.893  -0.137  -2.153
  187   3HE   MET  25          3HE       MET  25  -6.467  -0.386  -1.145
  188    H    LYS  26           H        LYS  26  -9.505   0.852   3.612
  189    HA   LYS  26           HA       LYS  26 -11.966   2.468   3.725
  190   1HB   LYS  26          1HB       LYS  26 -10.422   1.404   5.878
  191   2HB   LYS  26          2HB       LYS  26 -10.255   3.154   5.893
  192   1HG   LYS  26          1HG       LYS  26 -12.650   3.425   5.996
  193   2HG   LYS  26          2HG       LYS  26 -12.880   1.681   5.851
  194   1HD   LYS  26          1HD       LYS  26 -11.155   2.675   8.057
  195   2HD   LYS  26          2HD       LYS  26 -12.898   2.915   8.201
  196   1HE   LYS  26          1HE       LYS  26 -12.603   0.285   7.331
  197   2HE   LYS  26          2HE       LYS  26 -11.330   0.509   8.530
  198   1HZ   LYS  26          1HZ       LYS  26 -13.156   1.485   9.976
  199   2HZ   LYS  26          2HZ       LYS  26 -13.180  -0.189   9.739
  200   3HZ   LYS  26          3HZ       LYS  26 -14.250   0.801   8.882
  201    H    TYR  27           H        TYR  27  -8.443   2.460   3.607
  202    HA   TYR  27           HA       TYR  27  -8.542   5.088   2.317
  203   1HB   TYR  27          1HB       TYR  27  -7.904   5.099   4.870
  204   2HB   TYR  27          2HB       TYR  27  -6.342   4.548   4.273
  205    HD1  TYR  27           HD1      TYR  27  -8.872   7.196   3.504
  206    HD2  TYR  27           HD2      TYR  27  -4.758   6.163   3.837
  207    HE1  TYR  27           HE1      TYR  27  -8.253   9.523   3.000
  208    HE2  TYR  27           HE2      TYR  27  -4.127   8.486   3.335
  209    HH   TYR  27           HH       TYR  27  -6.354  11.043   3.365
  210    H    LEU  28           H        LEU  28  -6.882   5.486   0.842
  211    HA   LEU  28           HA       LEU  28  -5.152   3.180   0.236
  212   1HB   LEU  28          1HB       LEU  28  -6.713   3.134  -1.485
  213   2HB   LEU  28          2HB       LEU  28  -6.812   4.891  -1.571
  214    HG   LEU  28           HG       LEU  28  -4.713   5.019  -2.716
  215   1HD1  LEU  28          1HD1      LEU  28  -4.333   2.383  -1.585
  216   2HD1  LEU  28          2HD1      LEU  28  -3.145   3.528  -2.207
  217   3HD1  LEU  28          3HD1      LEU  28  -3.961   2.419  -3.308
  218   1HD2  LEU  28          1HD2      LEU  28  -5.234   3.835  -4.761
  219   2HD2  LEU  28          2HD2      LEU  28  -6.711   4.491  -4.055
  220   3HD2  LEU  28          3HD2      LEU  28  -6.344   2.773  -3.896
  221    H    VAL  29           H        VAL  29  -3.047   3.609   0.185
  222    HA   VAL  29           HA       VAL  29  -2.143   6.321  -0.464
  223    HB   VAL  29           HB       VAL  29  -1.246   4.771   1.970
  224   1HG1  VAL  29          1HG1      VAL  29  -0.016   6.969   0.455
  225   2HG1  VAL  29          2HG1      VAL  29  -0.100   7.213   2.201
  226   3HG1  VAL  29          3HG1      VAL  29   0.714   5.791   1.545
  227   1HG2  VAL  29          1HG2      VAL  29  -3.043   5.802   2.846
  228   2HG2  VAL  29          2HG2      VAL  29  -2.003   7.227   2.842
  229   3HG2  VAL  29          3HG2      VAL  29  -3.147   6.966   1.525
  230    H    TYR  30           H        TYR  30  -0.659   6.225  -2.005
  231    HA   TYR  30           HA       TYR  30   1.420   4.211  -1.946
  232   1HB   TYR  30          1HB       TYR  30   0.978   3.212  -4.036
  233   2HB   TYR  30          2HB       TYR  30  -0.580   3.243  -3.217
  234    HD1  TYR  30           HD1      TYR  30   1.417   4.682  -5.938
  235    HD2  TYR  30           HD2      TYR  30  -2.376   4.653  -4.011
  236    HE1  TYR  30           HE1      TYR  30   0.440   5.871  -7.857
  237    HE2  TYR  30           HE2      TYR  30  -3.364   5.841  -5.925
  238    HH   TYR  30           HH       TYR  30  -3.025   6.630  -7.977
  239    H    GLN  31           H        GLN  31   3.068   4.601  -3.648
  240    HA   GLN  31           HA       GLN  31   3.034   7.220  -4.894
  241   1HB   GLN  31          1HB       GLN  31   4.899   8.124  -3.793
  242   2HB   GLN  31          2HB       GLN  31   3.917   7.449  -2.500
  243   1HG   GLN  31          1HG       GLN  31   5.353   5.595  -2.244
  244   2HG   GLN  31          2HG       GLN  31   6.197   5.950  -3.750
  245   1HE2  GLN  31          1HE2      GLN  31   5.272   8.101  -1.104
  246   2HE2  GLN  31          2HE2      GLN  31   6.879   8.601  -0.713
  247    H    THR  32           H        THR  32   4.789   7.531  -6.404
  248    HA   THR  32           HA       THR  32   5.648   4.992  -7.560
  249    HB   THR  32           HB       THR  32   5.819   7.790  -8.696
  250    HG1  THR  32           HG1      THR  32   4.137   6.667 -10.119
  251   1HG2  THR  32          1HG2      THR  32   7.525   6.225  -9.583
  252   2HG2  THR  32          2HG2      THR  32   6.354   6.725 -10.802
  253   3HG2  THR  32          3HG2      THR  32   6.230   5.129 -10.062
  254    H    GLU  33           H        GLU  33   7.732   4.350  -7.745
  255    HA   GLU  33           HA       GLU  33   9.815   6.187  -6.766
  256   1HB   GLU  33          1HB       GLU  33   9.189   3.398  -5.936
  257   2HB   GLU  33          2HB       GLU  33  10.883   3.858  -6.032
  258   1HG   GLU  33          1HG       GLU  33   9.802   5.951  -4.655
  259   2HG   GLU  33          2HG       GLU  33   8.844   4.589  -4.078
  260    H    GLN  34           H        GLN  34  11.955   5.792  -7.585
  261    HA   GLN  34           HA       GLN  34  11.885   4.742 -10.311
  262   1HB   GLN  34          1HB       GLN  34  13.067   6.997  -9.149
  263   2HB   GLN  34          2HB       GLN  34  14.409   5.922  -9.521
  264   1HG   GLN  34          1HG       GLN  34  12.634   5.965 -11.745
  265   2HG   GLN  34          2HG       GLN  34  12.985   7.624 -11.262
  266   1HE2  GLN  34          1HE2      GLN  34  15.445   7.823 -10.618
  267   2HE2  GLN  34          2HE2      GLN  34  16.533   7.227 -11.821
  268    H    GLY  35           H        GLY  35  13.067   3.031 -11.003
  269   1HA   GLY  35          1HA       GLY  35  15.360   1.957  -9.913
  270   2HA   GLY  35          2HA       GLY  35  14.037   1.191  -9.047
  271    H    GLU  36           H        GLU  36  15.186  -0.704 -10.111
  272    HA   GLU  36           HA       GLU  36  15.370  -2.285 -11.762
  273   1HB   GLU  36          1HB       GLU  36  13.257  -3.105 -12.536
  274   2HB   GLU  36          2HB       GLU  36  13.037  -2.526 -10.891
  275   1HG   GLU  36          1HG       GLU  36  11.925  -0.574 -11.628
  276   2HG   GLU  36          2HG       GLU  36  12.382  -0.865 -13.305
  277    H    ALA  37           H        ALA  37  13.898  -2.511 -14.196
  278    HA   ALA  37           HA       ALA  37  15.582  -1.155 -15.963
  279   1HB   ALA  37          1HB       ALA  37  12.840  -2.119 -16.717
  280   2HB   ALA  37          2HB       ALA  37  14.301  -2.067 -17.704
  281   3HB   ALA  37          3HB       ALA  37  14.168  -3.232 -16.387
  282    H    GLY  38           H        GLY  38  14.082  -0.022 -17.943
  283   1HA   GLY  38          1HA       GLY  38  13.865   2.627 -17.211
  284   2HA   GLY  38          2HA       GLY  38  13.043   1.922 -18.594
  285    H    ASN  39           H        ASN  39  11.567   0.084 -16.708
  286    HA   ASN  39           HA       ASN  39   9.288   1.773 -16.353
  287   1HB   ASN  39          1HB       ASN  39   9.521  -0.958 -15.128
  288   2HB   ASN  39          2HB       ASN  39   8.107  -0.170 -15.823
  289   1HD2  ASN  39          1HD2      ASN  39  10.547  -2.389 -16.328
  290   2HD2  ASN  39          2HD2      ASN  39  10.376  -2.585 -18.036
  291    H    ILE  40           H        ILE  40   8.075   1.789 -14.239
  292    HA   ILE  40           HA       ILE  40   9.964   2.217 -12.017
  293    HB   ILE  40           HB       ILE  40   8.115   3.778 -11.145
  294   1HG1  ILE  40          1HG1      ILE  40   7.360   3.638 -14.072
  295   2HG1  ILE  40          2HG1      ILE  40   6.369   3.100 -12.721
  296   1HG2  ILE  40          1HG2      ILE  40  10.378   4.380 -12.152
  297   2HG2  ILE  40          2HG2      ILE  40   9.492   4.746 -13.631
  298   3HG2  ILE  40          3HG2      ILE  40   9.139   5.636 -12.150
  299   1HD1  ILE  40          1HD1      ILE  40   7.166   5.843 -12.377
  300   2HD1  ILE  40          2HD1      ILE  40   6.359   5.601 -13.927
  301   3HD1  ILE  40          3HD1      ILE  40   5.552   5.134 -12.430
  302    H    HIS  41           H        HIS  41   8.871   2.087  -9.827
  303    HA   HIS  41           HA       HIS  41   6.885  -0.090  -9.803
  304   1HB   HIS  41          1HB       HIS  41   8.066  -0.709  -7.569
  305   2HB   HIS  41          2HB       HIS  41   8.805  -1.199  -9.091
  306    HD1  HIS  41           HD1      HIS  41  11.200  -1.220  -8.257
  307    HD2  HIS  41           HD2      HIS  41   9.287   2.415  -7.636
  308    HE1  HIS  41           HE1      HIS  41  13.007   0.378  -7.548
  309    H    PHE  42           H        PHE  42   5.451  -0.138  -7.999
  310    HA   PHE  42           HA       PHE  42   5.039   2.523  -6.824
  311   1HB   PHE  42          1HB       PHE  42   3.191   0.274  -7.537
  312   2HB   PHE  42          2HB       PHE  42   2.715   1.430  -6.298
  313    HD1  PHE  42           HD1      PHE  42   4.675   2.119  -9.363
  314    HD2  PHE  42           HD2      PHE  42   0.949   2.546  -7.350
  315    HE1  PHE  42           HE1      PHE  42   3.911   3.671 -11.113
  316    HE2  PHE  42           HE2      PHE  42   0.179   4.098  -9.096
  317    HZ   PHE  42           HZ       PHE  42   1.660   4.662 -10.981
  318    H    GLN  43           H        GLN  43   4.784   2.807  -4.635
  319    HA   GLN  43           HA       GLN  43   4.904   0.484  -2.879
  320   1HB   GLN  43          1HB       GLN  43   7.149   2.255  -3.399
  321   2HB   GLN  43          2HB       GLN  43   6.713   2.237  -1.695
  322   1HG   GLN  43          1HG       GLN  43   7.448   0.143  -1.395
  323   2HG   GLN  43          2HG       GLN  43   6.840  -0.405  -2.957
  324   1HE2  GLN  43          1HE2      GLN  43   8.085   0.461  -4.865
  325   2HE2  GLN  43          2HE2      GLN  43   9.807   0.485  -4.723
  326    H    GLY  44           H        GLY  44   4.037   0.826  -0.847
  327   1HA   GLY  44          1HA       GLY  44   3.586   3.194   0.474
  328   2HA   GLY  44          2HA       GLY  44   2.225   3.031  -0.627
  329    H    TYR  45           H        TYR  45   1.125   3.061   1.553
  330    HA   TYR  45           HA       TYR  45   0.930   0.304   2.575
  331   1HB   TYR  45          1HB       TYR  45   0.399   1.214   4.781
  332   2HB   TYR  45          2HB       TYR  45   1.971   1.789   4.236
  333    HD1  TYR  45           HD1      TYR  45  -1.577   2.760   4.663
  334    HD2  TYR  45           HD2      TYR  45   2.403   4.102   3.987
  335    HE1  TYR  45           HE1      TYR  45  -2.301   5.079   5.047
  336    HE2  TYR  45           HE2      TYR  45   1.691   6.425   4.370
  337    HH   TYR  45           HH       TYR  45  -1.091   7.277   5.839
  338    H    ILE  46           H        ILE  46  -1.097  -0.525   2.925
  339    HA   ILE  46           HA       ILE  46  -3.388   1.201   2.273
  340    HB   ILE  46           HB       ILE  46  -3.045  -1.632   1.286
  341   1HG1  ILE  46          1HG1      ILE  46  -3.028   0.930  -0.319
  342   2HG1  ILE  46          2HG1      ILE  46  -1.571   0.071   0.169
  343   1HG2  ILE  46          1HG2      ILE  46  -5.193   0.406   0.714
  344   2HG2  ILE  46          2HG2      ILE  46  -5.087  -1.215   0.028
  345   3HG2  ILE  46          3HG2      ILE  46  -5.366  -1.006   1.756
  346   1HD1  ILE  46          1HD1      ILE  46  -2.081  -1.771  -1.198
  347   2HD1  ILE  46          2HD1      ILE  46  -3.738  -1.223  -1.450
  348   3HD1  ILE  46          3HD1      ILE  46  -2.397  -0.339  -2.177
  349    H    GLU  47           H        GLU  47  -4.979   1.103   3.719
  350    HA   GLU  47           HA       GLU  47  -4.905  -1.049   5.715
  351   1HB   GLU  47          1HB       GLU  47  -6.467   1.519   5.927
  352   2HB   GLU  47          2HB       GLU  47  -6.013   0.416   7.218
  353   1HG   GLU  47          1HG       GLU  47  -3.606   1.212   6.063
  354   2HG   GLU  47          2HG       GLU  47  -4.589   2.673   6.148
  355    H    MET  48           H        MET  48  -6.349  -2.620   5.553
  356    HA   MET  48           HA       MET  48  -8.593  -2.393   3.760
  357   1HB   MET  48          1HB       MET  48  -7.620  -4.621   5.549
  358   2HB   MET  48          2HB       MET  48  -9.050  -4.755   4.534
  359   1HG   MET  48          1HG       MET  48  -6.727  -3.830   3.062
  360   2HG   MET  48          2HG       MET  48  -6.471  -5.398   3.824
  361   1HE   MET  48          1HE       MET  48  -8.357  -3.167   1.702
  362   2HE   MET  48          2HE       MET  48  -8.370  -4.121   0.219
  363   3HE   MET  48          3HE       MET  48  -9.812  -4.048   1.234
  364    H    LYS  49           H        LYS  49 -10.691  -3.581   4.726
  365    HA   LYS  49           HA       LYS  49 -11.981  -1.743   6.341
  366   1HB   LYS  49          1HB       LYS  49 -12.698  -4.045   4.984
  367   2HB   LYS  49          2HB       LYS  49 -13.025  -4.452   6.664
  368   1HG   LYS  49          1HG       LYS  49 -14.670  -2.872   6.873
  369   2HG   LYS  49          2HG       LYS  49 -14.000  -1.848   5.602
  370   1HD   LYS  49          1HD       LYS  49 -14.602  -3.949   4.103
  371   2HD   LYS  49          2HD       LYS  49 -15.770  -4.230   5.397
  372   1HE   LYS  49          1HE       LYS  49 -15.740  -1.457   4.576
  373   2HE   LYS  49          2HE       LYS  49 -16.060  -2.528   3.213
  374   1HZ   LYS  49          1HZ       LYS  49 -17.515  -2.979   5.718
  375   2HZ   LYS  49          2HZ       LYS  49 -18.004  -3.259   4.123
  376   3HZ   LYS  49          3HZ       LYS  49 -17.988  -1.683   4.738
  377    H    LYS  50           H        LYS  50 -10.891  -4.994   7.334
  378    HA   LYS  50           HA       LYS  50  -9.700  -4.209   9.726
  379   1HB   LYS  50          1HB       LYS  50 -12.576  -4.275   9.846
  380   2HB   LYS  50          2HB       LYS  50 -11.908  -5.512  10.903
  381   1HG   LYS  50          1HG       LYS  50 -10.657  -3.902  12.129
  382   2HG   LYS  50          2HG       LYS  50 -11.035  -2.634  10.960
  383   1HD   LYS  50          1HD       LYS  50 -12.572  -2.143  12.581
  384   2HD   LYS  50          2HD       LYS  50 -13.517  -3.267  11.602
  385   1HE   LYS  50          1HE       LYS  50 -12.942  -5.088  13.109
  386   2HE   LYS  50          2HE       LYS  50 -11.938  -4.000  14.066
  387   1HZ   LYS  50          1HZ       LYS  50 -13.741  -2.991  14.985
  388   2HZ   LYS  50          2HZ       LYS  50 -14.399  -4.530  14.743
  389   3HZ   LYS  50          3HZ       LYS  50 -14.747  -3.282  13.655
  390    H    ARG  51           H        ARG  51 -12.056  -6.823   9.180
  391    HA   ARG  51           HA       ARG  51 -10.006  -8.778   9.840
  392   1HB   ARG  51          1HB       ARG  51 -12.595  -8.685  10.523
  393   2HB   ARG  51          2HB       ARG  51 -12.740  -9.629   9.046
  394   1HG   ARG  51          1HG       ARG  51 -12.480 -11.308  10.554
  395   2HG   ARG  51          2HG       ARG  51 -10.788 -11.014  10.151
  396   1HD   ARG  51          1HD       ARG  51 -11.655  -9.264  12.268
  397   2HD   ARG  51          2HD       ARG  51 -11.971 -10.948  12.683
  398    HE   ARG  51           HE       ARG  51  -9.391 -10.865  11.705
  399   1HH1  ARG  51          1HH1      ARG  51 -11.164  -9.450  14.346
  400   2HH1  ARG  51          2HH1      ARG  51  -9.785  -9.348  15.389
  401   1HH2  ARG  51          1HH2      ARG  51  -7.567 -10.735  13.069
  402   2HH2  ARG  51          2HH2      ARG  51  -7.739 -10.078  14.661
  403    H    THR  52           H        THR  52  -9.342  -7.569   7.511
  404    HA   THR  52           HA       THR  52 -10.117  -9.480   5.409
  405    HB   THR  52           HB       THR  52  -8.616  -7.057   4.628
  406    HG1  THR  52           HG1      THR  52 -11.204  -6.970   5.784
  407   1HG2  THR  52          1HG2      THR  52 -11.048  -8.512   3.591
  408   2HG2  THR  52          2HG2      THR  52  -9.416  -8.543   2.925
  409   3HG2  THR  52          3HG2      THR  52 -10.374  -7.065   2.844
  410    H    SER  53           H        SER  53  -8.681 -11.031   5.057
  411    HA   SER  53           HA       SER  53  -5.965 -10.825   5.957
  412   1HB   SER  53          1HB       SER  53  -5.853 -13.097   4.635
  413   2HB   SER  53          2HB       SER  53  -6.742 -13.000   6.155
  414    HG   SER  53           HG       SER  53  -7.717 -13.131   3.523
  415    H    LEU  54           H        LEU  54  -4.290 -11.823   4.249
  416    HA   LEU  54           HA       LEU  54  -3.643  -9.809   2.476
  417   1HB   LEU  54          1HB       LEU  54  -2.076 -11.523   3.244
  418   2HB   LEU  54          2HB       LEU  54  -2.924 -12.732   2.282
  419    HG   LEU  54           HG       LEU  54  -2.195 -11.699   0.239
  420   1HD1  LEU  54          1HD1      LEU  54  -0.799  -9.721   0.194
  421   2HD1  LEU  54          2HD1      LEU  54  -0.873  -9.599   1.951
  422   3HD1  LEU  54          3HD1      LEU  54  -2.332  -9.364   0.990
  423   1HD2  LEU  54          1HD2      LEU  54  -0.605 -13.232   1.024
  424   2HD2  LEU  54          2HD2      LEU  54  -0.057 -12.145   2.301
  425   3HD2  LEU  54          3HD2      LEU  54   0.328 -11.792   0.616
  426    H    ALA  55           H        ALA  55  -5.757 -12.545   2.029
  427    HA   ALA  55           HA       ALA  55  -5.901 -12.690  -0.737
  428   1HB   ALA  55          1HB       ALA  55  -8.222 -13.042   1.152
  429   2HB   ALA  55          2HB       ALA  55  -8.035 -13.747  -0.454
  430   3HB   ALA  55          3HB       ALA  55  -6.979 -14.260   0.863
  431    H    GLY  56           H        GLY  56  -7.307 -10.359   1.464
  432   1HA   GLY  56          1HA       GLY  56  -9.142  -9.216  -0.391
  433   2HA   GLY  56          2HA       GLY  56  -8.588  -8.481   1.106
  434    H    MET  57           H        MET  57  -5.889  -8.254   0.678
  435    HA   MET  57           HA       MET  57  -5.794  -5.974  -1.036
  436   1HB   MET  57          1HB       MET  57  -3.549  -7.456   0.345
  437   2HB   MET  57          2HB       MET  57  -3.416  -5.870  -0.404
  438   1HG   MET  57          1HG       MET  57  -5.518  -6.174   1.640
  439   2HG   MET  57          2HG       MET  57  -3.852  -6.250   2.209
  440   1HE   MET  57          1HE       MET  57  -5.314  -3.556  -0.768
  441   2HE   MET  57          2HE       MET  57  -6.418  -4.544   0.187
  442   3HE   MET  57          3HE       MET  57  -6.240  -2.826   0.544
  443    H    LYS  58           H        LYS  58  -4.409  -9.238  -1.187
  444    HA   LYS  58           HA       LYS  58  -2.917  -8.991  -3.507
  445   1HB   LYS  58          1HB       LYS  58  -3.428 -11.021  -1.807
  446   2HB   LYS  58          2HB       LYS  58  -4.419 -11.523  -3.171
  447   1HG   LYS  58          1HG       LYS  58  -2.632 -12.304  -4.209
  448   2HG   LYS  58          2HG       LYS  58  -1.874 -10.711  -4.152
  449   1HD   LYS  58          1HD       LYS  58  -0.412 -12.276  -3.077
  450   2HD   LYS  58          2HD       LYS  58  -1.111 -11.234  -1.836
  451   1HE   LYS  58          1HE       LYS  58  -1.336 -13.316  -0.874
  452   2HE   LYS  58          2HE       LYS  58  -2.902 -13.119  -1.659
  453   1HZ   LYS  58          1HZ       LYS  58  -2.135 -14.454  -3.498
  454   2HZ   LYS  58          2HZ       LYS  58  -1.932 -15.313  -2.055
  455   3HZ   LYS  58          3HZ       LYS  58  -0.597 -14.598  -2.808
  456    H    LYS  59           H        LYS  59  -6.371  -9.403  -3.102
  457    HA   LYS  59           HA       LYS  59  -7.088 -10.152  -5.687
  458   1HB   LYS  59          1HB       LYS  59  -8.413  -9.206  -3.329
  459   2HB   LYS  59          2HB       LYS  59  -9.066  -8.361  -4.726
  460   1HG   LYS  59          1HG       LYS  59  -9.653 -10.430  -5.780
  461   2HG   LYS  59          2HG       LYS  59  -8.835 -11.355  -4.519
  462   1HD   LYS  59          1HD       LYS  59 -10.428 -10.566  -2.868
  463   2HD   LYS  59          2HD       LYS  59 -11.212  -9.547  -4.078
  464   1HE   LYS  59          1HE       LYS  59 -11.323 -11.947  -5.310
  465   2HE   LYS  59          2HE       LYS  59 -11.407 -12.454  -3.624
  466   1HZ   LYS  59          1HZ       LYS  59 -13.124 -10.284  -3.932
  467   2HZ   LYS  59          2HZ       LYS  59 -13.534 -11.896  -3.626
  468   3HZ   LYS  59          3HZ       LYS  59 -13.434 -11.338  -5.219
  469    H    LEU  60           H        LEU  60  -6.393  -6.970  -4.343
  470    HA   LEU  60           HA       LEU  60  -7.112  -5.600  -6.779
  471   1HB   LEU  60          1HB       LEU  60  -5.864  -4.730  -4.189
  472   2HB   LEU  60          2HB       LEU  60  -6.033  -3.636  -5.560
  473    HG   LEU  60           HG       LEU  60  -8.554  -4.288  -5.419
  474   1HD1  LEU  60          1HD1      LEU  60  -9.173  -5.597  -3.745
  475   2HD1  LEU  60          2HD1      LEU  60  -8.521  -4.437  -2.587
  476   3HD1  LEU  60          3HD1      LEU  60  -7.496  -5.727  -3.215
  477   1HD2  LEU  60          1HD2      LEU  60  -7.095  -2.143  -4.615
  478   2HD2  LEU  60          2HD2      LEU  60  -7.886  -2.606  -3.108
  479   3HD2  LEU  60          3HD2      LEU  60  -8.854  -2.244  -4.538
  480    H    ILE  61           H        ILE  61  -4.165  -6.647  -5.161
  481    HA   ILE  61           HA       ILE  61  -2.617  -5.736  -7.497
  482    HB   ILE  61           HB       ILE  61  -1.291  -6.501  -4.933
  483   1HG1  ILE  61          1HG1      ILE  61  -3.048  -4.975  -4.212
  484   2HG1  ILE  61          2HG1      ILE  61  -1.488  -4.163  -4.144
  485   1HG2  ILE  61          1HG2      ILE  61  -0.105  -5.954  -7.115
  486   2HG2  ILE  61          2HG2      ILE  61  -0.610  -4.287  -6.844
  487   3HG2  ILE  61          3HG2      ILE  61   0.437  -5.091  -5.676
  488   1HD1  ILE  61          1HD1      ILE  61  -2.646  -3.711  -6.704
  489   2HD1  ILE  61          2HD1      ILE  61  -3.833  -3.332  -5.455
  490   3HD1  ILE  61          3HD1      ILE  61  -2.254  -2.548  -5.438
  491    HA   PRO  62           HA       PRO  62  -2.674 -10.354  -7.734
  492   1HB   PRO  62          1HB       PRO  62  -2.913 -10.430 -10.437
  493   2HB   PRO  62          2HB       PRO  62  -4.303 -10.291  -9.354
  494   1HG   PRO  62          1HG       PRO  62  -2.877  -8.153 -10.889
  495   2HG   PRO  62          2HG       PRO  62  -4.619  -8.396 -10.664
  496   1HD   PRO  62          1HD       PRO  62  -3.205  -6.579  -9.239
  497   2HD   PRO  62          2HD       PRO  62  -4.610  -7.434  -8.569
  498    H    GLY  63           H        GLY  63  -0.521 -10.629  -7.184
  499   1HA   GLY  63          1HA       GLY  63   1.534 -11.523  -7.992
  500   2HA   GLY  63          2HA       GLY  63   1.344 -10.561  -9.450
  501    H    ALA  64           H        ALA  64   1.492  -9.931  -5.940
  502    HA   ALA  64           HA       ALA  64   3.753  -8.139  -6.397
  503   1HB   ALA  64          1HB       ALA  64   1.053  -7.291  -5.543
  504   2HB   ALA  64          2HB       ALA  64   2.419  -6.577  -4.685
  505   3HB   ALA  64          3HB       ALA  64   2.292  -6.410  -6.436
  506    H    HIS  65           H        HIS  65   4.741  -7.419  -4.317
  507    HA   HIS  65           HA       HIS  65   4.721  -9.649  -2.430
  508   1HB   HIS  65          1HB       HIS  65   6.846  -8.641  -3.505
  509   2HB   HIS  65          2HB       HIS  65   6.631  -7.325  -2.354
  510    HD1  HIS  65           HD1      HIS  65   8.044  -7.641  -0.365
  511    HD2  HIS  65           HD2      HIS  65   6.732 -11.272  -1.901
  512    HE1  HIS  65           HE1      HIS  65   9.028  -9.401   1.138
  513    H    PHE  66           H        PHE  66   3.370  -9.482  -0.771
  514    HA   PHE  66           HA       PHE  66   2.924  -6.828   0.422
  515   1HB   PHE  66          1HB       PHE  66   1.153  -9.135  -0.097
  516   2HB   PHE  66          2HB       PHE  66   0.934  -8.354   1.465
  517    HD1  PHE  66           HD1      PHE  66   0.976  -7.742  -2.183
  518    HD2  PHE  66           HD2      PHE  66  -0.211  -6.318   1.648
  519    HE1  PHE  66           HE1      PHE  66  -0.373  -5.988  -3.258
  520    HE2  PHE  66           HE2      PHE  66  -1.563  -4.562   0.580
  521    HZ   PHE  66           HZ       PHE  66  -1.646  -4.395  -1.876
  522    H    GLU  67           H        GLU  67   2.658  -6.741   2.757
  523    HA   GLU  67           HA       GLU  67   3.704  -8.973   4.294
  524   1HB   GLU  67          1HB       GLU  67   5.303  -6.646   3.587
  525   2HB   GLU  67          2HB       GLU  67   5.170  -6.850   5.328
  526   1HG   GLU  67          1HG       GLU  67   5.861  -9.259   4.954
  527   2HG   GLU  67          2HG       GLU  67   6.285  -8.772   3.314
  528    H    LYS  68           H        LYS  68   2.212  -9.176   5.822
  529    HA   LYS  68           HA       LYS  68   0.989  -6.762   6.961
  530   1HB   LYS  68          1HB       LYS  68  -0.409  -8.673   5.974
  531   2HB   LYS  68          2HB       LYS  68   0.059  -9.594   7.398
  532   1HG   LYS  68          1HG       LYS  68  -0.840  -7.469   8.660
  533   2HG   LYS  68          2HG       LYS  68  -1.748  -7.248   7.163
  534   1HD   LYS  68          1HD       LYS  68  -3.231  -8.554   8.303
  535   2HD   LYS  68          2HD       LYS  68  -2.268  -9.821   7.539
  536   1HE   LYS  68          1HE       LYS  68  -1.935 -10.640   9.584
  537   2HE   LYS  68          2HE       LYS  68  -0.895  -9.246   9.875
  538   1HZ   LYS  68          1HZ       LYS  68  -2.586  -8.113  10.960
  539   2HZ   LYS  68          2HZ       LYS  68  -2.782  -9.700  11.510
  540   3HZ   LYS  68          3HZ       LYS  68  -3.810  -9.087  10.315
  541    H    ARG  69           H        ARG  69   3.661  -8.131   7.609
  542    HA   ARG  69           HA       ARG  69   3.395  -9.120  10.273
  543   1HB   ARG  69          1HB       ARG  69   5.359  -9.234   8.378
  544   2HB   ARG  69          2HB       ARG  69   6.015  -8.037   9.487
  545   1HG   ARG  69          1HG       ARG  69   5.855  -9.595  11.325
  546   2HG   ARG  69          2HG       ARG  69   5.082 -10.787  10.279
  547   1HD   ARG  69          1HD       ARG  69   7.797  -9.666   9.664
  548   2HD   ARG  69          2HD       ARG  69   7.588 -11.045  10.741
  549    HE   ARG  69           HE       ARG  69   6.245 -11.411   8.250
  550   1HH1  ARG  69          1HH1      ARG  69   9.347 -11.582   9.820
  551   2HH1  ARG  69          2HH1      ARG  69   9.985 -12.758   8.718
  552   1HH2  ARG  69          1HH2      ARG  69   7.073 -12.958   6.794
  553   2HH2  ARG  69          2HH2      ARG  69   8.691 -13.539   6.997
  554    H    ARG  70           H        ARG  70   3.063  -6.073   9.047
  555    HA   ARG  70           HA       ARG  70   2.878  -4.020  10.013
  556   1HB   ARG  70          1HB       ARG  70   3.524  -5.269  12.675
  557   2HB   ARG  70          2HB       ARG  70   2.559  -3.836  12.347
  558   1HG   ARG  70          1HG       ARG  70   0.798  -5.191  11.402
  559   2HG   ARG  70          2HG       ARG  70   1.778  -6.645  11.596
  560   1HD   ARG  70          1HD       ARG  70   1.063  -4.897  13.929
  561   2HD   ARG  70          2HD       ARG  70  -0.019  -6.166  13.358
  562    HE   ARG  70           HE       ARG  70   2.379  -7.420  13.680
  563   1HH1  ARG  70          1HH1      ARG  70   0.313  -5.510  15.730
  564   2HH1  ARG  70          2HH1      ARG  70   0.792  -6.318  17.186
  565   1HH2  ARG  70          1HH2      ARG  70   3.017  -8.492  15.590
  566   2HH2  ARG  70          2HH2      ARG  70   2.331  -8.013  17.105
  567    H    GLY  71           H        GLY  71   5.265  -4.613   8.836
  568   1HA   GLY  71          1HA       GLY  71   7.490  -4.100  10.572
  569   2HA   GLY  71          2HA       GLY  71   7.524  -4.136   8.815
  570    H    THR  72           H        THR  72   5.092  -2.097   9.485
  571    HA   THR  72           HA       THR  72   6.701   0.259  10.060
  572    HB   THR  72           HB       THR  72   6.834  -0.061   7.582
  573    HG1  THR  72           HG1      THR  72   7.038   2.034   7.758
  574   1HG2  THR  72          1HG2      THR  72   4.433  -0.971   7.483
  575   2HG2  THR  72          2HG2      THR  72   4.952   0.115   6.193
  576   3HG2  THR  72          3HG2      THR  72   3.934   0.720   7.500
  577    H    GLN  73           H        GLN  73   4.443  -1.231  11.276
  578    HA   GLN  73           HA       GLN  73   2.001   0.067  10.954
  579   1HB   GLN  73          1HB       GLN  73   1.584  -0.673  13.352
  580   2HB   GLN  73          2HB       GLN  73   2.003  -1.936  12.202
  581   1HG   GLN  73          1HG       GLN  73   3.932  -2.426  13.238
  582   2HG   GLN  73          2HG       GLN  73   4.276  -0.741  13.623
  583   1HE2  GLN  73          1HE2      GLN  73   4.916  -1.374  15.713
  584   2HE2  GLN  73          2HE2      GLN  73   3.751  -1.762  16.928
  585    H    GLY  74           H        GLY  74   2.004   2.261  10.860
  586   1HA   GLY  74          1HA       GLY  74   1.642   4.294  11.993
  587   2HA   GLY  74          2HA       GLY  74   2.522   3.656  13.373
  588    H    GLU  75           H        GLU  75   4.674   2.746  11.422
  589    HA   GLU  75           HA       GLU  75   6.258   5.136  11.630
  590   1HB   GLU  75          1HB       GLU  75   6.728   2.297  10.931
  591   2HB   GLU  75          2HB       GLU  75   7.827   3.463  10.207
  592   1HG   GLU  75          1HG       GLU  75   7.993   4.359  12.665
  593   2HG   GLU  75          2HG       GLU  75   7.453   2.728  13.063
  594    H    ALA  76           H        ALA  76   4.463   3.503   9.146
  595    HA   ALA  76           HA       ALA  76   5.715   4.757   6.915
  596   1HB   ALA  76          1HB       ALA  76   4.342   2.627   6.889
  597   2HB   ALA  76          2HB       ALA  76   2.915   3.662   6.961
  598   3HB   ALA  76          3HB       ALA  76   4.023   3.781   5.594
  599    H    ARG  77           H        ARG  77   3.727   5.958   9.321
  600    HA   ARG  77           HA       ARG  77   2.192   7.808   7.761
  601   1HB   ARG  77          1HB       ARG  77   2.233   6.925  10.447
  602   2HB   ARG  77          2HB       ARG  77   2.500   8.663  10.484
  603   1HG   ARG  77          1HG       ARG  77   0.315   8.940  10.287
  604   2HG   ARG  77          2HG       ARG  77   0.421   8.265   8.660
  605   1HD   ARG  77          1HD       ARG  77  -0.043   6.071   9.452
  606   2HD   ARG  77          2HD       ARG  77   0.139   6.573  11.133
  607    HE   ARG  77           HE       ARG  77  -2.185   6.897   9.461
  608   1HH1  ARG  77          1HH1      ARG  77  -0.492   8.012  12.291
  609   2HH1  ARG  77          2HH1      ARG  77  -1.911   8.658  13.046
  610   1HH2  ARG  77          1HH2      ARG  77  -4.061   7.745  10.445
  611   2HH2  ARG  77          2HH2      ARG  77  -3.941   8.505  11.995
  612    H    ALA  78           H        ALA  78   5.398   7.713   8.906
  613    HA   ALA  78           HA       ALA  78   5.700  10.600   8.388
  614   1HB   ALA  78          1HB       ALA  78   7.837  10.263   9.832
  615   2HB   ALA  78          2HB       ALA  78   6.267  10.432  10.618
  616   3HB   ALA  78          3HB       ALA  78   6.989   8.834  10.424
  617    H    TYR  79           H        TYR  79   7.610   7.583   8.407
  618    HA   TYR  79           HA       TYR  79   9.499   8.569   6.515
  619   1HB   TYR  79          1HB       TYR  79  10.114   6.850   8.138
  620   2HB   TYR  79          2HB       TYR  79   8.940   5.742   7.437
  621    HD1  TYR  79           HD1      TYR  79  11.239   7.982   5.580
  622    HD2  TYR  79           HD2      TYR  79  10.350   3.986   6.739
  623    HE1  TYR  79           HE1      TYR  79  12.956   7.156   4.025
  624    HE2  TYR  79           HE2      TYR  79  12.065   3.149   5.188
  625    HH   TYR  79           HH       TYR  79  13.931   3.809   3.975
  626    H    SER  80           H        SER  80   6.824   6.237   6.309
  627    HA   SER  80           HA       SER  80   5.598   5.473   4.551
  628   1HB   SER  80          1HB       SER  80   6.604   8.061   3.361
  629   2HB   SER  80          2HB       SER  80   5.476   6.998   2.520
  630    HG   SER  80           HG       SER  80   4.228   8.434   3.612
  631    H    MET  81           H        MET  81   7.898   7.001   2.390
  632    HA   MET  81           HA       MET  81   8.981   4.343   1.728
  633   1HB   MET  81          1HB       MET  81   7.715   6.366   0.011
  634   2HB   MET  81          2HB       MET  81   9.238   5.742  -0.608
  635   1HG   MET  81          1HG       MET  81   7.322   4.498  -1.462
  636   2HG   MET  81          2HG       MET  81   8.395   3.481  -0.502
  637   1HE   MET  81          1HE       MET  81   5.756   6.087   0.108
  638   2HE   MET  81          2HE       MET  81   4.544   4.978  -0.536
  639   3HE   MET  81          3HE       MET  81   4.578   5.342   1.190
  640    H    LYS  82           H        LYS  82  10.984   4.807   0.121
  641    HA   LYS  82           HA       LYS  82  12.850   6.321   1.757
  642   1HB   LYS  82          1HB       LYS  82  13.530   4.771  -0.733
  643   2HB   LYS  82          2HB       LYS  82  14.578   5.176   0.619
  644   1HG   LYS  82          1HG       LYS  82  14.178   3.129   1.375
  645   2HG   LYS  82          2HG       LYS  82  12.559   3.699   1.785
  646   1HD   LYS  82          1HD       LYS  82  11.994   3.110  -0.673
  647   2HD   LYS  82          2HD       LYS  82  13.468   2.141  -0.607
  648   1HE   LYS  82          1HE       LYS  82  12.413   1.204   1.587
  649   2HE   LYS  82          2HE       LYS  82  10.908   1.814   0.901
  650   1HZ   LYS  82          1HZ       LYS  82  11.017   0.349  -0.860
  651   2HZ   LYS  82          2HZ       LYS  82  11.618  -0.593   0.409
  652   3HZ   LYS  82          3HZ       LYS  82  12.683   0.100  -0.708
  653    H    GLU  83           H        GLU  83  13.491   8.318   1.300
  654    HA   GLU  83           HA       GLU  83  12.503   9.765  -0.906
  655   1HB   GLU  83          1HB       GLU  83  14.116  10.292   1.434
  656   2HB   GLU  83          2HB       GLU  83  14.768  11.129   0.033
  657   1HG   GLU  83          1HG       GLU  83  12.409  11.978  -0.367
  658   2HG   GLU  83          2HG       GLU  83  12.042  11.391   1.254
  659    H    ASP  84           H        ASP  84  15.507   8.049  -0.349
  660    HA   ASP  84           HA       ASP  84  17.051   9.084  -2.427
  661   1HB   ASP  84          1HB       ASP  84  17.201   6.891  -0.602
  662   2HB   ASP  84          2HB       ASP  84  17.602   6.302  -2.213
  663    H    THR  85           H        THR  85  14.560   6.603  -2.443
  664    HA   THR  85           HA       THR  85  14.875   6.350  -5.361
  665    HB   THR  85           HB       THR  85  13.357   4.279  -4.975
  666    HG1  THR  85           HG1      THR  85  14.546   4.352  -2.404
  667   1HG2  THR  85          1HG2      THR  85  15.822   4.337  -5.582
  668   2HG2  THR  85          2HG2      THR  85  15.256   2.880  -4.765
  669   3HG2  THR  85          3HG2      THR  85  16.151   4.104  -3.866
  670    H    ARG  86           H        ARG  86  13.214   8.173  -3.358
  671    HA   ARG  86           HA       ARG  86  10.504   7.721  -4.123
  672   1HB   ARG  86          1HB       ARG  86  11.139   8.882  -2.035
  673   2HB   ARG  86          2HB       ARG  86  11.785  10.213  -2.986
  674   1HG   ARG  86          1HG       ARG  86   9.703  10.972  -3.593
  675   2HG   ARG  86          2HG       ARG  86   8.946   9.394  -3.366
  676   1HD   ARG  86          1HD       ARG  86   8.196  10.242  -1.434
  677   2HD   ARG  86          2HD       ARG  86   9.836   9.966  -0.848
  678    HE   ARG  86           HE       ARG  86  10.082  12.223  -0.707
  679   1HH1  ARG  86          1HH1      ARG  86   7.569  11.537  -3.017
  680   2HH1  ARG  86          2HH1      ARG  86   7.177  13.204  -3.281
  681   1HH2  ARG  86          1HH2      ARG  86   9.575  14.421  -1.046
  682   2HH2  ARG  86          2HH2      ARG  86   8.319  14.844  -2.160
  683    H    LEU  87           H        LEU  87   9.607   8.161  -6.016
  684    HA   LEU  87           HA       LEU  87  10.904  10.124  -7.776
  685   1HB   LEU  87          1HB       LEU  87  10.024   7.525  -8.237
  686   2HB   LEU  87          2HB       LEU  87   8.811   8.547  -9.004
  687    HG   LEU  87           HG       LEU  87  11.759   8.423  -9.610
  688   1HD1  LEU  87          1HD1      LEU  87   9.257   7.692 -11.101
  689   2HD1  LEU  87          2HD1      LEU  87  10.640   6.672 -10.707
  690   3HD1  LEU  87          3HD1      LEU  87  10.802   7.949 -11.913
  691   1HD2  LEU  87          1HD2      LEU  87  11.281  10.146 -11.320
  692   2HD2  LEU  87          2HD2      LEU  87  11.111  10.743  -9.669
  693   3HD2  LEU  87          3HD2      LEU  87   9.676  10.355 -10.620
  694    H    GLU  88           H        GLU  88   7.598   8.939  -7.126
  695    HA   GLU  88           HA       GLU  88   6.679  11.734  -7.267
  696   1HB   GLU  88          1HB       GLU  88   6.068   9.785  -9.118
  697   2HB   GLU  88          2HB       GLU  88   4.684   9.735  -8.035
  698   1HG   GLU  88          1HG       GLU  88   4.049  11.899  -8.527
  699   2HG   GLU  88          2HG       GLU  88   5.656  12.351  -9.092
  700    H    GLY  89           H        GLY  89   4.319  11.841  -6.356
  701   1HA   GLY  89          1HA       GLY  89   2.779  11.226  -4.685
  702   2HA   GLY  89          2HA       GLY  89   3.916  10.013  -4.116
  703    HA   PRO  90           HA       PRO  90   3.196   9.712  -2.196
  704   1HB   PRO  90          1HB       PRO  90   1.693  10.421  -0.049
  705   2HB   PRO  90          2HB       PRO  90   3.396   9.963   0.079
  706   1HG   PRO  90          1HG       PRO  90   2.167  12.692   0.017
  707   2HG   PRO  90          2HG       PRO  90   3.469  12.075   1.050
  708   1HD   PRO  90          1HD       PRO  90   3.944  13.600  -1.136
  709   2HD   PRO  90          2HD       PRO  90   5.066  12.337  -0.590
  710    H    TRP  91           H        TRP  91   0.804   9.126  -1.878
  711    HA   TRP  91           HA       TRP  91  -1.015  11.100  -3.033
  712   1HB   TRP  91          1HB       TRP  91  -0.267   8.475  -4.284
  713   2HB   TRP  91          2HB       TRP  91  -1.869   9.158  -4.545
  714    HD1  TRP  91           HD1      TRP  91  -1.153  12.189  -4.948
  715    HE1  TRP  91           HE1      TRP  91   0.138  12.948  -7.042
  716    HE3  TRP  91           HE3      TRP  91   0.998   7.734  -6.237
  717    HZ2  TRP  91           HZ2      TRP  91   1.842  11.810  -8.982
  718    HZ3  TRP  91           HZ3      TRP  91   2.445   7.654  -8.226
  719    HH2  TRP  91           HH2      TRP  91   2.856   9.651  -9.569
  720    H    GLU  92           H        GLU  92  -3.002  11.015  -2.167
  721    HA   GLU  92           HA       GLU  92  -3.672   8.660  -0.526
  722   1HB   GLU  92          1HB       GLU  92  -3.976  11.584  -0.012
  723   2HB   GLU  92          2HB       GLU  92  -5.182  10.490   0.651
  724   1HG   GLU  92          1HG       GLU  92  -3.590  10.798   2.345
  725   2HG   GLU  92          2HG       GLU  92  -3.274   9.199   1.675
  726    H    TYR  93           H        TYR  93  -5.630   7.724  -0.793
  727    HA   TYR  93           HA       TYR  93  -7.656   9.081  -2.407
  728   1HB   TYR  93          1HB       TYR  93  -6.494   6.365  -3.050
  729   2HB   TYR  93          2HB       TYR  93  -7.984   6.986  -3.751
  730    HD1  TYR  93           HD1      TYR  93  -7.878   9.079  -5.162
  731    HD2  TYR  93           HD2      TYR  93  -4.394   6.967  -3.935
  732    HE1  TYR  93           HE1      TYR  93  -6.586  10.195  -6.932
  733    HE2  TYR  93           HE2      TYR  93  -3.092   8.079  -5.701
  734    HH   TYR  93           HH       TYR  93  -4.628  10.323  -7.981
  735    H    GLY  94           H        GLY  94  -9.766   7.975  -2.333
  736   1HA   GLY  94          1HA       GLY  94 -11.339   6.548  -1.321
  737   2HA   GLY  94          2HA       GLY  94 -10.111   6.051  -0.165
  738    H    GLU  95           H        GLU  95 -11.490   6.349   1.599
  739    HA   GLU  95           HA       GLU  95 -13.060   8.543   2.172
  740   1HB   GLU  95          1HB       GLU  95 -13.210   6.597   3.551
  741   2HB   GLU  95          2HB       GLU  95 -11.518   6.718   4.013
  742   1HG   GLU  95          1HG       GLU  95 -11.898   8.438   5.489
  743   2HG   GLU  95          2HG       GLU  95 -13.377   8.948   4.677
  Start of MODEL    8
    1   1H    ALA   2          1H        ALA   2 -14.370   0.309  18.921
    2    HA   ALA   2           HA       ALA   2 -12.821   2.304  18.261
    3   1HB   ALA   2          1HB       ALA   2 -12.373   1.874  21.197
    4   2HB   ALA   2          2HB       ALA   2 -11.141   2.597  20.162
    5   3HB   ALA   2          3HB       ALA   2 -12.712   3.377  20.340
    6    H    ARG   3           H        ARG   3 -12.016   0.883  16.790
    7    HA   ARG   3           HA       ARG   3 -10.019  -1.023  17.786
    8   1HB   ARG   3          1HB       ARG   3 -12.278  -1.589  15.882
    9   2HB   ARG   3          2HB       ARG   3 -10.803  -2.546  15.856
   10   1HG   ARG   3          1HG       ARG   3 -11.180  -3.392  18.007
   11   2HG   ARG   3          2HG       ARG   3 -12.389  -2.159  18.370
   12   1HD   ARG   3          1HD       ARG   3 -13.977  -3.155  16.935
   13   2HD   ARG   3          2HD       ARG   3 -12.760  -4.185  16.182
   14    HE   ARG   3           HE       ARG   3 -12.977  -5.668  17.920
   15   1HH1  ARG   3          1HH1      ARG   3 -14.540  -2.669  18.747
   16   2HH1  ARG   3          2HH1      ARG   3 -15.288  -3.302  20.176
   17   1HH2  ARG   3          1HH2      ARG   3 -13.957  -6.513  19.799
   18   2HH2  ARG   3          2HH2      ARG   3 -14.955  -5.488  20.774
   19    H    GLN   4           H        GLN   4  -8.119  -0.783  16.811
   20    HA   GLN   4           HA       GLN   4  -8.039   0.702  14.272
   21   1HB   GLN   4          1HB       GLN   4  -5.823   1.433  14.870
   22   2HB   GLN   4          2HB       GLN   4  -6.906   1.763  16.216
   23   1HG   GLN   4          1HG       GLN   4  -6.087  -0.200  17.385
   24   2HG   GLN   4          2HG       GLN   4  -5.035  -0.586  16.024
   25   1HE2  GLN   4          1HE2      GLN   4  -4.951   0.553  19.010
   26   2HE2  GLN   4          2HE2      GLN   4  -3.627   1.657  18.908
   27    H    VAL   5           H        VAL   5  -6.719  -0.009  12.589
   28    HA   VAL   5           HA       VAL   5  -5.803  -2.802  12.828
   29    HB   VAL   5           HB       VAL   5  -6.286  -3.109  10.465
   30   1HG1  VAL   5          1HG1      VAL   5  -8.893  -2.305  10.782
   31   2HG1  VAL   5          2HG1      VAL   5  -8.207  -3.825  11.358
   32   3HG1  VAL   5          3HG1      VAL   5  -8.320  -2.440  12.444
   33   1HG2  VAL   5          1HG2      VAL   5  -7.890  -0.789   9.962
   34   2HG2  VAL   5          2HG2      VAL   5  -6.253  -0.298  10.396
   35   3HG2  VAL   5          3HG2      VAL   5  -6.513  -1.409   9.051
   36    H    ILE   6           H        ILE   6  -3.990  -3.407  11.460
   37    HA   ILE   6           HA       ILE   6  -1.984  -1.311  11.415
   38    HB   ILE   6           HB       ILE   6  -1.683  -4.229  10.694
   39   1HG1  ILE   6          1HG1      ILE   6  -0.452  -3.963  13.090
   40   2HG1  ILE   6          2HG1      ILE   6  -1.758  -2.800  13.286
   41   1HG2  ILE   6          1HG2      ILE   6   0.160  -1.932  10.830
   42   2HG2  ILE   6          2HG2      ILE   6   0.742  -3.436  11.542
   43   3HG2  ILE   6          3HG2      ILE   6   0.239  -3.397   9.852
   44   1HD1  ILE   6          1HD1      ILE   6  -3.404  -4.464  12.979
   45   2HD1  ILE   6          2HD1      ILE   6  -2.211  -5.639  12.423
   46   3HD1  ILE   6          3HD1      ILE   6  -2.221  -5.122  14.109
   47    H    CYS   7           H        CYS   7  -0.751  -0.741   9.591
   48    HA   CYS   7           HA       CYS   7  -2.245  -0.696   7.140
   49   1HB   CYS   7          1HB       CYS   7  -0.597   0.807   6.335
   50   2HB   CYS   7          2HB       CYS   7  -0.799   1.191   8.040
   51    HG   CYS   7           HG       CYS   7   1.716   1.133   8.503
   52    H    TRP   8           H        TRP   8  -1.456  -1.419   5.080
   53    HA   TRP   8           HA       TRP   8   0.167  -3.861   5.317
   54   1HB   TRP   8          1HB       TRP   8  -1.947  -3.063   3.312
   55   2HB   TRP   8          2HB       TRP   8  -0.921  -4.483   3.125
   56    HD1  TRP   8           HD1      TRP   8  -3.387  -3.081   5.785
   57    HE1  TRP   8           HE1      TRP   8  -4.650  -5.075   6.812
   58    HE3  TRP   8           HE3      TRP   8  -1.059  -6.889   3.291
   59    HZ2  TRP   8           HZ2      TRP   8  -4.659  -7.889   6.594
   60    HZ3  TRP   8           HZ3      TRP   8  -1.754  -9.203   3.758
   61    HH2  TRP   8           HH2      TRP   8  -3.516  -9.691   5.376
   62    H    CYS   9           H        CYS   9   2.192  -3.665   4.649
   63    HA   CYS   9           HA       CYS   9   2.859  -1.620   2.662
   64   1HB   CYS   9          1HB       CYS   9   5.213  -2.067   3.349
   65   2HB   CYS   9          2HB       CYS   9   4.188  -1.533   4.676
   66    HG   CYS   9           HG       CYS   9   5.986  -4.274   4.408
   67    H    PHE  10           H        PHE  10   3.198  -2.151   0.615
   68    HA   PHE  10           HA       PHE  10   4.297  -4.777  -0.041
   69   1HB   PHE  10          1HB       PHE  10   2.590  -5.419  -1.488
   70   2HB   PHE  10          2HB       PHE  10   1.697  -4.699  -0.153
   71    HD1  PHE  10           HD2      PHE  10   1.120  -2.175  -0.406
   72    HD2  PHE  10           HD1      PHE  10   2.157  -4.735  -3.645
   73    HE1  PHE  10           HE2      PHE  10   0.018  -0.632  -1.974
   74    HE2  PHE  10           HE1      PHE  10   1.058  -3.195  -5.218
   75    HZ   PHE  10           HZ       PHE  10  -0.014  -1.142  -4.384
   76    H    THR  11           H        THR  11   4.946  -4.906  -2.363
   77    HA   THR  11           HA       THR  11   5.656  -2.257  -3.438
   78    HB   THR  11           HB       THR  11   7.494  -4.626  -3.692
   79    HG1  THR  11           HG1      THR  11   7.622  -4.381  -1.552
   80   1HG2  THR  11          1HG2      THR  11   7.502  -1.829  -4.495
   81   2HG2  THR  11          2HG2      THR  11   8.507  -3.167  -5.053
   82   3HG2  THR  11          3HG2      THR  11   8.950  -2.279  -3.595
   83    H    LEU  12           H        LEU  12   4.995  -1.957  -5.458
   84    HA   LEU  12           HA       LEU  12   4.321  -4.320  -7.077
   85   1HB   LEU  12          1HB       LEU  12   2.518  -2.656  -6.460
   86   2HB   LEU  12          2HB       LEU  12   3.347  -1.506  -7.507
   87    HG   LEU  12           HG       LEU  12   2.897  -2.856  -9.442
   88   1HD1  LEU  12          1HD1      LEU  12   1.160  -4.851  -8.650
   89   2HD1  LEU  12          2HD1      LEU  12   2.453  -4.921  -7.454
   90   3HD1  LEU  12          3HD1      LEU  12   2.832  -5.063  -9.170
   91   1HD2  LEU  12          1HD2      LEU  12   0.530  -2.394  -7.645
   92   2HD2  LEU  12          2HD2      LEU  12   0.365  -2.933  -9.317
   93   3HD2  LEU  12          3HD2      LEU  12   1.123  -1.380  -8.960
   94    H    ASN  13           H        ASN  13   5.678  -4.784  -8.664
   95    HA   ASN  13           HA       ASN  13   7.370  -2.645  -9.757
   96   1HB   ASN  13          1HB       ASN  13   7.737  -5.640  -9.983
   97   2HB   ASN  13          2HB       ASN  13   8.883  -4.402 -10.491
   98   1HD2  ASN  13          1HD2      ASN  13   9.122  -6.607  -8.552
   99   2HD2  ASN  13          2HD2      ASN  13   9.613  -5.866  -7.071
  100    H    ASN  14           H        ASN  14   7.255  -2.061 -11.848
  101    HA   ASN  14           HA       ASN  14   6.319  -1.786 -13.911
  102   1HB   ASN  14          1HB       ASN  14   6.340  -4.799 -14.059
  103   2HB   ASN  14          2HB       ASN  14   6.536  -3.647 -15.376
  104   1HD2  ASN  14          1HD2      ASN  14   8.071  -5.386 -12.856
  105   2HD2  ASN  14          2HD2      ASN  14   9.686  -4.860 -13.173
  106    HA   PRO  15           HA       PRO  15   2.073  -2.979 -12.310
  107   1HB   PRO  15          1HB       PRO  15   1.162  -0.438 -12.022
  108   2HB   PRO  15          2HB       PRO  15   2.020  -1.301 -10.741
  109   1HG   PRO  15          1HG       PRO  15   3.059   0.726 -12.682
  110   2HG   PRO  15          2HG       PRO  15   3.378   0.575 -10.944
  111   1HD   PRO  15          1HD       PRO  15   5.123  -0.290 -12.826
  112   2HD   PRO  15          2HD       PRO  15   4.947  -1.086 -11.249
  113    H    LEU  16           H        LEU  16   0.322  -3.148 -13.625
  114    HA   LEU  16           HA       LEU  16   0.593  -2.178 -16.337
  115   1HB   LEU  16          1HB       LEU  16  -1.320  -4.012 -14.937
  116   2HB   LEU  16          2HB       LEU  16  -1.651  -3.426 -16.566
  117    HG   LEU  16           HG       LEU  16   0.770  -4.393 -17.020
  118   1HD1  LEU  16          1HD1      LEU  16  -0.214  -6.020 -14.681
  119   2HD1  LEU  16          2HD1      LEU  16   1.242  -5.027 -14.735
  120   3HD1  LEU  16          3HD1      LEU  16   1.119  -6.468 -15.745
  121   1HD2  LEU  16          1HD2      LEU  16  -1.558  -5.049 -17.920
  122   2HD2  LEU  16          2HD2      LEU  16  -1.467  -6.368 -16.752
  123   3HD2  LEU  16          3HD2      LEU  16  -0.248  -6.227 -18.020
  124    H    SER  17           H        SER  17  -0.600  -0.886 -13.551
  125    HA   SER  17           HA       SER  17  -1.773   1.335 -14.772
  126   1HB   SER  17          1HB       SER  17  -4.165   0.693 -13.709
  127   2HB   SER  17          2HB       SER  17  -3.747   0.375 -15.392
  128    HG   SER  17           HG       SER  17  -4.564  -1.499 -14.462
  129    HA   PRO  18           HA       PRO  18  -1.341   2.968 -10.725
  130   1HB   PRO  18          1HB       PRO  18  -3.306   4.838 -10.631
  131   2HB   PRO  18          2HB       PRO  18  -1.842   5.030 -11.604
  132   1HG   PRO  18          1HG       PRO  18  -4.576   4.151 -12.448
  133   2HG   PRO  18          2HG       PRO  18  -3.461   5.269 -13.256
  134   1HD   PRO  18          1HD       PRO  18  -3.752   2.689 -14.027
  135   2HD   PRO  18          2HD       PRO  18  -2.211   3.561 -14.169
  136    H    LEU  19           H        LEU  19  -2.182   2.959  -8.615
  137    HA   LEU  19           HA       LEU  19  -4.086   0.921  -8.076
  138   1HB   LEU  19          1HB       LEU  19  -3.012   3.000  -6.179
  139   2HB   LEU  19          2HB       LEU  19  -3.750   1.458  -5.751
  140    HG   LEU  19           HG       LEU  19  -1.072   1.891  -7.067
  141   1HD1  LEU  19          1HD1      LEU  19  -0.109   1.293  -5.073
  142   2HD1  LEU  19          2HD1      LEU  19  -1.535   0.417  -4.519
  143   3HD1  LEU  19          3HD1      LEU  19  -1.524   2.180  -4.506
  144   1HD2  LEU  19          1HD2      LEU  19  -2.734  -0.566  -6.699
  145   2HD2  LEU  19          2HD2      LEU  19  -0.975  -0.671  -6.646
  146   3HD2  LEU  19          3HD2      LEU  19  -1.779  -0.056  -8.091
  147    H    SER  20           H        SER  20  -6.008   1.241  -6.677
  148    HA   SER  20           HA       SER  20  -7.295   3.842  -6.864
  149   1HB   SER  20          1HB       SER  20  -9.343   2.867  -7.895
  150   2HB   SER  20          2HB       SER  20  -7.948   2.832  -8.973
  151    HG   SER  20           HG       SER  20  -8.531   0.619  -7.337
  152    H    LEU  21           H        LEU  21  -9.159   4.041  -5.511
  153    HA   LEU  21           HA       LEU  21  -8.932   2.868  -3.012
  154   1HB   LEU  21          1HB       LEU  21 -10.125   4.903  -3.231
  155   2HB   LEU  21          2HB       LEU  21 -11.260   4.193  -4.378
  156    HG   LEU  21           HG       LEU  21 -12.127   2.769  -2.511
  157   1HD1  LEU  21          1HD1      LEU  21 -11.043   2.673  -0.583
  158   2HD1  LEU  21          2HD1      LEU  21 -11.309   4.399  -0.341
  159   3HD1  LEU  21          3HD1      LEU  21  -9.862   3.840  -1.179
  160   1HD2  LEU  21          1HD2      LEU  21 -13.123   4.864  -1.282
  161   2HD2  LEU  21          2HD2      LEU  21 -13.545   4.513  -2.958
  162   3HD2  LEU  21          3HD2      LEU  21 -12.331   5.740  -2.592
  163    H    HIS  22           H        HIS  22 -10.210   1.329  -1.893
  164    HA   HIS  22           HA       HIS  22 -11.558  -0.624  -3.641
  165   1HB   HIS  22          1HB       HIS  22  -9.270  -1.278  -2.636
  166   2HB   HIS  22          2HB       HIS  22 -10.133  -1.396  -1.105
  167    HD1  HIS  22           HD1      HIS  22 -10.325  -3.837  -0.701
  168    HD2  HIS  22           HD2      HIS  22 -11.300  -2.822  -4.610
  169    HE1  HIS  22           HE1      HIS  22 -11.143  -5.964  -1.764
  170    H    ASP  23           H        ASP  23 -13.592  -1.099  -3.124
  171    HA   ASP  23           HA       ASP  23 -15.042   0.263  -1.192
  172   1HB   ASP  23          1HB       ASP  23 -15.577  -2.314  -2.657
  173   2HB   ASP  23          2HB       ASP  23 -16.738  -1.640  -1.517
  174    H    SER  24           H        SER  24 -13.070  -2.550  -0.885
  175    HA   SER  24           HA       SER  24 -14.238  -3.410   1.613
  176   1HB   SER  24          1HB       SER  24 -12.734  -4.670  -0.321
  177   2HB   SER  24          2HB       SER  24 -11.566  -4.438   0.980
  178    HG   SER  24           HG       SER  24 -12.820  -6.415   1.100
  179    H    MET  25           H        MET  25 -11.310  -1.733   0.552
  180    HA   MET  25           HA       MET  25 -10.266  -1.477   3.215
  181   1HB   MET  25          1HB       MET  25  -8.431  -0.412   2.250
  182   2HB   MET  25          2HB       MET  25  -8.960  -1.512   0.984
  183   1HG   MET  25          1HG       MET  25 -10.046   0.279  -0.191
  184   2HG   MET  25          2HG       MET  25  -9.702   1.399   1.125
  185   1HE   MET  25          1HE       MET  25  -8.087  -1.332  -0.747
  186   2HE   MET  25          2HE       MET  25  -7.501  -0.400  -2.125
  187   3HE   MET  25          3HE       MET  25  -6.388  -0.869  -0.839
  188    H    LYS  26           H        LYS  26  -9.452   1.009   3.603
  189    HA   LYS  26           HA       LYS  26 -11.886   2.666   3.503
  190   1HB   LYS  26          1HB       LYS  26 -10.497   1.669   5.787
  191   2HB   LYS  26          2HB       LYS  26 -10.288   3.415   5.738
  192   1HG   LYS  26          1HG       LYS  26 -12.971   3.072   5.194
  193   2HG   LYS  26          2HG       LYS  26 -12.627   1.838   6.408
  194   1HD   LYS  26          1HD       LYS  26 -11.297   4.083   7.340
  195   2HD   LYS  26          2HD       LYS  26 -12.806   4.724   6.686
  196   1HE   LYS  26          1HE       LYS  26 -14.113   3.471   8.146
  197   2HE   LYS  26          2HE       LYS  26 -12.818   2.319   8.471
  198   1HZ   LYS  26          1HZ       LYS  26 -12.236   5.043   9.240
  199   2HZ   LYS  26          2HZ       LYS  26 -11.977   3.601  10.084
  200   3HZ   LYS  26          3HZ       LYS  26 -13.503   4.330  10.104
  201    H    TYR  27           H        TYR  27  -8.362   2.600   3.607
  202    HA   TYR  27           HA       TYR  27  -8.345   5.206   2.254
  203   1HB   TYR  27          1HB       TYR  27  -7.726   5.153   4.831
  204   2HB   TYR  27          2HB       TYR  27  -6.170   4.613   4.211
  205    HD1  TYR  27           HD1      TYR  27  -8.695   7.246   3.362
  206    HD2  TYR  27           HD2      TYR  27  -4.596   6.268   3.949
  207    HE1  TYR  27           HE1      TYR  27  -8.077   9.582   2.899
  208    HE2  TYR  27           HE2      TYR  27  -3.967   8.601   3.490
  209    HH   TYR  27           HH       TYR  27  -5.205  10.913   3.680
  210    H    LEU  28           H        LEU  28  -6.573   5.565   0.865
  211    HA   LEU  28           HA       LEU  28  -4.899   3.212   0.309
  212   1HB   LEU  28          1HB       LEU  28  -6.501   3.090  -1.389
  213   2HB   LEU  28          2HB       LEU  28  -6.543   4.840  -1.596
  214    HG   LEU  28           HG       LEU  28  -4.446   4.823  -2.746
  215   1HD1  LEU  28          1HD1      LEU  28  -3.719   2.205  -3.163
  216   2HD1  LEU  28          2HD1      LEU  28  -4.162   2.231  -1.456
  217   3HD1  LEU  28          3HD1      LEU  28  -2.931   3.338  -2.064
  218   1HD2  LEU  28          1HD2      LEU  28  -6.119   2.530  -3.765
  219   2HD2  LEU  28          2HD2      LEU  28  -4.999   3.519  -4.702
  220   3HD2  LEU  28          3HD2      LEU  28  -6.468   4.237  -4.038
  221    H    VAL  29           H        VAL  29  -2.799   3.657   0.235
  222    HA   VAL  29           HA       VAL  29  -1.925   6.350  -0.534
  223    HB   VAL  29           HB       VAL  29  -0.964   4.890   1.931
  224   1HG1  VAL  29          1HG1      VAL  29   0.275   6.919   0.284
  225   2HG1  VAL  29          2HG1      VAL  29   0.039   7.481   1.941
  226   3HG1  VAL  29          3HG1      VAL  29   0.944   5.998   1.631
  227   1HG2  VAL  29          1HG2      VAL  29  -2.866   7.109   1.463
  228   2HG2  VAL  29          2HG2      VAL  29  -2.845   5.880   2.729
  229   3HG2  VAL  29          3HG2      VAL  29  -1.768   7.272   2.833
  230    H    TYR  30           H        TYR  30  -0.454   6.220  -2.084
  231    HA   TYR  30           HA       TYR  30   1.637   4.219  -1.989
  232   1HB   TYR  30          1HB       TYR  30   1.159   3.108  -3.986
  233   2HB   TYR  30          2HB       TYR  30  -0.425   3.263  -3.235
  234    HD1  TYR  30           HD2      TYR  30  -1.961   5.111  -4.024
  235    HD2  TYR  30           HD1      TYR  30   1.591   4.039  -6.107
  236    HE1  TYR  30           HE2      TYR  30  -2.812   6.232  -6.041
  237    HE2  TYR  30           HE1      TYR  30   0.750   5.158  -8.129
  238    HH   TYR  30           HH       TYR  30  -0.817   6.740  -8.841
  239    H    GLN  31           H        GLN  31   3.357   4.635  -3.508
  240    HA   GLN  31           HA       GLN  31   3.275   7.242  -4.835
  241   1HB   GLN  31          1HB       GLN  31   5.678   6.498  -3.199
  242   2HB   GLN  31          2HB       GLN  31   5.195   8.080  -3.796
  243   1HG   GLN  31          1HG       GLN  31   3.242   7.960  -2.219
  244   2HG   GLN  31          2HG       GLN  31   3.995   6.526  -1.523
  245   1HE2  GLN  31          1HE2      GLN  31   4.095   7.677   0.465
  246   2HE2  GLN  31          2HE2      GLN  31   5.342   8.839   0.746
  247    H    THR  32           H        THR  32   4.964   7.538  -6.422
  248    HA   THR  32           HA       THR  32   5.742   4.988  -7.630
  249    HB   THR  32           HB       THR  32   5.723   7.778  -8.796
  250    HG1  THR  32           HG1      THR  32   3.966   6.873 -10.023
  251   1HG2  THR  32          1HG2      THR  32   6.308   5.124 -10.115
  252   2HG2  THR  32          2HG2      THR  32   7.478   6.407  -9.806
  253   3HG2  THR  32          3HG2      THR  32   6.157   6.673 -10.943
  254    H    GLU  33           H        GLU  33   7.801   4.332  -7.795
  255    HA   GLU  33           HA       GLU  33   9.920   6.246  -7.067
  256   1HB   GLU  33          1HB       GLU  33   9.328   3.541  -6.035
  257   2HB   GLU  33          2HB       GLU  33  11.020   3.866  -6.381
  258   1HG   GLU  33          1HG       GLU  33  10.183   6.112  -5.007
  259   2HG   GLU  33          2HG       GLU  33   9.363   4.781  -4.193
  260    H    GLN  34           H        GLN  34  12.058   5.727  -7.940
  261    HA   GLN  34           HA       GLN  34  11.817   4.605 -10.638
  262   1HB   GLN  34          1HB       GLN  34  13.037   6.934  -9.639
  263   2HB   GLN  34          2HB       GLN  34  14.354   5.870 -10.114
  264   1HG   GLN  34          1HG       GLN  34  12.323   5.869 -12.134
  265   2HG   GLN  34          2HG       GLN  34  12.800   7.523 -11.753
  266   1HE2  GLN  34          1HE2      GLN  34  15.418   7.322 -11.200
  267   2HE2  GLN  34          2HE2      GLN  34  16.295   6.757 -12.577
  268    H    GLY  35           H        GLY  35  12.754   2.738 -11.166
  269   1HA   GLY  35          1HA       GLY  35  15.149   1.689 -10.683
  270   2HA   GLY  35          2HA       GLY  35  14.352   1.368  -9.150
  271    H    GLU  36           H        GLU  36  15.350  -0.657 -10.796
  272    HA   GLU  36           HA       GLU  36  14.762  -2.693 -11.623
  273   1HB   GLU  36          1HB       GLU  36  13.314  -3.292  -9.971
  274   2HB   GLU  36          2HB       GLU  36  12.356  -1.827 -10.133
  275   1HG   GLU  36          1HG       GLU  36  11.091  -3.828 -10.732
  276   2HG   GLU  36          2HG       GLU  36  11.257  -2.719 -12.091
  277    H    ALA  37           H        ALA  37  14.760  -3.041 -13.733
  278    HA   ALA  37           HA       ALA  37  14.298  -2.871 -15.959
  279   1HB   ALA  37          1HB       ALA  37  11.883  -2.887 -16.551
  280   2HB   ALA  37          2HB       ALA  37  12.333  -4.106 -15.357
  281   3HB   ALA  37          3HB       ALA  37  11.507  -2.634 -14.846
  282    H    GLY  38           H        GLY  38  12.719  -1.441 -17.551
  283   1HA   GLY  38          1HA       GLY  38  13.718   1.254 -17.165
  284   2HA   GLY  38          2HA       GLY  38  12.908   0.634 -18.596
  285    H    ASN  39           H        ASN  39  11.039  -0.285 -16.066
  286    HA   ASN  39           HA       ASN  39   9.257   2.012 -16.451
  287   1HB   ASN  39          1HB       ASN  39   8.622  -0.704 -15.276
  288   2HB   ASN  39          2HB       ASN  39   7.463   0.555 -15.693
  289   1HD2  ASN  39          1HD2      ASN  39   9.847  -1.663 -17.017
  290   2HD2  ASN  39          2HD2      ASN  39   9.139  -1.775 -18.589
  291    H    ILE  40           H        ILE  40   7.651   1.859 -14.265
  292    HA   ILE  40           HA       ILE  40   9.494   2.482 -12.051
  293    HB   ILE  40           HB       ILE  40   7.469   3.890 -11.237
  294   1HG1  ILE  40          1HG1      ILE  40   6.914   3.854 -14.209
  295   2HG1  ILE  40          2HG1      ILE  40   5.948   2.991 -13.017
  296   1HG2  ILE  40          1HG2      ILE  40   8.955   4.916 -13.642
  297   2HG2  ILE  40          2HG2      ILE  40   8.386   5.823 -12.242
  298   3HG2  ILE  40          3HG2      ILE  40   9.719   4.682 -12.070
  299   1HD1  ILE  40          1HD1      ILE  40   6.387   5.944 -12.821
  300   2HD1  ILE  40          2HD1      ILE  40   5.114   5.260 -13.832
  301   3HD1  ILE  40          3HD1      ILE  40   5.118   4.958 -12.095
  302    H    HIS  41           H        HIS  41   8.442   2.303  -9.858
  303    HA   HIS  41           HA       HIS  41   6.532   0.068  -9.758
  304   1HB   HIS  41          1HB       HIS  41   7.900  -0.551  -7.598
  305   2HB   HIS  41          2HB       HIS  41   8.444  -1.093  -9.183
  306    HD1  HIS  41           HD1      HIS  41  10.923  -1.137  -8.784
  307    HD2  HIS  41           HD2      HIS  41   9.195   2.487  -7.715
  308    HE1  HIS  41           HE1      HIS  41  12.847   0.403  -8.280
  309    H    PHE  42           H        PHE  42   5.091   0.066  -8.033
  310    HA   PHE  42           HA       PHE  42   4.815   2.656  -6.698
  311   1HB   PHE  42          1HB       PHE  42   2.851   0.375  -7.001
  312   2HB   PHE  42          2HB       PHE  42   2.506   1.905  -6.201
  313    HD1  PHE  42           HD1      PHE  42   4.118   3.587  -8.238
  314    HD2  PHE  42           HD2      PHE  42   1.125   0.588  -8.641
  315    HE1  PHE  42           HE1      PHE  42   3.437   4.561 -10.392
  316    HE2  PHE  42           HE2      PHE  42   0.440   1.556 -10.797
  317    HZ   PHE  42           HZ       PHE  42   1.597   3.545 -11.675
  318    H    GLN  43           H        GLN  43   4.851   2.905  -4.519
  319    HA   GLN  43           HA       GLN  43   4.942   0.550  -2.802
  320   1HB   GLN  43          1HB       GLN  43   7.255   2.173  -3.487
  321   2HB   GLN  43          2HB       GLN  43   6.964   2.146  -1.753
  322   1HG   GLN  43          1HG       GLN  43   7.550  -0.010  -1.552
  323   2HG   GLN  43          2HG       GLN  43   6.810  -0.465  -3.086
  324   1HE2  GLN  43          1HE2      GLN  43   7.993   0.428  -5.041
  325   2HE2  GLN  43          2HE2      GLN  43   9.717   0.314  -5.010
  326    H    GLY  44           H        GLY  44   3.914   0.866  -0.917
  327   1HA   GLY  44          1HA       GLY  44   3.862   3.241   0.565
  328   2HA   GLY  44          2HA       GLY  44   2.436   3.222  -0.463
  329    H    TYR  45           H        TYR  45   1.348   3.250   1.669
  330    HA   TYR  45           HA       TYR  45   1.108   0.518   2.750
  331   1HB   TYR  45          1HB       TYR  45   0.356   1.673   4.884
  332   2HB   TYR  45          2HB       TYR  45   2.062   1.834   4.481
  333    HD1  TYR  45           HD1      TYR  45  -1.164   3.589   4.659
  334    HD2  TYR  45           HD2      TYR  45   3.006   3.972   3.908
  335    HE1  TYR  45           HE1      TYR  45  -1.369   6.036   4.803
  336    HE2  TYR  45           HE2      TYR  45   2.813   6.420   4.051
  337    HH   TYR  45           HH       TYR  45   1.427   8.115   4.830
  338    H    ILE  46           H        ILE  46  -0.933  -0.285   3.136
  339    HA   ILE  46           HA       ILE  46  -3.216   1.416   2.419
  340    HB   ILE  46           HB       ILE  46  -2.813  -1.398   1.397
  341   1HG1  ILE  46          1HG1      ILE  46  -2.885   1.192  -0.163
  342   2HG1  ILE  46          2HG1      ILE  46  -1.400   0.368   0.301
  343   1HG2  ILE  46          1HG2      ILE  46  -5.169   0.066   1.842
  344   2HG2  ILE  46          2HG2      ILE  46  -4.896   0.080   0.101
  345   3HG2  ILE  46          3HG2      ILE  46  -4.990  -1.454   0.966
  346   1HD1  ILE  46          1HD1      ILE  46  -2.167  -0.044  -2.038
  347   2HD1  ILE  46          2HD1      ILE  46  -1.918  -1.498  -1.070
  348   3HD1  ILE  46          3HD1      ILE  46  -3.552  -0.904  -1.366
  349    H    GLU  47           H        GLU  47  -4.879   1.251   3.786
  350    HA   GLU  47           HA       GLU  47  -4.810  -0.920   5.769
  351   1HB   GLU  47          1HB       GLU  47  -6.352   1.656   6.026
  352   2HB   GLU  47          2HB       GLU  47  -5.915   0.521   7.296
  353   1HG   GLU  47          1HG       GLU  47  -3.486   1.294   6.222
  354   2HG   GLU  47          2HG       GLU  47  -4.445   2.773   6.234
  355    H    MET  48           H        MET  48  -6.250  -2.483   5.521
  356    HA   MET  48           HA       MET  48  -8.491  -2.174   3.737
  357   1HB   MET  48          1HB       MET  48  -7.602  -4.492   5.460
  358   2HB   MET  48          2HB       MET  48  -8.946  -4.556   4.328
  359   1HG   MET  48          1HG       MET  48  -6.052  -4.088   3.657
  360   2HG   MET  48          2HG       MET  48  -6.989  -5.546   3.341
  361   1HE   MET  48          1HE       MET  48  -9.013  -4.894   0.310
  362   2HE   MET  48          2HE       MET  48  -8.584  -5.929   1.671
  363   3HE   MET  48          3HE       MET  48  -9.761  -4.633   1.886
  364    H    LYS  49           H        LYS  49 -10.590  -3.407   4.656
  365    HA   LYS  49           HA       LYS  49 -11.916  -1.643   6.299
  366   1HB   LYS  49          1HB       LYS  49 -12.558  -3.986   4.962
  367   2HB   LYS  49          2HB       LYS  49 -12.876  -4.376   6.647
  368   1HG   LYS  49          1HG       LYS  49 -14.546  -2.802   6.839
  369   2HG   LYS  49          2HG       LYS  49 -13.930  -1.832   5.499
  370   1HD   LYS  49          1HD       LYS  49 -15.968  -2.943   4.825
  371   2HD   LYS  49          2HD       LYS  49 -14.604  -3.625   3.937
  372   1HE   LYS  49          1HE       LYS  49 -15.275  -5.634   4.618
  373   2HE   LYS  49          2HE       LYS  49 -14.804  -5.166   6.251
  374   1HZ   LYS  49          1HZ       LYS  49 -17.103  -4.162   6.418
  375   2HZ   LYS  49          2HZ       LYS  49 -17.020  -5.851   6.410
  376   3HZ   LYS  49          3HZ       LYS  49 -17.486  -5.021   5.012
  377    H    LYS  50           H        LYS  50 -10.825  -4.887   7.317
  378    HA   LYS  50           HA       LYS  50  -9.576  -4.077   9.677
  379   1HB   LYS  50          1HB       LYS  50 -12.452  -4.119   9.842
  380   2HB   LYS  50          2HB       LYS  50 -11.771  -5.336  10.914
  381   1HG   LYS  50          1HG       LYS  50 -10.501  -3.710  12.090
  382   2HG   LYS  50          2HG       LYS  50 -10.874  -2.466  10.894
  383   1HD   LYS  50          1HD       LYS  50 -13.142  -3.801  12.279
  384   2HD   LYS  50          2HD       LYS  50 -12.182  -2.636  13.193
  385   1HE   LYS  50          1HE       LYS  50 -12.904  -1.719  10.515
  386   2HE   LYS  50          2HE       LYS  50 -14.296  -2.034  11.550
  387   1HZ   LYS  50          1HZ       LYS  50 -12.005  -0.258  12.201
  388   2HZ   LYS  50          2HZ       LYS  50 -13.309  -0.583  13.228
  389   3HZ   LYS  50          3HZ       LYS  50 -13.564   0.244  11.775
  390    H    ARG  51           H        ARG  51 -11.970  -6.673   9.256
  391    HA   ARG  51           HA       ARG  51  -9.940  -8.641   9.912
  392   1HB   ARG  51          1HB       ARG  51 -12.457  -8.554  10.676
  393   2HB   ARG  51          2HB       ARG  51 -12.738  -9.366   9.141
  394   1HG   ARG  51          1HG       ARG  51 -11.062 -11.089   9.855
  395   2HG   ARG  51          2HG       ARG  51 -11.067 -10.327  11.447
  396   1HD   ARG  51          1HD       ARG  51 -13.710 -10.981  10.310
  397   2HD   ARG  51          2HD       ARG  51 -12.696 -12.355  10.750
  398    HE   ARG  51           HE       ARG  51 -12.694 -10.529  12.873
  399   1HH1  ARG  51          1HH1      ARG  51 -14.863 -12.705  11.235
  400   2HH1  ARG  51          2HH1      ARG  51 -15.843 -12.991  12.635
  401   1HH2  ARG  51          1HH2      ARG  51 -13.976 -10.897  14.723
  402   2HH2  ARG  51          2HH2      ARG  51 -15.338 -11.961  14.619
  403    H    THR  52           H        THR  52  -9.187  -7.529   7.601
  404    HA   THR  52           HA       THR  52  -9.987  -9.457   5.520
  405    HB   THR  52           HB       THR  52  -8.574  -6.894   4.875
  406    HG1  THR  52           HG1      THR  52 -11.367  -7.218   5.347
  407   1HG2  THR  52          1HG2      THR  52 -10.629  -8.530   3.383
  408   2HG2  THR  52          2HG2      THR  52  -8.884  -8.625   3.141
  409   3HG2  THR  52          3HG2      THR  52  -9.748  -7.135   2.761
  410    H    SER  53           H        SER  53  -8.538 -11.006   5.213
  411    HA   SER  53           HA       SER  53  -5.823 -10.752   6.104
  412   1HB   SER  53          1HB       SER  53  -5.687 -13.055   4.846
  413   2HB   SER  53          2HB       SER  53  -6.590 -12.928   6.356
  414    HG   SER  53           HG       SER  53  -7.712 -12.731   3.755
  415    H    LEU  54           H        LEU  54  -4.136 -11.769   4.425
  416    HA   LEU  54           HA       LEU  54  -3.519  -9.794   2.595
  417   1HB   LEU  54          1HB       LEU  54  -1.864 -11.357   3.351
  418   2HB   LEU  54          2HB       LEU  54  -2.738 -12.703   2.624
  419    HG   LEU  54           HG       LEU  54  -2.245 -11.760   0.387
  420   1HD1  LEU  54          1HD1      LEU  54  -1.966  -9.407   1.240
  421   2HD1  LEU  54          2HD1      LEU  54  -0.745  -9.953   0.091
  422   3HD1  LEU  54          3HD1      LEU  54  -0.370  -9.890   1.813
  423   1HD2  LEU  54          1HD2      LEU  54  -0.737 -13.404   0.775
  424   2HD2  LEU  54          2HD2      LEU  54  -0.194 -12.702   2.299
  425   3HD2  LEU  54          3HD2      LEU  54   0.385 -12.043   0.768
  426    H    ALA  55           H        ALA  55  -5.585 -12.577   2.230
  427    HA   ALA  55           HA       ALA  55  -5.717 -12.816  -0.530
  428   1HB   ALA  55          1HB       ALA  55  -8.043 -13.138   1.360
  429   2HB   ALA  55          2HB       ALA  55  -7.834 -13.896  -0.219
  430   3HB   ALA  55          3HB       ALA  55  -6.779 -14.345   1.121
  431    H    GLY  56           H        GLY  56  -7.227 -10.467   1.598
  432   1HA   GLY  56          1HA       GLY  56  -9.012  -9.399  -0.359
  433   2HA   GLY  56          2HA       GLY  56  -8.571  -8.645   1.166
  434    H    MET  57           H        MET  57  -5.816  -8.416   0.828
  435    HA   MET  57           HA       MET  57  -5.694  -6.077  -0.799
  436   1HB   MET  57          1HB       MET  57  -3.574  -7.627   0.689
  437   2HB   MET  57          2HB       MET  57  -3.245  -6.138  -0.187
  438   1HG   MET  57          1HG       MET  57  -5.466  -5.996   1.727
  439   2HG   MET  57          2HG       MET  57  -3.875  -6.269   2.433
  440   1HE   MET  57          1HE       MET  57  -5.611  -4.091  -0.376
  441   2HE   MET  57          2HE       MET  57  -4.433  -2.788  -0.523
  442   3HE   MET  57          3HE       MET  57  -3.983  -4.437  -0.959
  443    H    LYS  58           H        LYS  58  -4.209  -9.300  -1.031
  444    HA   LYS  58           HA       LYS  58  -2.744  -8.940  -3.353
  445   1HB   LYS  58          1HB       LYS  58  -2.630 -11.286  -3.519
  446   2HB   LYS  58          2HB       LYS  58  -2.812 -10.967  -1.799
  447   1HG   LYS  58          1HG       LYS  58  -5.157 -11.530  -1.901
  448   2HG   LYS  58          2HG       LYS  58  -5.056 -11.742  -3.651
  449   1HD   LYS  58          1HD       LYS  58  -5.009 -13.890  -2.464
  450   2HD   LYS  58          2HD       LYS  58  -3.514 -13.601  -3.357
  451   1HE   LYS  58          1HE       LYS  58  -2.287 -13.218  -1.431
  452   2HE   LYS  58          2HE       LYS  58  -3.715 -12.807  -0.482
  453   1HZ   LYS  58          1HZ       LYS  58  -2.575 -15.073  -0.124
  454   2HZ   LYS  58          2HZ       LYS  58  -3.382 -15.536  -1.536
  455   3HZ   LYS  58          3HZ       LYS  58  -4.264 -15.012  -0.192
  456    H    LYS  59           H        LYS  59  -6.175  -9.496  -2.939
  457    HA   LYS  59           HA       LYS  59  -6.885 -10.234  -5.527
  458   1HB   LYS  59          1HB       LYS  59  -8.241  -9.133  -3.180
  459   2HB   LYS  59          2HB       LYS  59  -8.987  -8.650  -4.698
  460   1HG   LYS  59          1HG       LYS  59  -8.311 -11.519  -4.261
  461   2HG   LYS  59          2HG       LYS  59  -9.736 -10.832  -3.477
  462   1HD   LYS  59          1HD       LYS  59  -9.729  -9.970  -6.180
  463   2HD   LYS  59          2HD       LYS  59  -9.432 -11.710  -6.167
  464   1HE   LYS  59          1HE       LYS  59 -11.746 -11.590  -6.215
  465   2HE   LYS  59          2HE       LYS  59 -11.406 -11.791  -4.497
  466   1HZ   LYS  59          1HZ       LYS  59 -12.186  -9.763  -4.024
  467   2HZ   LYS  59          2HZ       LYS  59 -12.969  -9.869  -5.519
  468   3HZ   LYS  59          3HZ       LYS  59 -11.497  -9.046  -5.393
  469    H    LEU  60           H        LEU  60  -6.160  -7.077  -4.182
  470    HA   LEU  60           HA       LEU  60  -7.007  -5.668  -6.556
  471   1HB   LEU  60          1HB       LEU  60  -5.611  -4.825  -4.031
  472   2HB   LEU  60          2HB       LEU  60  -5.895  -3.716  -5.371
  473    HG   LEU  60           HG       LEU  60  -8.365  -4.258  -5.099
  474   1HD1  LEU  60          1HD1      LEU  60  -7.226  -5.933  -3.023
  475   2HD1  LEU  60          2HD1      LEU  60  -8.844  -5.939  -3.722
  476   3HD1  LEU  60          3HD1      LEU  60  -8.459  -4.837  -2.400
  477   1HD2  LEU  60          1HD2      LEU  60  -6.670  -2.428  -3.783
  478   2HD2  LEU  60          2HD2      LEU  60  -7.855  -2.976  -2.597
  479   3HD2  LEU  60          3HD2      LEU  60  -8.394  -2.268  -4.120
  480    H    ILE  61           H        ILE  61  -3.977  -6.712  -5.090
  481    HA   ILE  61           HA       ILE  61  -2.563  -5.818  -7.517
  482    HB   ILE  61           HB       ILE  61  -1.077  -6.470  -5.013
  483   1HG1  ILE  61          1HG1      ILE  61  -2.842  -4.991  -4.218
  484   2HG1  ILE  61          2HG1      ILE  61  -1.311  -4.123  -4.260
  485   1HG2  ILE  61          1HG2      ILE  61  -0.596  -4.285  -7.020
  486   2HG2  ILE  61          2HG2      ILE  61   0.546  -4.997  -5.880
  487   3HG2  ILE  61          3HG2      ILE  61  -0.026  -5.937  -7.258
  488   1HD1  ILE  61          1HD1      ILE  61  -2.203  -2.568  -5.547
  489   2HD1  ILE  61          2HD1      ILE  61  -2.651  -3.776  -6.752
  490   3HD1  ILE  61          3HD1      ILE  61  -3.756  -3.395  -5.432
  491    HA   PRO  62           HA       PRO  62  -2.519 -10.434  -7.625
  492   1HB   PRO  62          1HB       PRO  62  -2.827 -10.588 -10.318
  493   2HB   PRO  62          2HB       PRO  62  -4.190 -10.444  -9.202
  494   1HG   PRO  62          1HG       PRO  62  -2.844  -8.324 -10.832
  495   2HG   PRO  62          2HG       PRO  62  -4.574  -8.591 -10.553
  496   1HD   PRO  62          1HD       PRO  62  -3.156  -6.711  -9.216
  497   2HD   PRO  62          2HD       PRO  62  -4.527  -7.572  -8.486
  498    H    GLY  63           H        GLY  63  -0.345 -10.646  -7.121
  499   1HA   GLY  63          1HA       GLY  63   1.686 -11.557  -8.014
  500   2HA   GLY  63          2HA       GLY  63   1.467 -10.550  -9.438
  501    H    ALA  64           H        ALA  64   1.448  -9.811  -5.955
  502    HA   ALA  64           HA       ALA  64   3.783  -8.082  -6.369
  503   1HB   ALA  64          1HB       ALA  64   1.214  -7.244  -5.032
  504   2HB   ALA  64          2HB       ALA  64   2.717  -6.321  -4.990
  505   3HB   ALA  64          3HB       ALA  64   1.895  -6.598  -6.525
  506    H    HIS  65           H        HIS  65   4.786  -7.402  -4.297
  507    HA   HIS  65           HA       HIS  65   4.748  -9.641  -2.421
  508   1HB   HIS  65          1HB       HIS  65   6.880  -8.651  -3.501
  509   2HB   HIS  65          2HB       HIS  65   6.687  -7.343  -2.337
  510    HD1  HIS  65           HD1      HIS  65   8.966  -9.676  -2.511
  511    HD2  HIS  65           HD2      HIS  65   5.878  -9.302   0.243
  512    HE1  HIS  65           HE1      HIS  65   9.716 -10.958  -0.481
  513    H    PHE  66           H        PHE  66   3.398  -9.465  -0.761
  514    HA   PHE  66           HA       PHE  66   2.987  -6.812   0.446
  515   1HB   PHE  66          1HB       PHE  66   1.195  -9.103  -0.068
  516   2HB   PHE  66          2HB       PHE  66   0.992  -8.325   1.498
  517    HD1  PHE  66           HD1      PHE  66   0.949  -7.754  -2.148
  518    HD2  PHE  66           HD2      PHE  66  -0.069  -6.231   1.693
  519    HE1  PHE  66           HE1      PHE  66  -0.395  -5.986  -3.209
  520    HE2  PHE  66           HE2      PHE  66  -1.415  -4.462   0.639
  521    HZ   PHE  66           HZ       PHE  66  -1.580  -4.338  -1.815
  522    H    GLU  67           H        GLU  67   2.757  -6.716   2.777
  523    HA   GLU  67           HA       GLU  67   3.771  -8.962   4.313
  524   1HB   GLU  67          1HB       GLU  67   5.418  -6.680   3.573
  525   2HB   GLU  67          2HB       GLU  67   5.298  -6.866   5.317
  526   1HG   GLU  67          1HG       GLU  67   5.949  -9.275   4.991
  527   2HG   GLU  67          2HG       GLU  67   6.314  -8.862   3.317
  528    H    LYS  68           H        LYS  68   2.288  -9.121   5.854
  529    HA   LYS  68           HA       LYS  68   1.166  -6.667   7.016
  530   1HB   LYS  68          1HB       LYS  68  -0.331  -8.481   6.003
  531   2HB   LYS  68          2HB       LYS  68   0.101  -9.460   7.399
  532   1HG   LYS  68          1HG       LYS  68  -0.677  -7.261   8.679
  533   2HG   LYS  68          2HG       LYS  68  -1.642  -7.078   7.213
  534   1HD   LYS  68          1HD       LYS  68  -2.452  -9.423   7.559
  535   2HD   LYS  68          2HD       LYS  68  -1.631  -9.412   9.121
  536   1HE   LYS  68          1HE       LYS  68  -3.486  -7.175   8.512
  537   2HE   LYS  68          2HE       LYS  68  -4.190  -8.753   8.859
  538   1HZ   LYS  68          1HZ       LYS  68  -3.918  -8.312  10.997
  539   2HZ   LYS  68          2HZ       LYS  68  -3.108  -6.866  10.657
  540   3HZ   LYS  68          3HZ       LYS  68  -2.240  -8.313  10.777
  541    H    ARG  69           H        ARG  69   3.772  -8.146   7.641
  542    HA   ARG  69           HA       ARG  69   3.453  -9.165  10.295
  543   1HB   ARG  69          1HB       ARG  69   5.773  -8.546   8.513
  544   2HB   ARG  69          2HB       ARG  69   6.061  -8.786  10.231
  545   1HG   ARG  69          1HG       ARG  69   5.267 -11.007  10.154
  546   2HG   ARG  69          2HG       ARG  69   4.582 -10.782   8.543
  547   1HD   ARG  69          1HD       ARG  69   6.511 -11.888   8.008
  548   2HD   ARG  69          2HD       ARG  69   7.076 -10.220   7.924
  549    HE   ARG  69           HE       ARG  69   7.407 -11.456  10.505
  550   1HH1  ARG  69          1HH1      ARG  69   8.820 -10.899   7.373
  551   2HH1  ARG  69          2HH1      ARG  69  10.446 -11.139   7.919
  552   1HH2  ARG  69          1HH2      ARG  69   9.544 -11.776  11.237
  553   2HH2  ARG  69          2HH2      ARG  69  10.857 -11.639  10.117
  554    H    ARG  70           H        ARG  70   3.233  -6.105   9.127
  555    HA   ARG  70           HA       ARG  70   3.153  -4.060  10.126
  556   1HB   ARG  70          1HB       ARG  70   3.858  -5.360  12.748
  557   2HB   ARG  70          2HB       ARG  70   2.926  -3.895  12.471
  558   1HG   ARG  70          1HG       ARG  70   1.106  -5.138  12.705
  559   2HG   ARG  70          2HG       ARG  70   1.499  -5.864  11.145
  560   1HD   ARG  70          1HD       ARG  70   2.267  -7.782  12.078
  561   2HD   ARG  70          2HD       ARG  70   2.909  -6.958  13.499
  562    HE   ARG  70           HE       ARG  70   0.142  -6.827  13.663
  563   1HH1  ARG  70          1HH1      ARG  70   2.622  -9.270  13.641
  564   2HH1  ARG  70          2HH1      ARG  70   1.719 -10.381  14.616
  565   1HH2  ARG  70          1HH2      ARG  70  -1.057  -8.281  14.947
  566   2HH2  ARG  70          2HH2      ARG  70  -0.374  -9.817  15.358
  567    H    GLY  71           H        GLY  71   5.438  -4.620   8.825
  568   1HA   GLY  71          1HA       GLY  71   7.783  -4.324  10.430
  569   2HA   GLY  71          2HA       GLY  71   7.694  -4.170   8.682
  570    H    THR  72           H        THR  72   5.391  -2.142   9.659
  571    HA   THR  72           HA       THR  72   6.979   0.076  10.575
  572    HB   THR  72           HB       THR  72   5.682   0.881   8.084
  573    HG1  THR  72           HG1      THR  72   6.390  -0.994   7.187
  574   1HG2  THR  72          1HG2      THR  72   7.075   2.515   8.840
  575   2HG2  THR  72          2HG2      THR  72   8.237   1.642   7.841
  576   3HG2  THR  72          3HG2      THR  72   8.191   1.370   9.582
  577    H    GLN  73           H        GLN  73   4.577  -1.372  11.374
  578    HA   GLN  73           HA       GLN  73   2.197  -0.078  10.799
  579   1HB   GLN  73          1HB       GLN  73   2.156  -2.111  12.054
  580   2HB   GLN  73          2HB       GLN  73   3.141  -1.414  13.333
  581   1HG   GLN  73          1HG       GLN  73   0.690   0.074  12.880
  582   2HG   GLN  73          2HG       GLN  73   0.398  -1.611  13.306
  583   1HE2  GLN  73          1HE2      GLN  73   1.481  -2.414  15.249
  584   2HE2  GLN  73          2HE2      GLN  73   1.713  -1.332  16.575
  585    H    GLY  74           H        GLY  74   2.119   2.104  10.728
  586   1HA   GLY  74          1HA       GLY  74   1.603   4.123  11.829
  587   2HA   GLY  74          2HA       GLY  74   2.389   3.508  13.276
  588    H    GLU  75           H        GLU  75   4.730   2.665  11.552
  589    HA   GLU  75           HA       GLU  75   6.203   5.116  11.853
  590   1HB   GLU  75          1HB       GLU  75   6.858   2.292  11.167
  591   2HB   GLU  75          2HB       GLU  75   7.999   3.539  10.683
  592   1HG   GLU  75          1HG       GLU  75   7.164   3.896  13.420
  593   2HG   GLU  75          2HG       GLU  75   7.828   2.285  13.153
  594    H    ALA  76           H        ALA  76   4.704   3.372   9.251
  595    HA   ALA  76           HA       ALA  76   6.112   4.566   7.101
  596   1HB   ALA  76          1HB       ALA  76   4.588   2.472   7.128
  597   2HB   ALA  76          2HB       ALA  76   3.283   3.626   6.852
  598   3HB   ALA  76          3HB       ALA  76   4.609   3.502   5.696
  599    H    ARG  77           H        ARG  77   3.892   5.836   9.292
  600    HA   ARG  77           HA       ARG  77   2.529   7.673   7.598
  601   1HB   ARG  77          1HB       ARG  77   1.932   6.852   9.998
  602   2HB   ARG  77          2HB       ARG  77   2.987   8.157  10.523
  603   1HG   ARG  77          1HG       ARG  77   1.397   9.662  10.194
  604   2HG   ARG  77          2HG       ARG  77   1.132   9.102   8.541
  605   1HD   ARG  77          1HD       ARG  77  -0.363   7.376   9.322
  606   2HD   ARG  77          2HD       ARG  77  -0.021   7.795  11.000
  607    HE   ARG  77           HE       ARG  77  -1.050  10.009   9.521
  608   1HH1  ARG  77          1HH1      ARG  77  -1.941   7.098  11.209
  609   2HH1  ARG  77          2HH1      ARG  77  -3.541   7.648  11.582
  610   1HH2  ARG  77          1HH2      ARG  77  -3.154  10.745  10.006
  611   2HH2  ARG  77          2HH2      ARG  77  -4.230   9.723  10.897
  612    H    ALA  78           H        ALA  78   5.668   7.588   8.948
  613    HA   ALA  78           HA       ALA  78   6.041  10.459   8.404
  614   1HB   ALA  78          1HB       ALA  78   8.294   9.494   9.764
  615   2HB   ALA  78          2HB       ALA  78   7.022  10.541  10.393
  616   3HB   ALA  78          3HB       ALA  78   6.895   8.791  10.576
  617    H    TYR  79           H        TYR  79   8.017   7.484   8.370
  618    HA   TYR  79           HA       TYR  79   9.839   8.459   6.446
  619   1HB   TYR  79          1HB       TYR  79  10.590   6.699   7.846
  620   2HB   TYR  79          2HB       TYR  79   9.205   5.688   7.450
  621    HD1  TYR  79           HD1      TYR  79  11.568   7.553   5.244
  622    HD2  TYR  79           HD2      TYR  79  10.039   3.770   6.448
  623    HE1  TYR  79           HE1      TYR  79  12.879   6.466   3.469
  624    HE2  TYR  79           HE2      TYR  79  11.346   2.672   4.677
  625    HH   TYR  79           HH       TYR  79  12.391   3.208   2.559
  626    H    SER  80           H        SER  80   7.134   6.162   6.164
  627    HA   SER  80           HA       SER  80   5.877   5.497   4.389
  628   1HB   SER  80          1HB       SER  80   6.822   8.173   3.358
  629   2HB   SER  80          2HB       SER  80   5.688   7.156   2.470
  630    HG   SER  80           HG       SER  80   4.483   8.541   3.705
  631    H    MET  81           H        MET  81   8.061   7.193   2.245
  632    HA   MET  81           HA       MET  81   9.220   4.613   1.424
  633   1HB   MET  81          1HB       MET  81   7.731   6.588  -0.150
  634   2HB   MET  81          2HB       MET  81   9.266   6.124  -0.871
  635   1HG   MET  81          1HG       MET  81   7.455   4.743  -1.701
  636   2HG   MET  81          2HG       MET  81   8.616   3.784  -0.787
  637   1HE   MET  81          1HE       MET  81   4.453   4.993  -0.189
  638   2HE   MET  81          2HE       MET  81   5.186   5.679   1.261
  639   3HE   MET  81          3HE       MET  81   5.810   6.111  -0.332
  640    H    LYS  82           H        LYS  82  11.111   5.212  -0.256
  641    HA   LYS  82           HA       LYS  82  12.978   6.787   1.317
  642   1HB   LYS  82          1HB       LYS  82  13.659   4.578   0.485
  643   2HB   LYS  82          2HB       LYS  82  13.414   5.122  -1.170
  644   1HG   LYS  82          1HG       LYS  82  15.350   6.280  -1.223
  645   2HG   LYS  82          2HG       LYS  82  15.247   6.744   0.477
  646   1HD   LYS  82          1HD       LYS  82  15.747   4.292   0.995
  647   2HD   LYS  82          2HD       LYS  82  16.210   4.153  -0.703
  648   1HE   LYS  82          1HE       LYS  82  18.145   5.234  -0.379
  649   2HE   LYS  82          2HE       LYS  82  17.394   6.456   0.647
  650   1HZ   LYS  82          1HZ       LYS  82  17.473   4.907   2.495
  651   2HZ   LYS  82          2HZ       LYS  82  19.023   5.150   1.863
  652   3HZ   LYS  82          3HZ       LYS  82  18.181   3.725   1.512
  653    H    GLU  83           H        GLU  83  13.284   8.872   0.935
  654    HA   GLU  83           HA       GLU  83  12.204  10.240  -1.278
  655   1HB   GLU  83          1HB       GLU  83  13.351  10.941   1.166
  656   2HB   GLU  83          2HB       GLU  83  14.419  11.647  -0.038
  657   1HG   GLU  83          1HG       GLU  83  12.561  12.823  -1.045
  658   2HG   GLU  83          2HG       GLU  83  11.440  12.060   0.082
  659    H    ASP  84           H        ASP  84  15.378   8.892  -0.642
  660    HA   ASP  84           HA       ASP  84  16.843  10.142  -2.658
  661   1HB   ASP  84          1HB       ASP  84  17.576   8.497  -0.755
  662   2HB   ASP  84          2HB       ASP  84  17.318   7.260  -1.983
  663    H    THR  85           H        THR  85  14.683   7.371  -2.778
  664    HA   THR  85           HA       THR  85  15.120   7.197  -5.685
  665    HB   THR  85           HB       THR  85  13.715   4.960  -5.186
  666    HG1  THR  85           HG1      THR  85  14.666   4.105  -3.185
  667   1HG2  THR  85          1HG2      THR  85  16.018   3.840  -4.895
  668   2HG2  THR  85          2HG2      THR  85  16.670   5.472  -5.039
  669   3HG2  THR  85          3HG2      THR  85  15.729   4.778  -6.359
  670    H    ARG  86           H        ARG  86  13.182   8.772  -3.723
  671    HA   ARG  86           HA       ARG  86  10.570   7.998  -4.518
  672   1HB   ARG  86          1HB       ARG  86  10.936   9.281  -2.484
  673   2HB   ARG  86          2HB       ARG  86  11.597  10.618  -3.416
  674   1HG   ARG  86          1HG       ARG  86   9.533  11.260  -4.215
  675   2HG   ARG  86          2HG       ARG  86   8.823   9.665  -3.960
  676   1HD   ARG  86          1HD       ARG  86   8.310  10.096  -1.806
  677   2HD   ARG  86          2HD       ARG  86   9.788  11.018  -1.533
  678    HE   ARG  86           HE       ARG  86   7.846  12.355  -3.188
  679   1HH1  ARG  86          1HH1      ARG  86   8.951  11.772   0.061
  680   2HH1  ARG  86          2HH1      ARG  86   8.246  13.220   0.700
  681   1HH2  ARG  86          1HH2      ARG  86   6.914  14.265  -2.359
  682   2HH2  ARG  86          2HH2      ARG  86   7.087  14.637  -0.678
  683    H    LEU  87           H        LEU  87   9.637   8.255  -6.429
  684    HA   LEU  87           HA       LEU  87  10.769  10.185  -8.319
  685   1HB   LEU  87          1HB       LEU  87   9.845   7.549  -8.567
  686   2HB   LEU  87          2HB       LEU  87   8.665   8.554  -9.407
  687    HG   LEU  87           HG       LEU  87  11.604   8.265  -9.997
  688   1HD1  LEU  87          1HD1      LEU  87   9.063   7.601 -11.455
  689   2HD1  LEU  87          2HD1      LEU  87  10.389   6.528 -11.008
  690   3HD1  LEU  87          3HD1      LEU  87  10.618   7.731 -12.276
  691   1HD2  LEU  87          1HD2      LEU  87  11.119   9.903 -11.851
  692   2HD2  LEU  87          2HD2      LEU  87  11.191  10.587 -10.226
  693   3HD2  LEU  87          3HD2      LEU  87   9.629  10.305 -10.997
  694    H    GLU  88           H        GLU  88   7.527   9.021  -7.377
  695    HA   GLU  88           HA       GLU  88   6.561  11.787  -7.640
  696   1HB   GLU  88          1HB       GLU  88   5.927   9.805  -9.427
  697   2HB   GLU  88          2HB       GLU  88   4.587   9.715  -8.292
  698   1HG   GLU  88          1HG       GLU  88   3.902  11.184  -9.988
  699   2HG   GLU  88          2HG       GLU  88   4.311  12.200  -8.606
  700    H    GLY  89           H        GLY  89   4.238  11.914  -6.656
  701   1HA   GLY  89          1HA       GLY  89   2.747  11.299  -4.931
  702   2HA   GLY  89          2HA       GLY  89   3.944  10.160  -4.333
  703    HA   PRO  90           HA       PRO  90   3.275   9.934  -2.382
  704   1HB   PRO  90          1HB       PRO  90   1.797  10.700  -0.238
  705   2HB   PRO  90          2HB       PRO  90   3.517  10.309  -0.128
  706   1HG   PRO  90          1HG       PRO  90   2.191  12.987  -0.298
  707   2HG   PRO  90          2HG       PRO  90   3.537  12.469   0.733
  708   1HD   PRO  90          1HD       PRO  90   3.907  13.894  -1.539
  709   2HD   PRO  90          2HD       PRO  90   5.086  12.701  -0.958
  710    H    TRP  91           H        TRP  91   0.966   9.216  -2.116
  711    HA   TRP  91           HA       TRP  91  -0.978  11.087  -3.254
  712   1HB   TRP  91          1HB       TRP  91  -0.185   8.429  -4.426
  713   2HB   TRP  91          2HB       TRP  91  -1.768   9.136  -4.738
  714    HD1  TRP  91           HD1      TRP  91  -0.782  12.181  -5.076
  715    HE1  TRP  91           HE1      TRP  91   0.487  12.838  -7.217
  716    HE3  TRP  91           HE3      TRP  91   0.826   7.548  -6.521
  717    HZ2  TRP  91           HZ2      TRP  91   1.972  11.561  -9.250
  718    HZ3  TRP  91           HZ3      TRP  91   2.165   7.352  -8.576
  719    HH2  TRP  91           HH2      TRP  91   2.725   9.318  -9.911
  720    H    GLU  92           H        GLU  92  -2.875  10.994  -2.236
  721    HA   GLU  92           HA       GLU  92  -3.467   8.596  -0.627
  722   1HB   GLU  92          1HB       GLU  92  -3.907  11.512  -0.041
  723   2HB   GLU  92          2HB       GLU  92  -4.849  10.270   0.771
  724   1HG   GLU  92          1HG       GLU  92  -3.045   9.469   1.943
  725   2HG   GLU  92          2HG       GLU  92  -1.878  10.071   0.768
  726    H    TYR  93           H        TYR  93  -5.443   7.676  -0.813
  727    HA   TYR  93           HA       TYR  93  -7.534   9.075  -2.304
  728   1HB   TYR  93          1HB       TYR  93  -6.409   6.371  -3.044
  729   2HB   TYR  93          2HB       TYR  93  -7.944   6.985  -3.648
  730    HD1  TYR  93           HD1      TYR  93  -7.960   9.034  -5.088
  731    HD2  TYR  93           HD2      TYR  93  -4.352   7.063  -3.996
  732    HE1  TYR  93           HE1      TYR  93  -6.786  10.183  -6.918
  733    HE2  TYR  93           HE2      TYR  93  -3.167   8.207  -5.822
  734    HH   TYR  93           HH       TYR  93  -4.638  10.770  -7.646
  735    H    GLY  94           H        GLY  94  -9.646   7.966  -2.158
  736   1HA   GLY  94          1HA       GLY  94 -11.130   6.448  -1.098
  737   2HA   GLY  94          2HA       GLY  94  -9.878   6.089   0.082
  738    H    GLU  95           H        GLU  95 -11.287   6.413   1.822
  739    HA   GLU  95           HA       GLU  95 -12.958   8.571   2.258
  740   1HB   GLU  95          1HB       GLU  95 -13.058   6.691   3.730
  741   2HB   GLU  95          2HB       GLU  95 -11.378   6.897   4.207
  742   1HG   GLU  95          1HG       GLU  95 -13.015   9.245   4.737
  743   2HG   GLU  95          2HG       GLU  95 -13.567   7.801   5.583
  Start of MODEL    9
    1   1H    ALA   2          1H        ALA   2 -14.247  -1.777  20.274
    2    HA   ALA   2           HA       ALA   2 -13.984  -1.163  17.986
    3   1HB   ALA   2          1HB       ALA   2 -13.150   1.434  17.893
    4   2HB   ALA   2          2HB       ALA   2 -14.804   0.887  17.614
    5   3HB   ALA   2          3HB       ALA   2 -14.326   1.472  19.208
    6    H    ARG   3           H        ARG   3 -12.030  -1.103  16.841
    7    HA   ARG   3           HA       ARG   3  -9.587  -0.444  18.274
    8   1HB   ARG   3          1HB       ARG   3 -10.483  -3.049  18.335
    9   2HB   ARG   3          2HB       ARG   3  -9.375  -3.056  16.970
   10   1HG   ARG   3          1HG       ARG   3  -7.971  -3.599  18.696
   11   2HG   ARG   3          2HG       ARG   3  -7.768  -1.847  18.629
   12   1HD   ARG   3          1HD       ARG   3  -9.299  -1.551  20.462
   13   2HD   ARG   3          2HD       ARG   3  -9.689  -3.271  20.465
   14    HE   ARG   3           HE       ARG   3  -7.749  -3.683  21.621
   15   1HH1  ARG   3          1HH1      ARG   3  -7.700  -0.429  20.384
   16   2HH1  ARG   3          2HH1      ARG   3  -6.289   0.029  21.279
   17   1HH2  ARG   3          1HH2      ARG   3  -5.890  -3.092  22.805
   18   2HH2  ARG   3          2HH2      ARG   3  -5.260  -1.487  22.655
   19    H    GLN   4           H        GLN   4  -7.871   0.052  16.939
   20    HA   GLN   4           HA       GLN   4  -8.561   0.600  14.188
   21   1HB   GLN   4          1HB       GLN   4  -6.728   1.651  16.110
   22   2HB   GLN   4          2HB       GLN   4  -5.819   1.158  14.687
   23   1HG   GLN   4          1HG       GLN   4  -7.613   2.463  13.372
   24   2HG   GLN   4          2HG       GLN   4  -7.980   3.207  14.927
   25   1HE2  GLN   4          1HE2      GLN   4  -6.977   5.040  15.284
   26   2HE2  GLN   4          2HE2      GLN   4  -5.440   5.508  14.648
   27    H    VAL   5           H        VAL   5  -7.212  -0.025  12.384
   28    HA   VAL   5           HA       VAL   5  -6.015  -2.687  12.780
   29    HB   VAL   5           HB       VAL   5  -6.523  -3.163  10.448
   30   1HG1  VAL   5          1HG1      VAL   5  -8.539  -2.560  12.454
   31   2HG1  VAL   5          2HG1      VAL   5  -9.178  -2.507  10.810
   32   3HG1  VAL   5          3HG1      VAL   5  -8.376  -3.964  11.399
   33   1HG2  VAL   5          1HG2      VAL   5  -6.685  -0.372  10.217
   34   2HG2  VAL   5          2HG2      VAL   5  -6.921  -1.573   8.946
   35   3HG2  VAL   5          3HG2      VAL   5  -8.302  -0.986   9.872
   36    H    ILE   6           H        ILE   6  -4.187  -3.247  11.421
   37    HA   ILE   6           HA       ILE   6  -2.343  -1.017  11.182
   38    HB   ILE   6           HB       ILE   6  -1.780  -3.925  10.612
   39   1HG1  ILE   6          1HG1      ILE   6  -0.703  -3.571  13.040
   40   2HG1  ILE   6          2HG1      ILE   6  -2.045  -2.441  13.177
   41   1HG2  ILE   6          1HG2      ILE   6   0.499  -2.799  11.601
   42   2HG2  ILE   6          2HG2      ILE   6   0.131  -3.006   9.889
   43   3HG2  ILE   6          3HG2      ILE   6  -0.197  -1.465  10.682
   44   1HD1  ILE   6          1HD1      ILE   6  -2.036  -5.310  13.341
   45   2HD1  ILE   6          2HD1      ILE   6  -3.307  -4.161  13.758
   46   3HD1  ILE   6          3HD1      ILE   6  -3.160  -4.750  12.103
   47    H    CYS   7           H        CYS   7  -1.156  -0.534   9.291
   48    HA   CYS   7           HA       CYS   7  -2.696  -0.765   6.878
   49   1HB   CYS   7          1HB       CYS   7   0.100   0.333   7.025
   50   2HB   CYS   7          2HB       CYS   7  -1.207   0.797   5.943
   51    HG   CYS   7           HG       CYS   7  -2.260   1.396   8.952
   52    H    TRP   8           H        TRP   8  -1.816  -1.533   4.836
   53    HA   TRP   8           HA       TRP   8  -0.148  -3.920   5.239
   54   1HB   TRP   8          1HB       TRP   8  -2.184  -3.241   3.112
   55   2HB   TRP   8          2HB       TRP   8  -1.129  -4.648   3.029
   56    HD1  TRP   8           HD1      TRP   8  -3.611  -3.195   5.653
   57    HE1  TRP   8           HE1      TRP   8  -4.933  -5.164   6.653
   58    HE3  TRP   8           HE3      TRP   8  -1.401  -7.035   3.102
   59    HZ2  TRP   8           HZ2      TRP   8  -5.026  -7.973   6.395
   60    HZ3  TRP   8           HZ3      TRP   8  -2.164  -9.333   3.537
   61    HH2  TRP   8           HH2      TRP   8  -3.939  -9.791   5.150
   62    H    CYS   9           H        CYS   9   1.905  -3.690   4.671
   63    HA   CYS   9           HA       CYS   9   2.655  -1.682   2.695
   64   1HB   CYS   9          1HB       CYS   9   4.987  -2.235   3.411
   65   2HB   CYS   9          2HB       CYS   9   3.957  -1.667   4.719
   66    HG   CYS   9           HG       CYS   9   3.589  -4.846   4.791
   67    H    PHE  10           H        PHE  10   2.843  -2.215   0.633
   68    HA   PHE  10           HA       PHE  10   3.929  -4.847  -0.067
   69   1HB   PHE  10          1HB       PHE  10   2.211  -5.414  -1.508
   70   2HB   PHE  10          2HB       PHE  10   1.318  -4.605  -0.224
   71    HD1  PHE  10           HD2      PHE  10   1.008  -2.012  -0.572
   72    HD2  PHE  10           HD1      PHE  10   1.803  -4.806  -3.682
   73    HE1  PHE  10           HE2      PHE  10   0.063  -0.445  -2.216
   74    HE2  PHE  10           HE1      PHE  10   0.860  -3.243  -5.332
   75    HZ   PHE  10           HZ       PHE  10  -0.013  -1.060  -4.600
   76    H    THR  11           H        THR  11   4.655  -4.949  -2.350
   77    HA   THR  11           HA       THR  11   5.409  -2.310  -3.412
   78    HB   THR  11           HB       THR  11   7.326  -4.607  -3.606
   79    HG1  THR  11           HG1      THR  11   7.690  -2.760  -1.543
   80   1HG2  THR  11          1HG2      THR  11   8.122  -1.770  -3.225
   81   2HG2  THR  11          2HG2      THR  11   7.386  -2.212  -4.766
   82   3HG2  THR  11          3HG2      THR  11   8.854  -3.026  -4.222
   83    H    LEU  12           H        LEU  12   4.800  -2.069  -5.453
   84    HA   LEU  12           HA       LEU  12   4.300  -4.478  -7.066
   85   1HB   LEU  12          1HB       LEU  12   2.352  -3.040  -6.645
   86   2HB   LEU  12          2HB       LEU  12   3.199  -1.690  -7.397
   87    HG   LEU  12           HG       LEU  12   3.066  -2.697  -9.547
   88   1HD1  LEU  12          1HD1      LEU  12   2.081  -4.916  -9.903
   89   2HD1  LEU  12          2HD1      LEU  12   1.977  -5.141  -8.157
   90   3HD1  LEU  12          3HD1      LEU  12   3.553  -4.991  -8.934
   91   1HD2  LEU  12          1HD2      LEU  12   0.562  -2.690  -7.927
   92   2HD2  LEU  12          2HD2      LEU  12   0.509  -3.256  -9.596
   93   3HD2  LEU  12          3HD2      LEU  12   1.061  -1.619  -9.237
   94    H    ASN  13           H        ASN  13   5.749  -4.910  -8.580
   95    HA   ASN  13           HA       ASN  13   7.436  -2.736  -9.599
   96   1HB   ASN  13          1HB       ASN  13   7.883  -5.694 -10.000
   97   2HB   ASN  13          2HB       ASN  13   9.050  -4.387 -10.183
   98   1HD2  ASN  13          1HD2      ASN  13   8.719  -2.947  -7.923
   99   2HD2  ASN  13          2HD2      ASN  13   9.125  -3.898  -6.539
  100    H    ASN  14           H        ASN  14   7.435  -2.147 -11.698
  101    HA   ASN  14           HA       ASN  14   6.594  -1.851 -13.798
  102   1HB   ASN  14          1HB       ASN  14   6.502  -4.850 -14.024
  103   2HB   ASN  14          2HB       ASN  14   6.914  -3.665 -15.260
  104   1HD2  ASN  14          1HD2      ASN  14   8.071  -5.706 -12.812
  105   2HD2  ASN  14          2HD2      ASN  14   9.735  -5.245 -12.883
  106    HA   PRO  15           HA       PRO  15   2.262  -2.941 -12.382
  107   1HB   PRO  15          1HB       PRO  15   1.390  -0.378 -12.183
  108   2HB   PRO  15          2HB       PRO  15   2.174  -1.232 -10.849
  109   1HG   PRO  15          1HG       PRO  15   3.337   0.736 -12.781
  110   2HG   PRO  15          2HG       PRO  15   3.577   0.613 -11.029
  111   1HD   PRO  15          1HD       PRO  15   5.383  -0.321 -12.816
  112   2HD   PRO  15          2HD       PRO  15   5.125  -1.083 -11.233
  113    H    LEU  16           H        LEU  16   0.562  -3.097 -13.765
  114    HA   LEU  16           HA       LEU  16   0.965  -2.139 -16.474
  115   1HB   LEU  16          1HB       LEU  16  -0.975  -4.020 -15.177
  116   2HB   LEU  16          2HB       LEU  16  -1.231  -3.438 -16.821
  117    HG   LEU  16           HG       LEU  16   1.246  -4.351 -17.123
  118   1HD1  LEU  16          1HD1      LEU  16   0.138  -6.228 -15.050
  119   2HD1  LEU  16          2HD1      LEU  16   1.337  -4.986 -14.693
  120   3HD1  LEU  16          3HD1      LEU  16   1.719  -6.279 -15.830
  121   1HD2  LEU  16          1HD2      LEU  16  -0.157  -5.315 -18.600
  122   2HD2  LEU  16          2HD2      LEU  16  -1.429  -5.555 -17.402
  123   3HD2  LEU  16          3HD2      LEU  16  -0.069  -6.677 -17.483
  124    H    SER  17           H        SER  17  -0.433  -0.929 -13.728
  125    HA   SER  17           HA       SER  17  -1.567   1.297 -14.976
  126   1HB   SER  17          1HB       SER  17  -3.753   0.835 -15.318
  127   2HB   SER  17          2HB       SER  17  -3.244  -0.853 -15.293
  128    HG   SER  17           HG       SER  17  -4.824  -0.749 -13.799
  129    HA   PRO  18           HA       PRO  18  -1.453   2.832 -10.868
  130   1HB   PRO  18          1HB       PRO  18  -3.454   4.666 -10.872
  131   2HB   PRO  18          2HB       PRO  18  -1.928   4.907 -11.731
  132   1HG   PRO  18          1HG       PRO  18  -4.578   4.004 -12.793
  133   2HG   PRO  18          2HG       PRO  18  -3.429   5.160 -13.490
  134   1HD   PRO  18          1HD       PRO  18  -3.615   2.597 -14.343
  135   2HD   PRO  18          2HD       PRO  18  -2.085   3.497 -14.351
  136    H    LEU  19           H        LEU  19  -2.434   2.742  -8.826
  137    HA   LEU  19           HA       LEU  19  -4.472   0.729  -8.564
  138   1HB   LEU  19          1HB       LEU  19  -3.361   2.419  -6.345
  139   2HB   LEU  19          2HB       LEU  19  -4.045   0.798  -6.247
  140    HG   LEU  19           HG       LEU  19  -1.452   1.420  -7.650
  141   1HD1  LEU  19          1HD1      LEU  19  -1.604   1.912  -5.104
  142   2HD1  LEU  19          2HD1      LEU  19  -0.254   0.968  -5.732
  143   3HD1  LEU  19          3HD1      LEU  19  -1.609   0.155  -4.948
  144   1HD2  LEU  19          1HD2      LEU  19  -1.621  -1.211  -6.624
  145   2HD2  LEU  19          2HD2      LEU  19  -1.570  -0.693  -8.310
  146   3HD2  LEU  19          3HD2      LEU  19  -3.121  -0.881  -7.490
  147    H    SER  20           H        SER  20  -6.290   1.123  -6.947
  148    HA   SER  20           HA       SER  20  -7.348   3.832  -6.968
  149   1HB   SER  20          1HB       SER  20  -9.437   3.247  -8.029
  150   2HB   SER  20          2HB       SER  20  -8.121   2.771  -9.103
  151    HG   SER  20           HG       SER  20  -8.908   0.837  -9.016
  152    H    LEU  21           H        LEU  21  -9.157   4.117  -5.534
  153    HA   LEU  21           HA       LEU  21  -8.896   2.851  -3.082
  154   1HB   LEU  21          1HB       LEU  21  -9.946   4.967  -3.167
  155   2HB   LEU  21          2HB       LEU  21 -11.170   4.394  -4.299
  156    HG   LEU  21           HG       LEU  21 -12.065   2.950  -2.450
  157   1HD1  LEU  21          1HD1      LEU  21 -11.189   4.349  -0.213
  158   2HD1  LEU  21          2HD1      LEU  21  -9.724   3.998  -1.129
  159   3HD1  LEU  21          3HD1      LEU  21 -10.797   2.685  -0.647
  160   1HD2  LEU  21          1HD2      LEU  21 -13.427   4.745  -2.728
  161   2HD2  LEU  21          2HD2      LEU  21 -12.118   5.911  -2.531
  162   3HD2  LEU  21          3HD2      LEU  21 -12.821   5.127  -1.116
  163    H    HIS  22           H        HIS  22 -10.214   1.360  -1.953
  164    HA   HIS  22           HA       HIS  22 -11.720  -0.468  -3.706
  165   1HB   HIS  22          1HB       HIS  22  -9.503  -1.274  -2.661
  166   2HB   HIS  22          2HB       HIS  22 -10.393  -1.318  -1.142
  167    HD1  HIS  22           HD1      HIS  22 -10.605  -3.781  -0.775
  168    HD2  HIS  22           HD2      HIS  22 -11.764  -2.644  -4.599
  169    HE1  HIS  22           HE1      HIS  22 -11.595  -5.844  -1.818
  170    H    ASP  23           H        ASP  23 -13.745  -1.032  -3.128
  171    HA   ASP  23           HA       ASP  23 -15.171   0.512  -1.275
  172   1HB   ASP  23          1HB       ASP  23 -15.760  -1.962  -2.847
  173   2HB   ASP  23          2HB       ASP  23 -16.873  -1.490  -1.566
  174    H    SER  24           H        SER  24 -13.326  -2.374  -0.886
  175    HA   SER  24           HA       SER  24 -14.561  -3.108   1.627
  176   1HB   SER  24          1HB       SER  24 -11.972  -4.218   0.559
  177   2HB   SER  24          2HB       SER  24 -13.148  -4.999   1.616
  178    HG   SER  24           HG       SER  24 -14.614  -4.752  -0.285
  179    H    MET  25           H        MET  25 -11.548  -1.635   0.515
  180    HA   MET  25           HA       MET  25 -10.395  -1.439   3.119
  181   1HB   MET  25          1HB       MET  25  -8.602  -0.356   2.094
  182   2HB   MET  25          2HB       MET  25  -9.213  -1.404   0.822
  183   1HG   MET  25          1HG       MET  25 -10.280   0.409  -0.276
  184   2HG   MET  25          2HG       MET  25  -9.986   1.485   1.088
  185   1HE   MET  25          1HE       MET  25  -8.154  -1.124  -0.832
  186   2HE   MET  25          2HE       MET  25  -7.958  -0.086  -2.245
  187   3HE   MET  25          3HE       MET  25  -6.574  -0.435  -1.208
  188    H    LYS  26           H        LYS  26  -9.527   1.016   3.562
  189    HA   LYS  26           HA       LYS  26 -11.934   2.713   3.648
  190   1HB   LYS  26          1HB       LYS  26 -10.471   1.593   5.823
  191   2HB   LYS  26          2HB       LYS  26 -10.220   3.334   5.839
  192   1HG   LYS  26          1HG       LYS  26 -12.322   3.756   6.480
  193   2HG   LYS  26          2HG       LYS  26 -13.001   2.520   5.419
  194   1HD   LYS  26          1HD       LYS  26 -13.465   1.590   7.458
  195   2HD   LYS  26          2HD       LYS  26 -11.871   0.893   7.163
  196   1HE   LYS  26          1HE       LYS  26 -11.217   3.242   8.365
  197   2HE   LYS  26          2HE       LYS  26 -12.740   2.859   9.166
  198   1HZ   LYS  26          1HZ       LYS  26 -10.270   1.228   9.082
  199   2HZ   LYS  26          2HZ       LYS  26 -11.759   0.592   9.570
  200   3HZ   LYS  26          3HZ       LYS  26 -11.056   1.861  10.440
  201    H    TYR  27           H        TYR  27  -8.408   2.590   3.607
  202    HA   TYR  27           HA       TYR  27  -8.399   5.227   2.324
  203   1HB   TYR  27          1HB       TYR  27  -7.770   5.198   4.869
  204   2HB   TYR  27          2HB       TYR  27  -6.238   4.555   4.288
  205    HD1  TYR  27           HD1      TYR  27  -8.544   7.249   3.092
  206    HD2  TYR  27           HD2      TYR  27  -4.603   6.175   4.280
  207    HE1  TYR  27           HE1      TYR  27  -7.779   9.534   2.599
  208    HE2  TYR  27           HE2      TYR  27  -3.827   8.457   3.791
  209    HH   TYR  27           HH       TYR  27  -4.981  10.812   3.692
  210    H    LEU  28           H        LEU  28  -6.611   5.616   0.945
  211    HA   LEU  28           HA       LEU  28  -4.982   3.252   0.305
  212   1HB   LEU  28          1HB       LEU  28  -6.555   3.191  -1.404
  213   2HB   LEU  28          2HB       LEU  28  -6.640   4.947  -1.519
  214    HG   LEU  28           HG       LEU  28  -4.537   5.033  -2.671
  215   1HD1  LEU  28          1HD1      LEU  28  -4.208   2.391  -1.530
  216   2HD1  LEU  28          2HD1      LEU  28  -2.998   3.514  -2.151
  217   3HD1  LEU  28          3HD1      LEU  28  -3.835   2.421  -3.254
  218   1HD2  LEU  28          1HD2      LEU  28  -6.422   4.633  -4.092
  219   2HD2  LEU  28          2HD2      LEU  28  -6.377   2.903  -3.751
  220   3HD2  LEU  28          3HD2      LEU  28  -5.076   3.655  -4.677
  221    H    VAL  29           H        VAL  29  -2.871   3.655   0.187
  222    HA   VAL  29           HA       VAL  29  -1.956   6.360  -0.475
  223    HB   VAL  29           HB       VAL  29  -1.034   4.789   1.935
  224   1HG1  VAL  29          1HG1      VAL  29   0.151   7.094   0.476
  225   2HG1  VAL  29          2HG1      VAL  29   0.265   7.064   2.237
  226   3HG1  VAL  29          3HG1      VAL  29   0.941   5.741   1.285
  227   1HG2  VAL  29          1HG2      VAL  29  -1.707   7.302   2.775
  228   2HG2  VAL  29          2HG2      VAL  29  -2.915   6.993   1.528
  229   3HG2  VAL  29          3HG2      VAL  29  -2.746   5.881   2.887
  230    H    TYR  30           H        TYR  30  -0.522   6.252  -2.062
  231    HA   TYR  30           HA       TYR  30   1.550   4.232  -2.060
  232   1HB   TYR  30          1HB       TYR  30   1.024   3.171  -4.073
  233   2HB   TYR  30          2HB       TYR  30  -0.541   3.313  -3.279
  234    HD1  TYR  30           HD1      TYR  30   1.558   4.519  -6.031
  235    HD2  TYR  30           HD2      TYR  30  -2.241   4.814  -4.138
  236    HE1  TYR  30           HE1      TYR  30   0.672   5.688  -8.005
  237    HE2  TYR  30           HE2      TYR  30  -3.138   5.984  -6.107
  238    HH   TYR  30           HH       TYR  30  -2.427   6.000  -8.720
  239    H    GLN  31           H        GLN  31   3.285   4.713  -3.487
  240    HA   GLN  31           HA       GLN  31   3.176   7.311  -4.834
  241   1HB   GLN  31          1HB       GLN  31   5.596   6.632  -3.209
  242   2HB   GLN  31          2HB       GLN  31   5.023   8.206  -3.748
  243   1HG   GLN  31          1HG       GLN  31   3.147   8.022  -2.147
  244   2HG   GLN  31          2HG       GLN  31   3.843   6.512  -1.559
  245   1HE2  GLN  31          1HE2      GLN  31   4.042   7.421   0.513
  246   2HE2  GLN  31          2HE2      GLN  31   5.301   8.543   0.886
  247    H    THR  32           H        THR  32   4.892   7.633  -6.393
  248    HA   THR  32           HA       THR  32   5.685   5.102  -7.619
  249    HB   THR  32           HB       THR  32   5.803   7.910  -8.737
  250    HG1  THR  32           HG1      THR  32   3.961   7.271  -9.885
  251   1HG2  THR  32          1HG2      THR  32   7.473   6.408  -9.736
  252   2HG2  THR  32          2HG2      THR  32   6.203   6.825 -10.887
  253   3HG2  THR  32          3HG2      THR  32   6.199   5.245 -10.104
  254    H    GLU  33           H        GLU  33   7.757   4.455  -7.869
  255    HA   GLU  33           HA       GLU  33   9.892   6.311  -7.063
  256   1HB   GLU  33          1HB       GLU  33   9.267   3.603  -5.993
  257   2HB   GLU  33          2HB       GLU  33  10.960   4.032  -6.188
  258   1HG   GLU  33          1HG       GLU  33   9.676   6.213  -4.932
  259   2HG   GLU  33          2HG       GLU  33   9.163   4.743  -4.106
  260    H    GLN  34           H        GLN  34  12.009   5.772  -7.902
  261    HA   GLN  34           HA       GLN  34  11.812   4.477 -10.523
  262   1HB   GLN  34          1HB       GLN  34  13.028   6.861  -9.641
  263   2HB   GLN  34          2HB       GLN  34  14.342   5.768 -10.053
  264   1HG   GLN  34          1HG       GLN  34  12.238   5.760 -12.048
  265   2HG   GLN  34          2HG       GLN  34  12.926   7.363 -11.795
  266   1HE2  GLN  34          1HE2      GLN  34  13.674   7.105 -14.002
  267   2HE2  GLN  34          2HE2      GLN  34  15.147   6.253 -14.300
  268    H    GLY  35           H        GLY  35  12.853   2.636 -10.992
  269   1HA   GLY  35          1HA       GLY  35  15.281   1.759  -9.962
  270   2HA   GLY  35          2HA       GLY  35  14.031   1.096  -8.920
  271    H    GLU  36           H        GLU  36  15.510  -0.727 -10.102
  272    HA   GLU  36           HA       GLU  36  15.652  -2.376 -11.706
  273   1HB   GLU  36          1HB       GLU  36  13.394  -3.536 -11.966
  274   2HB   GLU  36          2HB       GLU  36  14.018  -3.366 -10.331
  275   1HG   GLU  36          1HG       GLU  36  12.559  -1.458  -9.954
  276   2HG   GLU  36          2HG       GLU  36  11.953  -1.585 -11.604
  277    H    ALA  37           H        ALA  37  16.298  -1.092 -13.498
  278    HA   ALA  37           HA       ALA  37  16.183  -0.427 -15.673
  279   1HB   ALA  37          1HB       ALA  37  14.735  -1.533 -17.114
  280   2HB   ALA  37          2HB       ALA  37  14.891  -2.657 -15.763
  281   3HB   ALA  37          3HB       ALA  37  13.456  -1.642 -15.904
  282    H    GLY  38           H        GLY  38  14.711   0.843 -17.268
  283   1HA   GLY  38          1HA       GLY  38  14.083   3.297 -16.166
  284   2HA   GLY  38          2HA       GLY  38  13.460   2.720 -17.705
  285    H    ASN  39           H        ASN  39  12.100   0.439 -16.352
  286    HA   ASN  39           HA       ASN  39   9.556   1.487 -16.123
  287   1HB   ASN  39          1HB       ASN  39  10.478  -0.945 -14.593
  288   2HB   ASN  39          2HB       ASN  39   8.878  -0.623 -15.253
  289   1HD2  ASN  39          1HD2      ASN  39   8.801  -0.369 -17.654
  290   2HD2  ASN  39          2HD2      ASN  39   9.783  -1.438 -18.592
  291    H    ILE  40           H        ILE  40   8.165   1.302 -14.079
  292    HA   ILE  40           HA       ILE  40   9.622   2.419 -11.775
  293    HB   ILE  40           HB       ILE  40   7.272   3.611 -11.420
  294   1HG1  ILE  40          1HG1      ILE  40   7.536   3.473 -14.431
  295   2HG1  ILE  40          2HG1      ILE  40   6.317   2.623 -13.489
  296   1HG2  ILE  40          1HG2      ILE  40   9.826   4.375 -12.230
  297   2HG2  ILE  40          2HG2      ILE  40   8.728   5.186 -13.346
  298   3HG2  ILE  40          3HG2      ILE  40   8.550   5.421 -11.607
  299   1HD1  ILE  40          1HD1      ILE  40   5.372   4.728 -12.766
  300   2HD1  ILE  40          2HD1      ILE  40   6.630   5.611 -13.630
  301   3HD1  ILE  40          3HD1      ILE  40   5.448   4.658 -14.526
  302    H    HIS  41           H        HIS  41   8.326   2.295  -9.726
  303    HA   HIS  41           HA       HIS  41   6.495   0.005  -9.669
  304   1HB   HIS  41          1HB       HIS  41   7.734  -0.606  -7.450
  305   2HB   HIS  41          2HB       HIS  41   8.408  -1.123  -8.993
  306    HD1  HIS  41           HD1      HIS  41  10.832  -1.168  -8.249
  307    HD2  HIS  41           HD2      HIS  41   8.991   2.500  -7.602
  308    HE1  HIS  41           HE1      HIS  41  12.685   0.414  -7.627
  309    H    PHE  42           H        PHE  42   5.063  -0.037  -7.883
  310    HA   PHE  42           HA       PHE  42   4.648   2.611  -6.699
  311   1HB   PHE  42          1HB       PHE  42   2.783   0.241  -6.945
  312   2HB   PHE  42          2HB       PHE  42   2.362   1.776  -6.193
  313    HD1  PHE  42           HD1      PHE  42   3.875   3.514  -8.219
  314    HD2  PHE  42           HD2      PHE  42   1.130   0.289  -8.650
  315    HE1  PHE  42           HE1      PHE  42   3.186   4.397 -10.410
  316    HE2  PHE  42           HE2      PHE  42   0.437   1.167 -10.841
  317    HZ   PHE  42           HZ       PHE  42   1.465   3.223 -11.724
  318    H    GLN  43           H        GLN  43   4.814   2.978  -4.568
  319    HA   GLN  43           HA       GLN  43   5.006   0.679  -2.753
  320   1HB   GLN  43          1HB       GLN  43   7.055   2.717  -3.324
  321   2HB   GLN  43          2HB       GLN  43   6.761   2.425  -1.615
  322   1HG   GLN  43          1HG       GLN  43   7.152   0.088  -3.409
  323   2HG   GLN  43          2HG       GLN  43   8.554   1.054  -2.952
  324   1HE2  GLN  43          1HE2      GLN  43   6.207  -1.232  -1.933
  325   2HE2  GLN  43          2HE2      GLN  43   6.827  -1.493  -0.342
  326    H    GLY  44           H        GLY  44   3.936   0.908  -0.869
  327   1HA   GLY  44          1HA       GLY  44   3.504   3.216   0.589
  328   2HA   GLY  44          2HA       GLY  44   2.166   3.117  -0.546
  329    H    TYR  45           H        TYR  45   1.136   3.068   1.727
  330    HA   TYR  45           HA       TYR  45   0.852   0.249   2.542
  331   1HB   TYR  45          1HB       TYR  45   0.393   0.994   4.803
  332   2HB   TYR  45          2HB       TYR  45   1.933   1.661   4.273
  333    HD1  TYR  45           HD1      TYR  45  -1.614   2.462   4.919
  334    HD2  TYR  45           HD2      TYR  45   2.265   4.013   4.112
  335    HE1  TYR  45           HE1      TYR  45  -2.404   4.720   5.491
  336    HE2  TYR  45           HE2      TYR  45   1.486   6.275   4.683
  337    HH   TYR  45           HH       TYR  45  -0.472   7.544   4.911
  338    H    ILE  46           H        ILE  46  -1.181  -0.572   2.770
  339    HA   ILE  46           HA       ILE  46  -3.430   1.244   2.197
  340    HB   ILE  46           HB       ILE  46  -3.163  -1.595   1.203
  341   1HG1  ILE  46          1HG1      ILE  46  -3.092   0.966  -0.400
  342   2HG1  ILE  46          2HG1      ILE  46  -1.650   0.087   0.096
  343   1HG2  ILE  46          1HG2      ILE  46  -5.245   0.478   0.537
  344   2HG2  ILE  46          2HG2      ILE  46  -5.207  -1.204   0.013
  345   3HG2  ILE  46          3HG2      ILE  46  -5.470  -0.817   1.713
  346   1HD1  ILE  46          1HD1      ILE  46  -3.756  -1.384  -1.391
  347   2HD1  ILE  46          2HD1      ILE  46  -2.721  -0.260  -2.272
  348   3HD1  ILE  46          3HD1      ILE  46  -2.006  -1.606  -1.385
  349    H    GLU  47           H        GLU  47  -5.009   1.204   3.655
  350    HA   GLU  47           HA       GLU  47  -5.004  -0.945   5.653
  351   1HB   GLU  47          1HB       GLU  47  -6.408   1.729   5.767
  352   2HB   GLU  47          2HB       GLU  47  -6.243   0.573   7.081
  353   1HG   GLU  47          1HG       GLU  47  -3.976   1.021   7.356
  354   2HG   GLU  47          2HG       GLU  47  -3.835   1.764   5.764
  355    H    MET  48           H        MET  48  -6.461  -2.501   5.465
  356    HA   MET  48           HA       MET  48  -8.698  -2.236   3.669
  357   1HB   MET  48          1HB       MET  48  -7.740  -4.484   5.438
  358   2HB   MET  48          2HB       MET  48  -9.186  -4.598   4.445
  359   1HG   MET  48          1HG       MET  48  -6.918  -3.686   2.909
  360   2HG   MET  48          2HG       MET  48  -6.592  -5.225   3.703
  361   1HE   MET  48          1HE       MET  48 -10.013  -3.953   1.258
  362   2HE   MET  48          2HE       MET  48  -8.474  -3.120   1.478
  363   3HE   MET  48          3HE       MET  48  -8.713  -4.180   0.088
  364    H    LYS  49           H        LYS  49 -10.810  -3.411   4.627
  365    HA   LYS  49           HA       LYS  49 -12.087  -1.566   6.244
  366   1HB   LYS  49          1HB       LYS  49 -12.831  -3.841   4.875
  367   2HB   LYS  49          2HB       LYS  49 -13.134  -4.283   6.550
  368   1HG   LYS  49          1HG       LYS  49 -14.757  -2.674   6.824
  369   2HG   LYS  49          2HG       LYS  49 -14.131  -1.669   5.515
  370   1HD   LYS  49          1HD       LYS  49 -16.185  -2.666   4.783
  371   2HD   LYS  49          2HD       LYS  49 -14.857  -3.429   3.906
  372   1HE   LYS  49          1HE       LYS  49 -16.214  -5.218   4.536
  373   2HE   LYS  49          2HE       LYS  49 -14.932  -5.215   5.746
  374   1HZ   LYS  49          1HZ       LYS  49 -17.274  -5.477   6.595
  375   2HZ   LYS  49          2HZ       LYS  49 -17.525  -3.856   6.184
  376   3HZ   LYS  49          3HZ       LYS  49 -16.354  -4.265   7.334
  377    H    LYS  50           H        LYS  50 -11.024  -4.826   7.237
  378    HA   LYS  50           HA       LYS  50  -9.836  -4.041   9.636
  379   1HB   LYS  50          1HB       LYS  50 -12.712  -4.118   9.742
  380   2HB   LYS  50          2HB       LYS  50 -12.043  -5.354  10.799
  381   1HG   LYS  50          1HG       LYS  50 -10.806  -3.742  12.035
  382   2HG   LYS  50          2HG       LYS  50 -11.181  -2.474  10.866
  383   1HD   LYS  50          1HD       LYS  50 -13.500  -2.508  11.485
  384   2HD   LYS  50          2HD       LYS  50 -13.252  -3.922  12.511
  385   1HE   LYS  50          1HE       LYS  50 -12.072  -2.696  14.113
  386   2HE   LYS  50          2HE       LYS  50 -11.757  -1.368  12.997
  387   1HZ   LYS  50          1HZ       LYS  50 -13.632  -1.255  14.841
  388   2HZ   LYS  50          2HZ       LYS  50 -14.548  -1.954  13.604
  389   3HZ   LYS  50          3HZ       LYS  50 -13.785  -0.466  13.353
  390    H    ARG  51           H        ARG  51 -12.181  -6.661   9.083
  391    HA   ARG  51           HA       ARG  51 -10.114  -8.608   9.723
  392   1HB   ARG  51          1HB       ARG  51 -12.533  -8.627  10.622
  393   2HB   ARG  51          2HB       ARG  51 -12.970  -9.251   9.037
  394   1HG   ARG  51          1HG       ARG  51 -12.240 -11.296   9.526
  395   2HG   ARG  51          2HG       ARG  51 -10.742 -10.685  10.233
  396   1HD   ARG  51          1HD       ARG  51 -12.345  -9.960  12.186
  397   2HD   ARG  51          2HD       ARG  51 -13.376 -11.227  11.521
  398    HE   ARG  51           HE       ARG  51 -10.904 -11.572  12.958
  399   1HH1  ARG  51          1HH1      ARG  51 -13.160 -12.999  10.723
  400   2HH1  ARG  51          2HH1      ARG  51 -12.685 -14.627  11.081
  401   1HH2  ARG  51          1HH2      ARG  51 -10.270 -13.710  13.437
  402   2HH2  ARG  51          2HH2      ARG  51 -11.042 -15.030  12.625
  403    H    THR  52           H        THR  52  -9.538  -7.369   7.363
  404    HA   THR  52           HA       THR  52 -10.349  -9.277   5.276
  405    HB   THR  52           HB       THR  52  -8.799  -6.940   4.412
  406    HG1  THR  52           HG1      THR  52 -11.353  -6.619   5.637
  407   1HG2  THR  52          1HG2      THR  52  -9.798  -8.210   2.717
  408   2HG2  THR  52          2HG2      THR  52 -10.856  -6.807   2.871
  409   3HG2  THR  52          3HG2      THR  52 -11.322  -8.348   3.592
  410    H    SER  53           H        SER  53  -8.953 -10.857   4.896
  411    HA   SER  53           HA       SER  53  -6.217 -10.706   5.752
  412   1HB   SER  53          1HB       SER  53  -6.193 -12.985   4.416
  413   2HB   SER  53          2HB       SER  53  -7.007 -12.867   5.976
  414    HG   SER  53           HG       SER  53  -8.600 -13.663   4.817
  415    H    LEU  54           H        LEU  54  -4.584 -11.726   4.031
  416    HA   LEU  54           HA       LEU  54  -3.954  -9.737   2.220
  417   1HB   LEU  54          1HB       LEU  54  -2.375 -11.432   2.992
  418   2HB   LEU  54          2HB       LEU  54  -3.241 -12.663   2.075
  419    HG   LEU  54           HG       LEU  54  -2.573 -11.620  -0.011
  420   1HD1  LEU  54          1HD1      LEU  54  -1.055  -9.628   1.665
  421   2HD1  LEU  54          2HD1      LEU  54  -2.567  -9.290   0.822
  422   3HD1  LEU  54          3HD1      LEU  54  -1.120  -9.706  -0.096
  423   1HD2  LEU  54          1HD2      LEU  54  -0.619 -12.518   1.997
  424   2HD2  LEU  54          2HD2      LEU  54   0.057 -11.666   0.609
  425   3HD2  LEU  54          3HD2      LEU  54  -0.928 -13.110   0.365
  426    H    ALA  55           H        ALA  55  -6.073 -12.481   1.845
  427    HA   ALA  55           HA       ALA  55  -6.254 -12.675  -0.914
  428   1HB   ALA  55          1HB       ALA  55  -8.557 -12.980   1.006
  429   2HB   ALA  55          2HB       ALA  55  -8.386 -13.720  -0.586
  430   3HB   ALA  55          3HB       ALA  55  -7.320 -14.207   0.733
  431    H    GLY  56           H        GLY  56  -7.664 -10.316   1.265
  432   1HA   GLY  56          1HA       GLY  56  -9.482  -9.193  -0.623
  433   2HA   GLY  56          2HA       GLY  56  -8.962  -8.453   0.883
  434    H    MET  57           H        MET  57  -6.209  -8.318   0.422
  435    HA   MET  57           HA       MET  57  -6.084  -5.971  -1.192
  436   1HB   MET  57          1HB       MET  57  -3.934  -7.607   0.157
  437   2HB   MET  57          2HB       MET  57  -3.622  -6.099  -0.693
  438   1HG   MET  57          1HG       MET  57  -5.704  -6.074   1.412
  439   2HG   MET  57          2HG       MET  57  -4.023  -6.208   1.923
  440   1HE   MET  57          1HE       MET  57  -6.441  -2.830   0.473
  441   2HE   MET  57          2HE       MET  57  -5.717  -3.461  -1.007
  442   3HE   MET  57          3HE       MET  57  -6.646  -4.530   0.046
  443    H    LYS  58           H        LYS  58  -4.713  -9.237  -1.519
  444    HA   LYS  58           HA       LYS  58  -3.393  -8.866  -3.943
  445   1HB   LYS  58          1HB       LYS  58  -3.239 -11.208  -4.084
  446   2HB   LYS  58          2HB       LYS  58  -3.308 -10.873  -2.359
  447   1HG   LYS  58          1HG       LYS  58  -5.683 -11.440  -2.339
  448   2HG   LYS  58          2HG       LYS  58  -5.617 -11.772  -4.072
  449   1HD   LYS  58          1HD       LYS  58  -5.487 -13.836  -2.770
  450   2HD   LYS  58          2HD       LYS  58  -3.994 -13.556  -3.671
  451   1HE   LYS  58          1HE       LYS  58  -2.771 -13.179  -1.789
  452   2HE   LYS  58          2HE       LYS  58  -4.133 -12.486  -0.911
  453   1HZ   LYS  58          1HZ       LYS  58  -5.003 -14.645  -0.500
  454   2HZ   LYS  58          2HZ       LYS  58  -3.368 -14.677  -0.066
  455   3HZ   LYS  58          3HZ       LYS  58  -3.870 -15.378  -1.522
  456    H    LYS  59           H        LYS  59  -6.771  -9.414  -3.255
  457    HA   LYS  59           HA       LYS  59  -7.678 -10.233  -5.759
  458   1HB   LYS  59          1HB       LYS  59  -9.040 -10.182  -3.675
  459   2HB   LYS  59          2HB       LYS  59  -9.128  -8.431  -3.811
  460   1HG   LYS  59          1HG       LYS  59 -11.120  -9.044  -4.750
  461   2HG   LYS  59          2HG       LYS  59 -10.093  -8.958  -6.182
  462   1HD   LYS  59          1HD       LYS  59 -10.026 -11.569  -4.890
  463   2HD   LYS  59          2HD       LYS  59 -11.644 -11.107  -5.422
  464   1HE   LYS  59          1HE       LYS  59 -11.042 -11.044  -7.641
  465   2HE   LYS  59          2HE       LYS  59  -9.346 -10.722  -7.282
  466   1HZ   LYS  59          1HZ       LYS  59  -9.005 -12.968  -6.677
  467   2HZ   LYS  59          2HZ       LYS  59  -9.838 -12.995  -8.149
  468   3HZ   LYS  59          3HZ       LYS  59 -10.660 -13.316  -6.706
  469    H    LEU  60           H        LEU  60  -6.789  -7.061  -4.587
  470    HA   LEU  60           HA       LEU  60  -7.874  -5.680  -6.874
  471   1HB   LEU  60          1HB       LEU  60  -6.205  -4.860  -4.522
  472   2HB   LEU  60          2HB       LEU  60  -6.489  -3.761  -5.869
  473    HG   LEU  60           HG       LEU  60  -9.001  -4.239  -5.385
  474   1HD1  LEU  60          1HD1      LEU  60  -9.414  -5.610  -3.691
  475   2HD1  LEU  60          2HD1      LEU  60  -8.726  -4.400  -2.608
  476   3HD1  LEU  60          3HD1      LEU  60  -7.704  -5.680  -3.262
  477   1HD2  LEU  60          1HD2      LEU  60  -8.029  -2.621  -3.173
  478   2HD2  LEU  60          2HD2      LEU  60  -9.002  -2.162  -4.571
  479   3HD2  LEU  60          3HD2      LEU  60  -7.244  -2.230  -4.703
  480    H    ILE  61           H        ILE  61  -4.713  -6.785  -5.775
  481    HA   ILE  61           HA       ILE  61  -3.699  -6.387  -8.496
  482    HB   ILE  61           HB       ILE  61  -2.173  -5.580  -6.017
  483   1HG1  ILE  61          1HG1      ILE  61  -2.309  -3.348  -7.543
  484   2HG1  ILE  61          2HG1      ILE  61  -3.852  -4.092  -7.949
  485   1HG2  ILE  61          1HG2      ILE  61  -0.389  -5.986  -7.295
  486   2HG2  ILE  61          2HG2      ILE  61  -1.370  -6.169  -8.749
  487   3HG2  ILE  61          3HG2      ILE  61  -0.870  -4.563  -8.219
  488   1HD1  ILE  61          1HD1      ILE  61  -2.993  -2.764  -5.504
  489   2HD1  ILE  61          2HD1      ILE  61  -4.614  -3.037  -6.144
  490   3HD1  ILE  61          3HD1      ILE  61  -3.802  -4.306  -5.227
  491    HA   PRO  62           HA       PRO  62  -2.776 -10.617  -6.844
  492   1HB   PRO  62          1HB       PRO  62  -3.480 -11.906  -9.127
  493   2HB   PRO  62          2HB       PRO  62  -4.643 -11.483  -7.865
  494   1HG   PRO  62          1HG       PRO  62  -4.048 -10.078 -10.440
  495   2HG   PRO  62          2HG       PRO  62  -5.617 -10.417  -9.687
  496   1HD   PRO  62          1HD       PRO  62  -4.420  -7.994  -9.530
  497   2HD   PRO  62          2HD       PRO  62  -5.445  -8.638  -8.232
  498    H    GLY  63           H        GLY  63  -0.571 -10.528  -6.807
  499   1HA   GLY  63          1HA       GLY  63   1.241 -11.694  -8.107
  500   2HA   GLY  63          2HA       GLY  63   0.810 -10.606  -9.418
  501    H    ALA  64           H        ALA  64   1.079  -9.834  -5.978
  502    HA   ALA  64           HA       ALA  64   3.497  -8.268  -6.541
  503   1HB   ALA  64          1HB       ALA  64   0.867  -7.230  -5.771
  504   2HB   ALA  64          2HB       ALA  64   2.208  -6.630  -4.793
  505   3HB   ALA  64          3HB       ALA  64   2.229  -6.418  -6.544
  506    H    HIS  65           H        HIS  65   4.468  -7.426  -4.437
  507    HA   HIS  65           HA       HIS  65   4.497  -9.641  -2.533
  508   1HB   HIS  65          1HB       HIS  65   6.599  -8.587  -3.607
  509   2HB   HIS  65          2HB       HIS  65   6.346  -7.269  -2.467
  510    HD1  HIS  65           HD1      HIS  65   8.762  -8.105  -1.581
  511    HD2  HIS  65           HD2      HIS  65   5.541 -10.631  -0.867
  512    HE1  HIS  65           HE1      HIS  65   9.530  -9.681   0.222
  513    H    PHE  66           H        PHE  66   3.131  -9.498  -0.884
  514    HA   PHE  66           HA       PHE  66   2.642  -6.852   0.311
  515   1HB   PHE  66          1HB       PHE  66   0.884  -9.169  -0.237
  516   2HB   PHE  66          2HB       PHE  66   0.628  -8.358   1.305
  517    HD1  PHE  66           HD1      PHE  66   0.720  -7.845  -2.353
  518    HD2  PHE  66           HD2      PHE  66  -0.480  -6.289   1.422
  519    HE1  PHE  66           HE1      PHE  66  -0.601  -6.110  -3.492
  520    HE2  PHE  66           HE2      PHE  66  -1.804  -4.552   0.289
  521    HZ   PHE  66           HZ       PHE  66  -1.866  -4.461  -2.171
  522    H    GLU  67           H        GLU  67   2.335  -6.787   2.642
  523    HA   GLU  67           HA       GLU  67   3.388  -9.033   4.163
  524   1HB   GLU  67          1HB       GLU  67   4.917  -6.622   3.564
  525   2HB   GLU  67          2HB       GLU  67   4.763  -6.909   5.292
  526   1HG   GLU  67          1HG       GLU  67   6.179  -8.625   5.247
  527   2HG   GLU  67          2HG       GLU  67   5.447  -9.309   3.797
  528    H    LYS  68           H        LYS  68   1.874  -9.318   5.654
  529    HA   LYS  68           HA       LYS  68   0.456  -7.003   6.746
  530   1HB   LYS  68          1HB       LYS  68  -0.840  -8.946   5.882
  531   2HB   LYS  68          2HB       LYS  68  -0.112  -9.948   7.131
  532   1HG   LYS  68          1HG       LYS  68  -1.327  -7.554   8.224
  533   2HG   LYS  68          2HG       LYS  68  -2.478  -8.542   7.320
  534   1HD   LYS  68          1HD       LYS  68  -2.279 -10.324   8.753
  535   2HD   LYS  68          2HD       LYS  68  -0.639  -9.888   9.240
  536   1HE   LYS  68          1HE       LYS  68  -1.397  -8.763  11.002
  537   2HE   LYS  68          2HE       LYS  68  -2.497  -7.825   9.993
  538   1HZ   LYS  68          1HZ       LYS  68  -3.432  -9.346  11.847
  539   2HZ   LYS  68          2HZ       LYS  68  -3.196 -10.587  10.722
  540   3HZ   LYS  68          3HZ       LYS  68  -4.213  -9.288  10.348
  541    H    ARG  69           H        ARG  69   3.237  -8.386   7.436
  542    HA   ARG  69           HA       ARG  69   2.881  -8.824  10.282
  543   1HB   ARG  69          1HB       ARG  69   5.224  -9.024   8.407
  544   2HB   ARG  69          2HB       ARG  69   5.443  -9.092  10.150
  545   1HG   ARG  69          1HG       ARG  69   3.995 -11.039  10.278
  546   2HG   ARG  69          2HG       ARG  69   3.715 -10.957   8.537
  547   1HD   ARG  69          1HD       ARG  69   5.369 -12.589   8.772
  548   2HD   ARG  69          2HD       ARG  69   6.258 -11.138   8.310
  549    HE   ARG  69           HE       ARG  69   6.152 -11.306  11.114
  550   1HH1  ARG  69          1HH1      ARG  69   7.624 -12.877   8.378
  551   2HH1  ARG  69          2HH1      ARG  69   9.017 -13.402   9.264
  552   1HH2  ARG  69          1HH2      ARG  69   7.981 -11.991  12.291
  553   2HH2  ARG  69          2HH2      ARG  69   9.219 -12.899  11.490
  554    H    ARG  70           H        ARG  70   2.571  -6.137   8.851
  555    HA   ARG  70           HA       ARG  70   3.259  -3.950   9.073
  556   1HB   ARG  70          1HB       ARG  70   3.307  -3.286  11.527
  557   2HB   ARG  70          2HB       ARG  70   1.847  -4.086  10.961
  558   1HG   ARG  70          1HG       ARG  70   2.593  -6.183  11.933
  559   2HG   ARG  70          2HG       ARG  70   4.095  -5.419  12.457
  560   1HD   ARG  70          1HD       ARG  70   2.630  -3.783  13.741
  561   2HD   ARG  70          2HD       ARG  70   1.296  -4.891  13.420
  562    HE   ARG  70           HE       ARG  70   3.234  -6.468  14.508
  563   1HH1  ARG  70          1HH1      ARG  70   1.604  -3.554  15.493
  564   2HH1  ARG  70          2HH1      ARG  70   1.729  -3.901  17.186
  565   1HH2  ARG  70          1HH2      ARG  70   3.406  -6.936  16.733
  566   2HH2  ARG  70          2HH2      ARG  70   2.756  -5.825  17.890
  567    H    GLY  71           H        GLY  71   5.335  -4.238   8.039
  568   1HA   GLY  71          1HA       GLY  71   7.706  -4.966   9.278
  569   2HA   GLY  71          2HA       GLY  71   7.593  -3.840   7.933
  570    H    THR  72           H        THR  72   5.838  -2.106   9.726
  571    HA   THR  72           HA       THR  72   7.567  -1.220  11.834
  572    HB   THR  72           HB       THR  72   7.226   1.047  10.032
  573    HG1  THR  72           HG1      THR  72   9.181  -0.815   9.202
  574   1HG2  THR  72          1HG2      THR  72   8.619   1.097  12.038
  575   2HG2  THR  72          2HG2      THR  72   9.592   1.396  10.597
  576   3HG2  THR  72          3HG2      THR  72   9.634  -0.184  11.377
  577    H    GLN  73           H        GLN  73   4.773  -1.981  11.400
  578    HA   GLN  73           HA       GLN  73   2.654  -1.323  11.927
  579   1HB   GLN  73          1HB       GLN  73   3.979   0.744  13.675
  580   2HB   GLN  73          2HB       GLN  73   2.438  -0.062  13.931
  581   1HG   GLN  73          1HG       GLN  73   3.700  -1.241  15.391
  582   2HG   GLN  73          2HG       GLN  73   3.982  -2.210  13.945
  583   1HE2  GLN  73          1HE2      GLN  73   5.303   0.422  15.883
  584   2HE2  GLN  73          2HE2      GLN  73   6.959   0.119  15.494
  585    H    GLY  74           H        GLY  74   1.487   1.074  12.583
  586   1HA   GLY  74          1HA       GLY  74   1.143   2.278  10.060
  587   2HA   GLY  74          2HA       GLY  74   0.544   2.913  11.585
  588    H    GLU  75           H        GLU  75   3.557   2.759  12.407
  589    HA   GLU  75           HA       GLU  75   4.101   5.488  12.139
  590   1HB   GLU  75          1HB       GLU  75   5.256   3.309  13.455
  591   2HB   GLU  75          2HB       GLU  75   6.521   3.917  12.396
  592   1HG   GLU  75          1HG       GLU  75   5.905   6.226  13.371
  593   2HG   GLU  75          2HG       GLU  75   5.124   5.295  14.648
  594    H    ALA  76           H        ALA  76   4.736   2.814  10.023
  595    HA   ALA  76           HA       ALA  76   6.796   3.942   8.466
  596   1HB   ALA  76          1HB       ALA  76   6.039   2.305   6.727
  597   2HB   ALA  76          2HB       ALA  76   6.383   1.601   8.308
  598   3HB   ALA  76          3HB       ALA  76   4.713   1.869   7.806
  599    H    ARG  77           H        ARG  77   3.529   4.781   8.760
  600    HA   ARG  77           HA       ARG  77   2.973   5.657   6.129
  601   1HB   ARG  77          1HB       ARG  77   1.043   6.663   7.017
  602   2HB   ARG  77          2HB       ARG  77   1.328   5.268   8.048
  603   1HG   ARG  77          1HG       ARG  77   1.055   6.715   9.726
  604   2HG   ARG  77          2HG       ARG  77   2.711   7.204   9.364
  605   1HD   ARG  77          1HD       ARG  77   1.767   9.252   9.226
  606   2HD   ARG  77          2HD       ARG  77   1.399   8.722   7.586
  607    HE   ARG  77           HE       ARG  77  -0.826   8.624   8.145
  608   1HH1  ARG  77          1HH1      ARG  77   1.089   8.945  11.034
  609   2HH1  ARG  77          2HH1      ARG  77  -0.275   9.227  12.064
  610   1HH2  ARG  77          1HH2      ARG  77  -2.631   8.994   9.491
  611   2HH2  ARG  77          2HH2      ARG  77  -2.391   9.254  11.186
  612    H    ALA  78           H        ALA  78   4.900   6.953   8.652
  613    HA   ALA  78           HA       ALA  78   4.813   9.681   7.702
  614   1HB   ALA  78          1HB       ALA  78   5.874   8.279  10.014
  615   2HB   ALA  78          2HB       ALA  78   6.993   9.488   9.382
  616   3HB   ALA  78          3HB       ALA  78   5.358   9.958   9.845
  617    H    TYR  79           H        TYR  79   7.340   7.170   7.904
  618    HA   TYR  79           HA       TYR  79   9.185   8.616   6.296
  619   1HB   TYR  79          1HB       TYR  79  10.522   7.104   7.259
  620   2HB   TYR  79          2HB       TYR  79   9.141   6.136   7.761
  621    HD1  TYR  79           HD1      TYR  79  11.424   6.768   4.897
  622    HD2  TYR  79           HD2      TYR  79   8.700   4.070   6.742
  623    HE1  TYR  79           HE1      TYR  79  12.072   5.024   3.289
  624    HE2  TYR  79           HE2      TYR  79   9.341   2.318   5.140
  625    HH   TYR  79           HH       TYR  79  12.063   2.527   3.178
  626    H    SER  80           H        SER  80   6.925   5.970   5.649
  627    HA   SER  80           HA       SER  80   6.033   5.165   3.717
  628   1HB   SER  80          1HB       SER  80   6.752   7.955   3.038
  629   2HB   SER  80          2HB       SER  80   6.503   6.873   1.668
  630    HG   SER  80           HG       SER  80   4.449   6.382   2.514
  631    H    MET  81           H        MET  81   8.574   6.916   2.025
  632    HA   MET  81           HA       MET  81  10.086   4.435   1.664
  633   1HB   MET  81          1HB       MET  81   9.317   6.209  -0.656
  634   2HB   MET  81          2HB       MET  81  10.188   4.683  -0.728
  635   1HG   MET  81          1HG       MET  81   8.241   3.707  -1.111
  636   2HG   MET  81          2HG       MET  81   7.828   4.049   0.567
  637   1HE   MET  81          1HE       MET  81   5.167   3.996  -0.123
  638   2HE   MET  81          2HE       MET  81   5.748   5.056   1.161
  639   3HE   MET  81          3HE       MET  81   4.572   5.653  -0.010
  640    H    LYS  82           H        LYS  82  11.948   5.296  -0.141
  641    HA   LYS  82           HA       LYS  82  13.404   7.269   1.447
  642   1HB   LYS  82          1HB       LYS  82  14.157   4.898   0.192
  643   2HB   LYS  82          2HB       LYS  82  14.848   6.161  -0.818
  644   1HG   LYS  82          1HG       LYS  82  16.448   6.578   0.660
  645   2HG   LYS  82          2HG       LYS  82  15.287   6.702   1.984
  646   1HD   LYS  82          1HD       LYS  82  15.253   4.071   1.727
  647   2HD   LYS  82          2HD       LYS  82  16.850   4.354   1.031
  648   1HE   LYS  82          1HE       LYS  82  17.574   5.477   3.037
  649   2HE   LYS  82          2HE       LYS  82  15.953   5.375   3.723
  650   1HZ   LYS  82          1HZ       LYS  82  17.191   3.652   4.699
  651   2HZ   LYS  82          2HZ       LYS  82  17.858   3.164   3.224
  652   3HZ   LYS  82          3HZ       LYS  82  16.219   2.893   3.541
  653    H    GLU  83           H        GLU  83  13.593   9.315   0.831
  654    HA   GLU  83           HA       GLU  83  12.383  10.327  -1.499
  655   1HB   GLU  83          1HB       GLU  83  13.258  11.427   0.823
  656   2HB   GLU  83          2HB       GLU  83  14.517  11.963  -0.280
  657   1HG   GLU  83          1HG       GLU  83  13.205  13.554  -1.067
  658   2HG   GLU  83          2HG       GLU  83  11.972  12.372  -1.502
  659    H    ASP  84           H        ASP  84  15.682   9.387  -0.768
  660    HA   ASP  84           HA       ASP  84  16.992  10.553  -2.941
  661   1HB   ASP  84          1HB       ASP  84  17.538   8.228  -1.155
  662   2HB   ASP  84          2HB       ASP  84  18.499   8.386  -2.623
  663    H    THR  85           H        THR  85  14.874   7.830  -2.780
  664    HA   THR  85           HA       THR  85  15.435   7.242  -5.615
  665    HB   THR  85           HB       THR  85  14.053   5.152  -4.057
  666    HG1  THR  85           HG1      THR  85  16.638   6.066  -3.417
  667   1HG2  THR  85          1HG2      THR  85  15.015   5.175  -6.499
  668   2HG2  THR  85          2HG2      THR  85  15.128   3.719  -5.510
  669   3HG2  THR  85          3HG2      THR  85  16.528   4.776  -5.687
  670    H    ARG  86           H        ARG  86  13.366   8.873  -3.819
  671    HA   ARG  86           HA       ARG  86  10.845   7.803  -4.673
  672   1HB   ARG  86          1HB       ARG  86  11.199   9.148  -2.577
  673   2HB   ARG  86          2HB       ARG  86  11.414  10.565  -3.595
  674   1HG   ARG  86          1HG       ARG  86   9.209  10.732  -4.069
  675   2HG   ARG  86          2HG       ARG  86   8.955   8.986  -4.026
  676   1HD   ARG  86          1HD       ARG  86   8.027   9.273  -2.023
  677   2HD   ARG  86          2HD       ARG  86   9.639   9.652  -1.419
  678    HE   ARG  86           HE       ARG  86   8.244  11.895  -2.571
  679   1HH1  ARG  86          1HH1      ARG  86   8.841  10.042   0.315
  680   2HH1  ARG  86          2HH1      ARG  86   8.427  11.337   1.389
  681   1HH2  ARG  86          1HH2      ARG  86   7.698  13.608  -1.167
  682   2HH2  ARG  86          2HH2      ARG  86   7.776  13.365   0.545
  683    H    LEU  87           H        LEU  87   9.792   8.177  -6.515
  684    HA   LEU  87           HA       LEU  87  10.941  10.093  -8.404
  685   1HB   LEU  87          1HB       LEU  87   9.929   7.498  -8.661
  686   2HB   LEU  87          2HB       LEU  87   8.747   8.543  -9.445
  687    HG   LEU  87           HG       LEU  87  11.660   8.218 -10.139
  688   1HD1  LEU  87          1HD1      LEU  87  10.519   7.729 -12.397
  689   2HD1  LEU  87          2HD1      LEU  87   9.063   7.482 -11.434
  690   3HD1  LEU  87          3HD1      LEU  87  10.489   6.486 -11.147
  691   1HD2  LEU  87          1HD2      LEU  87   9.656  10.268 -11.045
  692   2HD2  LEU  87          2HD2      LEU  87  11.077   9.841 -11.998
  693   3HD2  LEU  87          3HD2      LEU  87  11.270  10.530 -10.386
  694    H    GLU  88           H        GLU  88   7.687   9.052  -7.365
  695    HA   GLU  88           HA       GLU  88   6.823  11.854  -7.563
  696   1HB   GLU  88          1HB       GLU  88   6.082   9.925  -9.388
  697   2HB   GLU  88          2HB       GLU  88   4.741   9.917  -8.251
  698   1HG   GLU  88          1HG       GLU  88   4.235  12.169  -8.661
  699   2HG   GLU  88          2HG       GLU  88   5.781  12.456  -9.459
  700    H    GLY  89           H        GLY  89   4.519  12.044  -6.549
  701   1HA   GLY  89          1HA       GLY  89   3.022  11.446  -4.826
  702   2HA   GLY  89          2HA       GLY  89   4.166  10.225  -4.287
  703    HA   PRO  90           HA       PRO  90   3.504   9.959  -2.337
  704   1HB   PRO  90          1HB       PRO  90   2.088  10.718  -0.148
  705   2HB   PRO  90          2HB       PRO  90   3.787  10.235  -0.074
  706   1HG   PRO  90          1HG       PRO  90   2.600  12.982  -0.128
  707   2HG   PRO  90          2HG       PRO  90   3.927  12.357   0.867
  708   1HD   PRO  90          1HD       PRO  90   4.349  13.847  -1.354
  709   2HD   PRO  90          2HD       PRO  90   5.470  12.574  -0.831
  710    H    TRP  91           H        TRP  91   1.148   9.371  -2.025
  711    HA   TRP  91           HA       TRP  91  -0.699  11.375  -3.089
  712   1HB   TRP  91          1HB       TRP  91  -0.070   8.716  -4.356
  713   2HB   TRP  91          2HB       TRP  91  -1.614   9.521  -4.624
  714    HD1  TRP  91           HD1      TRP  91  -0.478  12.514  -4.889
  715    HE1  TRP  91           HE1      TRP  91   0.807  13.168  -7.021
  716    HE3  TRP  91           HE3      TRP  91   0.887   7.850  -6.477
  717    HZ2  TRP  91           HZ2      TRP  91   2.213  11.877  -9.101
  718    HZ3  TRP  91           HZ3      TRP  91   2.201   7.647  -8.548
  719    HH2  TRP  91           HH2      TRP  91   2.848   9.620  -9.831
  720    H    GLU  92           H        GLU  92  -2.698  11.262  -2.227
  721    HA   GLU  92           HA       GLU  92  -3.311   8.921  -0.544
  722   1HB   GLU  92          1HB       GLU  92  -3.671  11.850  -0.061
  723   2HB   GLU  92          2HB       GLU  92  -4.809  10.722   0.662
  724   1HG   GLU  92          1HG       GLU  92  -3.216   9.776   2.030
  725   2HG   GLU  92          2HG       GLU  92  -1.879  10.282   0.998
  726    H    TYR  93           H        TYR  93  -5.280   7.979  -0.745
  727    HA   TYR  93           HA       TYR  93  -7.324   9.291  -2.375
  728   1HB   TYR  93          1HB       TYR  93  -6.182   6.548  -2.926
  729   2HB   TYR  93          2HB       TYR  93  -7.680   7.144  -3.630
  730    HD1  TYR  93           HD1      TYR  93  -7.615   9.082  -5.199
  731    HD2  TYR  93           HD2      TYR  93  -4.066   7.205  -3.790
  732    HE1  TYR  93           HE1      TYR  93  -6.345  10.123  -7.029
  733    HE2  TYR  93           HE2      TYR  93  -2.786   8.242  -5.616
  734    HH   TYR  93           HH       TYR  93  -3.560  10.732  -7.222
  735    H    GLY  94           H        GLY  94  -9.438   8.192  -2.238
  736   1HA   GLY  94          1HA       GLY  94 -11.020   6.846  -1.149
  737   2HA   GLY  94          2HA       GLY  94  -9.777   6.341  -0.015
  738    H    GLU  95           H        GLU  95 -11.139   6.697   1.762
  739    HA   GLU  95           HA       GLU  95 -12.621   8.954   2.330
  740   1HB   GLU  95          1HB       GLU  95 -12.827   7.027   3.729
  741   2HB   GLU  95          2HB       GLU  95 -11.127   7.091   4.172
  742   1HG   GLU  95          1HG       GLU  95 -12.566   7.862   5.980
  743   2HG   GLU  95          2HG       GLU  95 -11.496   9.141   5.408
  Start of MODEL   10
    1   1H    ALA   2          1H        ALA   2 -12.973   0.192  21.184
    2    HA   ALA   2           HA       ALA   2 -13.302   1.053  18.417
    3   1HB   ALA   2          1HB       ALA   2 -11.357   2.707  19.848
    4   2HB   ALA   2          2HB       ALA   2 -12.568   3.157  18.647
    5   3HB   ALA   2          3HB       ALA   2 -13.032   2.969  20.338
    6    H    ARG   3           H        ARG   3 -11.957  -0.108  17.220
    7    HA   ARG   3           HA       ARG   3  -9.329  -0.825  18.330
    8   1HB   ARG   3          1HB       ARG   3 -11.347  -2.598  16.988
    9   2HB   ARG   3          2HB       ARG   3  -9.632  -2.980  16.911
   10   1HG   ARG   3          1HG       ARG   3 -10.653  -2.385  19.599
   11   2HG   ARG   3          2HG       ARG   3 -11.308  -3.840  18.845
   12   1HD   ARG   3          1HD       ARG   3  -8.397  -3.484  18.595
   13   2HD   ARG   3          2HD       ARG   3  -8.988  -3.753  20.235
   14    HE   ARG   3           HE       ARG   3  -8.934  -5.654  18.072
   15   1HH1  ARG   3          1HH1      ARG   3 -10.388  -4.795  21.117
   16   2HH1  ARG   3          2HH1      ARG   3 -10.877  -6.415  21.488
   17   1HH2  ARG   3          1HH2      ARG   3  -9.574  -7.790  18.549
   18   2HH2  ARG   3          2HH2      ARG   3 -10.413  -8.118  20.028
   19    H    GLN   4           H        GLN   4  -7.669  -0.313  17.056
   20    HA   GLN   4           HA       GLN   4  -8.240   0.645  14.354
   21   1HB   GLN   4          1HB       GLN   4  -6.050   1.692  14.443
   22   2HB   GLN   4          2HB       GLN   4  -6.972   2.110  15.880
   23   1HG   GLN   4          1HG       GLN   4  -5.512   1.128  17.252
   24   2HG   GLN   4          2HG       GLN   4  -5.310  -0.269  16.196
   25   1HE2  GLN   4          1HE2      GLN   4  -4.024   2.713  17.233
   26   2HE2  GLN   4          2HE2      GLN   4  -2.622   2.725  16.223
   27    H    VAL   5           H        VAL   5  -7.066  -0.051  12.536
   28    HA   VAL   5           HA       VAL   5  -5.924  -2.748  12.830
   29    HB   VAL   5           HB       VAL   5  -6.467  -3.119  10.488
   30   1HG1  VAL   5          1HG1      VAL   5  -9.089  -2.410  10.868
   31   2HG1  VAL   5          2HG1      VAL   5  -8.328  -3.886  11.466
   32   3HG1  VAL   5          3HG1      VAL   5  -8.464  -2.474  12.515
   33   1HG2  VAL   5          1HG2      VAL   5  -6.536  -0.312  10.365
   34   2HG2  VAL   5          2HG2      VAL   5  -6.801  -1.457   9.050
   35   3HG2  VAL   5          3HG2      VAL   5  -8.169  -0.866   9.993
   36    H    ILE   6           H        ILE   6  -4.133  -3.324  11.426
   37    HA   ILE   6           HA       ILE   6  -2.204  -1.161  11.262
   38    HB   ILE   6           HB       ILE   6  -1.793  -4.076  10.595
   39   1HG1  ILE   6          1HG1      ILE   6  -0.601  -3.842  12.967
   40   2HG1  ILE   6          2HG1      ILE   6  -1.833  -2.605  13.187
   41   1HG2  ILE   6          1HG2      ILE   6   0.106  -1.807  11.152
   42   2HG2  ILE   6          2HG2      ILE   6   0.589  -3.501  11.098
   43   3HG2  ILE   6          3HG2      ILE   6  -0.066  -2.725   9.656
   44   1HD1  ILE   6          1HD1      ILE   6  -2.302  -5.027  13.948
   45   2HD1  ILE   6          2HD1      ILE   6  -3.560  -4.129  13.099
   46   3HD1  ILE   6          3HD1      ILE   6  -2.597  -5.328  12.236
   47    H    CYS   7           H        CYS   7  -1.045  -0.606   9.386
   48    HA   CYS   7           HA       CYS   7  -2.608  -0.707   6.977
   49   1HB   CYS   7          1HB       CYS   7  -1.034   0.831   6.071
   50   2HB   CYS   7          2HB       CYS   7  -1.249   1.282   7.758
   51    HG   CYS   7           HG       CYS   7   1.451  -0.208   6.308
   52    H    TRP   8           H        TRP   8  -1.812  -1.441   4.913
   53    HA   TRP   8           HA       TRP   8  -0.114  -3.824   5.190
   54   1HB   TRP   8          1HB       TRP   8  -2.226  -3.112   3.149
   55   2HB   TRP   8          2HB       TRP   8  -1.176  -4.520   3.016
   56    HD1  TRP   8           HD1      TRP   8  -3.619  -3.087   5.687
   57    HE1  TRP   8           HE1      TRP   8  -4.897  -5.067   6.721
   58    HE3  TRP   8           HE3      TRP   8  -1.390  -6.915   3.134
   59    HZ2  TRP   8           HZ2      TRP   8  -4.952  -7.879   6.487
   60    HZ3  TRP   8           HZ3      TRP   8  -2.113  -9.220   3.598
   61    HH2  TRP   8           HH2      TRP   8  -3.857  -9.691   5.241
   62    H    CYS   9           H        CYS   9   1.916  -3.548   4.560
   63    HA   CYS   9           HA       CYS   9   2.535  -1.534   2.530
   64   1HB   CYS   9          1HB       CYS   9   4.905  -1.930   3.240
   65   2HB   CYS   9          2HB       CYS   9   3.857  -1.349   4.528
   66    HG   CYS   9           HG       CYS   9   5.865  -3.773   4.736
   67    H    PHE  10           H        PHE  10   2.732  -2.147   0.491
   68    HA   PHE  10           HA       PHE  10   3.889  -4.786  -0.091
   69   1HB   PHE  10          1HB       PHE  10   2.231  -5.364  -1.607
   70   2HB   PHE  10          2HB       PHE  10   1.297  -4.550  -0.355
   71    HD1  PHE  10           HD2      PHE  10   0.412  -2.300  -0.731
   72    HD2  PHE  10           HD1      PHE  10   2.472  -4.426  -3.789
   73    HE1  PHE  10           HE2      PHE  10  -0.483  -0.743  -2.411
   74    HE2  PHE  10           HE1      PHE  10   1.581  -2.871  -5.475
   75    HZ   PHE  10           HZ       PHE  10   0.100  -1.027  -4.787
   76    H    THR  11           H        THR  11   4.686  -4.956  -2.355
   77    HA   THR  11           HA       THR  11   5.488  -2.360  -3.476
   78    HB   THR  11           HB       THR  11   7.408  -4.678  -3.321
   79    HG1  THR  11           HG1      THR  11   8.360  -3.372  -1.573
   80   1HG2  THR  11          1HG2      THR  11   8.489  -3.346  -4.765
   81   2HG2  THR  11          2HG2      THR  11   8.813  -2.312  -3.373
   82   3HG2  THR  11          3HG2      THR  11   7.435  -1.975  -4.421
   83    H    LEU  12           H        LEU  12   5.033  -2.222  -5.569
   84    HA   LEU  12           HA       LEU  12   4.739  -4.718  -7.107
   85   1HB   LEU  12          1HB       LEU  12   2.610  -3.730  -6.957
   86   2HB   LEU  12          2HB       LEU  12   3.252  -2.114  -7.245
   87    HG   LEU  12           HG       LEU  12   3.533  -2.537  -9.558
   88   1HD1  LEU  12          1HD1      LEU  12   4.289  -4.561 -10.112
   89   2HD1  LEU  12          2HD1      LEU  12   2.594  -5.045 -10.148
   90   3HD1  LEU  12          3HD1      LEU  12   3.559  -5.321  -8.698
   91   1HD2  LEU  12          1HD2      LEU  12   1.169  -3.592 -10.089
   92   2HD2  LEU  12          2HD2      LEU  12   1.326  -1.985  -9.380
   93   3HD2  LEU  12          3HD2      LEU  12   0.947  -3.368  -8.354
   94    H    ASN  13           H        ASN  13   6.081  -5.005  -8.760
   95    HA   ASN  13           HA       ASN  13   7.634  -2.694  -9.708
   96   1HB   ASN  13          1HB       ASN  13   9.339  -4.282 -10.405
   97   2HB   ASN  13          2HB       ASN  13   8.937  -4.553  -8.712
   98   1HD2  ASN  13          1HD2      ASN  13   7.903  -6.428  -8.110
   99   2HD2  ASN  13          2HD2      ASN  13   7.729  -7.781  -9.169
  100    H    ASN  14           H        ASN  14   7.667  -2.145 -11.831
  101    HA   ASN  14           HA       ASN  14   6.840  -1.919 -13.945
  102   1HB   ASN  14          1HB       ASN  14   8.375  -3.977 -14.055
  103   2HB   ASN  14          2HB       ASN  14   6.893  -4.928 -14.086
  104   1HD2  ASN  14          1HD2      ASN  14   7.772  -5.622 -16.164
  105   2HD2  ASN  14          2HD2      ASN  14   7.443  -4.664 -17.564
  106    HA   PRO  15           HA       PRO  15   2.540  -3.149 -12.545
  107   1HB   PRO  15          1HB       PRO  15   1.571  -0.617 -12.389
  108   2HB   PRO  15          2HB       PRO  15   2.376  -1.423 -11.037
  109   1HG   PRO  15          1HG       PRO  15   3.480   0.560 -12.988
  110   2HG   PRO  15          2HG       PRO  15   3.711   0.471 -11.232
  111   1HD   PRO  15          1HD       PRO  15   5.565  -0.421 -12.992
  112   2HD   PRO  15          2HD       PRO  15   5.322  -1.169 -11.400
  113    H    LEU  16           H        LEU  16   0.465  -2.537 -13.647
  114    HA   LEU  16           HA       LEU  16   0.976  -1.884 -16.474
  115   1HB   LEU  16          1HB       LEU  16  -0.046  -4.205 -15.450
  116   2HB   LEU  16          2HB       LEU  16  -1.507  -3.305 -15.853
  117    HG   LEU  16           HG       LEU  16  -0.860  -4.806 -17.660
  118   1HD1  LEU  16          1HD1      LEU  16  -0.265  -2.025 -18.603
  119   2HD1  LEU  16          2HD1      LEU  16  -1.869  -2.475 -18.027
  120   3HD1  LEU  16          3HD1      LEU  16  -1.165  -3.306 -19.414
  121   1HD2  LEU  16          1HD2      LEU  16   1.625  -3.156 -18.024
  122   2HD2  LEU  16          2HD2      LEU  16   1.188  -4.675 -18.808
  123   3HD2  LEU  16          3HD2      LEU  16   1.615  -4.656 -17.096
  124    H    SER  17           H        SER  17  -0.368  -0.713 -13.694
  125    HA   SER  17           HA       SER  17  -1.557   1.511 -14.896
  126   1HB   SER  17          1HB       SER  17  -3.746   1.030 -15.185
  127   2HB   SER  17          2HB       SER  17  -3.221  -0.653 -15.185
  128    HG   SER  17           HG       SER  17  -3.907  -0.890 -13.151
  129    HA   PRO  18           HA       PRO  18  -1.359   3.020 -10.782
  130   1HB   PRO  18          1HB       PRO  18  -3.390   4.820 -10.715
  131   2HB   PRO  18          2HB       PRO  18  -1.894   5.093 -11.616
  132   1HG   PRO  18          1HG       PRO  18  -4.557   4.152 -12.608
  133   2HG   PRO  18          2HG       PRO  18  -3.447   5.333 -13.329
  134   1HD   PRO  18          1HD       PRO  18  -3.615   2.773 -14.196
  135   2HD   PRO  18          2HD       PRO  18  -2.101   3.700 -14.241
  136    H    LEU  19           H        LEU  19  -2.267   2.876  -8.715
  137    HA   LEU  19           HA       LEU  19  -4.171   0.788  -8.356
  138   1HB   LEU  19          1HB       LEU  19  -3.180   2.730  -6.280
  139   2HB   LEU  19          2HB       LEU  19  -3.861   1.128  -6.008
  140    HG   LEU  19           HG       LEU  19  -1.199   1.732  -7.296
  141   1HD1  LEU  19          1HD1      LEU  19  -1.599   0.263  -4.726
  142   2HD1  LEU  19          2HD1      LEU  19  -1.579   2.026  -4.743
  143   3HD1  LEU  19          3HD1      LEU  19  -0.178   1.123  -5.320
  144   1HD2  LEU  19          1HD2      LEU  19  -1.425  -0.283  -8.221
  145   2HD2  LEU  19          2HD2      LEU  19  -2.879  -0.636  -7.286
  146   3HD2  LEU  19          3HD2      LEU  19  -1.286  -0.937  -6.588
  147    H    SER  20           H        SER  20  -6.051   1.109  -6.790
  148    HA   SER  20           HA       SER  20  -7.362   3.696  -7.008
  149   1HB   SER  20          1HB       SER  20  -9.439   2.677  -7.935
  150   2HB   SER  20          2HB       SER  20  -8.084   2.619  -9.061
  151    HG   SER  20           HG       SER  20  -7.850   0.470  -8.681
  152    H    LEU  21           H        LEU  21  -9.310   3.835  -5.682
  153    HA   LEU  21           HA       LEU  21  -8.940   2.688  -3.137
  154   1HB   LEU  21          1HB       LEU  21 -10.014   4.782  -3.248
  155   2HB   LEU  21          2HB       LEU  21 -11.211   4.193  -4.399
  156    HG   LEU  21           HG       LEU  21 -12.126   2.751  -2.551
  157   1HD1  LEU  21          1HD1      LEU  21 -11.043   4.437  -0.454
  158   2HD1  LEU  21          2HD1      LEU  21  -9.802   3.469  -1.249
  159   3HD1  LEU  21          3HD1      LEU  21 -11.205   2.682  -0.527
  160   1HD2  LEU  21          1HD2      LEU  21 -12.350   5.608  -2.940
  161   2HD2  LEU  21          2HD2      LEU  21 -12.722   5.146  -1.279
  162   3HD2  LEU  21          3HD2      LEU  21 -13.605   4.411  -2.618
  163    H    HIS  22           H        HIS  22 -10.244   1.205  -1.981
  164    HA   HIS  22           HA       HIS  22 -11.703  -0.689  -3.704
  165   1HB   HIS  22          1HB       HIS  22  -9.503  -1.436  -2.588
  166   2HB   HIS  22          2HB       HIS  22 -10.420  -1.432  -1.084
  167    HD1  HIS  22           HD1      HIS  22 -10.623  -3.880  -0.625
  168    HD2  HIS  22           HD2      HIS  22 -11.706  -2.903  -4.515
  169    HE1  HIS  22           HE1      HIS  22 -11.571  -5.991  -1.609
  170    H    ASP  23           H        ASP  23 -13.703  -1.371  -3.090
  171    HA   ASP  23           HA       ASP  23 -15.208   0.249  -1.344
  172   1HB   ASP  23          1HB       ASP  23 -15.711  -2.268  -2.866
  173   2HB   ASP  23          2HB       ASP  23 -16.850  -1.821  -1.598
  174    H    SER  24           H        SER  24 -13.313  -2.582  -0.821
  175    HA   SER  24           HA       SER  24 -14.584  -3.246   1.697
  176   1HB   SER  24          1HB       SER  24 -11.970  -4.366   0.696
  177   2HB   SER  24          2HB       SER  24 -13.143  -5.118   1.777
  178    HG   SER  24           HG       SER  24 -14.000  -5.950   0.063
  179    H    MET  25           H        MET  25 -11.588  -1.756   0.570
  180    HA   MET  25           HA       MET  25 -10.443  -1.476   3.165
  181   1HB   MET  25          1HB       MET  25  -8.683  -0.361   2.119
  182   2HB   MET  25          2HB       MET  25  -9.270  -1.441   0.861
  183   1HG   MET  25          1HG       MET  25 -10.377   0.324  -0.263
  184   2HG   MET  25          2HG       MET  25 -10.136   1.425   1.092
  185   1HE   MET  25          1HE       MET  25  -8.057  -0.118  -2.201
  186   2HE   MET  25          2HE       MET  25  -6.634  -0.369  -1.190
  187   3HE   MET  25          3HE       MET  25  -8.164  -1.139  -0.767
  188    H    LYS  26           H        LYS  26  -9.644   1.010   3.567
  189    HA   LYS  26           HA       LYS  26 -12.100   2.636   3.639
  190   1HB   LYS  26          1HB       LYS  26 -10.584   1.600   5.822
  191   2HB   LYS  26          2HB       LYS  26 -10.398   3.349   5.808
  192   1HG   LYS  26          1HG       LYS  26 -13.149   2.607   5.381
  193   2HG   LYS  26          2HG       LYS  26 -12.516   1.884   6.862
  194   1HD   LYS  26          1HD       LYS  26 -11.541   4.341   7.174
  195   2HD   LYS  26          2HD       LYS  26 -12.928   4.739   6.157
  196   1HE   LYS  26          1HE       LYS  26 -13.803   4.902   8.297
  197   2HE   LYS  26          2HE       LYS  26 -14.261   3.268   7.817
  198   1HZ   LYS  26          1HZ       LYS  26 -13.314   3.464  10.096
  199   2HZ   LYS  26          2HZ       LYS  26 -11.831   3.886   9.401
  200   3HZ   LYS  26          3HZ       LYS  26 -12.502   2.362   9.102
  201    H    TYR  27           H        TYR  27  -8.575   2.613   3.560
  202    HA   TYR  27           HA       TYR  27  -8.651   5.221   2.226
  203   1HB   TYR  27          1HB       TYR  27  -8.030   5.278   4.774
  204   2HB   TYR  27          2HB       TYR  27  -6.474   4.678   4.211
  205    HD1  TYR  27           HD1      TYR  27  -8.922   7.334   3.222
  206    HD2  TYR  27           HD2      TYR  27  -4.854   6.278   3.889
  207    HE1  TYR  27           HE1      TYR  27  -8.242   9.633   2.674
  208    HE2  TYR  27           HE2      TYR  27  -4.163   8.575   3.344
  209    HH   TYR  27           HH       TYR  27  -5.456  10.964   3.463
  210    H    LEU  28           H        LEU  28  -6.959   5.599   0.771
  211    HA   LEU  28           HA       LEU  28  -5.245   3.272   0.200
  212   1HB   LEU  28          1HB       LEU  28  -6.819   3.207  -1.516
  213   2HB   LEU  28          2HB       LEU  28  -6.882   4.963  -1.651
  214    HG   LEU  28           HG       LEU  28  -4.776   5.017  -2.789
  215   1HD1  LEU  28          1HD1      LEU  28  -3.249   3.508  -2.203
  216   2HD1  LEU  28          2HD1      LEU  28  -4.055   2.407  -3.318
  217   3HD1  LEU  28          3HD1      LEU  28  -4.470   2.385  -1.605
  218   1HD2  LEU  28          1HD2      LEU  28  -6.330   2.726  -3.972
  219   2HD2  LEU  28          2HD2      LEU  28  -5.347   3.923  -4.816
  220   3HD2  LEU  28          3HD2      LEU  28  -6.864   4.406  -4.054
  221    H    VAL  29           H        VAL  29  -3.140   3.698   0.144
  222    HA   VAL  29           HA       VAL  29  -2.232   6.399  -0.547
  223    HB   VAL  29           HB       VAL  29  -1.343   4.883   1.910
  224   1HG1  VAL  29          1HG1      VAL  29  -0.159   7.163   0.423
  225   2HG1  VAL  29          2HG1      VAL  29  -0.114   7.215   2.186
  226   3HG1  VAL  29          3HG1      VAL  29   0.627   5.867   1.323
  227   1HG2  VAL  29          1HG2      VAL  29  -3.267   7.028   1.429
  228   2HG2  VAL  29          2HG2      VAL  29  -3.088   5.956   2.818
  229   3HG2  VAL  29          3HG2      VAL  29  -2.087   7.402   2.687
  230    H    TYR  30           H        TYR  30  -0.754   6.277  -2.091
  231    HA   TYR  30           HA       TYR  30   1.322   4.258  -2.005
  232   1HB   TYR  30          1HB       TYR  30   0.866   3.206  -4.049
  233   2HB   TYR  30          2HB       TYR  30  -0.714   3.320  -3.281
  234    HD1  TYR  30           HD1      TYR  30   1.409   4.562  -5.995
  235    HD2  TYR  30           HD2      TYR  30  -2.419   4.812  -4.154
  236    HE1  TYR  30           HE1      TYR  30   0.538   5.730  -7.977
  237    HE2  TYR  30           HE2      TYR  30  -3.300   5.979  -6.131
  238    HH   TYR  30           HH       TYR  30  -1.936   7.524  -8.114
  239    H    GLN  31           H        GLN  31   3.015   4.649  -3.614
  240    HA   GLN  31           HA       GLN  31   2.982   7.240  -4.932
  241   1HB   GLN  31          1HB       GLN  31   4.218   8.309  -3.416
  242   2HB   GLN  31          2HB       GLN  31   4.207   6.879  -2.393
  243   1HG   GLN  31          1HG       GLN  31   6.182   6.035  -3.591
  244   2HG   GLN  31          2HG       GLN  31   6.207   7.514  -4.551
  245   1HE2  GLN  31          1HE2      GLN  31   5.622   9.390  -2.630
  246   2HE2  GLN  31          2HE2      GLN  31   6.914   9.462  -1.485
  247    H    THR  32           H        THR  32   4.724   7.521  -6.445
  248    HA   THR  32           HA       THR  32   5.643   4.961  -7.511
  249    HB   THR  32           HB       THR  32   5.770   7.710  -8.767
  250    HG1  THR  32           HG1      THR  32   4.025   6.717 -10.074
  251   1HG2  THR  32          1HG2      THR  32   6.322   6.595 -10.810
  252   2HG2  THR  32          2HG2      THR  32   6.084   5.010 -10.075
  253   3HG2  THR  32          3HG2      THR  32   7.441   6.020  -9.576
  254    H    GLU  33           H        GLU  33   7.753   4.388  -7.717
  255    HA   GLU  33           HA       GLU  33   9.782   6.319  -6.815
  256   1HB   GLU  33          1HB       GLU  33   9.236   3.559  -5.843
  257   2HB   GLU  33          2HB       GLU  33  10.916   4.062  -5.966
  258   1HG   GLU  33          1HG       GLU  33  10.579   5.853  -4.444
  259   2HG   GLU  33          2HG       GLU  33   8.831   5.629  -4.475
  260    H    GLN  34           H        GLN  34  11.971   5.833  -7.555
  261    HA   GLN  34           HA       GLN  34  11.912   4.748 -10.267
  262   1HB   GLN  34          1HB       GLN  34  13.140   6.982  -9.118
  263   2HB   GLN  34          2HB       GLN  34  14.457   5.864  -9.448
  264   1HG   GLN  34          1HG       GLN  34  12.683   5.965 -11.694
  265   2HG   GLN  34          2HG       GLN  34  13.177   7.595 -11.238
  266   1HE2  GLN  34          1HE2      GLN  34  14.331   7.719 -13.211
  267   2HE2  GLN  34          2HE2      GLN  34  15.872   6.959 -13.385
  268    H    GLY  35           H        GLY  35  13.054   2.994 -10.920
  269   1HA   GLY  35          1HA       GLY  35  15.278   1.876  -9.658
  270   2HA   GLY  35          2HA       GLY  35  13.855   1.087  -8.996
  271    H    GLU  36           H        GLU  36  15.332  -0.663 -10.110
  272    HA   GLU  36           HA       GLU  36  15.718  -2.100 -11.858
  273   1HB   GLU  36          1HB       GLU  36  13.706  -3.065 -12.751
  274   2HB   GLU  36          2HB       GLU  36  13.419  -2.652 -11.066
  275   1HG   GLU  36          1HG       GLU  36  12.065  -0.830 -11.621
  276   2HG   GLU  36          2HG       GLU  36  12.636  -0.802 -13.288
  277    H    ALA  37           H        ALA  37  14.239  -2.278 -14.329
  278    HA   ALA  37           HA       ALA  37  15.836  -0.712 -15.994
  279   1HB   ALA  37          1HB       ALA  37  14.331  -2.826 -16.454
  280   2HB   ALA  37          2HB       ALA  37  13.172  -1.602 -16.972
  281   3HB   ALA  37          3HB       ALA  37  14.753  -1.702 -17.746
  282    H    GLY  38           H        GLY  38  14.304   0.503 -17.883
  283   1HA   GLY  38          1HA       GLY  38  13.938   3.069 -16.933
  284   2HA   GLY  38          2HA       GLY  38  13.187   2.445 -18.393
  285    H    ASN  39           H        ASN  39  11.785   0.375 -16.680
  286    HA   ASN  39           HA       ASN  39   9.378   1.839 -16.317
  287   1HB   ASN  39          1HB       ASN  39   9.849  -0.865 -15.099
  288   2HB   ASN  39          2HB       ASN  39   8.374  -0.209 -15.804
  289   1HD2  ASN  39          1HD2      ASN  39  10.368  -2.571 -16.268
  290   2HD2  ASN  39          2HD2      ASN  39  10.487  -2.616 -17.991
  291    H    ILE  40           H        ILE  40   8.129   1.835 -14.262
  292    HA   ILE  40           HA       ILE  40   9.914   2.346 -11.971
  293    HB   ILE  40           HB       ILE  40   7.960   3.824 -11.175
  294   1HG1  ILE  40          1HG1      ILE  40   7.358   3.745 -14.140
  295   2HG1  ILE  40          2HG1      ILE  40   6.354   3.025 -12.886
  296   1HG2  ILE  40          1HG2      ILE  40   9.451   4.814 -13.592
  297   2HG2  ILE  40          2HG2      ILE  40   8.920   5.735 -12.186
  298   3HG2  ILE  40          3HG2      ILE  40  10.221   4.556 -12.027
  299   1HD1  ILE  40          1HD1      ILE  40   5.802   5.380 -13.874
  300   2HD1  ILE  40          2HD1      ILE  40   5.582   5.047 -12.156
  301   3HD1  ILE  40          3HD1      ILE  40   7.012   5.919 -12.710
  302    H    HIS  41           H        HIS  41   8.763   2.156  -9.823
  303    HA   HIS  41           HA       HIS  41   6.869  -0.101  -9.869
  304   1HB   HIS  41          1HB       HIS  41   7.982  -0.682  -7.601
  305   2HB   HIS  41          2HB       HIS  41   8.826  -1.106  -9.087
  306    HD1  HIS  41           HD1      HIS  41  11.180  -0.990  -8.171
  307    HD2  HIS  41           HD2      HIS  41   9.012   2.495  -7.525
  308    HE1  HIS  41           HE1      HIS  41  12.850   0.696  -7.337
  309    H    PHE  42           H        PHE  42   5.407  -0.232  -8.068
  310    HA   PHE  42           HA       PHE  42   4.839   2.412  -6.911
  311   1HB   PHE  42          1HB       PHE  42   3.087   0.137  -7.766
  312   2HB   PHE  42          2HB       PHE  42   2.519   1.250  -6.526
  313    HD1  PHE  42           HD1      PHE  42   4.553   1.936  -9.560
  314    HD2  PHE  42           HD2      PHE  42   0.840   2.475  -7.550
  315    HE1  PHE  42           HE1      PHE  42   3.839   3.512 -11.309
  316    HE2  PHE  42           HE2      PHE  42   0.119   4.051  -9.296
  317    HZ   PHE  42           HZ       PHE  42   1.619   4.571 -11.179
  318    H    GLN  43           H        GLN  43   4.628   2.671  -4.743
  319    HA   GLN  43           HA       GLN  43   4.581   0.331  -3.006
  320   1HB   GLN  43          1HB       GLN  43   6.920   2.030  -3.429
  321   2HB   GLN  43          2HB       GLN  43   6.451   1.922  -1.738
  322   1HG   GLN  43          1HG       GLN  43   6.993  -0.269  -1.579
  323   2HG   GLN  43          2HG       GLN  43   6.566  -0.611  -3.255
  324   1HE2  GLN  43          1HE2      GLN  43   8.053   0.446  -4.884
  325   2HE2  GLN  43          2HE2      GLN  43   9.744   0.382  -4.539
  326    H    GLY  44           H        GLY  44   3.934   0.790  -0.843
  327   1HA   GLY  44          1HA       GLY  44   3.499   3.173   0.393
  328   2HA   GLY  44          2HA       GLY  44   2.118   3.022  -0.684
  329    H    TYR  45           H        TYR  45   1.032   3.122   1.490
  330    HA   TYR  45           HA       TYR  45   0.796   0.399   2.591
  331   1HB   TYR  45          1HB       TYR  45   0.334   1.354   4.778
  332   2HB   TYR  45          2HB       TYR  45   1.881   1.949   4.187
  333    HD1  TYR  45           HD1      TYR  45  -1.640   2.848   4.807
  334    HD2  TYR  45           HD2      TYR  45   2.226   4.275   3.752
  335    HE1  TYR  45           HE1      TYR  45  -2.403   5.159   5.164
  336    HE2  TYR  45           HE2      TYR  45   1.475   6.590   4.107
  337    HH   TYR  45           HH       TYR  45  -0.523   7.882   4.204
  338    H    ILE  46           H        ILE  46  -1.231  -0.406   2.900
  339    HA   ILE  46           HA       ILE  46  -3.505   1.355   2.286
  340    HB   ILE  46           HB       ILE  46  -3.221  -1.472   1.265
  341   1HG1  ILE  46          1HG1      ILE  46  -3.103   1.115  -0.297
  342   2HG1  ILE  46          2HG1      ILE  46  -1.689   0.172   0.161
  343   1HG2  ILE  46          1HG2      ILE  46  -5.291   0.614   0.602
  344   2HG2  ILE  46          2HG2      ILE  46  -5.257  -1.066   0.067
  345   3HG2  ILE  46          3HG2      ILE  46  -5.527  -0.688   1.768
  346   1HD1  ILE  46          1HD1      ILE  46  -2.506  -0.158  -2.182
  347   2HD1  ILE  46          2HD1      ILE  46  -2.340  -1.631  -1.226
  348   3HD1  ILE  46          3HD1      ILE  46  -3.936  -0.932  -1.498
  349    H    GLU  47           H        GLU  47  -5.088   1.256   3.740
  350    HA   GLU  47           HA       GLU  47  -5.025  -0.919   5.711
  351   1HB   GLU  47          1HB       GLU  47  -6.425   1.755   5.875
  352   2HB   GLU  47          2HB       GLU  47  -6.298   0.567   7.165
  353   1HG   GLU  47          1HG       GLU  47  -4.118   1.066   7.606
  354   2HG   GLU  47          2HG       GLU  47  -3.790   1.596   5.957
  355    H    MET  48           H        MET  48  -6.500  -2.466   5.586
  356    HA   MET  48           HA       MET  48  -8.731  -2.230   3.778
  357   1HB   MET  48          1HB       MET  48  -7.775  -4.451   5.583
  358   2HB   MET  48          2HB       MET  48  -9.222  -4.581   4.591
  359   1HG   MET  48          1HG       MET  48  -6.921  -3.697   3.066
  360   2HG   MET  48          2HG       MET  48  -6.652  -5.250   3.853
  361   1HE   MET  48          1HE       MET  48  -8.412  -3.078   1.604
  362   2HE   MET  48          2HE       MET  48  -8.614  -4.129   0.203
  363   3HE   MET  48          3HE       MET  48  -9.964  -3.859   1.306
  364    H    LYS  49           H        LYS  49 -10.843  -3.396   4.754
  365    HA   LYS  49           HA       LYS  49 -12.126  -1.525   6.337
  366   1HB   LYS  49          1HB       LYS  49 -12.854  -3.844   5.017
  367   2HB   LYS  49          2HB       LYS  49 -13.182  -4.226   6.702
  368   1HG   LYS  49          1HG       LYS  49 -14.782  -2.569   6.905
  369   2HG   LYS  49          2HG       LYS  49 -14.158  -1.658   5.527
  370   1HD   LYS  49          1HD       LYS  49 -16.250  -2.720   4.930
  371   2HD   LYS  49          2HD       LYS  49 -14.926  -3.459   4.025
  372   1HE   LYS  49          1HE       LYS  49 -15.543  -5.447   4.797
  373   2HE   LYS  49          2HE       LYS  49 -15.183  -4.902   6.435
  374   1HZ   LYS  49          1HZ       LYS  49 -17.367  -4.412   6.851
  375   2HZ   LYS  49          2HZ       LYS  49 -17.548  -5.746   5.827
  376   3HZ   LYS  49          3HZ       LYS  49 -17.759  -4.180   5.221
  377    H    LYS  50           H        LYS  50 -11.046  -4.762   7.386
  378    HA   LYS  50           HA       LYS  50  -9.892  -3.906   9.788
  379   1HB   LYS  50          1HB       LYS  50 -12.787  -4.212   9.853
  380   2HB   LYS  50          2HB       LYS  50 -11.986  -5.256  11.020
  381   1HG   LYS  50          1HG       LYS  50 -11.062  -2.455  10.923
  382   2HG   LYS  50          2HG       LYS  50 -12.693  -2.729  11.539
  383   1HD   LYS  50          1HD       LYS  50 -10.496  -4.460  12.554
  384   2HD   LYS  50          2HD       LYS  50 -10.577  -2.792  13.128
  385   1HE   LYS  50          1HE       LYS  50 -12.456  -3.160  14.326
  386   2HE   LYS  50          2HE       LYS  50 -13.126  -4.271  13.133
  387   1HZ   LYS  50          1HZ       LYS  50 -12.326  -6.021  14.227
  388   2HZ   LYS  50          2HZ       LYS  50 -12.081  -4.975  15.533
  389   3HZ   LYS  50          3HZ       LYS  50 -10.809  -5.312  14.470
  390    H    ARG  51           H        ARG  51 -12.136  -6.621   9.323
  391    HA   ARG  51           HA       ARG  51  -9.976  -8.474   9.935
  392   1HB   ARG  51          1HB       ARG  51 -12.362  -8.569  10.911
  393   2HB   ARG  51          2HB       ARG  51 -12.827  -9.236   9.352
  394   1HG   ARG  51          1HG       ARG  51 -11.983 -11.242   9.833
  395   2HG   ARG  51          2HG       ARG  51 -10.510 -10.558  10.523
  396   1HD   ARG  51          1HD       ARG  51 -13.126 -10.460  11.989
  397   2HD   ARG  51          2HD       ARG  51 -12.076 -11.874  12.074
  398    HE   ARG  51           HE       ARG  51 -11.653  -9.314  13.325
  399   1HH1  ARG  51          1HH1      ARG  51 -10.160 -12.248  12.192
  400   2HH1  ARG  51          2HH1      ARG  51  -8.787 -12.109  13.240
  401   1HH2  ARG  51          1HH2      ARG  51  -9.850  -9.119  14.709
  402   2HH2  ARG  51          2HH2      ARG  51  -8.613 -10.329  14.672
  403    H    THR  52           H        THR  52  -9.490  -7.285   7.545
  404    HA   THR  52           HA       THR  52 -10.325  -9.230   5.506
  405    HB   THR  52           HB       THR  52  -8.795  -6.885   4.606
  406    HG1  THR  52           HG1      THR  52 -11.424  -6.555   5.665
  407   1HG2  THR  52          1HG2      THR  52 -11.314  -8.313   3.790
  408   2HG2  THR  52          2HG2      THR  52  -9.772  -8.232   2.938
  409   3HG2  THR  52          3HG2      THR  52 -10.805  -6.806   3.031
  410    H    SER  53           H        SER  53  -8.935 -10.814   5.119
  411    HA   SER  53           HA       SER  53  -6.191 -10.670   5.934
  412   1HB   SER  53          1HB       SER  53  -6.173 -12.938   4.594
  413   2HB   SER  53          2HB       SER  53  -7.002 -12.829   6.146
  414    HG   SER  53           HG       SER  53  -8.665 -13.501   5.055
  415    H    LEU  54           H        LEU  54  -4.579 -11.686   4.187
  416    HA   LEU  54           HA       LEU  54  -3.953  -9.681   2.392
  417   1HB   LEU  54          1HB       LEU  54  -2.393 -11.420   3.143
  418   2HB   LEU  54          2HB       LEU  54  -3.262 -12.608   2.175
  419    HG   LEU  54           HG       LEU  54  -2.621 -11.317   0.139
  420   1HD1  LEU  54          1HD1      LEU  54  -2.201  -9.204   1.559
  421   2HD1  LEU  54          2HD1      LEU  54  -1.134  -9.540   0.196
  422   3HD1  LEU  54          3HD1      LEU  54  -0.606  -9.901   1.840
  423   1HD2  LEU  54          1HD2      LEU  54  -1.338 -13.230   0.544
  424   2HD2  LEU  54          2HD2      LEU  54  -0.546 -12.514   1.948
  425   3HD2  LEU  54          3HD2      LEU  54  -0.147 -11.947   0.325
  426    H    ALA  55           H        ALA  55  -6.099 -12.401   2.008
  427    HA   ALA  55           HA       ALA  55  -6.308 -12.572  -0.748
  428   1HB   ALA  55          1HB       ALA  55  -7.381 -14.101   0.892
  429   2HB   ALA  55          2HB       ALA  55  -8.597 -12.858   1.191
  430   3HB   ALA  55          3HB       ALA  55  -8.454 -13.585  -0.409
  431    H    GLY  56           H        GLY  56  -7.617 -10.182   1.447
  432   1HA   GLY  56          1HA       GLY  56  -9.469  -9.030  -0.390
  433   2HA   GLY  56          2HA       GLY  56  -8.879  -8.289   1.090
  434    H    MET  57           H        MET  57  -6.181  -8.119   0.614
  435    HA   MET  57           HA       MET  57  -6.073  -5.856  -1.122
  436   1HB   MET  57          1HB       MET  57  -3.828  -7.368   0.227
  437   2HB   MET  57          2HB       MET  57  -3.687  -5.787  -0.530
  438   1HG   MET  57          1HG       MET  57  -5.759  -6.039   1.546
  439   2HG   MET  57          2HG       MET  57  -4.090  -6.165   2.095
  440   1HE   MET  57          1HE       MET  57  -6.386  -2.670   0.440
  441   2HE   MET  57          2HE       MET  57  -5.484  -3.429  -0.872
  442   3HE   MET  57          3HE       MET  57  -6.617  -4.383   0.086
  443    H    LYS  58           H        LYS  58  -4.639  -9.110  -1.243
  444    HA   LYS  58           HA       LYS  58  -3.283  -8.856  -3.660
  445   1HB   LYS  58          1HB       LYS  58  -3.536 -10.834  -1.845
  446   2HB   LYS  58          2HB       LYS  58  -4.574 -11.467  -3.116
  447   1HG   LYS  58          1HG       LYS  58  -2.830 -12.092  -4.331
  448   2HG   LYS  58          2HG       LYS  58  -2.090 -10.494  -4.206
  449   1HD   LYS  58          1HD       LYS  58  -0.584 -12.094  -3.250
  450   2HD   LYS  58          2HD       LYS  58  -1.267 -11.131  -1.938
  451   1HE   LYS  58          1HE       LYS  58  -2.442 -12.880  -1.084
  452   2HE   LYS  58          2HE       LYS  58  -2.695 -13.622  -2.663
  453   1HZ   LYS  58          1HZ       LYS  58  -1.151 -14.799  -1.048
  454   2HZ   LYS  58          2HZ       LYS  58  -0.030 -13.578  -1.385
  455   3HZ   LYS  58          3HZ       LYS  58  -0.586 -14.582  -2.628
  456    H    LYS  59           H        LYS  59  -6.665  -9.245  -3.016
  457    HA   LYS  59           HA       LYS  59  -7.516 -10.257  -5.495
  458   1HB   LYS  59          1HB       LYS  59  -8.760  -8.922  -3.184
  459   2HB   LYS  59          2HB       LYS  59  -9.611  -8.694  -4.706
  460   1HG   LYS  59          1HG       LYS  59  -8.771 -11.433  -3.867
  461   2HG   LYS  59          2HG       LYS  59 -10.215 -10.695  -3.171
  462   1HD   LYS  59          1HD       LYS  59 -11.371 -10.784  -5.131
  463   2HD   LYS  59          2HD       LYS  59  -9.923 -10.583  -6.120
  464   1HE   LYS  59          1HE       LYS  59  -9.598 -12.795  -6.295
  465   2HE   LYS  59          2HE       LYS  59  -9.981 -13.079  -4.597
  466   1HZ   LYS  59          1HZ       LYS  59 -12.278 -12.341  -6.139
  467   2HZ   LYS  59          2HZ       LYS  59 -12.051 -13.663  -5.108
  468   3HZ   LYS  59          3HZ       LYS  59 -11.544 -13.750  -6.720
  469    H    LEU  60           H        LEU  60  -6.675  -7.029  -4.448
  470    HA   LEU  60           HA       LEU  60  -7.731  -5.757  -6.811
  471   1HB   LEU  60          1HB       LEU  60  -6.071  -4.812  -4.494
  472   2HB   LEU  60          2HB       LEU  60  -6.405  -3.778  -5.882
  473    HG   LEU  60           HG       LEU  60  -8.886  -4.245  -5.359
  474   1HD1  LEU  60          1HD1      LEU  60  -8.713  -4.437  -2.611
  475   2HD1  LEU  60          2HD1      LEU  60  -7.561  -5.640  -3.188
  476   3HD1  LEU  60          3HD1      LEU  60  -9.242  -5.704  -3.717
  477   1HD2  LEU  60          1HD2      LEU  60  -8.003  -2.646  -3.124
  478   2HD2  LEU  60          2HD2      LEU  60  -8.852  -2.159  -4.591
  479   3HD2  LEU  60          3HD2      LEU  60  -7.091  -2.263  -4.584
  480    H    ILE  61           H        ILE  61  -4.576  -6.781  -5.615
  481    HA   ILE  61           HA       ILE  61  -3.533  -6.553  -8.340
  482    HB   ILE  61           HB       ILE  61  -1.991  -5.539  -5.951
  483   1HG1  ILE  61          1HG1      ILE  61  -2.307  -3.343  -7.437
  484   2HG1  ILE  61          2HG1      ILE  61  -3.789  -4.175  -7.896
  485   1HG2  ILE  61          1HG2      ILE  61  -1.361  -6.019  -8.792
  486   2HG2  ILE  61          2HG2      ILE  61  -0.760  -4.510  -8.105
  487   3HG2  ILE  61          3HG2      ILE  61  -0.314  -6.052  -7.374
  488   1HD1  ILE  61          1HD1      ILE  61  -4.571  -3.021  -6.119
  489   2HD1  ILE  61          2HD1      ILE  61  -3.980  -4.443  -5.260
  490   3HD1  ILE  61          3HD1      ILE  61  -3.003  -2.976  -5.314
  491    HA   PRO  62           HA       PRO  62  -2.496 -10.591  -6.313
  492   1HB   PRO  62          1HB       PRO  62  -3.150 -12.100  -8.473
  493   2HB   PRO  62          2HB       PRO  62  -4.331 -11.602  -7.256
  494   1HG   PRO  62          1HG       PRO  62  -3.768 -10.415  -9.945
  495   2HG   PRO  62          2HG       PRO  62  -5.329 -10.734  -9.168
  496   1HD   PRO  62          1HD       PRO  62  -4.207  -8.270  -9.226
  497   2HD   PRO  62          2HD       PRO  62  -5.219  -8.827  -7.878
  498    H    GLY  63           H        GLY  63  -0.383 -11.018  -6.301
  499   1HA   GLY  63          1HA       GLY  63   1.380 -12.122  -7.685
  500   2HA   GLY  63          2HA       GLY  63   1.086 -10.848  -8.860
  501    H    ALA  64           H        ALA  64   0.771  -8.823  -6.721
  502    HA   ALA  64           HA       ALA  64   3.485  -7.994  -6.589
  503   1HB   ALA  64          1HB       ALA  64   0.887  -6.933  -5.618
  504   2HB   ALA  64          2HB       ALA  64   2.365  -6.301  -4.890
  505   3HB   ALA  64          3HB       ALA  64   2.114  -6.173  -6.631
  506    H    HIS  65           H        HIS  65   4.494  -7.297  -4.473
  507    HA   HIS  65           HA       HIS  65   4.394  -9.562  -2.631
  508   1HB   HIS  65          1HB       HIS  65   6.555  -8.605  -3.676
  509   2HB   HIS  65          2HB       HIS  65   6.378  -7.303  -2.504
  510    HD1  HIS  65           HD1      HIS  65   8.445  -9.947  -2.785
  511    HD2  HIS  65           HD2      HIS  65   5.674  -8.997   0.161
  512    HE1  HIS  65           HE1      HIS  65   9.193 -11.191  -0.731
  513    H    PHE  66           H        PHE  66   3.088  -9.399  -0.940
  514    HA   PHE  66           HA       PHE  66   2.680  -6.751   0.279
  515   1HB   PHE  66          1HB       PHE  66   0.886  -9.050  -0.217
  516   2HB   PHE  66          2HB       PHE  66   0.686  -8.246   1.336
  517    HD1  PHE  66           HD1      PHE  66   0.741  -7.656  -2.320
  518    HD2  PHE  66           HD2      PHE  66  -0.475  -6.225   1.500
  519    HE1  PHE  66           HE1      PHE  66  -0.601  -5.904  -3.408
  520    HE2  PHE  66           HE2      PHE  66  -1.820  -4.471   0.418
  521    HZ   PHE  66           HZ       PHE  66  -1.885  -4.310  -2.038
  522    H    GLU  67           H        GLU  67   2.431  -6.686   2.621
  523    HA   GLU  67           HA       GLU  67   3.461  -8.934   4.135
  524   1HB   GLU  67          1HB       GLU  67   5.380  -7.369   3.225
  525   2HB   GLU  67          2HB       GLU  67   4.881  -6.339   4.560
  526   1HG   GLU  67          1HG       GLU  67   5.088  -8.670   5.858
  527   2HG   GLU  67          2HG       GLU  67   6.277  -8.935   4.584
  528    H    LYS  68           H        LYS  68   1.991  -9.097   5.688
  529    HA   LYS  68           HA       LYS  68   0.881  -6.646   6.868
  530   1HB   LYS  68          1HB       LYS  68  -0.659  -8.389   5.860
  531   2HB   LYS  68          2HB       LYS  68  -0.181  -9.454   7.176
  532   1HG   LYS  68          1HG       LYS  68  -0.911  -7.171   8.500
  533   2HG   LYS  68          2HG       LYS  68  -2.053  -7.222   7.155
  534   1HD   LYS  68          1HD       LYS  68  -2.433  -9.664   7.797
  535   2HD   LYS  68          2HD       LYS  68  -1.591  -9.278   9.299
  536   1HE   LYS  68          1HE       LYS  68  -3.330  -7.262   9.282
  537   2HE   LYS  68          2HE       LYS  68  -4.261  -8.418   8.332
  538   1HZ   LYS  68          1HZ       LYS  68  -4.027  -8.320  11.081
  539   2HZ   LYS  68          2HZ       LYS  68  -3.144  -9.681  10.605
  540   3HZ   LYS  68          3HZ       LYS  68  -4.769  -9.530  10.163
  541    H    ARG  69           H        ARG  69   3.481  -8.159   7.469
  542    HA   ARG  69           HA       ARG  69   3.102  -9.067  10.185
  543   1HB   ARG  69          1HB       ARG  69   5.299  -9.039   8.215
  544   2HB   ARG  69          2HB       ARG  69   5.799  -8.878   9.894
  545   1HG   ARG  69          1HG       ARG  69   4.357 -10.930  10.345
  546   2HG   ARG  69          2HG       ARG  69   4.325 -11.141   8.593
  547   1HD   ARG  69          1HD       ARG  69   6.128 -12.449   9.213
  548   2HD   ARG  69          2HD       ARG  69   6.902 -10.927   8.774
  549    HE   ARG  69           HE       ARG  69   7.512 -10.634  10.969
  550   1HH1  ARG  69          1HH1      ARG  69   5.165 -13.195  10.743
  551   2HH1  ARG  69          2HH1      ARG  69   5.365 -13.700  12.388
  552   1HH2  ARG  69          1HH2      ARG  69   7.784 -11.289  13.137
  553   2HH2  ARG  69          2HH2      ARG  69   6.854 -12.615  13.749
  554    H    ARG  70           H        ARG  70   2.964  -6.113   8.984
  555    HA   ARG  70           HA       ARG  70   3.138  -4.032   9.892
  556   1HB   ARG  70          1HB       ARG  70   2.656  -5.513  12.037
  557   2HB   ARG  70          2HB       ARG  70   4.314  -5.077  12.427
  558   1HG   ARG  70          1HG       ARG  70   3.807  -2.888  12.777
  559   2HG   ARG  70          2HG       ARG  70   2.471  -2.898  11.624
  560   1HD   ARG  70          1HD       ARG  70   1.432  -2.709  13.710
  561   2HD   ARG  70          2HD       ARG  70   1.279  -4.417  13.301
  562    HE   ARG  70           HE       ARG  70   3.623  -4.032  14.802
  563   1HH1  ARG  70          1HH1      ARG  70   0.161  -3.973  15.160
  564   2HH1  ARG  70          2HH1      ARG  70   0.196  -4.415  16.835
  565   1HH2  ARG  70          1HH2      ARG  70   3.683  -4.615  17.006
  566   2HH2  ARG  70          2HH2      ARG  70   2.200  -4.779  17.884
  567    H    GLY  71           H        GLY  71   4.949  -4.124   8.222
  568   1HA   GLY  71          1HA       GLY  71   7.620  -4.485   8.778
  569   2HA   GLY  71          2HA       GLY  71   7.013  -3.301   7.629
  570    H    THR  72           H        THR  72   5.596  -1.738   9.618
  571    HA   THR  72           HA       THR  72   7.440  -0.879  11.620
  572    HB   THR  72           HB       THR  72   7.059   1.429   9.892
  573    HG1  THR  72           HG1      THR  72   7.435   0.261   8.114
  574   1HG2  THR  72          1HG2      THR  72   9.759   0.413  10.517
  575   2HG2  THR  72          2HG2      THR  72   8.723   0.745  11.905
  576   3HG2  THR  72          3HG2      THR  72   9.073   2.021  10.739
  577    H    GLN  73           H        GLN  73   4.630  -1.604  11.334
  578    HA   GLN  73           HA       GLN  73   2.545  -0.928  11.965
  579   1HB   GLN  73          1HB       GLN  73   3.968   1.125  13.651
  580   2HB   GLN  73          2HB       GLN  73   2.441   0.317  13.984
  581   1HG   GLN  73          1HG       GLN  73   3.556  -1.760  14.395
  582   2HG   GLN  73          2HG       GLN  73   5.099  -1.086  13.870
  583   1HE2  GLN  73          1HE2      GLN  73   2.562  -0.764  16.299
  584   2HE2  GLN  73          2HE2      GLN  73   3.592  -0.182  17.558
  585    H    GLY  74           H        GLY  74   1.464   1.501  12.709
  586   1HA   GLY  74          1HA       GLY  74   0.954   2.702  10.219
  587   2HA   GLY  74          2HA       GLY  74   0.507   3.369  11.782
  588    H    GLU  75           H        GLU  75   3.567   3.138  12.358
  589    HA   GLU  75           HA       GLU  75   4.175   5.839  12.029
  590   1HB   GLU  75          1HB       GLU  75   5.297   3.894  13.450
  591   2HB   GLU  75          2HB       GLU  75   6.399   3.855  12.081
  592   1HG   GLU  75          1HG       GLU  75   7.074   6.090  12.439
  593   2HG   GLU  75          2HG       GLU  75   5.765   6.376  13.584
  594    H    ALA  76           H        ALA  76   4.474   3.179   9.835
  595    HA   ALA  76           HA       ALA  76   6.425   4.201   8.090
  596   1HB   ALA  76          1HB       ALA  76   4.813   1.925   8.216
  597   2HB   ALA  76          2HB       ALA  76   4.416   2.696   6.679
  598   3HB   ALA  76          3HB       ALA  76   6.088   2.270   7.046
  599    H    ARG  77           H        ARG  77   3.245   5.230   8.710
  600    HA   ARG  77           HA       ARG  77   2.472   6.217   6.196
  601   1HB   ARG  77          1HB       ARG  77   0.831   6.047   7.926
  602   2HB   ARG  77          2HB       ARG  77   1.765   7.083   8.997
  603   1HG   ARG  77          1HG       ARG  77   1.280   9.008   7.712
  604   2HG   ARG  77          2HG       ARG  77   0.627   8.042   6.388
  605   1HD   ARG  77          1HD       ARG  77  -1.269   8.855   7.475
  606   2HD   ARG  77          2HD       ARG  77  -1.094   7.215   8.099
  607    HE   ARG  77           HE       ARG  77  -0.656   8.081  10.180
  608   1HH1  ARG  77          1HH1      ARG  77  -0.492  10.620   7.803
  609   2HH1  ARG  77          2HH1      ARG  77  -0.398  11.891   8.977
  610   1HH2  ARG  77          1HH2      ARG  77  -0.532   9.746  11.735
  611   2HH2  ARG  77          2HH2      ARG  77  -0.419  11.392  11.213
  612    H    ALA  78           H        ALA  78   4.734   7.382   8.537
  613    HA   ALA  78           HA       ALA  78   4.834  10.059   7.428
  614   1HB   ALA  78          1HB       ALA  78   5.605  10.539   9.450
  615   2HB   ALA  78          2HB       ALA  78   5.645   8.824   9.860
  616   3HB   ALA  78          3HB       ALA  78   7.052   9.586   9.120
  617    H    TYR  79           H        TYR  79   7.419   7.675   8.020
  618    HA   TYR  79           HA       TYR  79   9.251   8.736   6.230
  619   1HB   TYR  79          1HB       TYR  79  10.359   7.186   7.439
  620   2HB   TYR  79          2HB       TYR  79   8.919   6.201   7.671
  621    HD1  TYR  79           HD1      TYR  79  11.475   7.064   5.098
  622    HD2  TYR  79           HD2      TYR  79   8.726   4.166   6.562
  623    HE1  TYR  79           HE1      TYR  79  12.338   5.433   3.471
  624    HE2  TYR  79           HE2      TYR  79   9.581   2.527   4.940
  625    HH   TYR  79           HH       TYR  79  12.252   3.336   2.744
  626    H    SER  80           H        SER  80   6.534   6.623   5.662
  627    HA   SER  80           HA       SER  80   5.568   5.823   3.764
  628   1HB   SER  80          1HB       SER  80   7.121   8.149   2.628
  629   2HB   SER  80          2HB       SER  80   6.063   7.145   1.636
  630    HG   SER  80           HG       SER  80   4.424   8.181   2.424
  631    H    MET  81           H        MET  81   8.326   6.815   1.876
  632    HA   MET  81           HA       MET  81   9.404   4.093   1.893
  633   1HB   MET  81          1HB       MET  81   8.641   5.609  -0.608
  634   2HB   MET  81          2HB       MET  81   9.537   4.097  -0.580
  635   1HG   MET  81          1HG       MET  81   7.681   2.901  -0.411
  636   2HG   MET  81          2HG       MET  81   7.086   3.887   0.923
  637   1HE   MET  81          1HE       MET  81   5.113   6.294   0.108
  638   2HE   MET  81          2HE       MET  81   4.052   4.952  -0.318
  639   3HE   MET  81          3HE       MET  81   5.236   4.763   0.975
  640    H    LYS  82           H        LYS  82  11.357   4.241   0.085
  641    HA   LYS  82           HA       LYS  82  13.346   5.767   1.351
  642   1HB   LYS  82          1HB       LYS  82  13.212   4.268  -1.245
  643   2HB   LYS  82          2HB       LYS  82  14.627   5.235  -0.855
  644   1HG   LYS  82          1HG       LYS  82  13.705   3.354   1.225
  645   2HG   LYS  82          2HG       LYS  82  14.401   2.648  -0.235
  646   1HD   LYS  82          1HD       LYS  82  16.461   3.195   0.408
  647   2HD   LYS  82          2HD       LYS  82  15.988   4.875   0.676
  648   1HE   LYS  82          1HE       LYS  82  16.592   4.304   2.801
  649   2HE   LYS  82          2HE       LYS  82  14.890   3.846   2.848
  650   1HZ   LYS  82          1HZ       LYS  82  15.647   1.560   2.206
  651   2HZ   LYS  82          2HZ       LYS  82  16.104   2.058   3.756
  652   3HZ   LYS  82          3HZ       LYS  82  17.235   2.068   2.497
  653    H    GLU  83           H        GLU  83  13.542   7.902   1.330
  654    HA   GLU  83           HA       GLU  83  12.256   9.603  -0.510
  655   1HB   GLU  83          1HB       GLU  83  13.295  10.005   1.911
  656   2HB   GLU  83          2HB       GLU  83  14.656  10.575   0.957
  657   1HG   GLU  83          1HG       GLU  83  12.198  11.678  -0.040
  658   2HG   GLU  83          2HG       GLU  83  12.372  11.998   1.685
  659    H    ASP  84           H        ASP  84  15.487   8.243  -0.393
  660    HA   ASP  84           HA       ASP  84  16.659   9.867  -2.381
  661   1HB   ASP  84          1HB       ASP  84  17.311   7.087  -1.399
  662   2HB   ASP  84          2HB       ASP  84  18.288   7.932  -2.596
  663    H    THR  85           H        THR  85  14.789   6.893  -2.525
  664    HA   THR  85           HA       THR  85  15.081   6.807  -5.438
  665    HB   THR  85           HB       THR  85  13.385   4.717  -4.513
  666    HG1  THR  85           HG1      THR  85  14.951   3.724  -3.062
  667   1HG2  THR  85          1HG2      THR  85  16.252   4.237  -5.151
  668   2HG2  THR  85          2HG2      THR  85  15.234   4.965  -6.395
  669   3HG2  THR  85          3HG2      THR  85  14.812   3.392  -5.718
  670    H    ARG  86           H        ARG  86  13.241   8.493  -3.462
  671    HA   ARG  86           HA       ARG  86  10.589   7.889  -4.279
  672   1HB   ARG  86          1HB       ARG  86  11.808   9.617  -2.437
  673   2HB   ARG  86          2HB       ARG  86  10.942  10.664  -3.553
  674   1HG   ARG  86          1HG       ARG  86   8.877   9.521  -3.107
  675   2HG   ARG  86          2HG       ARG  86   9.711   8.326  -2.112
  676   1HD   ARG  86          1HD       ARG  86  10.157  11.116  -1.319
  677   2HD   ARG  86          2HD       ARG  86   8.490  10.564  -1.162
  678    HE   ARG  86           HE       ARG  86  10.015   8.592  -0.017
  679   1HH1  ARG  86          1HH1      ARG  86   9.557  12.007   0.478
  680   2HH1  ARG  86          2HH1      ARG  86   9.890  11.938   2.177
  681   1HH2  ARG  86          1HH2      ARG  86  10.456   8.488   2.219
  682   2HH2  ARG  86          2HH2      ARG  86  10.402   9.936   3.166
  683    H    LEU  87           H        LEU  87   9.685   8.232  -6.190
  684    HA   LEU  87           HA       LEU  87  10.917  10.177  -8.011
  685   1HB   LEU  87          1HB       LEU  87  10.016   7.547  -8.363
  686   2HB   LEU  87          2HB       LEU  87   8.855   8.567  -9.211
  687    HG   LEU  87           HG       LEU  87  11.818   8.344  -9.712
  688   1HD1  LEU  87          1HD1      LEU  87  11.042   7.693 -11.969
  689   2HD1  LEU  87          2HD1      LEU  87   9.382   7.727 -11.376
  690   3HD1  LEU  87          3HD1      LEU  87  10.533   6.571 -10.708
  691   1HD2  LEU  87          1HD2      LEU  87  11.422  10.632  -9.986
  692   2HD2  LEU  87          2HD2      LEU  87   9.816  10.368 -10.664
  693   3HD2  LEU  87          3HD2      LEU  87  11.250   9.966 -11.610
  694    H    GLU  88           H        GLU  88   7.638   8.969  -7.271
  695    HA   GLU  88           HA       GLU  88   6.673  11.741  -7.514
  696   1HB   GLU  88          1HB       GLU  88   6.080   9.752  -9.302
  697   2HB   GLU  88          2HB       GLU  88   4.727   9.646  -8.185
  698   1HG   GLU  88          1HG       GLU  88   4.251  11.106 -10.086
  699   2HG   GLU  88          2HG       GLU  88   4.192  11.971  -8.551
  700    H    GLY  89           H        GLY  89   4.321  11.847  -6.578
  701   1HA   GLY  89          1HA       GLY  89   2.818  11.312  -4.859
  702   2HA   GLY  89          2HA       GLY  89   3.944  10.092  -4.283
  703    HA   PRO  90           HA       PRO  90   3.236   9.847  -2.346
  704   1HB   PRO  90          1HB       PRO  90   1.775  10.633  -0.197
  705   2HB   PRO  90          2HB       PRO  90   3.470  10.144  -0.080
  706   1HG   PRO  90          1HG       PRO  90   2.295  12.895  -0.186
  707   2HG   PRO  90          2HG       PRO  90   3.597  12.273   0.845
  708   1HD   PRO  90          1HD       PRO  90   4.076  13.741  -1.380
  709   2HD   PRO  90          2HD       PRO  90   5.179  12.468  -0.821
  710    H    TRP  91           H        TRP  91   0.852   9.296  -2.029
  711    HA   TRP  91           HA       TRP  91  -0.952  11.290  -3.177
  712   1HB   TRP  91          1HB       TRP  91  -0.295   8.620  -4.398
  713   2HB   TRP  91          2HB       TRP  91  -1.850   9.394  -4.688
  714    HD1  TRP  91           HD1      TRP  91  -0.898  12.383  -5.076
  715    HE1  TRP  91           HE1      TRP  91   0.443  13.037  -7.173
  716    HE3  TRP  91           HE3      TRP  91   0.878   7.769  -6.377
  717    HZ2  TRP  91           HZ2      TRP  91   2.042  11.766  -9.121
  718    HZ3  TRP  91           HZ3      TRP  91   2.307   7.574  -8.371
  719    HH2  TRP  91           HH2      TRP  91   2.875   9.532  -9.714
  720    H    GLU  92           H        GLU  92  -2.969  11.205  -2.355
  721    HA   GLU  92           HA       GLU  92  -3.629   8.899  -0.642
  722   1HB   GLU  92          1HB       GLU  92  -3.962  11.836  -0.221
  723   2HB   GLU  92          2HB       GLU  92  -5.155  10.749   0.475
  724   1HG   GLU  92          1HG       GLU  92  -3.514   9.649   1.790
  725   2HG   GLU  92          2HG       GLU  92  -2.201  10.467   0.943
  726    H    TYR  93           H        TYR  93  -5.593   7.955  -0.872
  727    HA   TYR  93           HA       TYR  93  -7.601   9.241  -2.566
  728   1HB   TYR  93          1HB       TYR  93  -6.413   6.509  -3.060
  729   2HB   TYR  93          2HB       TYR  93  -7.931   7.045  -3.772
  730    HD1  TYR  93           HD1      TYR  93  -7.931   8.942  -5.386
  731    HD2  TYR  93           HD2      TYR  93  -4.319   7.222  -3.937
  732    HE1  TYR  93           HE1      TYR  93  -6.698   9.984  -7.241
  733    HE2  TYR  93           HE2      TYR  93  -3.075   8.261  -5.787
  734    HH   TYR  93           HH       TYR  93  -3.261   9.345  -7.751
  735    H    GLY  94           H        GLY  94  -9.716   8.132  -2.464
  736   1HA   GLY  94          1HA       GLY  94 -11.341   6.848  -1.383
  737   2HA   GLY  94          2HA       GLY  94 -10.115   6.290  -0.254
  738    H    GLU  95           H        GLU  95 -11.463   6.651   1.530
  739    HA   GLU  95           HA       GLU  95 -12.896   8.930   2.133
  740   1HB   GLU  95          1HB       GLU  95 -13.141   6.987   3.503
  741   2HB   GLU  95          2HB       GLU  95 -11.440   7.008   3.946
  742   1HG   GLU  95          1HG       GLU  95 -12.838   7.782   5.773
  743   2HG   GLU  95          2HG       GLU  95 -11.774   9.065   5.198
  Start of MODEL   11
    1   1H    ALA   2          1H        ALA   2 -13.102   3.027  16.618
    2    HA   ALA   2           HA       ALA   2 -12.924   2.770  19.027
    3   1HB   ALA   2          1HB       ALA   2 -14.710   0.468  18.383
    4   2HB   ALA   2          2HB       ALA   2 -13.702   0.410  19.829
    5   3HB   ALA   2          3HB       ALA   2 -14.876   1.709  19.625
    6    H    ARG   3           H        ARG   3 -12.706  -0.067  16.878
    7    HA   ARG   3           HA       ARG   3 -10.075  -0.688  17.985
    8   1HB   ARG   3          1HB       ARG   3 -12.115  -2.327  17.311
    9   2HB   ARG   3          2HB       ARG   3 -11.198  -2.353  15.811
   10   1HG   ARG   3          1HG       ARG   3  -9.172  -2.865  17.325
   11   2HG   ARG   3          2HG       ARG   3 -10.388  -3.288  18.532
   12   1HD   ARG   3          1HD       ARG   3 -10.787  -4.431  15.843
   13   2HD   ARG   3          2HD       ARG   3  -9.383  -5.025  16.729
   14    HE   ARG   3           HE       ARG   3 -11.598  -5.083  18.437
   15   1HH1  ARG   3          1HH1      ARG   3 -10.422  -6.647  15.558
   16   2HH1  ARG   3          2HH1      ARG   3 -11.247  -8.137  15.873
   17   1HH2  ARG   3          1HH2      ARG   3 -12.690  -7.041  18.863
   18   2HH2  ARG   3          2HH2      ARG   3 -12.537  -8.360  17.753
   19    H    GLN   4           H        GLN   4  -8.196  -0.509  16.874
   20    HA   GLN   4           HA       GLN   4  -8.351   0.782  14.239
   21   1HB   GLN   4          1HB       GLN   4  -6.632   1.129  16.577
   22   2HB   GLN   4          2HB       GLN   4  -5.728   0.999  15.074
   23   1HG   GLN   4          1HG       GLN   4  -7.084   2.814  14.124
   24   2HG   GLN   4          2HG       GLN   4  -7.929   2.964  15.663
   25   1HE2  GLN   4          1HE2      GLN   4  -5.631   4.330  13.850
   26   2HE2  GLN   4          2HE2      GLN   4  -4.635   5.030  15.076
   27    H    VAL   5           H        VAL   5  -6.889   0.147  12.575
   28    HA   VAL   5           HA       VAL   5  -5.893  -2.613  12.869
   29    HB   VAL   5           HB       VAL   5  -6.364  -2.992  10.513
   30   1HG1  VAL   5          1HG1      VAL   5  -8.416  -2.373  12.485
   31   2HG1  VAL   5          2HG1      VAL   5  -9.003  -2.280  10.823
   32   3HG1  VAL   5          3HG1      VAL   5  -8.257  -3.765  11.414
   33   1HG2  VAL   5          1HG2      VAL   5  -6.667  -1.338   9.061
   34   2HG2  VAL   5          2HG2      VAL   5  -8.062  -0.746   9.964
   35   3HG2  VAL   5          3HG2      VAL   5  -6.441  -0.187  10.379
   36    H    ILE   6           H        ILE   6  -4.055  -3.178  11.523
   37    HA   ILE   6           HA       ILE   6  -2.137  -1.002  11.415
   38    HB   ILE   6           HB       ILE   6  -1.708  -3.924  10.785
   39   1HG1  ILE   6          1HG1      ILE   6  -0.524  -3.618  13.164
   40   2HG1  ILE   6          2HG1      ILE   6  -1.785  -2.403  13.343
   41   1HG2  ILE   6          1HG2      ILE   6   0.668  -3.364  11.253
   42   2HG2  ILE   6          2HG2      ILE   6   0.014  -2.555   9.829
   43   3HG2  ILE   6          3HG2      ILE   6   0.206  -1.664  11.339
   44   1HD1  ILE   6          1HD1      ILE   6  -1.952  -5.262  13.547
   45   2HD1  ILE   6          2HD1      ILE   6  -3.137  -4.030  13.983
   46   3HD1  ILE   6          3HD1      ILE   6  -3.079  -4.654  12.335
   47    H    CYS   7           H        CYS   7  -0.936  -0.426   9.576
   48    HA   CYS   7           HA       CYS   7  -2.423  -0.543   7.122
   49   1HB   CYS   7          1HB       CYS   7  -0.821   1.002   6.260
   50   2HB   CYS   7          2HB       CYS   7  -1.121   1.463   7.931
   51    HG   CYS   7           HG       CYS   7   1.714   0.562   6.465
   52    H    TRP   8           H        TRP   8  -1.561  -1.269   5.082
   53    HA   TRP   8           HA       TRP   8   0.158  -3.632   5.409
   54   1HB   TRP   8          1HB       TRP   8  -1.909  -2.948   3.311
   55   2HB   TRP   8          2HB       TRP   8  -0.838  -4.343   3.207
   56    HD1  TRP   8           HD1      TRP   8  -3.404  -2.938   5.772
   57    HE1  TRP   8           HE1      TRP   8  -4.669  -4.935   6.790
   58    HE3  TRP   8           HE3      TRP   8  -0.973  -6.744   3.376
   59    HZ2  TRP   8           HZ2      TRP   8  -4.639  -7.751   6.603
   60    HZ3  TRP   8           HZ3      TRP   8  -1.652  -9.060   3.852
   61    HH2  TRP   8           HH2      TRP   8  -3.446  -9.552   5.432
   62    H    CYS   9           H        CYS   9   2.202  -3.310   4.848
   63    HA   CYS   9           HA       CYS   9   2.861  -1.280   2.856
   64   1HB   CYS   9          1HB       CYS   9   4.783  -2.924   4.506
   65   2HB   CYS   9          2HB       CYS   9   5.114  -1.420   3.653
   66    HG   CYS   9           HG       CYS   9   5.063  -0.315   6.017
   67    H    PHE  10           H        PHE  10   3.068  -1.846   0.804
   68    HA   PHE  10           HA       PHE  10   4.304  -4.426   0.158
   69   1HB   PHE  10          1HB       PHE  10   2.621  -5.120  -1.265
   70   2HB   PHE  10          2HB       PHE  10   1.681  -4.321  -0.010
   71    HD1  PHE  10           HD2      PHE  10   1.151  -1.806  -0.422
   72    HD2  PHE  10           HD1      PHE  10   2.288  -4.549  -3.471
   73    HE1  PHE  10           HE2      PHE  10   0.138  -0.337  -2.116
   74    HE2  PHE  10           HE1      PHE  10   1.278  -3.084  -5.170
   75    HZ   PHE  10           HZ       PHE  10   0.200  -0.976  -4.494
   76    H    THR  11           H        THR  11   5.034  -4.532  -2.127
   77    HA   THR  11           HA       THR  11   5.651  -1.875  -3.234
   78    HB   THR  11           HB       THR  11   7.654  -4.127  -3.251
   79    HG1  THR  11           HG1      THR  11   8.645  -2.702  -1.541
   80   1HG2  THR  11          1HG2      THR  11   7.508  -1.480  -4.381
   81   2HG2  THR  11          2HG2      THR  11   8.721  -2.736  -4.630
   82   3HG2  THR  11          3HG2      THR  11   8.881  -1.609  -3.283
   83    H    LEU  12           H        LEU  12   5.240  -1.681  -5.343
   84    HA   LEU  12           HA       LEU  12   4.686  -4.134  -6.869
   85   1HB   LEU  12          1HB       LEU  12   2.959  -2.192  -6.450
   86   2HB   LEU  12          2HB       LEU  12   3.817  -1.439  -7.793
   87    HG   LEU  12           HG       LEU  12   3.231  -3.295  -9.243
   88   1HD1  LEU  12          1HD1      LEU  12   1.600  -5.000  -8.398
   89   2HD1  LEU  12          2HD1      LEU  12   1.952  -4.430  -6.767
   90   3HD1  LEU  12          3HD1      LEU  12   3.233  -5.142  -7.747
   91   1HD2  LEU  12          1HD2      LEU  12   1.664  -1.352  -8.856
   92   2HD2  LEU  12          2HD2      LEU  12   0.744  -2.417  -7.793
   93   3HD2  LEU  12          3HD2      LEU  12   0.928  -2.820  -9.501
   94    H    ASN  13           H        ASN  13   6.068  -4.684  -8.412
   95    HA   ASN  13           HA       ASN  13   7.913  -2.635  -9.438
   96   1HB   ASN  13          1HB       ASN  13   9.371  -4.552 -10.068
   97   2HB   ASN  13          2HB       ASN  13   9.066  -4.459  -8.336
   98   1HD2  ASN  13          1HD2      ASN  13   8.011  -6.092  -7.328
   99   2HD2  ASN  13          2HD2      ASN  13   7.522  -7.551  -8.113
  100    H    ASN  14           H        ASN  14   7.769  -2.029 -11.497
  101    HA   ASN  14           HA       ASN  14   6.981  -1.849 -13.628
  102   1HB   ASN  14          1HB       ASN  14   8.625  -3.706 -13.866
  103   2HB   ASN  14          2HB       ASN  14   7.315  -4.857 -13.616
  104   1HD2  ASN  14          1HD2      ASN  14   8.817  -4.988 -15.869
  105   2HD2  ASN  14          2HD2      ASN  14   7.883  -4.496 -17.237
  106    HA   PRO  15           HA       PRO  15   2.712  -3.245 -12.304
  107   1HB   PRO  15          1HB       PRO  15   1.632  -0.756 -12.227
  108   2HB   PRO  15          2HB       PRO  15   2.442  -1.495 -10.841
  109   1HG   PRO  15          1HG       PRO  15   3.500   0.491 -12.816
  110   2HG   PRO  15          2HG       PRO  15   3.697   0.451 -11.054
  111   1HD   PRO  15          1HD       PRO  15   5.625  -0.397 -12.755
  112   2HD   PRO  15          2HD       PRO  15   5.381  -1.119 -11.152
  113    H    LEU  16           H        LEU  16   0.614  -2.643 -13.442
  114    HA   LEU  16           HA       LEU  16   1.163  -2.077 -16.281
  115   1HB   LEU  16          1HB       LEU  16  -0.809  -3.964 -15.015
  116   2HB   LEU  16          2HB       LEU  16  -0.883  -3.490 -16.711
  117    HG   LEU  16           HG       LEU  16   1.614  -4.719 -15.617
  118   1HD1  LEU  16          1HD1      LEU  16   0.370  -6.482 -14.963
  119   2HD1  LEU  16          2HD1      LEU  16   0.392  -6.857 -16.686
  120   3HD1  LEU  16          3HD1      LEU  16  -1.000  -6.035 -15.980
  121   1HD2  LEU  16          1HD2      LEU  16   1.927  -5.418 -17.883
  122   2HD2  LEU  16          2HD2      LEU  16   1.509  -3.705 -17.894
  123   3HD2  LEU  16          3HD2      LEU  16   0.295  -4.912 -18.320
  124    H    SER  17           H        SER  17  -0.238  -0.854 -13.566
  125    HA   SER  17           HA       SER  17  -1.497   1.278 -14.859
  126   1HB   SER  17          1HB       SER  17  -3.885   0.492 -13.887
  127   2HB   SER  17          2HB       SER  17  -3.378   0.184 -15.547
  128    HG   SER  17           HG       SER  17  -4.001  -1.765 -14.797
  129    HA   PRO  18           HA       PRO  18  -1.340   2.969 -10.815
  130   1HB   PRO  18          1HB       PRO  18  -3.429   4.704 -10.818
  131   2HB   PRO  18          2HB       PRO  18  -1.944   4.986 -11.735
  132   1HG   PRO  18          1HG       PRO  18  -4.577   3.918 -12.677
  133   2HG   PRO  18          2HG       PRO  18  -3.508   5.101 -13.452
  134   1HD   PRO  18          1HD       PRO  18  -3.593   2.503 -14.207
  135   2HD   PRO  18          2HD       PRO  18  -2.111   3.475 -14.297
  136    H    LEU  19           H        LEU  19  -2.276   2.941  -8.739
  137    HA   LEU  19           HA       LEU  19  -4.128   0.802  -8.300
  138   1HB   LEU  19          1HB       LEU  19  -3.071   2.806  -6.314
  139   2HB   LEU  19          2HB       LEU  19  -3.809   1.247  -5.952
  140    HG   LEU  19           HG       LEU  19  -1.124   1.737  -7.232
  141   1HD1  LEU  19          1HD1      LEU  19  -1.542   1.949  -4.682
  142   2HD1  LEU  19          2HD1      LEU  19  -0.175   0.998  -5.261
  143   3HD1  LEU  19          3HD1      LEU  19  -1.649   0.189  -4.731
  144   1HD2  LEU  19          1HD2      LEU  19  -1.421  -0.225  -8.250
  145   2HD2  LEU  19          2HD2      LEU  19  -2.893  -0.568  -7.341
  146   3HD2  LEU  19          3HD2      LEU  19  -1.317  -0.949  -6.645
  147    H    SER  20           H        SER  20  -6.005   1.123  -6.759
  148    HA   SER  20           HA       SER  20  -7.328   3.704  -6.977
  149   1HB   SER  20          1HB       SER  20  -9.413   2.639  -7.880
  150   2HB   SER  20          2HB       SER  20  -8.070   2.662  -9.023
  151    HG   SER  20           HG       SER  20  -8.669   0.613  -9.146
  152    H    LEU  21           H        LEU  21  -9.309   3.808  -5.671
  153    HA   LEU  21           HA       LEU  21  -8.924   2.705  -3.112
  154   1HB   LEU  21          1HB       LEU  21 -10.069   4.761  -3.267
  155   2HB   LEU  21          2HB       LEU  21 -11.243   4.107  -4.408
  156    HG   LEU  21           HG       LEU  21 -12.104   2.666  -2.532
  157   1HD1  LEU  21          1HD1      LEU  21 -11.177   4.379  -0.424
  158   2HD1  LEU  21          2HD1      LEU  21  -9.811   3.616  -1.237
  159   3HD1  LEU  21          3HD1      LEU  21 -11.099   2.622  -0.557
  160   1HD2  LEU  21          1HD2      LEU  21 -13.560   4.366  -2.896
  161   2HD2  LEU  21          2HD2      LEU  21 -12.321   5.611  -2.738
  162   3HD2  LEU  21          3HD2      LEU  21 -13.000   4.855  -1.296
  163    H    HIS  22           H        HIS  22 -10.180   1.192  -1.945
  164    HA   HIS  22           HA       HIS  22 -11.585  -0.762  -3.647
  165   1HB   HIS  22          1HB       HIS  22  -9.343  -1.431  -2.561
  166   2HB   HIS  22          2HB       HIS  22 -10.241  -1.461  -1.046
  167    HD1  HIS  22           HD1      HIS  22 -10.317  -3.924  -0.602
  168    HD2  HIS  22           HD2      HIS  22 -11.556  -2.963  -4.450
  169    HE1  HIS  22           HE1      HIS  22 -11.213  -6.063  -1.574
  170    H    ASP  23           H        ASP  23 -13.578  -1.427  -3.051
  171    HA   ASP  23           HA       ASP  23 -15.092   0.118  -1.262
  172   1HB   ASP  23          1HB       ASP  23 -15.544  -2.359  -2.841
  173   2HB   ASP  23          2HB       ASP  23 -16.652  -2.047  -1.508
  174    H    SER  24           H        SER  24 -13.118  -2.663  -0.775
  175    HA   SER  24           HA       SER  24 -14.343  -3.376   1.751
  176   1HB   SER  24          1HB       SER  24 -11.707  -4.419   0.730
  177   2HB   SER  24          2HB       SER  24 -12.862  -5.213   1.800
  178    HG   SER  24           HG       SER  24 -13.111  -6.103  -0.215
  179    H    MET  25           H        MET  25 -11.392  -1.810   0.604
  180    HA   MET  25           HA       MET  25 -10.236  -1.508   3.192
  181   1HB   MET  25          1HB       MET  25  -8.512  -0.345   2.135
  182   2HB   MET  25          2HB       MET  25  -9.079  -1.440   0.882
  183   1HG   MET  25          1HG       MET  25 -10.237   0.295  -0.237
  184   2HG   MET  25          2HG       MET  25 -10.019   1.401   1.117
  185   1HE   MET  25          1HE       MET  25  -7.912  -0.092  -2.182
  186   2HE   MET  25          2HE       MET  25  -6.478  -0.298  -1.177
  187   3HE   MET  25          3HE       MET  25  -7.983  -1.111  -0.744
  188    H    LYS  26           H        LYS  26  -9.494   0.996   3.594
  189    HA   LYS  26           HA       LYS  26 -11.984   2.569   3.677
  190   1HB   LYS  26          1HB       LYS  26 -10.467   1.541   5.860
  191   2HB   LYS  26          2HB       LYS  26 -10.293   3.291   5.857
  192   1HG   LYS  26          1HG       LYS  26 -12.377   3.605   6.573
  193   2HG   LYS  26          2HG       LYS  26 -13.039   2.432   5.432
  194   1HD   LYS  26          1HD       LYS  26 -13.484   1.277   7.326
  195   2HD   LYS  26          2HD       LYS  26 -11.805   0.763   7.140
  196   1HE   LYS  26          1HE       LYS  26 -12.385   3.275   8.634
  197   2HE   LYS  26          2HE       LYS  26 -12.695   1.729   9.423
  198   1HZ   LYS  26          1HZ       LYS  26 -10.179   2.993   8.761
  199   2HZ   LYS  26          2HZ       LYS  26 -10.246   1.338   8.420
  200   3HZ   LYS  26          3HZ       LYS  26 -10.547   1.890   9.990
  201    H    TYR  27           H        TYR  27  -8.454   2.624   3.638
  202    HA   TYR  27           HA       TYR  27  -8.583   5.256   2.344
  203   1HB   TYR  27          1HB       TYR  27  -7.908   5.242   4.879
  204   2HB   TYR  27          2HB       TYR  27  -6.360   4.672   4.266
  205    HD1  TYR  27           HD1      TYR  27  -8.798   7.252   3.083
  206    HD2  TYR  27           HD2      TYR  27  -4.811   6.377   4.282
  207    HE1  TYR  27           HE1      TYR  27  -8.147   9.572   2.589
  208    HE2  TYR  27           HE2      TYR  27  -4.149   8.695   3.792
  209    HH   TYR  27           HH       TYR  27  -5.541  11.027   3.705
  210    H    LEU  28           H        LEU  28  -6.911   5.694   0.876
  211    HA   LEU  28           HA       LEU  28  -5.182   3.406   0.210
  212   1HB   LEU  28          1HB       LEU  28  -6.817   3.341  -1.457
  213   2HB   LEU  28          2HB       LEU  28  -6.888   5.098  -1.581
  214    HG   LEU  28           HG       LEU  28  -4.822   5.166  -2.780
  215   1HD1  LEU  28          1HD1      LEU  28  -3.256   3.681  -2.243
  216   2HD1  LEU  28          2HD1      LEU  28  -4.091   2.552  -3.311
  217   3HD1  LEU  28          3HD1      LEU  28  -4.442   2.555  -1.583
  218   1HD2  LEU  28          1HD2      LEU  28  -5.451   4.117  -4.789
  219   2HD2  LEU  28          2HD2      LEU  28  -6.965   4.477  -3.958
  220   3HD2  LEU  28          3HD2      LEU  28  -6.320   2.835  -3.944
  221    H    VAL  29           H        VAL  29  -3.088   3.881   0.109
  222    HA   VAL  29           HA       VAL  29  -2.260   6.611  -0.569
  223    HB   VAL  29           HB       VAL  29  -1.306   5.084   1.856
  224   1HG1  VAL  29          1HG1      VAL  29  -0.191   7.470   0.437
  225   2HG1  VAL  29          2HG1      VAL  29   0.016   7.290   2.180
  226   3HG1  VAL  29          3HG1      VAL  29   0.648   6.061   1.084
  227   1HG2  VAL  29          1HG2      VAL  29  -2.018   7.618   2.636
  228   2HG2  VAL  29          2HG2      VAL  29  -3.233   7.230   1.418
  229   3HG2  VAL  29          3HG2      VAL  29  -3.012   6.172   2.812
  230    H    TYR  30           H        TYR  30  -0.800   6.555  -2.135
  231    HA   TYR  30           HA       TYR  30   1.304   4.562  -2.137
  232   1HB   TYR  30          1HB       TYR  30   0.830   3.577  -4.216
  233   2HB   TYR  30          2HB       TYR  30  -0.729   3.622  -3.401
  234    HD1  TYR  30           HD2      TYR  30  -2.361   5.451  -4.014
  235    HD2  TYR  30           HD1      TYR  30   1.151   4.662  -6.283
  236    HE1  TYR  30           HE2      TYR  30  -3.328   6.666  -5.922
  237    HE2  TYR  30           HE1      TYR  30   0.194   5.876  -8.197
  238    HH   TYR  30           HH       TYR  30  -3.096   6.812  -8.320
  239    H    GLN  31           H        GLN  31   2.924   4.996  -3.852
  240    HA   GLN  31           HA       GLN  31   2.851   7.633  -5.057
  241   1HB   GLN  31          1HB       GLN  31   4.421   8.662  -3.796
  242   2HB   GLN  31          2HB       GLN  31   3.897   7.518  -2.567
  243   1HG   GLN  31          1HG       GLN  31   5.716   6.001  -3.245
  244   2HG   GLN  31          2HG       GLN  31   6.264   7.215  -4.401
  245   1HE2  GLN  31          1HE2      GLN  31   5.896   9.508  -2.892
  246   2HE2  GLN  31          2HE2      GLN  31   7.009   9.497  -1.571
  247    H    THR  32           H        THR  32   4.635   7.994  -6.548
  248    HA   THR  32           HA       THR  32   5.457   5.489  -7.795
  249    HB   THR  32           HB       THR  32   6.157   8.116  -9.010
  250    HG1  THR  32           HG1      THR  32   3.982   8.249  -9.830
  251   1HG2  THR  32          1HG2      THR  32   5.088   5.498 -10.069
  252   2HG2  THR  32          2HG2      THR  32   6.747   6.086 -10.181
  253   3HG2  THR  32          3HG2      THR  32   5.458   6.906 -11.063
  254    H    GLU  33           H        GLU  33   7.559   4.875  -8.132
  255    HA   GLU  33           HA       GLU  33   9.666   6.597  -7.020
  256   1HB   GLU  33          1HB       GLU  33   9.134   3.698  -6.414
  257   2HB   GLU  33          2HB       GLU  33  10.738   4.393  -6.223
  258   1HG   GLU  33          1HG       GLU  33   9.805   6.052  -4.662
  259   2HG   GLU  33          2HG       GLU  33   8.229   5.277  -4.815
  260    H    GLN  34           H        GLN  34  11.653   6.495  -8.033
  261    HA   GLN  34           HA       GLN  34  11.620   5.241 -10.672
  262   1HB   GLN  34          1HB       GLN  34  12.571   7.707  -9.685
  263   2HB   GLN  34          2HB       GLN  34  13.991   6.786 -10.164
  264   1HG   GLN  34          1HG       GLN  34  11.965   6.550 -12.172
  265   2HG   GLN  34          2HG       GLN  34  12.248   8.250 -11.799
  266   1HE2  GLN  34          1HE2      GLN  34  14.545   8.932 -11.774
  267   2HE2  GLN  34          2HE2      GLN  34  15.603   8.244 -12.953
  268    H    GLY  35           H        GLY  35  13.011   3.667 -11.306
  269   1HA   GLY  35          1HA       GLY  35  15.473   2.998 -10.292
  270   2HA   GLY  35          2HA       GLY  35  14.327   2.153  -9.262
  271    H    GLU  36           H        GLU  36  15.628   0.316 -10.220
  272    HA   GLU  36           HA       GLU  36  15.926  -1.382 -11.733
  273   1HB   GLU  36          1HB       GLU  36  13.892  -2.528 -12.287
  274   2HB   GLU  36          2HB       GLU  36  13.705  -1.834 -10.682
  275   1HG   GLU  36          1HG       GLU  36  12.316  -0.095 -11.502
  276   2HG   GLU  36          2HG       GLU  36  12.678  -0.511 -13.176
  277    H    ALA  37           H        ALA  37  14.311  -2.011 -14.022
  278    HA   ALA  37           HA       ALA  37  15.715  -0.690 -16.034
  279   1HB   ALA  37          1HB       ALA  37  14.281  -1.793 -17.592
  280   2HB   ALA  37          2HB       ALA  37  14.557  -2.893 -16.241
  281   3HB   ALA  37          3HB       ALA  37  13.032  -2.017 -16.367
  282    H    GLY  38           H        GLY  38  14.055   0.173 -17.979
  283   1HA   GLY  38          1HA       GLY  38  13.616   2.838 -17.409
  284   2HA   GLY  38          2HA       GLY  38  12.830   1.970 -18.719
  285    H    ASN  39           H        ASN  39  11.596   0.134 -16.651
  286    HA   ASN  39           HA       ASN  39   9.177   1.633 -16.331
  287   1HB   ASN  39          1HB       ASN  39   9.673  -0.994 -14.970
  288   2HB   ASN  39          2HB       ASN  39   8.184  -0.372 -15.678
  289   1HD2  ASN  39          1HD2      ASN  39  10.697  -2.479 -16.085
  290   2HD2  ASN  39          2HD2      ASN  39  10.557  -2.756 -17.784
  291    H    ILE  40           H        ILE  40   8.035   1.777 -14.227
  292    HA   ILE  40           HA       ILE  40   9.935   2.433 -12.072
  293    HB   ILE  40           HB       ILE  40   8.003   3.907 -11.239
  294   1HG1  ILE  40          1HG1      ILE  40   7.178   3.552 -14.129
  295   2HG1  ILE  40          2HG1      ILE  40   6.275   2.993 -12.725
  296   1HG2  ILE  40          1HG2      ILE  40   8.788   5.778 -12.499
  297   2HG2  ILE  40          2HG2      ILE  40  10.148   4.684 -12.252
  298   3HG2  ILE  40          3HG2      ILE  40   9.329   4.734 -13.813
  299   1HD1  ILE  40          1HD1      ILE  40   6.795   5.776 -12.435
  300   2HD1  ILE  40          2HD1      ILE  40   6.106   5.476 -14.031
  301   3HD1  ILE  40          3HD1      ILE  40   5.250   4.941 -12.585
  302    H    HIS  41           H        HIS  41   8.892   2.363  -9.849
  303    HA   HIS  41           HA       HIS  41   7.084   0.046  -9.645
  304   1HB   HIS  41          1HB       HIS  41   8.520   0.014  -7.292
  305   2HB   HIS  41          2HB       HIS  41   8.805  -1.033  -8.679
  306    HD1  HIS  41           HD1      HIS  41  11.181  -1.081  -9.314
  307    HD2  HIS  41           HD2      HIS  41  10.090   2.612  -7.756
  308    HE1  HIS  41           HE1      HIS  41  13.276   0.310  -9.352
  309    H    PHE  42           H        PHE  42   5.455   0.156  -8.159
  310    HA   PHE  42           HA       PHE  42   4.973   2.790  -6.997
  311   1HB   PHE  42          1HB       PHE  42   3.248   0.428  -7.645
  312   2HB   PHE  42          2HB       PHE  42   2.695   1.605  -6.458
  313    HD1  PHE  42           HD1      PHE  42   4.590   2.100  -9.620
  314    HD2  PHE  42           HD2      PHE  42   0.975   2.767  -7.474
  315    HE1  PHE  42           HE1      PHE  42   3.782   3.547 -11.438
  316    HE2  PHE  42           HE2      PHE  42   0.160   4.214  -9.290
  317    HZ   PHE  42           HZ       PHE  42   1.564   4.605 -11.276
  318    H    GLN  43           H        GLN  43   4.571   3.138  -4.820
  319    HA   GLN  43           HA       GLN  43   4.884   0.895  -2.977
  320   1HB   GLN  43          1HB       GLN  43   6.772   3.181  -3.275
  321   2HB   GLN  43          2HB       GLN  43   6.433   2.600  -1.650
  322   1HG   GLN  43          1HG       GLN  43   7.038   0.475  -3.559
  323   2HG   GLN  43          2HG       GLN  43   8.355   1.622  -3.318
  324   1HE2  GLN  43          1HE2      GLN  43   6.058  -0.408  -1.561
  325   2HE2  GLN  43          2HE2      GLN  43   7.108  -0.755  -0.233
  326    H    GLY  44           H        GLY  44   4.347   1.493  -0.726
  327   1HA   GLY  44          1HA       GLY  44   3.407   3.665   0.428
  328   2HA   GLY  44          2HA       GLY  44   2.120   3.391  -0.738
  329    H    TYR  45           H        TYR  45   1.049   3.379   1.529
  330    HA   TYR  45           HA       TYR  45   0.924   0.578   2.435
  331   1HB   TYR  45          1HB       TYR  45   0.141   1.642   4.656
  332   2HB   TYR  45          2HB       TYR  45   1.858   1.690   4.271
  333    HD1  TYR  45           HD1      TYR  45  -1.203   3.668   4.627
  334    HD2  TYR  45           HD2      TYR  45   2.951   3.786   3.716
  335    HE1  TYR  45           HE1      TYR  45  -1.219   6.113   4.899
  336    HE2  TYR  45           HE2      TYR  45   2.947   6.231   3.987
  337    HH   TYR  45           HH       TYR  45   0.623   7.908   5.515
  338    H    ILE  46           H        ILE  46  -1.084  -0.306   2.792
  339    HA   ILE  46           HA       ILE  46  -3.408   1.387   2.156
  340    HB   ILE  46           HB       ILE  46  -3.015  -1.465   1.243
  341   1HG1  ILE  46          1HG1      ILE  46  -3.133   1.041  -0.441
  342   2HG1  ILE  46          2HG1      ILE  46  -1.626   0.282   0.061
  343   1HG2  ILE  46          1HG2      ILE  46  -5.093  -1.118  -0.004
  344   2HG2  ILE  46          2HG2      ILE  46  -5.340  -0.939   1.733
  345   3HG2  ILE  46          3HG2      ILE  46  -5.246   0.490   0.704
  346   1HD1  ILE  46          1HD1      ILE  46  -2.345  -0.295  -2.237
  347   2HD1  ILE  46          2HD1      ILE  46  -2.140  -1.693  -1.181
  348   3HD1  ILE  46          3HD1      ILE  46  -3.758  -1.096  -1.550
  349    H    GLU  47           H        GLU  47  -4.985   1.316   3.618
  350    HA   GLU  47           HA       GLU  47  -4.867  -0.767   5.683
  351   1HB   GLU  47          1HB       GLU  47  -6.338   1.873   5.733
  352   2HB   GLU  47          2HB       GLU  47  -6.169   0.750   7.075
  353   1HG   GLU  47          1HG       GLU  47  -4.015   1.347   7.492
  354   2HG   GLU  47          2HG       GLU  47  -3.689   1.771   5.813
  355    H    MET  48           H        MET  48  -6.267  -2.380   5.549
  356    HA   MET  48           HA       MET  48  -8.535  -2.242   3.779
  357   1HB   MET  48          1HB       MET  48  -7.509  -4.411   5.611
  358   2HB   MET  48          2HB       MET  48  -8.929  -4.596   4.591
  359   1HG   MET  48          1HG       MET  48  -6.617  -3.648   3.116
  360   2HG   MET  48          2HG       MET  48  -6.332  -5.196   3.909
  361   1HE   MET  48          1HE       MET  48  -8.256  -4.042   0.262
  362   2HE   MET  48          2HE       MET  48  -9.684  -3.953   1.294
  363   3HE   MET  48          3HE       MET  48  -8.231  -3.047   1.719
  364    H    LYS  49           H        LYS  49 -10.598  -3.449   4.786
  365    HA   LYS  49           HA       LYS  49 -11.894  -1.601   6.398
  366   1HB   LYS  49          1HB       LYS  49 -12.596  -3.928   5.056
  367   2HB   LYS  49          2HB       LYS  49 -12.940  -4.299   6.740
  368   1HG   LYS  49          1HG       LYS  49 -14.556  -2.663   6.911
  369   2HG   LYS  49          2HG       LYS  49 -13.903  -1.731   5.561
  370   1HD   LYS  49          1HD       LYS  49 -15.953  -2.762   4.855
  371   2HD   LYS  49          2HD       LYS  49 -14.613  -3.567   4.035
  372   1HE   LYS  49          1HE       LYS  49 -15.307  -5.517   4.837
  373   2HE   LYS  49          2HE       LYS  49 -15.059  -4.925   6.479
  374   1HZ   LYS  49          1HZ       LYS  49 -17.239  -4.675   6.787
  375   2HZ   LYS  49          2HZ       LYS  49 -17.438  -5.654   5.423
  376   3HZ   LYS  49          3HZ       LYS  49 -17.486  -3.970   5.269
  377    H    LYS  50           H        LYS  50 -10.840  -4.863   7.394
  378    HA   LYS  50           HA       LYS  50  -9.626  -4.064   9.783
  379   1HB   LYS  50          1HB       LYS  50 -12.503  -4.169   9.903
  380   2HB   LYS  50          2HB       LYS  50 -11.814  -5.392  10.962
  381   1HG   LYS  50          1HG       LYS  50 -10.592  -3.762  12.186
  382   2HG   LYS  50          2HG       LYS  50 -10.979  -2.503  11.010
  383   1HD   LYS  50          1HD       LYS  50 -13.463  -3.270  11.686
  384   2HD   LYS  50          2HD       LYS  50 -12.620  -3.641  13.192
  385   1HE   LYS  50          1HE       LYS  50 -12.065  -1.436  13.577
  386   2HE   LYS  50          2HE       LYS  50 -12.168  -1.003  11.871
  387   1HZ   LYS  50          1HZ       LYS  50 -14.062  -0.491  13.730
  388   2HZ   LYS  50          2HZ       LYS  50 -14.666  -1.887  12.989
  389   3HZ   LYS  50          3HZ       LYS  50 -14.323  -0.517  12.058
  390    H    ARG  51           H        ARG  51 -11.957  -6.703   9.266
  391    HA   ARG  51           HA       ARG  51  -9.890  -8.637   9.914
  392   1HB   ARG  51          1HB       ARG  51 -12.322  -8.683  10.760
  393   2HB   ARG  51          2HB       ARG  51 -12.729  -9.285   9.158
  394   1HG   ARG  51          1HG       ARG  51 -11.266 -11.197   9.483
  395   2HG   ARG  51          2HG       ARG  51 -10.801 -10.584  11.072
  396   1HD   ARG  51          1HD       ARG  51 -13.680 -11.069  10.408
  397   2HD   ARG  51          2HD       ARG  51 -12.638 -12.404  10.899
  398    HE   ARG  51           HE       ARG  51 -12.245 -10.504  12.813
  399   1HH1  ARG  51          1HH1      ARG  51 -15.033 -12.130  11.509
  400   2HH1  ARG  51          2HH1      ARG  51 -15.936 -12.044  12.985
  401   1HH2  ARG  51          1HH2      ARG  51 -13.423 -10.385  14.762
  402   2HH2  ARG  51          2HH2      ARG  51 -15.020 -11.051  14.835
  403    H    THR  52           H        THR  52  -9.163  -7.462   7.620
  404    HA   THR  52           HA       THR  52  -9.908  -9.376   5.506
  405    HB   THR  52           HB       THR  52  -8.486  -6.893   4.744
  406    HG1  THR  52           HG1      THR  52 -11.005  -6.927   5.982
  407   1HG2  THR  52          1HG2      THR  52  -9.163  -8.423   3.024
  408   2HG2  THR  52          2HG2      THR  52 -10.183  -6.989   2.908
  409   3HG2  THR  52          3HG2      THR  52 -10.814  -8.464   3.641
  410    H    SER  53           H        SER  53  -8.423 -10.884   5.169
  411    HA   SER  53           HA       SER  53  -5.709 -10.563   6.062
  412   1HB   SER  53          1HB       SER  53  -5.547 -12.873   4.789
  413   2HB   SER  53          2HB       SER  53  -6.380 -12.757   6.339
  414    HG   SER  53           HG       SER  53  -7.369 -13.602   4.062
  415    H    LEU  54           H        LEU  54  -4.009 -11.548   4.380
  416    HA   LEU  54           HA       LEU  54  -3.454  -9.578   2.529
  417   1HB   LEU  54          1HB       LEU  54  -1.798 -11.170   3.330
  418   2HB   LEU  54          2HB       LEU  54  -2.618 -12.474   2.474
  419    HG   LEU  54           HG       LEU  54  -2.034 -11.435   0.335
  420   1HD1  LEU  54          1HD1      LEU  54  -1.990  -9.098   1.209
  421   2HD1  LEU  54          2HD1      LEU  54  -0.616  -9.522   0.188
  422   3HD1  LEU  54          3HD1      LEU  54  -0.426  -9.459   1.940
  423   1HD2  LEU  54          1HD2      LEU  54  -0.434 -12.985   0.782
  424   2HD2  LEU  54          2HD2      LEU  54   0.015 -12.245   2.319
  425   3HD2  LEU  54          3HD2      LEU  54   0.580 -11.542   0.803
  426    H    ALA  55           H        ALA  55  -5.459 -12.410   2.199
  427    HA   ALA  55           HA       ALA  55  -5.613 -12.667  -0.558
  428   1HB   ALA  55          1HB       ALA  55  -7.702 -13.792  -0.222
  429   2HB   ALA  55          2HB       ALA  55  -6.625 -14.210   1.111
  430   3HB   ALA  55          3HB       ALA  55  -7.913 -13.031   1.355
  431    H    GLY  56           H        GLY  56  -7.131 -10.325   1.567
  432   1HA   GLY  56          1HA       GLY  56  -8.985  -9.316  -0.349
  433   2HA   GLY  56          2HA       GLY  56  -8.500  -8.524   1.142
  434    H    MET  57           H        MET  57  -5.756  -8.281   0.689
  435    HA   MET  57           HA       MET  57  -5.722  -5.968  -0.977
  436   1HB   MET  57          1HB       MET  57  -3.497  -7.483   0.396
  437   2HB   MET  57          2HB       MET  57  -3.268  -5.964  -0.460
  438   1HG   MET  57          1HG       MET  57  -5.358  -6.020   1.628
  439   2HG   MET  57          2HG       MET  57  -3.682  -6.107   2.164
  440   1HE   MET  57          1HE       MET  57  -5.324  -3.482  -0.858
  441   2HE   MET  57          2HE       MET  57  -6.305  -4.489   0.207
  442   3HE   MET  57          3HE       MET  57  -6.117  -2.768   0.547
  443    H    LYS  58           H        LYS  58  -4.228  -9.185  -1.230
  444    HA   LYS  58           HA       LYS  58  -2.909  -8.813  -3.657
  445   1HB   LYS  58          1HB       LYS  58  -2.658 -11.148  -3.744
  446   2HB   LYS  58          2HB       LYS  58  -2.756 -10.782  -2.026
  447   1HG   LYS  58          1HG       LYS  58  -5.104 -11.446  -2.012
  448   2HG   LYS  58          2HG       LYS  58  -5.014 -11.805  -3.738
  449   1HD   LYS  58          1HD       LYS  58  -4.809 -13.838  -2.393
  450   2HD   LYS  58          2HD       LYS  58  -3.330 -13.518  -3.302
  451   1HE   LYS  58          1HE       LYS  58  -2.137 -12.950  -1.417
  452   2HE   LYS  58          2HE       LYS  58  -3.578 -12.473  -0.520
  453   1HZ   LYS  58          1HZ       LYS  58  -2.627 -15.220  -1.093
  454   2HZ   LYS  58          2HZ       LYS  58  -4.181 -14.893  -0.509
  455   3HZ   LYS  58          3HZ       LYS  58  -2.826 -14.484   0.418
  456    H    LYS  59           H        LYS  59  -6.266  -9.479  -2.969
  457    HA   LYS  59           HA       LYS  59  -7.129 -10.386  -5.457
  458   1HB   LYS  59          1HB       LYS  59  -8.353  -9.240  -3.066
  459   2HB   LYS  59          2HB       LYS  59  -9.223  -8.826  -4.537
  460   1HG   LYS  59          1HG       LYS  59  -8.430 -11.659  -4.053
  461   2HG   LYS  59          2HG       LYS  59  -9.825 -10.983  -3.210
  462   1HD   LYS  59          1HD       LYS  59  -9.895 -10.286  -6.003
  463   2HD   LYS  59          2HD       LYS  59  -9.746 -12.034  -5.805
  464   1HE   LYS  59          1HE       LYS  59 -11.633 -11.697  -4.029
  465   2HE   LYS  59          2HE       LYS  59 -11.923 -10.195  -4.905
  466   1HZ   LYS  59          1HZ       LYS  59 -13.202 -12.270  -5.615
  467   2HZ   LYS  59          2HZ       LYS  59 -11.754 -12.775  -6.328
  468   3HZ   LYS  59          3HZ       LYS  59 -12.486 -11.335  -6.830
  469    H    LEU  60           H        LEU  60  -6.395  -7.151  -4.342
  470    HA   LEU  60           HA       LEU  60  -7.506  -5.876  -6.681
  471   1HB   LEU  60          1HB       LEU  60  -5.917  -4.913  -4.325
  472   2HB   LEU  60          2HB       LEU  60  -6.260  -3.863  -5.698
  473    HG   LEU  60           HG       LEU  60  -8.747  -4.548  -5.193
  474   1HD1  LEU  60          1HD1      LEU  60  -8.405  -4.462  -2.410
  475   2HD1  LEU  60          2HD1      LEU  60  -7.321  -5.720  -3.002
  476   3HD1  LEU  60          3HD1      LEU  60  -9.042  -5.790  -3.381
  477   1HD2  LEU  60          1HD2      LEU  60  -7.180  -2.342  -4.709
  478   2HD2  LEU  60          2HD2      LEU  60  -7.890  -2.678  -3.131
  479   3HD2  LEU  60          3HD2      LEU  60  -8.933  -2.424  -4.531
  480    H    ILE  61           H        ILE  61  -4.318  -6.800  -5.495
  481    HA   ILE  61           HA       ILE  61  -3.265  -6.381  -8.200
  482    HB   ILE  61           HB       ILE  61  -1.835  -5.513  -5.685
  483   1HG1  ILE  61          1HG1      ILE  61  -2.020  -3.321  -7.322
  484   2HG1  ILE  61          2HG1      ILE  61  -3.564  -4.115  -7.609
  485   1HG2  ILE  61          1HG2      ILE  61  -0.436  -4.459  -7.752
  486   2HG2  ILE  61          2HG2      ILE  61  -0.032  -5.974  -6.946
  487   3HG2  ILE  61          3HG2      ILE  61  -0.958  -5.993  -8.447
  488   1HD1  ILE  61          1HD1      ILE  61  -2.665  -2.590  -5.331
  489   2HD1  ILE  61          2HD1      ILE  61  -4.294  -3.083  -5.792
  490   3HD1  ILE  61          3HD1      ILE  61  -3.272  -4.177  -4.859
  491    HA   PRO  62           HA       PRO  62  -2.224 -10.576  -6.535
  492   1HB   PRO  62          1HB       PRO  62  -2.818 -11.883  -8.839
  493   2HB   PRO  62          2HB       PRO  62  -4.030 -11.508  -7.608
  494   1HG   PRO  62          1HG       PRO  62  -3.419 -10.073 -10.163
  495   2HG   PRO  62          2HG       PRO  62  -4.994 -10.473  -9.453
  496   1HD   PRO  62          1HD       PRO  62  -3.892  -8.007  -9.258
  497   2HD   PRO  62          2HD       PRO  62  -4.928  -8.693  -7.990
  498    H    GLY  63           H        GLY  63  -0.028 -10.435  -6.438
  499   1HA   GLY  63          1HA       GLY  63   1.871 -11.506  -7.665
  500   2HA   GLY  63          2HA       GLY  63   1.422 -10.472  -9.014
  501    H    ALA  64           H        ALA  64   1.632  -9.668  -5.569
  502    HA   ALA  64           HA       ALA  64   3.952  -7.964  -6.135
  503   1HB   ALA  64          1HB       ALA  64   1.401  -6.928  -5.909
  504   2HB   ALA  64          2HB       ALA  64   2.100  -6.677  -4.309
  505   3HB   ALA  64          3HB       ALA  64   2.912  -6.035  -5.736
  506    H    HIS  65           H        HIS  65   4.912  -7.093  -4.064
  507    HA   HIS  65           HA       HIS  65   5.002  -9.269  -2.117
  508   1HB   HIS  65          1HB       HIS  65   7.072  -8.185  -3.229
  509   2HB   HIS  65          2HB       HIS  65   6.801  -6.859  -2.102
  510    HD1  HIS  65           HD1      HIS  65   8.629  -9.903  -2.395
  511    HD2  HIS  65           HD2      HIS  65   6.696  -7.939   0.715
  512    HE1  HIS  65           HE1      HIS  65   9.601 -10.865  -0.285
  513    H    PHE  66           H        PHE  66   3.637  -9.120  -0.466
  514    HA   PHE  66           HA       PHE  66   3.088  -6.460   0.671
  515   1HB   PHE  66          1HB       PHE  66   1.405  -8.863   0.238
  516   2HB   PHE  66          2HB       PHE  66   1.130  -7.974   1.733
  517    HD1  PHE  66           HD1      PHE  66   1.256  -7.611  -1.951
  518    HD2  PHE  66           HD2      PHE  66  -0.111  -5.995   1.742
  519    HE1  PHE  66           HE1      PHE  66  -0.126  -5.987  -3.178
  520    HE2  PHE  66           HE2      PHE  66  -1.496  -4.369   0.521
  521    HZ   PHE  66           HZ       PHE  66  -1.506  -4.363  -1.942
  522    H    GLU  67           H        GLU  67   2.804  -6.341   3.003
  523    HA   GLU  67           HA       GLU  67   3.906  -8.507   4.590
  524   1HB   GLU  67          1HB       GLU  67   5.764  -6.875   3.680
  525   2HB   GLU  67          2HB       GLU  67   5.187  -5.832   4.972
  526   1HG   GLU  67          1HG       GLU  67   5.493  -8.280   6.205
  527   2HG   GLU  67          2HG       GLU  67   6.859  -8.194   5.095
  528    H    LYS  68           H        LYS  68   2.421  -8.710   6.123
  529    HA   LYS  68           HA       LYS  68   1.343  -6.264   7.366
  530   1HB   LYS  68          1HB       LYS  68  -0.296  -7.663   6.057
  531   2HB   LYS  68          2HB       LYS  68  -0.031  -8.950   7.225
  532   1HG   LYS  68          1HG       LYS  68  -0.616  -6.718   8.770
  533   2HG   LYS  68          2HG       LYS  68  -1.723  -6.620   7.399
  534   1HD   LYS  68          1HD       LYS  68  -2.663  -8.722   7.871
  535   2HD   LYS  68          2HD       LYS  68  -1.336  -9.167   8.947
  536   1HE   LYS  68          1HE       LYS  68  -2.970  -8.633  10.470
  537   2HE   LYS  68          2HE       LYS  68  -2.147  -7.082  10.309
  538   1HZ   LYS  68          1HZ       LYS  68  -3.940  -6.802   8.411
  539   2HZ   LYS  68          2HZ       LYS  68  -4.275  -6.405  10.021
  540   3HZ   LYS  68          3HZ       LYS  68  -4.800  -7.883   9.388
  541    H    ARG  69           H        ARG  69   3.710  -8.092   7.990
  542    HA   ARG  69           HA       ARG  69   3.108  -9.446  10.410
  543   1HB   ARG  69          1HB       ARG  69   5.200  -9.527   8.735
  544   2HB   ARG  69          2HB       ARG  69   5.863  -8.439   9.948
  545   1HG   ARG  69          1HG       ARG  69   6.418 -10.206  11.155
  546   2HG   ARG  69          2HG       ARG  69   4.701 -10.556  11.368
  547   1HD   ARG  69          1HD       ARG  69   4.678 -11.974   9.449
  548   2HD   ARG  69          2HD       ARG  69   6.304 -11.471   8.989
  549    HE   ARG  69           HE       ARG  69   6.669 -12.544  11.440
  550   1HH1  ARG  69          1HH1      ARG  69   5.104 -13.685   8.548
  551   2HH1  ARG  69          2HH1      ARG  69   5.447 -15.353   8.863
  552   1HH2  ARG  69          1HH2      ARG  69   7.127 -14.738  11.867
  553   2HH2  ARG  69          2HH2      ARG  69   6.597 -15.951  10.752
  554    H    ARG  70           H        ARG  70   3.199  -6.201   9.717
  555    HA   ARG  70           HA       ARG  70   3.008  -4.355  11.045
  556   1HB   ARG  70          1HB       ARG  70   1.900  -6.105  12.610
  557   2HB   ARG  70          2HB       ARG  70   3.417  -6.038  13.497
  558   1HG   ARG  70          1HG       ARG  70   3.084  -3.548  13.657
  559   2HG   ARG  70          2HG       ARG  70   1.458  -3.810  13.023
  560   1HD   ARG  70          1HD       ARG  70   0.718  -4.427  15.026
  561   2HD   ARG  70          2HD       ARG  70   1.990  -5.639  15.172
  562    HE   ARG  70           HE       ARG  70   1.953  -3.005  16.341
  563   1HH1  ARG  70          1HH1      ARG  70   3.930  -5.692  15.346
  564   2HH1  ARG  70          2HH1      ARG  70   5.236  -5.296  16.413
  565   1HH2  ARG  70          1HH2      ARG  70   3.665  -2.473  17.751
  566   2HH2  ARG  70          2HH2      ARG  70   5.083  -3.465  17.782
  567    H    GLY  71           H        GLY  71   5.494  -5.151   9.971
  568   1HA   GLY  71          1HA       GLY  71   7.482  -4.705  12.053
  569   2HA   GLY  71          2HA       GLY  71   7.804  -5.067  10.363
  570    H    THR  72           H        THR  72   5.493  -2.668  10.574
  571    HA   THR  72           HA       THR  72   7.302  -0.436  10.883
  572    HB   THR  72           HB       THR  72   6.547   0.457   8.562
  573    HG1  THR  72           HG1      THR  72   6.213  -2.357   8.260
  574   1HG2  THR  72          1HG2      THR  72   8.869  -0.435   9.410
  575   2HG2  THR  72          2HG2      THR  72   8.601  -0.122   7.695
  576   3HG2  THR  72          3HG2      THR  72   8.518  -1.771   8.314
  577    H    GLN  73           H        GLN  73   4.808  -1.436  12.070
  578    HA   GLN  73           HA       GLN  73   2.546  -0.046  11.245
  579   1HB   GLN  73          1HB       GLN  73   1.768  -0.297  13.597
  580   2HB   GLN  73          2HB       GLN  73   2.375  -1.790  12.894
  581   1HG   GLN  73          1HG       GLN  73   3.546  -1.981  14.776
  582   2HG   GLN  73          2HG       GLN  73   4.615  -0.774  14.064
  583   1HE2  GLN  73          1HE2      GLN  73   1.475  -0.786  15.727
  584   2HE2  GLN  73          2HE2      GLN  73   1.866   0.482  16.833
  585    H    GLY  74           H        GLY  74   2.455   2.074  10.865
  586   1HA   GLY  74          1HA       GLY  74   2.261   4.308  11.514
  587   2HA   GLY  74          2HA       GLY  74   3.048   3.910  13.034
  588    H    GLU  75           H        GLU  75   5.071   2.505  11.040
  589    HA   GLU  75           HA       GLU  75   6.940   4.688  11.103
  590   1HB   GLU  75          1HB       GLU  75   7.320   2.082  11.357
  591   2HB   GLU  75          2HB       GLU  75   7.501   2.165   9.610
  592   1HG   GLU  75          1HG       GLU  75   9.669   2.362  10.417
  593   2HG   GLU  75          2HG       GLU  75   9.197   4.020  10.050
  594    H    ALA  76           H        ALA  76   4.856   3.216   8.747
  595    HA   ALA  76           HA       ALA  76   6.164   4.386   6.466
  596   1HB   ALA  76          1HB       ALA  76   4.818   2.241   6.457
  597   2HB   ALA  76          2HB       ALA  76   3.378   3.257   6.532
  598   3HB   ALA  76          3HB       ALA  76   4.476   3.384   5.158
  599    H    ARG  77           H        ARG  77   4.159   5.577   8.867
  600    HA   ARG  77           HA       ARG  77   2.636   7.419   7.272
  601   1HB   ARG  77          1HB       ARG  77   3.020   6.948  10.202
  602   2HB   ARG  77          2HB       ARG  77   2.307   8.463   9.663
  603   1HG   ARG  77          1HG       ARG  77   0.905   6.556   8.248
  604   2HG   ARG  77          2HG       ARG  77   1.143   5.814   9.832
  605   1HD   ARG  77          1HD       ARG  77   0.111   7.654  10.935
  606   2HD   ARG  77          2HD       ARG  77   0.101   8.612   9.455
  607    HE   ARG  77           HE       ARG  77  -1.796   7.506   8.782
  608   1HH1  ARG  77          1HH1      ARG  77  -0.378   5.847  11.494
  609   2HH1  ARG  77          2HH1      ARG  77  -1.732   4.790  11.722
  610   1HH2  ARG  77          1HH2      ARG  77  -3.584   6.120   9.072
  611   2HH2  ARG  77          2HH2      ARG  77  -3.555   4.945  10.343
  612    H    ALA  78           H        ALA  78   5.781   7.355   8.627
  613    HA   ALA  78           HA       ALA  78   6.092  10.234   8.071
  614   1HB   ALA  78          1HB       ALA  78   8.100   9.970   9.696
  615   2HB   ALA  78          2HB       ALA  78   6.468  10.122  10.347
  616   3HB   ALA  78          3HB       ALA  78   7.234   8.537  10.249
  617    H    TYR  79           H        TYR  79   7.704   7.075   8.024
  618    HA   TYR  79           HA       TYR  79   9.843   8.089   6.351
  619   1HB   TYR  79          1HB       TYR  79  10.508   6.470   7.970
  620   2HB   TYR  79          2HB       TYR  79   9.228   5.362   7.489
  621    HD1  TYR  79           HD1      TYR  79  11.617   7.232   5.333
  622    HD2  TYR  79           HD2      TYR  79  10.372   3.442   6.812
  623    HE1  TYR  79           HE1      TYR  79  13.169   6.123   3.780
  624    HE2  TYR  79           HE2      TYR  79  11.921   2.322   5.264
  625    HH   TYR  79           HH       TYR  79  14.305   3.283   4.031
  626    H    SER  80           H        SER  80   6.976   6.075   6.047
  627    HA   SER  80           HA       SER  80   5.812   5.333   4.238
  628   1HB   SER  80          1HB       SER  80   7.457   7.450   2.835
  629   2HB   SER  80          2HB       SER  80   6.133   6.566   2.077
  630    HG   SER  80           HG       SER  80   5.610   7.792   4.521
  631    H    MET  81           H        MET  81   8.695   6.104   2.361
  632    HA   MET  81           HA       MET  81   9.668   3.394   2.401
  633   1HB   MET  81          1HB       MET  81   9.478   3.477  -0.259
  634   2HB   MET  81          2HB       MET  81   8.222   2.773   0.750
  635   1HG   MET  81          1HG       MET  81   7.988   5.660   0.210
  636   2HG   MET  81          2HG       MET  81   7.756   4.584  -1.166
  637   1HE   MET  81          1HE       MET  81   4.190   5.801   0.250
  638   2HE   MET  81          2HE       MET  81   5.728   6.643   0.062
  639   3HE   MET  81          3HE       MET  81   5.092   5.661  -1.259
  640    H    LYS  82           H        LYS  82  11.362   3.263   0.400
  641    HA   LYS  82           HA       LYS  82  13.500   4.861   1.072
  642   1HB   LYS  82          1HB       LYS  82  12.842   3.370  -1.457
  643   2HB   LYS  82          2HB       LYS  82  14.344   4.270  -1.294
  644   1HG   LYS  82          1HG       LYS  82  14.676   2.898   0.861
  645   2HG   LYS  82          2HG       LYS  82  13.434   1.838   0.191
  646   1HD   LYS  82          1HD       LYS  82  14.756   1.348  -1.716
  647   2HD   LYS  82          2HD       LYS  82  15.896   2.643  -1.344
  648   1HE   LYS  82          1HE       LYS  82  15.461   0.382   0.572
  649   2HE   LYS  82          2HE       LYS  82  16.548   0.199  -0.804
  650   1HZ   LYS  82          1HZ       LYS  82  17.976   1.814   0.007
  651   2HZ   LYS  82          2HZ       LYS  82  17.515   0.990   1.411
  652   3HZ   LYS  82          3HZ       LYS  82  16.817   2.486   1.041
  653    H    GLU  83           H        GLU  83  13.327   7.030   1.148
  654    HA   GLU  83           HA       GLU  83  11.861   8.606  -0.675
  655   1HB   GLU  83          1HB       GLU  83  13.231   9.028   1.726
  656   2HB   GLU  83          2HB       GLU  83  14.051  10.051   0.555
  657   1HG   GLU  83          1HG       GLU  83  12.008  11.173   0.011
  658   2HG   GLU  83          2HG       GLU  83  11.077  10.055   1.006
  659    H    ASP  84           H        ASP  84  15.197   7.533  -0.599
  660    HA   ASP  84           HA       ASP  84  16.332   9.242  -2.468
  661   1HB   ASP  84          1HB       ASP  84  16.891   6.372  -1.753
  662   2HB   ASP  84          2HB       ASP  84  17.829   7.208  -2.988
  663    H    THR  85           H        THR  85  14.289   6.432  -2.931
  664    HA   THR  85           HA       THR  85  14.577   6.629  -5.837
  665    HB   THR  85           HB       THR  85  13.100   4.563  -5.825
  666    HG1  THR  85           HG1      THR  85  12.459   3.776  -3.955
  667   1HG2  THR  85          1HG2      THR  85  14.997   3.113  -4.849
  668   2HG2  THR  85          2HG2      THR  85  15.835   4.643  -4.591
  669   3HG2  THR  85          3HG2      THR  85  15.367   4.157  -6.220
  670    H    ARG  86           H        ARG  86  12.886   8.269  -3.700
  671    HA   ARG  86           HA       ARG  86  10.189   7.995  -4.453
  672   1HB   ARG  86          1HB       ARG  86  11.234   9.260  -2.450
  673   2HB   ARG  86          2HB       ARG  86  11.388  10.605  -3.572
  674   1HG   ARG  86          1HG       ARG  86   9.073  10.824  -3.810
  675   2HG   ARG  86          2HG       ARG  86   8.765   9.225  -3.129
  676   1HD   ARG  86          1HD       ARG  86   8.812   9.988  -1.022
  677   2HD   ARG  86          2HD       ARG  86  10.212  11.015  -1.328
  678    HE   ARG  86           HE       ARG  86   7.860  12.074  -2.526
  679   1HH1  ARG  86          1HH1      ARG  86   9.523  11.735   0.513
  680   2HH1  ARG  86          2HH1      ARG  86   8.813  13.153   1.209
  681   1HH2  ARG  86          1HH2      ARG  86   6.917  13.943  -1.620
  682   2HH2  ARG  86          2HH2      ARG  86   7.329  14.408  -0.004
  683    H    LEU  87           H        LEU  87   9.241   8.436  -6.322
  684    HA   LEU  87           HA       LEU  87  10.544  10.333  -8.153
  685   1HB   LEU  87          1HB       LEU  87   9.870   7.776  -8.640
  686   2HB   LEU  87          2HB       LEU  87   8.380   8.577  -9.133
  687    HG   LEU  87           HG       LEU  87  11.137   8.925 -10.293
  688   1HD1  LEU  87          1HD1      LEU  87   8.524   7.836 -11.287
  689   2HD1  LEU  87          2HD1      LEU  87  10.105   7.057 -11.251
  690   3HD1  LEU  87          3HD1      LEU  87   9.794   8.367 -12.389
  691   1HD2  LEU  87          1HD2      LEU  87  10.109  11.122 -10.083
  692   2HD2  LEU  87          2HD2      LEU  87   8.645  10.526 -10.866
  693   3HD2  LEU  87          3HD2      LEU  87  10.156  10.611 -11.771
  694    H    GLU  88           H        GLU  88   7.241   9.193  -7.410
  695    HA   GLU  88           HA       GLU  88   6.343  11.992  -7.605
  696   1HB   GLU  88          1HB       GLU  88   5.670  10.019  -9.389
  697   2HB   GLU  88          2HB       GLU  88   4.329   9.958  -8.255
  698   1HG   GLU  88          1HG       GLU  88   3.893  11.434 -10.164
  699   2HG   GLU  88          2HG       GLU  88   3.849  12.286  -8.621
  700    H    GLY  89           H        GLY  89   4.021  12.161  -6.623
  701   1HA   GLY  89          1HA       GLY  89   2.521  11.601  -4.893
  702   2HA   GLY  89          2HA       GLY  89   3.674  10.410  -4.310
  703    HA   PRO  90           HA       PRO  90   3.020  10.179  -2.360
  704   1HB   PRO  90          1HB       PRO  90   1.583  10.965  -0.195
  705   2HB   PRO  90          2HB       PRO  90   3.290  10.516  -0.103
  706   1HG   PRO  90          1HG       PRO  90   2.052  13.239  -0.228
  707   2HG   PRO  90          2HG       PRO  90   3.388  12.663   0.786
  708   1HD   PRO  90          1HD       PRO  90   3.789  14.106  -1.470
  709   2HD   PRO  90          2HD       PRO  90   4.932  12.867  -0.913
  710    H    TRP  91           H        TRP  91   0.685   9.542  -2.069
  711    HA   TRP  91           HA       TRP  91  -1.211  11.489  -3.150
  712   1HB   TRP  91          1HB       TRP  91  -0.482   8.860  -4.423
  713   2HB   TRP  91          2HB       TRP  91  -2.058   9.599  -4.690
  714    HD1  TRP  91           HD1      TRP  91  -1.074  12.636  -4.959
  715    HE1  TRP  91           HE1      TRP  91   0.192  13.353  -7.082
  716    HE3  TRP  91           HE3      TRP  91   0.545   8.047  -6.527
  717    HZ2  TRP  91           HZ2      TRP  91   1.679  12.134  -9.149
  718    HZ3  TRP  91           HZ3      TRP  91   1.884   7.910  -8.587
  719    HH2  TRP  91           HH2      TRP  91   2.438   9.912  -9.869
  720    H    GLU  92           H        GLU  92  -3.186  11.339  -2.258
  721    HA   GLU  92           HA       GLU  92  -3.755   8.962  -0.611
  722   1HB   GLU  92          1HB       GLU  92  -4.203  11.877  -0.099
  723   2HB   GLU  92          2HB       GLU  92  -5.279  10.696   0.634
  724   1HG   GLU  92          1HG       GLU  92  -3.556   9.736   1.891
  725   2HG   GLU  92          2HG       GLU  92  -2.302  10.500   0.916
  726    H    TYR  93           H        TYR  93  -5.698   7.976  -0.830
  727    HA   TYR  93           HA       TYR  93  -7.777   9.267  -2.432
  728   1HB   TYR  93          1HB       TYR  93  -6.450   6.640  -3.075
  729   2HB   TYR  93          2HB       TYR  93  -8.070   7.026  -3.647
  730    HD1  TYR  93           HD1      TYR  93  -8.418   8.735  -5.342
  731    HD2  TYR  93           HD2      TYR  93  -4.505   7.787  -3.967
  732    HE1  TYR  93           HE1      TYR  93  -7.458   9.932  -7.265
  733    HE2  TYR  93           HE2      TYR  93  -3.534   8.982  -5.885
  734    HH   TYR  93           HH       TYR  93  -5.604  10.573  -8.297
  735    H    GLY  94           H        GLY  94  -9.858   8.082  -2.330
  736   1HA   GLY  94          1HA       GLY  94 -11.392   6.663  -1.264
  737   2HA   GLY  94          2HA       GLY  94 -10.138   6.200  -0.123
  738    H    GLU  95           H        GLU  95 -11.505   6.493   1.654
  739    HA   GLU  95           HA       GLU  95 -13.087   8.689   2.220
  740   1HB   GLU  95          1HB       GLU  95 -13.235   6.744   3.601
  741   2HB   GLU  95          2HB       GLU  95 -11.543   6.866   4.062
  742   1HG   GLU  95          1HG       GLU  95 -11.975   8.841   5.351
  743   2HG   GLU  95          2HG       GLU  95 -13.642   8.898   4.780
  Start of MODEL   12
    1   1H    ALA   2          1H        ALA   2 -14.887  -0.234  20.309
    2    HA   ALA   2           HA       ALA   2 -14.060   0.574  17.659
    3   1HB   ALA   2          1HB       ALA   2 -14.664   2.379  19.011
    4   2HB   ALA   2          2HB       ALA   2 -13.754   1.768  20.394
    5   3HB   ALA   2          3HB       ALA   2 -12.901   2.426  18.997
    6    H    ARG   3           H        ARG   3 -12.286  -0.153  16.706
    7    HA   ARG   3           HA       ARG   3  -9.852  -0.538  18.255
    8   1HB   ARG   3          1HB       ARG   3 -11.413  -2.725  17.007
    9   2HB   ARG   3          2HB       ARG   3  -9.674  -2.767  16.749
   10   1HG   ARG   3          1HG       ARG   3  -9.568  -3.839  18.693
   11   2HG   ARG   3          2HG       ARG   3  -9.876  -2.270  19.441
   12   1HD   ARG   3          1HD       ARG   3 -12.379  -2.890  19.018
   13   2HD   ARG   3          2HD       ARG   3 -11.753  -4.536  18.934
   14    HE   ARG   3           HE       ARG   3 -11.991  -2.882  21.281
   15   1HH1  ARG   3          1HH1      ARG   3 -10.403  -5.621  19.834
   16   2HH1  ARG   3          2HH1      ARG   3 -10.007  -6.358  21.351
   17   1HH2  ARG   3          1HH2      ARG   3 -11.475  -3.842  23.285
   18   2HH2  ARG   3          2HH2      ARG   3 -10.618  -5.346  23.313
   19    H    GLN   4           H        GLN   4  -7.952  -0.448  17.016
   20    HA   GLN   4           HA       GLN   4  -8.342   0.727  14.357
   21   1HB   GLN   4          1HB       GLN   4  -6.602   1.313  16.569
   22   2HB   GLN   4          2HB       GLN   4  -5.640   0.960  15.139
   23   1HG   GLN   4          1HG       GLN   4  -6.951   2.640  13.891
   24   2HG   GLN   4          2HG       GLN   4  -7.805   3.036  15.382
   25   1HE2  GLN   4          1HE2      GLN   4  -6.875   5.180  14.696
   26   2HE2  GLN   4          2HE2      GLN   4  -5.319   5.590  15.323
   27    H    VAL   5           H        VAL   5  -6.835   0.173  12.646
   28    HA   VAL   5           HA       VAL   5  -5.807  -2.581  12.890
   29    HB   VAL   5           HB       VAL   5  -6.360  -2.981  10.569
   30   1HG1  VAL   5          1HG1      VAL   5  -8.361  -3.667  11.240
   31   2HG1  VAL   5          2HG1      VAL   5  -8.242  -2.595  12.637
   32   3HG1  VAL   5          3HG1      VAL   5  -8.985  -2.020  11.144
   33   1HG2  VAL   5          1HG2      VAL   5  -6.345  -1.177   9.240
   34   2HG2  VAL   5          2HG2      VAL   5  -8.032  -0.991   9.720
   35   3HG2  VAL   5          3HG2      VAL   5  -6.772  -0.085  10.558
   36    H    ILE   6           H        ILE   6  -3.996  -3.109  11.502
   37    HA   ILE   6           HA       ILE   6  -2.130  -0.892  11.324
   38    HB   ILE   6           HB       ILE   6  -1.649  -3.810  10.718
   39   1HG1  ILE   6          1HG1      ILE   6  -0.422  -3.485  13.057
   40   2HG1  ILE   6          2HG1      ILE   6  -1.660  -2.251  13.262
   41   1HG2  ILE   6          1HG2      ILE   6   0.019  -2.420   9.704
   42   2HG2  ILE   6          2HG2      ILE   6   0.220  -1.496  11.191
   43   3HG2  ILE   6          3HG2      ILE   6   0.726  -3.184  11.127
   44   1HD1  ILE   6          1HD1      ILE   6  -2.120  -4.614  14.136
   45   2HD1  ILE   6          2HD1      ILE   6  -3.384  -3.803  13.210
   46   3HD1  ILE   6          3HD1      ILE   6  -2.382  -5.035  12.444
   47    H    CYS   7           H        CYS   7  -0.990  -0.315   9.447
   48    HA   CYS   7           HA       CYS   7  -2.537  -0.505   7.033
   49   1HB   CYS   7          1HB       CYS   7  -1.002   1.073   6.110
   50   2HB   CYS   7          2HB       CYS   7  -1.281   1.552   7.780
   51    HG   CYS   7           HG       CYS   7   1.529   0.265   6.376
   52    H    TRP   8           H        TRP   8  -1.699  -1.230   4.981
   53    HA   TRP   8           HA       TRP   8   0.091  -3.540   5.296
   54   1HB   TRP   8          1HB       TRP   8  -2.017  -2.934   3.216
   55   2HB   TRP   8          2HB       TRP   8  -0.926  -4.315   3.137
   56    HD1  TRP   8           HD1      TRP   8  -3.441  -2.888   5.743
   57    HE1  TRP   8           HE1      TRP   8  -4.687  -4.878   6.799
   58    HE3  TRP   8           HE3      TRP   8  -1.095  -6.710   3.289
   59    HZ2  TRP   8           HZ2      TRP   8  -4.676  -7.694   6.616
   60    HZ3  TRP   8           HZ3      TRP   8  -1.771  -9.023   3.787
   61    HH2  TRP   8           HH2      TRP   8  -3.524  -9.503   5.417
   62    H    CYS   9           H        CYS   9   2.112  -3.198   4.671
   63    HA   CYS   9           HA       CYS   9   2.676  -1.169   2.644
   64   1HB   CYS   9          1HB       CYS   9   5.055  -1.503   3.352
   65   2HB   CYS   9          2HB       CYS   9   3.991  -0.959   4.644
   66    HG   CYS   9           HG       CYS   9   4.421  -2.913   6.262
   67    H    PHE  10           H        PHE  10   2.873  -1.771   0.601
   68    HA   PHE  10           HA       PHE  10   4.157  -4.340  -0.004
   69   1HB   PHE  10          1HB       PHE  10   2.492  -5.050  -1.456
   70   2HB   PHE  10          2HB       PHE  10   1.547  -4.296  -0.176
   71    HD1  PHE  10           HD2      PHE  10   0.973  -1.776  -0.539
   72    HD2  PHE  10           HD1      PHE  10   2.101  -4.459  -3.645
   73    HE1  PHE  10           HE2      PHE  10  -0.093  -0.302  -2.195
   74    HE2  PHE  10           HE1      PHE  10   1.038  -2.988  -5.306
   75    HZ   PHE  10           HZ       PHE  10  -0.062  -0.907  -4.582
   76    H    THR  11           H        THR  11   4.857  -4.472  -2.313
   77    HA   THR  11           HA       THR  11   5.499  -1.820  -3.418
   78    HB   THR  11           HB       THR  11   7.450  -4.119  -3.469
   79    HG1  THR  11           HG1      THR  11   7.442  -1.912  -1.664
   80   1HG2  THR  11          1HG2      THR  11   8.956  -1.940  -3.665
   81   2HG2  THR  11          2HG2      THR  11   7.458  -1.266  -4.308
   82   3HG2  THR  11          3HG2      THR  11   8.193  -2.672  -5.076
   83    H    LEU  12           H        LEU  12   4.966  -1.604  -5.490
   84    HA   LEU  12           HA       LEU  12   4.470  -4.045  -7.062
   85   1HB   LEU  12          1HB       LEU  12   2.487  -2.659  -6.630
   86   2HB   LEU  12          2HB       LEU  12   3.286  -1.293  -7.404
   87    HG   LEU  12           HG       LEU  12   3.154  -2.318  -9.543
   88   1HD1  LEU  12          1HD1      LEU  12   2.843  -4.762  -7.969
   89   2HD1  LEU  12          2HD1      LEU  12   3.515  -4.525  -9.582
   90   3HD1  LEU  12          3HD1      LEU  12   1.771  -4.663  -9.366
   91   1HD2  LEU  12          1HD2      LEU  12   0.641  -2.903  -9.622
   92   2HD2  LEU  12          2HD2      LEU  12   1.119  -1.279  -9.128
   93   3HD2  LEU  12          3HD2      LEU  12   0.646  -2.468  -7.913
   94    H    ASN  13           H        ASN  13   5.919  -4.448  -8.583
   95    HA   ASN  13           HA       ASN  13   7.490  -2.217  -9.675
   96   1HB   ASN  13          1HB       ASN  13   8.082  -5.184  -9.764
   97   2HB   ASN  13          2HB       ASN  13   9.146  -3.895 -10.320
   98   1HD2  ASN  13          1HD2      ASN  13   9.869  -2.342  -8.696
   99   2HD2  ASN  13          2HD2      ASN  13  10.136  -2.895  -7.081
  100    H    ASN  14           H        ASN  14   7.538  -1.784 -11.828
  101    HA   ASN  14           HA       ASN  14   6.686  -1.636 -13.940
  102   1HB   ASN  14          1HB       ASN  14   6.665  -4.638 -14.017
  103   2HB   ASN  14          2HB       ASN  14   7.110  -3.501 -15.286
  104   1HD2  ASN  14          1HD2      ASN  14   9.188  -3.130 -15.605
  105   2HD2  ASN  14          2HD2      ASN  14  10.465  -3.545 -14.519
  106    HA   PRO  15           HA       PRO  15   2.396  -2.858 -12.447
  107   1HB   PRO  15          1HB       PRO  15   1.437  -0.329 -12.216
  108   2HB   PRO  15          2HB       PRO  15   2.258  -1.170 -10.895
  109   1HG   PRO  15          1HG       PRO  15   3.341   0.858 -12.813
  110   2HG   PRO  15          2HG       PRO  15   3.595   0.725 -11.063
  111   1HD   PRO  15          1HD       PRO  15   5.423  -0.128 -12.869
  112   2HD   PRO  15          2HD       PRO  15   5.199  -0.914 -11.293
  113    H    LEU  16           H        LEU  16   0.714  -3.082 -13.836
  114    HA   LEU  16           HA       LEU  16   1.067  -2.103 -16.537
  115   1HB   LEU  16          1HB       LEU  16  -0.853  -3.994 -15.222
  116   2HB   LEU  16          2HB       LEU  16  -1.111  -3.427 -16.871
  117    HG   LEU  16           HG       LEU  16   1.400  -4.323 -17.117
  118   1HD1  LEU  16          1HD1      LEU  16   0.539  -6.600 -15.555
  119   2HD1  LEU  16          2HD1      LEU  16   0.765  -5.166 -14.554
  120   3HD1  LEU  16          3HD1      LEU  16   2.087  -5.755 -15.563
  121   1HD2  LEU  16          1HD2      LEU  16  -0.130  -5.116 -18.643
  122   2HD2  LEU  16          2HD2      LEU  16  -1.248  -5.673 -17.398
  123   3HD2  LEU  16          3HD2      LEU  16   0.231  -6.578 -17.724
  124    H    SER  17           H        SER  17  -0.335  -0.906 -13.783
  125    HA   SER  17           HA       SER  17  -1.486   1.315 -15.019
  126   1HB   SER  17          1HB       SER  17  -3.666   0.837 -15.381
  127   2HB   SER  17          2HB       SER  17  -3.142  -0.847 -15.367
  128    HG   SER  17           HG       SER  17  -4.937  -0.215 -13.911
  129    HA   PRO  18           HA       PRO  18  -1.417   2.816 -10.898
  130   1HB   PRO  18          1HB       PRO  18  -3.435   4.633 -10.902
  131   2HB   PRO  18          2HB       PRO  18  -1.905   4.895 -11.747
  132   1HG   PRO  18          1HG       PRO  18  -4.538   3.976 -12.836
  133   2HG   PRO  18          2HG       PRO  18  -3.394   5.149 -13.515
  134   1HD   PRO  18          1HD       PRO  18  -3.551   2.591 -14.390
  135   2HD   PRO  18          2HD       PRO  18  -2.029   3.505 -14.380
  136    H    LEU  19           H        LEU  19  -2.368   2.625  -8.869
  137    HA   LEU  19           HA       LEU  19  -4.380   0.605  -8.626
  138   1HB   LEU  19          1HB       LEU  19  -3.314   2.349  -6.421
  139   2HB   LEU  19          2HB       LEU  19  -4.021   0.741  -6.284
  140    HG   LEU  19           HG       LEU  19  -1.469   1.151  -7.798
  141   1HD1  LEU  19          1HD1      LEU  19  -1.475   0.475  -4.884
  142   2HD1  LEU  19          2HD1      LEU  19  -1.433   2.156  -5.416
  143   3HD1  LEU  19          3HD1      LEU  19  -0.150   1.047  -5.899
  144   1HD2  LEU  19          1HD2      LEU  19  -1.881  -1.213  -6.127
  145   2HD2  LEU  19          2HD2      LEU  19  -1.361  -1.085  -7.808
  146   3HD2  LEU  19          3HD2      LEU  19  -3.079  -1.021  -7.408
  147    H    SER  20           H        SER  20  -6.235   0.956  -7.040
  148    HA   SER  20           HA       SER  20  -7.374   3.631  -7.099
  149   1HB   SER  20          1HB       SER  20  -9.451   2.937  -8.160
  150   2HB   SER  20          2HB       SER  20  -8.098   2.580  -9.233
  151    HG   SER  20           HG       SER  20  -8.582   0.544  -9.114
  152    H    LEU  21           H        LEU  21  -9.167   3.896  -5.667
  153    HA   LEU  21           HA       LEU  21  -8.922   2.669  -3.209
  154   1HB   LEU  21          1HB       LEU  21 -10.065   4.739  -3.367
  155   2HB   LEU  21          2HB       LEU  21 -11.256   4.072  -4.483
  156    HG   LEU  21           HG       LEU  21 -12.053   2.622  -2.575
  157   1HD1  LEU  21          1HD1      LEU  21 -10.818   2.562  -0.733
  158   2HD1  LEU  21          2HD1      LEU  21 -11.296   4.231  -0.421
  159   3HD1  LEU  21          3HD1      LEU  21  -9.807   3.891  -1.303
  160   1HD2  LEU  21          1HD2      LEU  21 -13.537   4.300  -2.985
  161   2HD2  LEU  21          2HD2      LEU  21 -12.331   5.571  -2.784
  162   3HD2  LEU  21          3HD2      LEU  21 -13.018   4.774  -1.368
  163    H    HIS  22           H        HIS  22 -10.073   1.075  -2.103
  164    HA   HIS  22           HA       HIS  22 -11.501  -0.830  -3.839
  165   1HB   HIS  22          1HB       HIS  22  -9.267  -1.510  -2.752
  166   2HB   HIS  22          2HB       HIS  22 -10.168  -1.560  -1.240
  167    HD1  HIS  22           HD1      HIS  22 -10.375  -3.995  -0.778
  168    HD2  HIS  22           HD2      HIS  22 -11.334  -3.059  -4.711
  169    HE1  HIS  22           HE1      HIS  22 -11.228  -6.134  -1.789
  170    H    ASP  23           H        ASP  23 -13.508  -1.477  -3.291
  171    HA   ASP  23           HA       ASP  23 -15.047   0.016  -1.494
  172   1HB   ASP  23          1HB       ASP  23 -15.454  -2.440  -3.109
  173   2HB   ASP  23          2HB       ASP  23 -16.567  -2.186  -1.767
  174    H    SER  24           H        SER  24 -13.061  -2.762  -1.010
  175    HA   SER  24           HA       SER  24 -14.298  -3.512   1.494
  176   1HB   SER  24          1HB       SER  24 -12.777  -4.876  -0.346
  177   2HB   SER  24          2HB       SER  24 -11.618  -4.581   0.950
  178    HG   SER  24           HG       SER  24 -12.570  -6.104   2.016
  179    H    MET  25           H        MET  25 -11.325  -1.918   0.423
  180    HA   MET  25           HA       MET  25 -10.265  -1.583   3.048
  181   1HB   MET  25          1HB       MET  25  -8.508  -0.423   2.042
  182   2HB   MET  25          2HB       MET  25  -9.021  -1.541   0.786
  183   1HG   MET  25          1HG       MET  25 -10.174   0.182  -0.383
  184   2HG   MET  25          2HG       MET  25  -9.949   1.312   0.949
  185   1HE   MET  25          1HE       MET  25  -7.777  -0.255  -2.313
  186   2HE   MET  25          2HE       MET  25  -6.424  -0.536  -1.217
  187   3HE   MET  25          3HE       MET  25  -7.996  -1.263  -0.882
  188    H    LYS  26           H        LYS  26  -9.543   0.931   3.440
  189    HA   LYS  26           HA       LYS  26 -12.027   2.512   3.389
  190   1HB   LYS  26          1HB       LYS  26 -10.662   1.474   5.665
  191   2HB   LYS  26          2HB       LYS  26 -10.476   3.223   5.673
  192   1HG   LYS  26          1HG       LYS  26 -13.019   3.279   5.278
  193   2HG   LYS  26          2HG       LYS  26 -12.982   1.596   5.808
  194   1HD   LYS  26          1HD       LYS  26 -11.434   3.015   7.664
  195   2HD   LYS  26          2HD       LYS  26 -12.863   4.009   7.373
  196   1HE   LYS  26          1HE       LYS  26 -13.119   1.069   7.885
  197   2HE   LYS  26          2HE       LYS  26 -12.938   2.201   9.224
  198   1HZ   LYS  26          1HZ       LYS  26 -14.882   3.421   8.263
  199   2HZ   LYS  26          2HZ       LYS  26 -15.240   1.890   8.885
  200   3HZ   LYS  26          3HZ       LYS  26 -15.114   2.115   7.213
  201    H    TYR  27           H        TYR  27  -8.504   2.528   3.552
  202    HA   TYR  27           HA       TYR  27  -8.533   5.185   2.298
  203   1HB   TYR  27          1HB       TYR  27  -7.948   5.113   4.845
  204   2HB   TYR  27          2HB       TYR  27  -6.401   4.486   4.289
  205    HD1  TYR  27           HD1      TYR  27  -8.730   7.251   3.309
  206    HD2  TYR  27           HD2      TYR  27  -4.730   6.057   4.131
  207    HE1  TYR  27           HE1      TYR  27  -7.963   9.547   2.879
  208    HE2  TYR  27           HE2      TYR  27  -3.952   8.350   3.704
  209    HH   TYR  27           HH       TYR  27  -6.156  10.853   2.546
  210    H    LEU  28           H        LEU  28  -6.946   5.556   0.782
  211    HA   LEU  28           HA       LEU  28  -5.166   3.289   0.174
  212   1HB   LEU  28          1HB       LEU  28  -7.044   3.432  -1.408
  213   2HB   LEU  28          2HB       LEU  28  -6.568   5.082  -1.804
  214    HG   LEU  28           HG       LEU  28  -4.538   4.307  -2.834
  215   1HD1  LEU  28          1HD1      LEU  28  -3.580   2.469  -2.033
  216   2HD1  LEU  28          2HD1      LEU  28  -4.749   1.545  -2.976
  217   3HD1  LEU  28          3HD1      LEU  28  -5.083   1.926  -1.287
  218   1HD2  LEU  28          1HD2      LEU  28  -6.937   2.698  -3.698
  219   2HD2  LEU  28          2HD2      LEU  28  -5.477   2.933  -4.659
  220   3HD2  LEU  28          3HD2      LEU  28  -6.494   4.314  -4.248
  221    H    VAL  29           H        VAL  29  -3.076   3.781   0.095
  222    HA   VAL  29           HA       VAL  29  -2.259   6.504  -0.615
  223    HB   VAL  29           HB       VAL  29  -1.263   5.033   1.830
  224   1HG1  VAL  29          1HG1      VAL  29   0.618   6.186   1.486
  225   2HG1  VAL  29          2HG1      VAL  29  -0.124   7.184   0.233
  226   3HG1  VAL  29          3HG1      VAL  29  -0.314   7.615   1.934
  227   1HG2  VAL  29          1HG2      VAL  29  -3.292   5.948   2.476
  228   2HG2  VAL  29          2HG2      VAL  29  -2.147   7.219   2.905
  229   3HG2  VAL  29          3HG2      VAL  29  -3.107   7.357   1.432
  230    H    TYR  30           H        TYR  30  -0.759   6.440  -2.144
  231    HA   TYR  30           HA       TYR  30   1.343   4.444  -2.080
  232   1HB   TYR  30          1HB       TYR  30   0.896   3.400  -4.111
  233   2HB   TYR  30          2HB       TYR  30  -0.712   3.563  -3.413
  234    HD1  TYR  30           HD2      TYR  30  -2.239   5.346  -4.248
  235    HD2  TYR  30           HD1      TYR  30   1.481   4.507  -6.135
  236    HE1  TYR  30           HE2      TYR  30  -2.994   6.546  -6.258
  237    HE2  TYR  30           HE1      TYR  30   0.737   5.705  -8.149
  238    HH   TYR  30           HH       TYR  30  -1.357   6.364  -9.232
  239    H    GLN  31           H        GLN  31   3.090   4.921  -3.553
  240    HA   GLN  31           HA       GLN  31   3.033   7.577  -4.777
  241   1HB   GLN  31          1HB       GLN  31   4.256   8.466  -3.133
  242   2HB   GLN  31          2HB       GLN  31   4.444   6.901  -2.354
  243   1HG   GLN  31          1HG       GLN  31   6.350   6.400  -3.773
  244   2HG   GLN  31          2HG       GLN  31   6.150   7.942  -4.604
  245   1HE2  GLN  31          1HE2      GLN  31   8.526   7.728  -3.720
  246   2HE2  GLN  31          2HE2      GLN  31   8.800   8.561  -2.231
  247    H    THR  32           H        THR  32   4.661   7.915  -6.374
  248    HA   THR  32           HA       THR  32   5.520   5.418  -7.622
  249    HB   THR  32           HB       THR  32   5.495   8.241  -8.707
  250    HG1  THR  32           HG1      THR  32   3.918   6.166  -9.734
  251   1HG2  THR  32          1HG2      THR  32   5.674   6.685 -10.887
  252   2HG2  THR  32          2HG2      THR  32   6.588   5.695  -9.749
  253   3HG2  THR  32          3HG2      THR  32   7.084   7.356 -10.068
  254    H    GLU  33           H        GLU  33   7.554   4.732  -7.543
  255    HA   GLU  33           HA       GLU  33   9.656   6.671  -6.829
  256   1HB   GLU  33          1HB       GLU  33   9.129   3.887  -5.899
  257   2HB   GLU  33          2HB       GLU  33  10.802   4.409  -6.042
  258   1HG   GLU  33          1HG       GLU  33  10.501   6.135  -4.459
  259   2HG   GLU  33          2HG       GLU  33   8.748   5.956  -4.494
  260    H    GLN  34           H        GLN  34  11.857   6.031  -7.576
  261    HA   GLN  34           HA       GLN  34  11.700   5.166 -10.355
  262   1HB   GLN  34          1HB       GLN  34  13.225   7.093  -8.954
  263   2HB   GLN  34          2HB       GLN  34  14.357   5.885  -9.547
  264   1HG   GLN  34          1HG       GLN  34  12.578   6.441 -11.658
  265   2HG   GLN  34          2HG       GLN  34  13.060   7.989 -10.966
  266   1HE2  GLN  34          1HE2      GLN  34  13.730   6.295 -13.465
  267   2HE2  GLN  34          2HE2      GLN  34  15.450   6.422 -13.567
  268    H    GLY  35           H        GLY  35  12.024   3.100 -10.828
  269   1HA   GLY  35          1HA       GLY  35  14.009   1.605  -9.229
  270   2HA   GLY  35          2HA       GLY  35  12.490   0.886  -9.740
  271    H    GLU  36           H        GLU  36  12.824  -0.543 -11.298
  272    HA   GLU  36           HA       GLU  36  15.049  -0.953 -12.804
  273   1HB   GLU  36          1HB       GLU  36  13.384  -1.888 -14.572
  274   2HB   GLU  36          2HB       GLU  36  13.468  -2.637 -12.984
  275   1HG   GLU  36          1HG       GLU  36  11.537  -0.471 -13.097
  276   2HG   GLU  36          2HG       GLU  36  11.195  -1.758 -14.252
  277    H    ALA  37           H        ALA  37  16.099   0.094 -14.356
  278    HA   ALA  37           HA       ALA  37  15.517   2.631 -15.239
  279   1HB   ALA  37          1HB       ALA  37  17.245   2.389 -16.818
  280   2HB   ALA  37          2HB       ALA  37  17.686   1.331 -15.477
  281   3HB   ALA  37          3HB       ALA  37  16.993   0.648 -16.948
  282    H    GLY  38           H        GLY  38  14.039   3.472 -16.555
  283   1HA   GLY  38          1HA       GLY  38  12.896   3.586 -18.645
  284   2HA   GLY  38          2HA       GLY  38  12.995   1.835 -18.759
  285    H    ASN  39           H        ASN  39  12.087   1.361 -16.047
  286    HA   ASN  39           HA       ASN  39   9.259   2.130 -16.361
  287   1HB   ASN  39          1HB       ASN  39   9.949  -0.303 -14.802
  288   2HB   ASN  39          2HB       ASN  39   8.573   0.007 -15.856
  289   1HD2  ASN  39          1HD2      ASN  39  11.973  -0.828 -15.770
  290   2HD2  ASN  39          2HD2      ASN  39  12.026  -1.568 -17.331
  291    H    ILE  40           H        ILE  40   8.053   1.805 -14.176
  292    HA   ILE  40           HA       ILE  40   9.715   2.780 -11.956
  293    HB   ILE  40           HB       ILE  40   7.454   4.116 -11.427
  294   1HG1  ILE  40          1HG1      ILE  40   7.667   4.181 -14.444
  295   2HG1  ILE  40          2HG1      ILE  40   6.400   3.353 -13.545
  296   1HG2  ILE  40          1HG2      ILE  40   8.665   6.019 -11.819
  297   2HG2  ILE  40          2HG2      ILE  40   9.956   4.818 -11.828
  298   3HG2  ILE  40          3HG2      ILE  40   9.307   5.427 -13.351
  299   1HD1  ILE  40          1HD1      ILE  40   6.424   6.002 -14.436
  300   2HD1  ILE  40          2HD1      ILE  40   5.226   5.219 -13.405
  301   3HD1  ILE  40          3HD1      ILE  40   6.587   6.076 -12.682
  302    H    HIS  41           H        HIS  41   8.516   2.675  -9.839
  303    HA   HIS  41           HA       HIS  41   6.583   0.462  -9.783
  304   1HB   HIS  41          1HB       HIS  41   7.772  -0.277  -7.636
  305   2HB   HIS  41          2HB       HIS  41   8.575  -0.634  -9.162
  306    HD1  HIS  41           HD1      HIS  41  10.841  -0.747  -7.849
  307    HD2  HIS  41           HD2      HIS  41   8.997   2.976  -7.839
  308    HE1  HIS  41           HE1      HIS  41  12.599   0.872  -7.066
  309    H    PHE  42           H        PHE  42   5.340   0.347  -7.766
  310    HA   PHE  42           HA       PHE  42   4.878   3.041  -6.688
  311   1HB   PHE  42          1HB       PHE  42   3.035   0.642  -6.738
  312   2HB   PHE  42          2HB       PHE  42   2.627   2.232  -6.102
  313    HD1  PHE  42           HD1      PHE  42   4.114   3.759  -8.343
  314    HD2  PHE  42           HD2      PHE  42   1.278   0.585  -8.356
  315    HE1  PHE  42           HE1      PHE  42   3.350   4.455 -10.576
  316    HE2  PHE  42           HE2      PHE  42   0.510   1.276 -10.589
  317    HZ   PHE  42           HZ       PHE  42   1.547   3.213 -11.702
  318    H    GLN  43           H        GLN  43   4.712   3.398  -4.485
  319    HA   GLN  43           HA       GLN  43   5.161   1.167  -2.663
  320   1HB   GLN  43          1HB       GLN  43   7.178   3.161  -3.372
  321   2HB   GLN  43          2HB       GLN  43   6.888   3.062  -1.640
  322   1HG   GLN  43          1HG       GLN  43   8.432   1.444  -1.732
  323   2HG   GLN  43          2HG       GLN  43   7.072   0.445  -2.241
  324   1HE2  GLN  43          1HE2      GLN  43   9.945   0.232  -2.824
  325   2HE2  GLN  43          2HE2      GLN  43  10.071   0.226  -4.547
  326    H    GLY  44           H        GLY  44   3.961   1.374  -0.883
  327   1HA   GLY  44          1HA       GLY  44   3.556   3.717   0.582
  328   2HA   GLY  44          2HA       GLY  44   2.206   3.558  -0.531
  329    H    TYR  45           H        TYR  45   1.055   3.485   1.600
  330    HA   TYR  45           HA       TYR  45   0.943   0.703   2.566
  331   1HB   TYR  45          1HB       TYR  45   0.409   1.502   4.783
  332   2HB   TYR  45          2HB       TYR  45   1.902   2.267   4.250
  333    HD1  TYR  45           HD2      TYR  45   1.919   4.652   3.626
  334    HD2  TYR  45           HD1      TYR  45  -1.573   2.791   5.189
  335    HE1  TYR  45           HE2      TYR  45   0.957   6.866   4.096
  336    HE2  TYR  45           HE1      TYR  45  -2.546   5.000   5.663
  337    HH   TYR  45           HH       TYR  45  -1.917   7.260   5.975
  338    H    ILE  46           H        ILE  46  -1.065  -0.196   2.886
  339    HA   ILE  46           HA       ILE  46  -3.392   1.458   2.168
  340    HB   ILE  46           HB       ILE  46  -2.912  -1.379   1.247
  341   1HG1  ILE  46          1HG1      ILE  46  -3.088   1.129  -0.428
  342   2HG1  ILE  46          2HG1      ILE  46  -1.562   0.436   0.110
  343   1HG2  ILE  46          1HG2      ILE  46  -5.181   0.503   0.615
  344   2HG2  ILE  46          2HG2      ILE  46  -4.981  -1.141   0.010
  345   3HG2  ILE  46          3HG2      ILE  46  -5.270  -0.863   1.727
  346   1HD1  ILE  46          1HD1      ILE  46  -3.579  -1.086  -1.512
  347   2HD1  ILE  46          2HD1      ILE  46  -2.261  -0.152  -2.219
  348   3HD1  ILE  46          3HD1      ILE  46  -1.906  -1.524  -1.170
  349    H    GLU  47           H        GLU  47  -4.998   1.364   3.595
  350    HA   GLU  47           HA       GLU  47  -4.913  -0.734   5.646
  351   1HB   GLU  47          1HB       GLU  47  -6.411   1.891   5.678
  352   2HB   GLU  47          2HB       GLU  47  -6.265   0.760   7.015
  353   1HG   GLU  47          1HG       GLU  47  -4.109   1.353   7.470
  354   2HG   GLU  47          2HG       GLU  47  -3.777   1.846   5.811
  355    H    MET  48           H        MET  48  -6.302  -2.354   5.484
  356    HA   MET  48           HA       MET  48  -8.516  -2.237   3.645
  357   1HB   MET  48          1HB       MET  48  -7.449  -4.377   5.479
  358   2HB   MET  48          2HB       MET  48  -8.926  -4.594   4.549
  359   1HG   MET  48          1HG       MET  48  -6.736  -3.652   2.906
  360   2HG   MET  48          2HG       MET  48  -6.353  -5.163   3.727
  361   1HE   MET  48          1HE       MET  48  -8.689  -4.381   0.106
  362   2HE   MET  48          2HE       MET  48  -9.751  -3.858   1.414
  363   3HE   MET  48          3HE       MET  48  -8.111  -3.217   1.298
  364    H    LYS  49           H        LYS  49 -10.591  -3.482   4.615
  365    HA   LYS  49           HA       LYS  49 -12.002  -1.648   6.111
  366   1HB   LYS  49          1HB       LYS  49 -12.614  -3.989   4.854
  367   2HB   LYS  49          2HB       LYS  49 -12.816  -4.447   6.540
  368   1HG   LYS  49          1HG       LYS  49 -14.476  -2.801   6.887
  369   2HG   LYS  49          2HG       LYS  49 -14.117  -2.016   5.347
  370   1HD   LYS  49          1HD       LYS  49 -14.712  -4.649   4.673
  371   2HD   LYS  49          2HD       LYS  49 -15.886  -4.235   5.924
  372   1HE   LYS  49          1HE       LYS  49 -15.358  -2.362   3.648
  373   2HE   LYS  49          2HE       LYS  49 -16.443  -3.736   3.442
  374   1HZ   LYS  49          1HZ       LYS  49 -18.002  -2.822   4.773
  375   2HZ   LYS  49          2HZ       LYS  49 -17.266  -1.377   4.291
  376   3HZ   LYS  49          3HZ       LYS  49 -16.879  -2.064   5.787
  377    H    LYS  50           H        LYS  50 -10.678  -4.735   7.316
  378    HA   LYS  50           HA       LYS  50  -9.592  -3.728   9.666
  379   1HB   LYS  50          1HB       LYS  50 -12.464  -3.998   9.764
  380   2HB   LYS  50          2HB       LYS  50 -11.710  -5.083  10.925
  381   1HG   LYS  50          1HG       LYS  50 -10.707  -3.328  12.093
  382   2HG   LYS  50          2HG       LYS  50 -10.942  -2.191  10.764
  383   1HD   LYS  50          1HD       LYS  50 -13.309  -2.139  11.148
  384   2HD   LYS  50          2HD       LYS  50 -13.194  -3.440  12.334
  385   1HE   LYS  50          1HE       LYS  50 -11.442  -1.585  13.325
  386   2HE   LYS  50          2HE       LYS  50 -12.704  -0.571  12.628
  387   1HZ   LYS  50          1HZ       LYS  50 -12.768  -2.179  14.989
  388   2HZ   LYS  50          2HZ       LYS  50 -14.067  -2.521  13.962
  389   3HZ   LYS  50          3HZ       LYS  50 -13.811  -0.939  14.504
  390    H    ARG  51           H        ARG  51 -11.768  -6.519   9.281
  391    HA   ARG  51           HA       ARG  51  -9.578  -8.285  10.043
  392   1HB   ARG  51          1HB       ARG  51 -12.039  -8.348  10.931
  393   2HB   ARG  51          2HB       ARG  51 -12.359  -9.225   9.441
  394   1HG   ARG  51          1HG       ARG  51 -10.602 -10.855  10.088
  395   2HG   ARG  51          2HG       ARG  51 -10.454 -10.013  11.632
  396   1HD   ARG  51          1HD       ARG  51 -13.093 -11.053  10.652
  397   2HD   ARG  51          2HD       ARG  51 -11.961 -12.087  11.524
  398    HE   ARG  51           HE       ARG  51 -12.270  -9.802  13.049
  399   1HH1  ARG  51          1HH1      ARG  51 -14.283 -12.383  11.863
  400   2HH1  ARG  51          2HH1      ARG  51 -15.384 -12.313  13.199
  401   1HH2  ARG  51          1HH2      ARG  51 -13.713  -9.700  14.813
  402   2HH2  ARG  51          2HH2      ARG  51 -15.060 -10.786  14.876
  403    H    THR  52           H        THR  52  -9.236  -7.127   7.541
  404    HA   THR  52           HA       THR  52  -9.944  -9.228   5.620
  405    HB   THR  52           HB       THR  52  -8.480  -6.880   4.617
  406    HG1  THR  52           HG1      THR  52 -11.171  -6.528   5.462
  407   1HG2  THR  52          1HG2      THR  52  -9.418  -8.418   3.054
  408   2HG2  THR  52          2HG2      THR  52 -10.388  -6.947   2.976
  409   3HG2  THR  52          3HG2      THR  52 -10.992  -8.357   3.846
  410    H    SER  53           H        SER  53  -8.505 -10.784   5.307
  411    HA   SER  53           HA       SER  53  -5.774 -10.528   6.134
  412   1HB   SER  53          1HB       SER  53  -5.682 -12.845   4.877
  413   2HB   SER  53          2HB       SER  53  -6.519 -12.701   6.422
  414    HG   SER  53           HG       SER  53  -7.629 -12.783   3.822
  415    H    LEU  54           H        LEU  54  -4.113 -11.555   4.446
  416    HA   LEU  54           HA       LEU  54  -3.542  -9.602   2.572
  417   1HB   LEU  54          1HB       LEU  54  -1.890 -11.184   3.388
  418   2HB   LEU  54          2HB       LEU  54  -2.724 -12.504   2.571
  419    HG   LEU  54           HG       LEU  54  -2.182 -11.421   0.397
  420   1HD1  LEU  54          1HD1      LEU  54  -0.266  -9.693   1.927
  421   2HD1  LEU  54          2HD1      LEU  54  -1.883  -9.135   1.498
  422   3HD1  LEU  54          3HD1      LEU  54  -0.742  -9.588   0.232
  423   1HD2  LEU  54          1HD2      LEU  54  -0.163 -12.468   2.302
  424   2HD2  LEU  54          2HD2      LEU  54   0.420 -11.775   0.788
  425   3HD2  LEU  54          3HD2      LEU  54  -0.718 -13.124   0.761
  426    H    ALA  55           H        ALA  55  -5.573 -12.419   2.293
  427    HA   ALA  55           HA       ALA  55  -5.734 -12.731  -0.456
  428   1HB   ALA  55          1HB       ALA  55  -7.839 -13.816  -0.097
  429   2HB   ALA  55          2HB       ALA  55  -6.771 -14.220   1.247
  430   3HB   ALA  55          3HB       ALA  55  -8.041 -13.016   1.462
  431    H    GLY  56           H        GLY  56  -7.222 -10.323   1.617
  432   1HA   GLY  56          1HA       GLY  56  -9.048  -9.325  -0.337
  433   2HA   GLY  56          2HA       GLY  56  -8.573  -8.517   1.149
  434    H    MET  57           H        MET  57  -5.836  -8.278   0.756
  435    HA   MET  57           HA       MET  57  -5.757  -6.011  -0.973
  436   1HB   MET  57          1HB       MET  57  -3.589  -7.479   0.533
  437   2HB   MET  57          2HB       MET  57  -3.308  -6.008  -0.388
  438   1HG   MET  57          1HG       MET  57  -5.467  -5.951   1.635
  439   2HG   MET  57          2HG       MET  57  -3.804  -5.999   2.217
  440   1HE   MET  57          1HE       MET  57  -5.454  -3.483  -0.930
  441   2HE   MET  57          2HE       MET  57  -6.399  -4.513   0.145
  442   3HE   MET  57          3HE       MET  57  -6.263  -2.785   0.473
  443    H    LYS  58           H        LYS  58  -4.220  -9.219  -1.079
  444    HA   LYS  58           HA       LYS  58  -2.816  -8.936  -3.454
  445   1HB   LYS  58          1HB       LYS  58  -2.609 -11.273  -3.483
  446   2HB   LYS  58          2HB       LYS  58  -2.803 -10.880  -1.779
  447   1HG   LYS  58          1HG       LYS  58  -5.148 -11.510  -1.880
  448   2HG   LYS  58          2HG       LYS  58  -4.991 -11.859  -3.603
  449   1HD   LYS  58          1HD       LYS  58  -4.893 -13.903  -2.255
  450   2HD   LYS  58          2HD       LYS  58  -3.378 -13.619  -3.115
  451   1HE   LYS  58          1HE       LYS  58  -2.224 -13.137  -1.197
  452   2HE   LYS  58          2HE       LYS  58  -3.655 -12.544  -0.356
  453   1HZ   LYS  58          1HZ       LYS  58  -3.330 -14.524   0.698
  454   2HZ   LYS  58          2HZ       LYS  58  -2.685 -15.292  -0.664
  455   3HZ   LYS  58          3HZ       LYS  58  -4.354 -15.042  -0.545
  456    H    LYS  59           H        LYS  59  -6.218  -9.503  -2.919
  457    HA   LYS  59           HA       LYS  59  -6.991 -10.442  -5.421
  458   1HB   LYS  59          1HB       LYS  59  -8.276  -9.311  -3.097
  459   2HB   LYS  59          2HB       LYS  59  -9.029  -8.704  -4.566
  460   1HG   LYS  59          1HG       LYS  59  -9.727 -10.801  -5.236
  461   2HG   LYS  59          2HG       LYS  59  -8.524 -11.630  -4.245
  462   1HD   LYS  59          1HD       LYS  59  -9.770 -10.719  -2.229
  463   2HD   LYS  59          2HD       LYS  59 -11.056 -10.269  -3.352
  464   1HE   LYS  59          1HE       LYS  59 -10.854 -12.761  -4.117
  465   2HE   LYS  59          2HE       LYS  59 -10.103 -12.981  -2.537
  466   1HZ   LYS  59          1HZ       LYS  59 -12.469 -13.403  -2.432
  467   2HZ   LYS  59          2HZ       LYS  59 -12.808 -11.860  -3.036
  468   3HZ   LYS  59          3HZ       LYS  59 -12.088 -12.033  -1.515
  469    H    LEU  60           H        LEU  60  -6.212  -7.199  -4.355
  470    HA   LEU  60           HA       LEU  60  -7.153  -5.965  -6.791
  471   1HB   LEU  60          1HB       LEU  60  -5.648  -4.951  -4.395
  472   2HB   LEU  60          2HB       LEU  60  -5.968  -3.942  -5.804
  473    HG   LEU  60           HG       LEU  60  -8.448  -4.518  -5.376
  474   1HD1  LEU  60          1HD1      LEU  60  -7.169  -5.874  -3.183
  475   2HD1  LEU  60          2HD1      LEU  60  -8.855  -5.910  -3.697
  476   3HD1  LEU  60          3HD1      LEU  60  -8.296  -4.652  -2.594
  477   1HD2  LEU  60          1HD2      LEU  60  -6.806  -2.429  -4.622
  478   2HD2  LEU  60          2HD2      LEU  60  -7.661  -2.845  -3.136
  479   3HD2  LEU  60          3HD2      LEU  60  -8.569  -2.435  -4.592
  480    H    ILE  61           H        ILE  61  -4.064  -6.911  -5.377
  481    HA   ILE  61           HA       ILE  61  -2.849  -6.732  -8.027
  482    HB   ILE  61           HB       ILE  61  -1.596  -5.466  -5.587
  483   1HG1  ILE  61          1HG1      ILE  61  -1.735  -3.453  -7.318
  484   2HG1  ILE  61          2HG1      ILE  61  -3.099  -4.384  -7.926
  485   1HG2  ILE  61          1HG2      ILE  61   0.108  -4.696  -7.272
  486   2HG2  ILE  61          2HG2      ILE  61   0.128  -6.420  -6.905
  487   3HG2  ILE  61          3HG2      ILE  61  -0.606  -5.846  -8.402
  488   1HD1  ILE  61          1HD1      ILE  61  -4.238  -3.168  -6.426
  489   2HD1  ILE  61          2HD1      ILE  61  -3.652  -4.387  -5.294
  490   3HD1  ILE  61          3HD1      ILE  61  -2.810  -2.844  -5.443
  491    HA   PRO  62           HA       PRO  62  -1.759 -10.630  -5.807
  492   1HB   PRO  62          1HB       PRO  62  -2.038 -12.208  -7.998
  493   2HB   PRO  62          2HB       PRO  62  -3.393 -11.771  -6.950
  494   1HG   PRO  62          1HG       PRO  62  -2.569 -10.587  -9.573
  495   2HG   PRO  62          2HG       PRO  62  -4.193 -10.996  -8.991
  496   1HD   PRO  62          1HD       PRO  62  -3.229  -8.466  -8.962
  497   2HD   PRO  62          2HD       PRO  62  -4.367  -9.069  -7.739
  498    H    GLY  63           H        GLY  63  -0.452  -8.728  -8.268
  499   1HA   GLY  63          1HA       GLY  63   1.916 -10.467  -8.516
  500   2HA   GLY  63          2HA       GLY  63   1.459  -9.221  -9.668
  501    H    ALA  64           H        ALA  64   1.637  -9.022  -6.135
  502    HA   ALA  64           HA       ALA  64   3.988  -7.302  -6.334
  503   1HB   ALA  64          1HB       ALA  64   1.488  -6.392  -4.917
  504   2HB   ALA  64          2HB       ALA  64   2.999  -5.499  -5.089
  505   3HB   ALA  64          3HB       ALA  64   2.002  -5.825  -6.507
  506    H    HIS  65           H        HIS  65   4.929  -6.814  -4.195
  507    HA   HIS  65           HA       HIS  65   4.663  -9.138  -2.447
  508   1HB   HIS  65          1HB       HIS  65   6.900  -8.211  -3.370
  509   2HB   HIS  65          2HB       HIS  65   6.723  -6.971  -2.132
  510    HD1  HIS  65           HD1      HIS  65   8.161 -10.204  -2.647
  511    HD2  HIS  65           HD2      HIS  65   6.390  -8.251   0.564
  512    HE1  HIS  65           HE1      HIS  65   8.916 -11.455  -0.600
  513    H    PHE  66           H        PHE  66   3.401  -9.017  -0.723
  514    HA   PHE  66           HA       PHE  66   2.926  -6.383   0.499
  515   1HB   PHE  66          1HB       PHE  66   1.217  -8.774   0.073
  516   2HB   PHE  66          2HB       PHE  66   0.977  -7.887   1.575
  517    HD1  PHE  66           HD1      PHE  66   1.003  -7.544  -2.108
  518    HD2  PHE  66           HD2      PHE  66  -0.214  -5.870   1.610
  519    HE1  PHE  66           HE1      PHE  66  -0.389  -5.906  -3.306
  520    HE2  PHE  66           HE2      PHE  66  -1.609  -4.230   0.420
  521    HZ   PHE  66           HZ       PHE  66  -1.699  -4.247  -2.042
  522    H    GLU  67           H        GLU  67   2.704  -6.304   2.837
  523    HA   GLU  67           HA       GLU  67   3.786  -8.510   4.371
  524   1HB   GLU  67          1HB       GLU  67   5.418  -6.253   3.560
  525   2HB   GLU  67          2HB       GLU  67   5.311  -6.369   5.311
  526   1HG   GLU  67          1HG       GLU  67   6.126  -8.637   5.254
  527   2HG   GLU  67          2HG       GLU  67   6.128  -8.622   3.491
  528    H    LYS  68           H        LYS  68   2.326  -8.659   5.936
  529    HA   LYS  68           HA       LYS  68   1.439  -6.180   7.263
  530   1HB   LYS  68          1HB       LYS  68  -0.318  -7.412   5.922
  531   2HB   LYS  68          2HB       LYS  68  -0.157  -8.736   7.068
  532   1HG   LYS  68          1HG       LYS  68  -0.540  -6.512   8.669
  533   2HG   LYS  68          2HG       LYS  68  -1.621  -6.250   7.298
  534   1HD   LYS  68          1HD       LYS  68  -2.377  -8.665   7.664
  535   2HD   LYS  68          2HD       LYS  68  -1.559  -8.557   9.224
  536   1HE   LYS  68          1HE       LYS  68  -2.994  -6.845   9.971
  537   2HE   LYS  68          2HE       LYS  68  -3.603  -6.537   8.345
  538   1HZ   LYS  68          1HZ       LYS  68  -4.303  -8.680  10.217
  539   2HZ   LYS  68          2HZ       LYS  68  -4.373  -9.013   8.561
  540   3HZ   LYS  68          3HZ       LYS  68  -5.304  -7.759   9.211
  541    H    ARG  69           H        ARG  69   3.640  -8.262   7.766
  542    HA   ARG  69           HA       ARG  69   2.974  -9.654  10.136
  543   1HB   ARG  69          1HB       ARG  69   5.194  -9.475   8.424
  544   2HB   ARG  69          2HB       ARG  69   5.778  -8.976  10.006
  545   1HG   ARG  69          1HG       ARG  69   4.809 -11.070  10.947
  546   2HG   ARG  69          2HG       ARG  69   4.438 -11.574   9.297
  547   1HD   ARG  69          1HD       ARG  69   6.471 -12.525   9.367
  548   2HD   ARG  69          2HD       ARG  69   7.056 -10.889   9.067
  549    HE   ARG  69           HE       ARG  69   6.738 -11.289  11.837
  550   1HH1  ARG  69          1HH1      ARG  69   8.775 -12.244   9.180
  551   2HH1  ARG  69          2HH1      ARG  69  10.171 -12.501  10.173
  552   1HH2  ARG  69          1HH2      ARG  69   8.570 -11.624  13.155
  553   2HH2  ARG  69          2HH2      ARG  69  10.054 -12.149  12.433
  554    H    ARG  70           H        ARG  70   3.341  -6.384   9.581
  555    HA   ARG  70           HA       ARG  70   3.310  -4.585  10.980
  556   1HB   ARG  70          1HB       ARG  70   2.066  -6.418  12.456
  557   2HB   ARG  70          2HB       ARG  70   3.519  -6.262  13.433
  558   1HG   ARG  70          1HG       ARG  70   3.113  -3.963  13.833
  559   2HG   ARG  70          2HG       ARG  70   1.838  -3.910  12.614
  560   1HD   ARG  70          1HD       ARG  70   0.345  -5.101  13.947
  561   2HD   ARG  70          2HD       ARG  70   1.628  -5.741  14.974
  562    HE   ARG  70           HE       ARG  70   1.569  -2.948  15.229
  563   1HH1  ARG  70          1HH1      ARG  70  -0.341  -5.746  16.030
  564   2HH1  ARG  70          2HH1      ARG  70  -1.064  -5.015  17.424
  565   1HH2  ARG  70          1HH2      ARG  70   0.624  -1.974  17.062
  566   2HH2  ARG  70          2HH2      ARG  70  -0.515  -2.869  18.009
  567    H    GLY  71           H        GLY  71   5.749  -5.699   9.974
  568   1HA   GLY  71          1HA       GLY  71   7.699  -5.533  12.113
  569   2HA   GLY  71          2HA       GLY  71   8.035  -5.813  10.411
  570    H    THR  72           H        THR  72   5.973  -3.205  10.740
  571    HA   THR  72           HA       THR  72   7.924  -1.178  11.311
  572    HB   THR  72           HB       THR  72   6.857  -1.126   8.500
  573    HG1  THR  72           HG1      THR  72   8.650  -2.193   7.805
  574   1HG2  THR  72          1HG2      THR  72   8.078   0.745   8.274
  575   2HG2  THR  72          2HG2      THR  72   9.463   0.048   9.114
  576   3HG2  THR  72          3HG2      THR  72   8.137   0.756  10.036
  577    H    GLN  73           H        GLN  73   5.255  -1.977  12.177
  578    HA   GLN  73           HA       GLN  73   3.168  -0.477  11.205
  579   1HB   GLN  73          1HB       GLN  73   2.370  -0.446  13.644
  580   2HB   GLN  73          2HB       GLN  73   2.641  -2.014  12.895
  581   1HG   GLN  73          1HG       GLN  73   4.416  -2.498  14.215
  582   2HG   GLN  73          2HG       GLN  73   4.910  -0.813  14.362
  583   1HE2  GLN  73          1HE2      GLN  73   4.609  -2.847  16.422
  584   2HE2  GLN  73          2HE2      GLN  73   3.469  -2.217  17.557
  585    H    GLY  74           H        GLY  74   2.578   1.615  11.219
  586   1HA   GLY  74          1HA       GLY  74   2.499   3.832  11.979
  587   2HA   GLY  74          2HA       GLY  74   3.832   3.482  13.070
  588    H    GLU  75           H        GLU  75   5.978   3.110  11.997
  589    HA   GLU  75           HA       GLU  75   6.709   5.344  10.497
  590   1HB   GLU  75          1HB       GLU  75   8.065   2.717  11.038
  591   2HB   GLU  75          2HB       GLU  75   8.814   3.925  10.004
  592   1HG   GLU  75          1HG       GLU  75   9.453   5.165  11.734
  593   2HG   GLU  75          2HG       GLU  75   7.878   5.037  12.517
  594    H    ALA  76           H        ALA  76   5.499   2.254   9.501
  595    HA   ALA  76           HA       ALA  76   6.382   2.382   6.791
  596   1HB   ALA  76          1HB       ALA  76   4.497   0.673   8.333
  597   2HB   ALA  76          2HB       ALA  76   4.402   0.661   6.571
  598   3HB   ALA  76          3HB       ALA  76   5.909   0.222   7.377
  599    H    ARG  77           H        ARG  77   4.179   4.215   8.446
  600    HA   ARG  77           HA       ARG  77   2.225   4.468   6.321
  601   1HB   ARG  77          1HB       ARG  77   1.704   4.628   8.809
  602   2HB   ARG  77          2HB       ARG  77   2.474   6.209   8.770
  603   1HG   ARG  77          1HG       ARG  77   0.841   6.896   7.027
  604   2HG   ARG  77          2HG       ARG  77   0.023   5.348   7.252
  605   1HD   ARG  77          1HD       ARG  77   0.249   6.277   9.819
  606   2HD   ARG  77          2HD       ARG  77  -0.020   7.760   8.904
  607    HE   ARG  77           HE       ARG  77  -1.851   5.669   8.210
  608   1HH1  ARG  77          1HH1      ARG  77  -1.195   8.234  10.471
  609   2HH1  ARG  77          2HH1      ARG  77  -2.857   8.451  10.907
  610   1HH2  ARG  77          1HH2      ARG  77  -4.043   5.946   8.776
  611   2HH2  ARG  77          2HH2      ARG  77  -4.477   7.149   9.943
  612    H    ALA  78           H        ALA  78   5.267   5.685   6.917
  613    HA   ALA  78           HA       ALA  78   4.835   7.850   4.995
  614   1HB   ALA  78          1HB       ALA  78   5.938   8.158   7.756
  615   2HB   ALA  78          2HB       ALA  78   6.493   9.215   6.458
  616   3HB   ALA  78          3HB       ALA  78   4.783   9.171   6.889
  617    H    TYR  79           H        TYR  79   7.231   6.018   6.876
  618    HA   TYR  79           HA       TYR  79   9.370   6.566   5.064
  619   1HB   TYR  79          1HB       TYR  79   9.732   6.036   7.457
  620   2HB   TYR  79          2HB       TYR  79   9.156   4.399   7.164
  621    HD1  TYR  79           HD1      TYR  79  11.396   6.445   5.016
  622    HD2  TYR  79           HD2      TYR  79  11.052   3.097   7.620
  623    HE1  TYR  79           HE1      TYR  79  13.680   5.754   4.420
  624    HE2  TYR  79           HE2      TYR  79  13.335   2.398   7.033
  625    HH   TYR  79           HH       TYR  79  14.884   2.897   4.759
  626    H    SER  80           H        SER  80   6.696   4.610   4.820
  627    HA   SER  80           HA       SER  80   7.505   2.206   3.783
  628   1HB   SER  80          1HB       SER  80   5.241   2.193   3.776
  629   2HB   SER  80          2HB       SER  80   5.139   3.927   3.471
  630    HG   SER  80           HG       SER  80   5.697   1.916   1.545
  631    H    MET  81           H        MET  81   7.616   5.358   2.271
  632    HA   MET  81           HA       MET  81   8.537   4.182  -0.247
  633   1HB   MET  81          1HB       MET  81   8.068   7.106   0.322
  634   2HB   MET  81          2HB       MET  81   8.173   6.315  -1.245
  635   1HG   MET  81          1HG       MET  81   5.959   6.262  -1.227
  636   2HG   MET  81          2HG       MET  81   6.096   4.999  -0.006
  637   1HE   MET  81          1HE       MET  81   3.768   6.406  -0.536
  638   2HE   MET  81          2HE       MET  81   3.148   6.710   1.087
  639   3HE   MET  81          3HE       MET  81   3.529   8.063   0.020
  640    H    LYS  82           H        LYS  82  10.567   4.491  -1.063
  641    HA   LYS  82           HA       LYS  82  12.592   5.329   0.843
  642   1HB   LYS  82          1HB       LYS  82  12.576   3.808  -1.722
  643   2HB   LYS  82          2HB       LYS  82  14.066   4.611  -1.246
  644   1HG   LYS  82          1HG       LYS  82  14.432   3.208   0.499
  645   2HG   LYS  82          2HG       LYS  82  12.712   2.949   0.796
  646   1HD   LYS  82          1HD       LYS  82  12.576   1.233  -0.689
  647   2HD   LYS  82          2HD       LYS  82  13.800   1.919  -1.759
  648   1HE   LYS  82          1HE       LYS  82  14.878   0.063  -0.892
  649   2HE   LYS  82          2HE       LYS  82  15.441   1.357   0.165
  650   1HZ   LYS  82          1HZ       LYS  82  13.637  -0.864   0.745
  651   2HZ   LYS  82          2HZ       LYS  82  13.325   0.605   1.523
  652   3HZ   LYS  82          3HZ       LYS  82  14.825  -0.154   1.718
  653    H    GLU  83           H        GLU  83  13.505   7.272   0.854
  654    HA   GLU  83           HA       GLU  83  12.746   9.321  -0.920
  655   1HB   GLU  83          1HB       GLU  83  14.922   9.078   1.140
  656   2HB   GLU  83          2HB       GLU  83  14.772  10.518   0.144
  657   1HG   GLU  83          1HG       GLU  83  12.726  11.104   1.075
  658   2HG   GLU  83          2HG       GLU  83  12.440   9.481   1.702
  659    H    ASP  84           H        ASP  84  15.554   7.203  -0.814
  660    HA   ASP  84           HA       ASP  84  17.162   8.485  -2.699
  661   1HB   ASP  84          1HB       ASP  84  17.453   6.274  -1.180
  662   2HB   ASP  84          2HB       ASP  84  17.145   5.522  -2.743
  663    H    THR  85           H        THR  85  14.247   6.698  -3.094
  664    HA   THR  85           HA       THR  85  14.616   6.721  -6.019
  665    HB   THR  85           HB       THR  85  12.721   4.974  -5.966
  666    HG1  THR  85           HG1      THR  85  13.691   4.304  -3.419
  667   1HG2  THR  85          1HG2      THR  85  14.274   3.199  -5.903
  668   2HG2  THR  85          2HG2      THR  85  15.319   4.047  -4.763
  669   3HG2  THR  85          3HG2      THR  85  15.201   4.602  -6.433
  670    H    ARG  86           H        ARG  86  13.307   8.538  -3.758
  671    HA   ARG  86           HA       ARG  86  10.605   8.816  -4.200
  672   1HB   ARG  86          1HB       ARG  86  12.375  10.144  -2.691
  673   2HB   ARG  86          2HB       ARG  86  12.181  11.324  -3.980
  674   1HG   ARG  86          1HG       ARG  86  10.308  12.039  -3.052
  675   2HG   ARG  86          2HG       ARG  86   9.600  10.431  -3.221
  676   1HD   ARG  86          1HD       ARG  86  10.057   9.852  -1.064
  677   2HD   ARG  86          2HD       ARG  86  11.497  10.866  -0.983
  678    HE   ARG  86           HE       ARG  86  10.198  12.509  -0.093
  679   1HH1  ARG  86          1HH1      ARG  86   8.149  10.344  -1.891
  680   2HH1  ARG  86          2HH1      ARG  86   6.683  11.149  -1.442
  681   1HH2  ARG  86          1HH2      ARG  86   8.275  13.578   0.506
  682   2HH2  ARG  86          2HH2      ARG  86   6.755  12.989  -0.079
  683    H    LEU  87           H        LEU  87   9.447   9.205  -5.959
  684    HA   LEU  87           HA       LEU  87  10.650  10.813  -8.114
  685   1HB   LEU  87          1HB       LEU  87   9.676   8.131  -8.181
  686   2HB   LEU  87          2HB       LEU  87   8.641   9.139  -9.190
  687    HG   LEU  87           HG       LEU  87  11.615   8.728  -9.476
  688   1HD1  LEU  87          1HD1      LEU  87   9.255   7.947 -11.178
  689   2HD1  LEU  87          2HD1      LEU  87  10.353   6.869 -10.318
  690   3HD1  LEU  87          3HD1      LEU  87  10.940   7.819 -11.683
  691   1HD2  LEU  87          1HD2      LEU  87   9.735  10.605 -10.890
  692   2HD2  LEU  87          2HD2      LEU  87  11.296  10.122 -11.551
  693   3HD2  LEU  87          3HD2      LEU  87  11.219  10.999 -10.023
  694    H    GLU  88           H        GLU  88   7.474   9.553  -7.074
  695    HA   GLU  88           HA       GLU  88   6.398  12.272  -7.359
  696   1HB   GLU  88          1HB       GLU  88   5.846  10.226  -9.141
  697   2HB   GLU  88          2HB       GLU  88   4.473  10.189  -8.045
  698   1HG   GLU  88          1HG       GLU  88   3.924  11.604  -9.875
  699   2HG   GLU  88          2HG       GLU  88   4.156  12.618  -8.452
  700    H    GLY  89           H        GLY  89   4.052  12.287  -6.409
  701   1HA   GLY  89          1HA       GLY  89   2.573  11.661  -4.695
  702   2HA   GLY  89          2HA       GLY  89   3.752  10.483  -4.139
  703    HA   PRO  90           HA       PRO  90   3.057  10.188  -2.203
  704   1HB   PRO  90          1HB       PRO  90   1.571  10.890  -0.042
  705   2HB   PRO  90          2HB       PRO  90   3.284  10.467   0.067
  706   1HG   PRO  90          1HG       PRO  90   2.000  13.171  -0.006
  707   2HG   PRO  90          2HG       PRO  90   3.329  12.590   1.015
  708   1HD   PRO  90          1HD       PRO  90   3.742  14.101  -1.194
  709   2HD   PRO  90          2HD       PRO  90   4.897  12.867  -0.651
  710    H    TRP  91           H        TRP  91   0.749   9.483  -2.020
  711    HA   TRP  91           HA       TRP  91  -1.164  11.433  -3.078
  712   1HB   TRP  91          1HB       TRP  91  -0.399   8.819  -4.367
  713   2HB   TRP  91          2HB       TRP  91  -1.960   9.577  -4.669
  714    HD1  TRP  91           HD1      TRP  91  -0.904  12.611  -4.847
  715    HE1  TRP  91           HE1      TRP  91   0.417  13.340  -6.932
  716    HE3  TRP  91           HE3      TRP  91   0.634   8.017  -6.481
  717    HZ2  TRP  91           HZ2      TRP  91   1.913  12.129  -8.997
  718    HZ3  TRP  91           HZ3      TRP  91   2.006   7.890  -8.520
  719    HH2  TRP  91           HH2      TRP  91   2.631   9.904  -9.750
  720    H    GLU  92           H        GLU  92  -3.138  11.260  -2.198
  721    HA   GLU  92           HA       GLU  92  -3.721   8.839  -0.621
  722   1HB   GLU  92          1HB       GLU  92  -4.322  11.735  -0.054
  723   2HB   GLU  92          2HB       GLU  92  -5.194  10.434   0.744
  724   1HG   GLU  92          1HG       GLU  92  -3.422   9.835   2.023
  725   2HG   GLU  92          2HG       GLU  92  -2.240  10.313   0.806
  726    H    TYR  93           H        TYR  93  -5.668   7.866  -0.876
  727    HA   TYR  93           HA       TYR  93  -7.723   9.198  -2.477
  728   1HB   TYR  93          1HB       TYR  93  -6.438   6.550  -3.136
  729   2HB   TYR  93          2HB       TYR  93  -8.021   7.010  -3.754
  730    HD1  TYR  93           HD1      TYR  93  -8.210   9.037  -5.229
  731    HD2  TYR  93           HD2      TYR  93  -4.454   7.368  -4.128
  732    HE1  TYR  93           HE1      TYR  93  -7.138  10.235  -7.090
  733    HE2  TYR  93           HE2      TYR  93  -3.372   8.563  -5.985
  734    HH   TYR  93           HH       TYR  93  -3.852   9.620  -8.022
  735    H    GLY  94           H        GLY  94  -9.813   8.031  -2.415
  736   1HA   GLY  94          1HA       GLY  94 -11.391   6.648  -1.384
  737   2HA   GLY  94          2HA       GLY  94 -10.145   6.087  -0.280
  738    H    GLU  95           H        GLU  95 -11.433   6.344   1.546
  739    HA   GLU  95           HA       GLU  95 -12.872   8.670   2.189
  740   1HB   GLU  95          1HB       GLU  95 -13.375   6.644   3.350
  741   2HB   GLU  95          2HB       GLU  95 -11.718   6.481   3.913
  742   1HG   GLU  95          1HG       GLU  95 -12.811   8.988   4.776
  743   2HG   GLU  95          2HG       GLU  95 -13.872   7.661   5.246
  Start of MODEL   13
    1   1H    ALA   2          1H        ALA   2 -14.337   1.034  20.114
    2    HA   ALA   2           HA       ALA   2 -13.716   0.376  17.414
    3   1HB   ALA   2          1HB       ALA   2 -12.756   2.735  17.407
    4   2HB   ALA   2          2HB       ALA   2 -14.474   2.567  17.775
    5   3HB   ALA   2          3HB       ALA   2 -13.316   2.844  19.076
    6    H    ARG   3           H        ARG   3 -12.020  -0.866  16.931
    7    HA   ARG   3           HA       ARG   3  -9.500  -0.440  18.388
    8   1HB   ARG   3          1HB       ARG   3 -10.686  -2.825  17.010
    9   2HB   ARG   3          2HB       ARG   3  -8.945  -2.711  17.226
   10   1HG   ARG   3          1HG       ARG   3  -9.325  -2.435  19.667
   11   2HG   ARG   3          2HG       ARG   3 -11.042  -2.731  19.383
   12   1HD   ARG   3          1HD       ARG   3 -10.739  -4.943  19.097
   13   2HD   ARG   3          2HD       ARG   3  -9.236  -4.721  18.202
   14    HE   ARG   3           HE       ARG   3  -8.769  -4.105  20.893
   15   1HH1  ARG   3          1HH1      ARG   3  -9.526  -6.847  18.885
   16   2HH1  ARG   3          2HH1      ARG   3  -8.735  -7.988  19.921
   17   1HH2  ARG   3          1HH2      ARG   3  -7.724  -5.598  22.264
   18   2HH2  ARG   3          2HH2      ARG   3  -7.710  -7.277  21.842
   19    H    GLN   4           H        GLN   4  -7.508  -0.501  17.173
   20    HA   GLN   4           HA       GLN   4  -7.830   0.721  14.532
   21   1HB   GLN   4          1HB       GLN   4  -5.597   1.579  14.805
   22   2HB   GLN   4          2HB       GLN   4  -6.508   1.915  16.271
   23   1HG   GLN   4          1HG       GLN   4  -5.394  -0.462  16.908
   24   2HG   GLN   4          2HG       GLN   4  -4.155   0.212  15.851
   25   1HE2  GLN   4          1HE2      GLN   4  -4.209  -0.295  18.768
   26   2HE2  GLN   4          2HE2      GLN   4  -3.804   1.217  19.499
   27    H    VAL   5           H        VAL   5  -6.418   0.101  12.783
   28    HA   VAL   5           HA       VAL   5  -5.530  -2.705  12.964
   29    HB   VAL   5           HB       VAL   5  -6.126  -3.010  10.626
   30   1HG1  VAL   5          1HG1      VAL   5  -8.716  -2.207  11.074
   31   2HG1  VAL   5          2HG1      VAL   5  -8.001  -3.731  11.605
   32   3HG1  VAL   5          3HG1      VAL   5  -8.060  -2.353  12.704
   33   1HG2  VAL   5          1HG2      VAL   5  -6.102  -0.200  10.560
   34   2HG2  VAL   5          2HG2      VAL   5  -6.425  -1.309   9.227
   35   3HG2  VAL   5          3HG2      VAL   5  -7.758  -0.692  10.203
   36    H    ILE   6           H        ILE   6  -3.777  -3.306  11.527
   37    HA   ILE   6           HA       ILE   6  -1.788  -1.197  11.368
   38    HB   ILE   6           HB       ILE   6  -1.497  -4.123  10.679
   39   1HG1  ILE   6          1HG1      ILE   6  -0.193  -3.923  12.991
   40   2HG1  ILE   6          2HG1      ILE   6  -1.354  -2.627  13.255
   41   1HG2  ILE   6          1HG2      ILE   6   0.517  -1.931  11.142
   42   2HG2  ILE   6          2HG2      ILE   6   0.922  -3.645  11.052
   43   3HG2  ILE   6          3HG2      ILE   6   0.230  -2.828   9.651
   44   1HD1  ILE   6          1HD1      ILE   6  -2.815  -4.818  12.283
   45   2HD1  ILE   6          2HD1      ILE   6  -1.708  -5.443  13.507
   46   3HD1  ILE   6          3HD1      ILE   6  -2.823  -4.137  13.910
   47    H    CYS   7           H        CYS   7  -0.646  -0.640   9.484
   48    HA   CYS   7           HA       CYS   7  -2.247  -0.654   7.100
   49   1HB   CYS   7          1HB       CYS   7  -0.627   0.840   6.188
   50   2HB   CYS   7          2HB       CYS   7  -0.826   1.282   7.880
   51    HG   CYS   7           HG       CYS   7   1.735   1.444   8.114
   52    H    TRP   8           H        TRP   8  -1.505  -1.375   5.010
   53    HA   TRP   8           HA       TRP   8   0.118  -3.818   5.220
   54   1HB   TRP   8          1HB       TRP   8  -1.996  -2.997   3.221
   55   2HB   TRP   8          2HB       TRP   8  -0.996  -4.437   3.048
   56    HD1  TRP   8           HD1      TRP   8  -3.397  -2.969   5.735
   57    HE1  TRP   8           HE1      TRP   8  -4.709  -4.928   6.767
   58    HE3  TRP   8           HE3      TRP   8  -1.228  -6.833   3.185
   59    HZ2  TRP   8           HZ2      TRP   8  -4.810  -7.739   6.532
   60    HZ3  TRP   8           HZ3      TRP   8  -1.989  -9.126   3.648
   61    HH2  TRP   8           HH2      TRP   8  -3.743  -9.568   5.288
   62    H    CYS   9           H        CYS   9   2.145  -3.603   4.561
   63    HA   CYS   9           HA       CYS   9   2.804  -1.574   2.558
   64   1HB   CYS   9          1HB       CYS   9   5.166  -2.040   3.234
   65   2HB   CYS   9          2HB       CYS   9   4.150  -1.466   4.551
   66    HG   CYS   9           HG       CYS   9   6.132  -3.755   4.927
   67    H    PHE  10           H        PHE  10   2.957  -2.162   0.508
   68    HA   PHE  10           HA       PHE  10   4.045  -4.815  -0.129
   69   1HB   PHE  10          1HB       PHE  10   2.338  -5.363  -1.596
   70   2HB   PHE  10          2HB       PHE  10   1.447  -4.531  -0.326
   71    HD1  PHE  10           HD2      PHE  10   0.736  -2.172  -0.672
   72    HD2  PHE  10           HD1      PHE  10   2.411  -4.525  -3.798
   73    HE1  PHE  10           HE2      PHE  10  -0.167  -0.600  -2.335
   74    HE2  PHE  10           HE1      PHE  10   1.512  -2.956  -5.466
   75    HZ   PHE  10           HZ       PHE  10   0.220  -0.991  -4.736
   76    H    THR  11           H        THR  11   4.774  -4.972  -2.420
   77    HA   THR  11           HA       THR  11   5.598  -2.373  -3.522
   78    HB   THR  11           HB       THR  11   7.440  -4.763  -3.383
   79    HG1  THR  11           HG1      THR  11   8.511  -3.521  -1.740
   80   1HG2  THR  11          1HG2      THR  11   7.549  -2.099  -4.618
   81   2HG2  THR  11          2HG2      THR  11   8.439  -3.570  -5.014
   82   3HG2  THR  11          3HG2      THR  11   8.982  -2.540  -3.689
   83    H    LEU  12           H        LEU  12   5.251  -2.178  -5.643
   84    HA   LEU  12           HA       LEU  12   4.770  -4.633  -7.201
   85   1HB   LEU  12          1HB       LEU  12   2.682  -3.589  -7.014
   86   2HB   LEU  12          2HB       LEU  12   3.370  -1.981  -7.234
   87    HG   LEU  12           HG       LEU  12   3.630  -2.317  -9.569
   88   1HD1  LEU  12          1HD1      LEU  12   2.561  -4.760 -10.239
   89   2HD1  LEU  12          2HD1      LEU  12   3.551  -5.128  -8.827
   90   3HD1  LEU  12          3HD1      LEU  12   4.275  -4.345 -10.232
   91   1HD2  LEU  12          1HD2      LEU  12   1.020  -3.060  -8.367
   92   2HD2  LEU  12          2HD2      LEU  12   1.209  -3.253 -10.110
   93   3HD2  LEU  12          3HD2      LEU  12   1.456  -1.672  -9.365
   94    H    ASN  13           H        ASN  13   6.068  -4.941  -8.884
   95    HA   ASN  13           HA       ASN  13   7.691  -2.675  -9.823
   96   1HB   ASN  13          1HB       ASN  13   8.251  -5.616 -10.239
   97   2HB   ASN  13          2HB       ASN  13   9.349  -4.268 -10.522
   98   1HD2  ASN  13          1HD2      ASN  13  10.031  -3.031  -8.651
   99   2HD2  ASN  13          2HD2      ASN  13  10.187  -3.829  -7.126
  100    H    ASN  14           H        ASN  14   7.688  -2.075 -11.929
  101    HA   ASN  14           HA       ASN  14   6.834  -1.777 -14.022
  102   1HB   ASN  14          1HB       ASN  14   8.297  -3.810 -14.302
  103   2HB   ASN  14          2HB       ASN  14   6.849  -4.798 -14.130
  104   1HD2  ASN  14          1HD2      ASN  14   5.718  -5.243 -15.890
  105   2HD2  ASN  14          2HD2      ASN  14   5.900  -4.469 -17.424
  106    HA   PRO  15           HA       PRO  15   2.514  -2.834 -12.557
  107   1HB   PRO  15          1HB       PRO  15   1.658  -0.264 -12.378
  108   2HB   PRO  15          2HB       PRO  15   2.453  -1.106 -11.043
  109   1HG   PRO  15          1HG       PRO  15   3.603   0.833 -13.013
  110   2HG   PRO  15          2HG       PRO  15   3.863   0.730 -11.262
  111   1HD   PRO  15          1HD       PRO  15   5.644  -0.236 -13.059
  112   2HD   PRO  15          2HD       PRO  15   5.400  -0.977 -11.464
  113    H    LEU  16           H        LEU  16   0.782  -2.977 -13.908
  114    HA   LEU  16           HA       LEU  16   1.159  -2.025 -16.631
  115   1HB   LEU  16          1HB       LEU  16  -0.705  -3.970 -15.321
  116   2HB   LEU  16          2HB       LEU  16  -1.022  -3.373 -16.949
  117    HG   LEU  16           HG       LEU  16   1.679  -4.462 -16.523
  118   1HD1  LEU  16          1HD1      LEU  16  -0.786  -6.152 -16.236
  119   2HD1  LEU  16          2HD1      LEU  16   0.639  -6.097 -15.199
  120   3HD1  LEU  16          3HD1      LEU  16   0.746  -6.810 -16.809
  121   1HD2  LEU  16          1HD2      LEU  16  -0.471  -4.610 -18.614
  122   2HD2  LEU  16          2HD2      LEU  16   0.970  -5.625 -18.685
  123   3HD2  LEU  16          3HD2      LEU  16   1.126  -3.868 -18.720
  124    H    SER  17           H        SER  17  -0.255  -0.876 -13.861
  125    HA   SER  17           HA       SER  17  -1.445   1.336 -15.079
  126   1HB   SER  17          1HB       SER  17  -3.875   0.604 -14.261
  127   2HB   SER  17          2HB       SER  17  -3.298   0.245 -15.888
  128    HG   SER  17           HG       SER  17  -2.909  -1.557 -13.750
  129    HA   PRO  18           HA       PRO  18  -1.361   2.824 -10.954
  130   1HB   PRO  18          1HB       PRO  18  -3.408   4.607 -10.931
  131   2HB   PRO  18          2HB       PRO  18  -1.891   4.897 -11.790
  132   1HG   PRO  18          1HG       PRO  18  -4.519   3.940 -12.857
  133   2HG   PRO  18          2HG       PRO  18  -3.401   5.133 -13.543
  134   1HD   PRO  18          1HD       PRO  18  -3.525   2.577 -14.426
  135   2HD   PRO  18          2HD       PRO  18  -2.018   3.516 -14.427
  136    H    LEU  19           H        LEU  19  -2.347   2.702  -8.910
  137    HA   LEU  19           HA       LEU  19  -4.280   0.604  -8.638
  138   1HB   LEU  19          1HB       LEU  19  -3.306   2.426  -6.456
  139   2HB   LEU  19          2HB       LEU  19  -3.933   0.786  -6.304
  140    HG   LEU  19           HG       LEU  19  -1.310   1.507  -7.609
  141   1HD1  LEU  19          1HD1      LEU  19  -1.532   1.917  -5.097
  142   2HD1  LEU  19          2HD1      LEU  19  -0.208   0.889  -5.643
  143   3HD1  LEU  19          3HD1      LEU  19  -1.658   0.164  -4.949
  144   1HD2  LEU  19          1HD2      LEU  19  -1.508  -0.540  -8.469
  145   2HD2  LEU  19          2HD2      LEU  19  -2.900  -0.922  -7.456
  146   3HD2  LEU  19          3HD2      LEU  19  -1.266  -1.136  -6.827
  147    H    SER  20           H        SER  20  -6.136   0.945  -7.021
  148    HA   SER  20           HA       SER  20  -7.381   3.570  -7.213
  149   1HB   SER  20          1HB       SER  20  -8.300   1.163  -8.687
  150   2HB   SER  20          2HB       SER  20  -9.547   2.124  -7.892
  151    HG   SER  20           HG       SER  20  -8.833   2.675 -10.160
  152    H    LEU  21           H        LEU  21  -9.235   3.807  -5.810
  153    HA   LEU  21           HA       LEU  21  -8.860   2.694  -3.274
  154   1HB   LEU  21          1HB       LEU  21  -9.958   4.773  -3.419
  155   2HB   LEU  21          2HB       LEU  21 -11.167   4.144  -4.536
  156    HG   LEU  21           HG       LEU  21 -12.027   2.732  -2.631
  157   1HD1  LEU  21          1HD1      LEU  21  -9.700   3.669  -1.381
  158   2HD1  LEU  21          2HD1      LEU  21 -10.986   2.692  -0.675
  159   3HD1  LEU  21          3HD1      LEU  21 -11.049   4.450  -0.555
  160   1HD2  LEU  21          1HD2      LEU  21 -12.225   5.651  -2.946
  161   2HD2  LEU  21          2HD2      LEU  21 -12.807   5.010  -1.409
  162   3HD2  LEU  21          3HD2      LEU  21 -13.487   4.420  -2.926
  163    H    HIS  22           H        HIS  22 -10.121   1.225  -2.059
  164    HA   HIS  22           HA       HIS  22 -11.569  -0.740  -3.710
  165   1HB   HIS  22          1HB       HIS  22  -9.369  -1.424  -2.566
  166   2HB   HIS  22          2HB       HIS  22 -10.278  -1.357  -1.059
  167    HD1  HIS  22           HD1      HIS  22 -10.506  -3.768  -0.470
  168    HD2  HIS  22           HD2      HIS  22 -11.525  -3.010  -4.426
  169    HE1  HIS  22           HE1      HIS  22 -11.431  -5.933  -1.353
  170    H    ASP  23           H        ASP  23 -13.539  -1.491  -3.032
  171    HA   ASP  23           HA       ASP  23 -15.084   0.197  -1.370
  172   1HB   ASP  23          1HB       ASP  23 -15.570  -1.904  -3.196
  173   2HB   ASP  23          2HB       ASP  23 -16.312  -2.384  -1.672
  174    H    SER  24           H        SER  24 -13.152  -2.589  -0.740
  175    HA   SER  24           HA       SER  24 -14.414  -3.154   1.810
  176   1HB   SER  24          1HB       SER  24 -11.817  -4.332   0.836
  177   2HB   SER  24          2HB       SER  24 -12.990  -5.033   1.951
  178    HG   SER  24           HG       SER  24 -13.583  -6.020   0.166
  179    H    MET  25           H        MET  25 -11.436  -1.710   0.589
  180    HA   MET  25           HA       MET  25 -10.229  -1.353   3.142
  181   1HB   MET  25          1HB       MET  25  -8.511  -0.256   2.024
  182   2HB   MET  25          2HB       MET  25  -9.138  -1.340   0.790
  183   1HG   MET  25          1HG       MET  25 -10.268   0.415  -0.313
  184   2HG   MET  25          2HG       MET  25 -10.018   1.518   1.038
  185   1HE   MET  25          1HE       MET  25  -6.508  -0.289  -1.165
  186   2HE   MET  25          2HE       MET  25  -8.081  -1.021  -0.846
  187   3HE   MET  25          3HE       MET  25  -7.851  -0.009  -2.274
  188    H    LYS  26           H        LYS  26  -9.455   1.141   3.492
  189    HA   LYS  26           HA       LYS  26 -11.914   2.761   3.564
  190   1HB   LYS  26          1HB       LYS  26 -10.431   1.722   5.763
  191   2HB   LYS  26          2HB       LYS  26 -10.217   3.467   5.745
  192   1HG   LYS  26          1HG       LYS  26 -12.963   2.369   5.433
  193   2HG   LYS  26          2HG       LYS  26 -12.212   2.347   7.030
  194   1HD   LYS  26          1HD       LYS  26 -11.803   4.766   6.852
  195   2HD   LYS  26          2HD       LYS  26 -12.597   4.773   5.276
  196   1HE   LYS  26          1HE       LYS  26 -14.666   4.623   6.173
  197   2HE   LYS  26          2HE       LYS  26 -14.136   3.572   7.485
  198   1HZ   LYS  26          1HZ       LYS  26 -14.695   5.539   8.543
  199   2HZ   LYS  26          2HZ       LYS  26 -14.040   6.516   7.329
  200   3HZ   LYS  26          3HZ       LYS  26 -13.016   5.676   8.381
  201    H    TYR  27           H        TYR  27  -8.386   2.736   3.532
  202    HA   TYR  27           HA       TYR  27  -8.450   5.357   2.214
  203   1HB   TYR  27          1HB       TYR  27  -7.784   5.345   4.757
  204   2HB   TYR  27          2HB       TYR  27  -6.243   4.754   4.146
  205    HD1  TYR  27           HD1      TYR  27  -8.693   7.417   3.178
  206    HD2  TYR  27           HD2      TYR  27  -4.635   6.381   3.926
  207    HE1  TYR  27           HE1      TYR  27  -8.016   9.727   2.673
  208    HE2  TYR  27           HE2      TYR  27  -3.947   8.688   3.424
  209    HH   TYR  27           HH       TYR  27  -6.327  11.212   2.759
  210    H    LEU  28           H        LEU  28  -6.812   5.722   0.712
  211    HA   LEU  28           HA       LEU  28  -5.102   3.403   0.099
  212   1HB   LEU  28          1HB       LEU  28  -6.693   3.297  -1.584
  213   2HB   LEU  28          2HB       LEU  28  -6.832   5.050  -1.698
  214    HG   LEU  28           HG       LEU  28  -4.761   5.199  -2.896
  215   1HD1  LEU  28          1HD1      LEU  28  -3.977   2.614  -3.482
  216   2HD1  LEU  28          2HD1      LEU  28  -4.320   2.572  -1.753
  217   3HD1  LEU  28          3HD1      LEU  28  -3.161   3.737  -2.394
  218   1HD2  LEU  28          1HD2      LEU  28  -6.630   4.745  -4.298
  219   2HD2  LEU  28          2HD2      LEU  28  -6.576   3.023  -3.917
  220   3HD2  LEU  28          3HD2      LEU  28  -5.289   3.756  -4.876
  221    H    VAL  29           H        VAL  29  -3.005   3.854   0.030
  222    HA   VAL  29           HA       VAL  29  -2.124   6.531  -0.766
  223    HB   VAL  29           HB       VAL  29  -1.220   5.152   1.765
  224   1HG1  VAL  29          1HG1      VAL  29   0.729   6.160   1.199
  225   2HG1  VAL  29          2HG1      VAL  29  -0.058   7.341   0.149
  226   3HG1  VAL  29          3HG1      VAL  29  -0.075   7.565   1.899
  227   1HG2  VAL  29          1HG2      VAL  29  -2.205   6.985   2.941
  228   2HG2  VAL  29          2HG2      VAL  29  -2.578   7.823   1.435
  229   3HG2  VAL  29          3HG2      VAL  29  -3.424   6.331   1.847
  230    H    TYR  30           H        TYR  30  -0.612   6.364  -2.274
  231    HA   TYR  30           HA       TYR  30   1.464   4.352  -2.083
  232   1HB   TYR  30          1HB       TYR  30   1.051   3.259  -4.131
  233   2HB   TYR  30          2HB       TYR  30  -0.520   3.335  -3.343
  234    HD1  TYR  30           HD2      TYR  30  -2.238   4.909  -4.152
  235    HD2  TYR  30           HD1      TYR  30   1.477   4.444  -6.172
  236    HE1  TYR  30           HE2      TYR  30  -3.185   6.013  -6.136
  237    HE2  TYR  30           HE1      TYR  30   0.542   5.547  -8.161
  238    HH   TYR  30           HH       TYR  30  -1.289   6.385  -9.112
  239    H    GLN  31           H        GLN  31   3.271   4.781  -3.428
  240    HA   GLN  31           HA       GLN  31   3.233   7.345  -4.853
  241   1HB   GLN  31          1HB       GLN  31   5.550   6.603  -3.088
  242   2HB   GLN  31          2HB       GLN  31   5.150   8.172  -3.773
  243   1HG   GLN  31          1HG       GLN  31   3.101   8.153  -2.301
  244   2HG   GLN  31          2HG       GLN  31   3.804   6.751  -1.497
  245   1HE2  GLN  31          1HE2      GLN  31   5.277   9.723  -2.735
  246   2HE2  GLN  31          2HE2      GLN  31   5.958  10.220  -1.227
  247    H    THR  32           H        THR  32   5.014   7.613  -6.359
  248    HA   THR  32           HA       THR  32   5.770   5.050  -7.543
  249    HB   THR  32           HB       THR  32   6.489   7.578  -8.914
  250    HG1  THR  32           HG1      THR  32   4.217   7.660  -9.664
  251   1HG2  THR  32          1HG2      THR  32   5.274   6.165 -10.766
  252   2HG2  THR  32          2HG2      THR  32   5.516   4.846  -9.621
  253   3HG2  THR  32          3HG2      THR  32   6.903   5.741 -10.242
  254    H    GLU  33           H        GLU  33   7.829   4.344  -7.731
  255    HA   GLU  33           HA       GLU  33   9.986   6.139  -6.843
  256   1HB   GLU  33          1HB       GLU  33   9.312   3.385  -5.894
  257   2HB   GLU  33          2HB       GLU  33  11.000   3.873  -5.954
  258   1HG   GLU  33          1HG       GLU  33  10.783   4.929  -4.029
  259   2HG   GLU  33          2HG       GLU  33   9.520   5.952  -4.711
  260    H    GLN  34           H        GLN  34  12.151   5.434  -7.555
  261    HA   GLN  34           HA       GLN  34  11.991   4.248 -10.237
  262   1HB   GLN  34          1HB       GLN  34  12.924   6.616  -9.814
  263   2HB   GLN  34          2HB       GLN  34  14.336   5.795  -9.164
  264   1HG   GLN  34          1HG       GLN  34  15.145   5.537 -11.200
  265   2HG   GLN  34          2HG       GLN  34  13.712   4.624 -11.671
  266   1HE2  GLN  34          1HE2      GLN  34  12.639   5.415 -13.322
  267   2HE2  GLN  34          2HE2      GLN  34  12.603   7.068 -13.822
  268    H    GLY  35           H        GLY  35  13.210   2.506 -10.815
  269   1HA   GLY  35          1HA       GLY  35  15.432   1.367 -10.118
  270   2HA   GLY  35          2HA       GLY  35  14.568   1.118  -8.608
  271    H    GLU  36           H        GLU  36  15.630  -0.932 -10.283
  272    HA   GLU  36           HA       GLU  36  15.051  -2.982 -11.080
  273   1HB   GLU  36          1HB       GLU  36  13.647  -3.594  -9.396
  274   2HB   GLU  36          2HB       GLU  36  12.670  -2.139  -9.539
  275   1HG   GLU  36          1HG       GLU  36  11.409  -4.150 -10.102
  276   2HG   GLU  36          2HG       GLU  36  11.536  -3.048 -11.471
  277    H    ALA  37           H        ALA  37  14.996  -3.359 -13.184
  278    HA   ALA  37           HA       ALA  37  14.419  -3.306 -15.386
  279   1HB   ALA  37          1HB       ALA  37  11.879  -2.840 -15.775
  280   2HB   ALA  37          2HB       ALA  37  12.399  -4.333 -14.992
  281   3HB   ALA  37          3HB       ALA  37  11.785  -2.995 -14.020
  282    H    GLY  38           H        GLY  38  13.414  -1.862 -17.143
  283   1HA   GLY  38          1HA       GLY  38  14.507   0.757 -16.821
  284   2HA   GLY  38          2HA       GLY  38  13.650   0.155 -18.232
  285    H    ASN  39           H        ASN  39  11.515  -0.542 -15.988
  286    HA   ASN  39           HA       ASN  39  10.097   1.993 -16.337
  287   1HB   ASN  39          1HB       ASN  39   9.033  -0.651 -15.323
  288   2HB   ASN  39          2HB       ASN  39   8.082   0.760 -15.778
  289   1HD2  ASN  39          1HD2      ASN  39  10.185  -1.774 -16.977
  290   2HD2  ASN  39          2HD2      ASN  39   9.623  -1.728 -18.610
  291    H    ILE  40           H        ILE  40   8.328   1.964 -14.271
  292    HA   ILE  40           HA       ILE  40  10.081   2.342 -11.935
  293    HB   ILE  40           HB       ILE  40   8.187   3.864 -11.136
  294   1HG1  ILE  40          1HG1      ILE  40   7.480   3.664 -14.071
  295   2HG1  ILE  40          2HG1      ILE  40   6.478   3.144 -12.720
  296   1HG2  ILE  40          1HG2      ILE  40   9.754   4.697 -13.574
  297   2HG2  ILE  40          2HG2      ILE  40   9.070   5.769 -12.353
  298   3HG2  ILE  40          3HG2      ILE  40  10.372   4.661 -11.923
  299   1HD1  ILE  40          1HD1      ILE  40   5.538   5.142 -12.738
  300   2HD1  ILE  40          2HD1      ILE  40   7.082   5.831 -12.233
  301   3HD1  ILE  40          3HD1      ILE  40   6.683   5.720 -13.947
  302    H    HIS  41           H        HIS  41   8.935   2.126  -9.802
  303    HA   HIS  41           HA       HIS  41   6.968  -0.065  -9.888
  304   1HB   HIS  41          1HB       HIS  41   8.095  -0.707  -7.622
  305   2HB   HIS  41          2HB       HIS  41   8.855  -1.188  -9.136
  306    HD1  HIS  41           HD1      HIS  41  11.249  -1.205  -8.336
  307    HD2  HIS  41           HD2      HIS  41   9.315   2.392  -7.574
  308    HE1  HIS  41           HE1      HIS  41  13.048   0.375  -7.568
  309    H    PHE  42           H        PHE  42   5.458  -0.152  -8.162
  310    HA   PHE  42           HA       PHE  42   4.965   2.477  -6.961
  311   1HB   PHE  42          1HB       PHE  42   3.206   0.156  -7.676
  312   2HB   PHE  42          2HB       PHE  42   2.675   1.315  -6.461
  313    HD1  PHE  42           HD1      PHE  42   4.720   2.206  -9.384
  314    HD2  PHE  42           HD2      PHE  42   0.821   2.171  -7.678
  315    HE1  PHE  42           HE1      PHE  42   3.930   3.707 -11.167
  316    HE2  PHE  42           HE2      PHE  42   0.025   3.671  -9.459
  317    HZ   PHE  42           HZ       PHE  42   1.579   4.440 -11.207
  318    H    GLN  43           H        GLN  43   4.833   2.786  -4.792
  319    HA   GLN  43           HA       GLN  43   4.894   0.486  -3.002
  320   1HB   GLN  43          1HB       GLN  43   7.165   2.276  -3.515
  321   2HB   GLN  43          2HB       GLN  43   6.771   2.088  -1.811
  322   1HG   GLN  43          1HG       GLN  43   7.980   0.235  -1.843
  323   2HG   GLN  43          2HG       GLN  43   6.695  -0.492  -2.807
  324   1HE2  GLN  43          1HE2      GLN  43   9.859  -0.303  -2.675
  325   2HE2  GLN  43          2HE2      GLN  43  10.274  -0.288  -4.352
  326    H    GLY  44           H        GLY  44   3.931   0.850  -1.051
  327   1HA   GLY  44          1HA       GLY  44   3.612   3.286   0.251
  328   2HA   GLY  44          2HA       GLY  44   2.226   3.103  -0.814
  329    H    TYR  45           H        TYR  45   1.164   3.212   1.377
  330    HA   TYR  45           HA       TYR  45   0.969   0.493   2.497
  331   1HB   TYR  45          1HB       TYR  45   0.292   1.675   4.653
  332   2HB   TYR  45          2HB       TYR  45   1.990   1.775   4.201
  333    HD1  TYR  45           HD1      TYR  45  -1.172   3.643   4.436
  334    HD2  TYR  45           HD2      TYR  45   2.996   3.876   3.614
  335    HE1  TYR  45           HE1      TYR  45  -1.289   6.096   4.571
  336    HE2  TYR  45           HE2      TYR  45   2.891   6.329   3.748
  337    HH   TYR  45           HH       TYR  45   1.622   8.095   4.223
  338    H    ILE  46           H        ILE  46  -1.059  -0.304   2.918
  339    HA   ILE  46           HA       ILE  46  -3.350   1.424   2.278
  340    HB   ILE  46           HB       ILE  46  -3.010  -1.413   1.297
  341   1HG1  ILE  46          1HG1      ILE  46  -3.175   1.112  -0.351
  342   2HG1  ILE  46          2HG1      ILE  46  -1.645   0.393   0.141
  343   1HG2  ILE  46          1HG2      ILE  46  -5.110  -0.979   0.077
  344   2HG2  ILE  46          2HG2      ILE  46  -5.317  -0.927   1.827
  345   3HG2  ILE  46          3HG2      ILE  46  -5.244   0.573   0.903
  346   1HD1  ILE  46          1HD1      ILE  46  -2.378  -0.189  -2.161
  347   2HD1  ILE  46          2HD1      ILE  46  -2.092  -1.581  -1.115
  348   3HD1  ILE  46          3HD1      ILE  46  -3.741  -1.055  -1.453
  349    H    GLU  47           H        GLU  47  -4.901   1.357   3.767
  350    HA   GLU  47           HA       GLU  47  -4.806  -0.786   5.773
  351   1HB   GLU  47          1HB       GLU  47  -6.255   1.856   5.974
  352   2HB   GLU  47          2HB       GLU  47  -5.934   0.715   7.273
  353   1HG   GLU  47          1HG       GLU  47  -3.426   1.297   6.272
  354   2HG   GLU  47          2HG       GLU  47  -4.278   2.839   6.215
  355    H    MET  48           H        MET  48  -6.273  -2.338   5.639
  356    HA   MET  48           HA       MET  48  -8.567  -2.070   3.916
  357   1HB   MET  48          1HB       MET  48  -7.584  -4.324   5.668
  358   2HB   MET  48          2HB       MET  48  -9.032  -4.430   4.677
  359   1HG   MET  48          1HG       MET  48  -6.756  -3.521   3.145
  360   2HG   MET  48          2HG       MET  48  -6.446  -5.070   3.927
  361   1HE   MET  48          1HE       MET  48  -8.504  -3.967   0.315
  362   2HE   MET  48          2HE       MET  48  -9.841  -3.757   1.446
  363   3HE   MET  48          3HE       MET  48  -8.309  -2.926   1.726
  364    H    LYS  49           H        LYS  49 -10.652  -3.230   4.935
  365    HA   LYS  49           HA       LYS  49 -11.888  -1.392   6.576
  366   1HB   LYS  49          1HB       LYS  49 -12.759  -3.522   5.213
  367   2HB   LYS  49          2HB       LYS  49 -12.760  -4.225   6.825
  368   1HG   LYS  49          1HG       LYS  49 -14.939  -3.344   6.330
  369   2HG   LYS  49          2HG       LYS  49 -14.191  -2.375   7.601
  370   1HD   LYS  49          1HD       LYS  49 -14.743  -0.607   6.343
  371   2HD   LYS  49          2HD       LYS  49 -13.392  -1.085   5.313
  372   1HE   LYS  49          1HE       LYS  49 -15.138  -0.898   3.802
  373   2HE   LYS  49          2HE       LYS  49 -15.129  -2.623   4.165
  374   1HZ   LYS  49          1HZ       LYS  49 -16.969  -2.366   5.613
  375   2HZ   LYS  49          2HZ       LYS  49 -17.364  -1.553   4.184
  376   3HZ   LYS  49          3HZ       LYS  49 -16.887  -0.677   5.550
  377    H    LYS  50           H        LYS  50 -10.726  -4.612   7.590
  378    HA   LYS  50           HA       LYS  50  -9.460  -3.775   9.922
  379   1HB   LYS  50          1HB       LYS  50 -12.330  -3.853  10.149
  380   2HB   LYS  50          2HB       LYS  50 -11.613  -5.056  11.212
  381   1HG   LYS  50          1HG       LYS  50 -10.366  -3.424  12.378
  382   2HG   LYS  50          2HG       LYS  50 -10.713  -2.190  11.163
  383   1HD   LYS  50          1HD       LYS  50 -13.207  -3.117  12.045
  384   2HD   LYS  50          2HD       LYS  50 -12.223  -2.932  13.499
  385   1HE   LYS  50          1HE       LYS  50 -11.602  -0.637  12.590
  386   2HE   LYS  50          2HE       LYS  50 -12.912  -0.860  11.432
  387   1HZ   LYS  50          1HZ       LYS  50 -14.464  -0.531  12.997
  388   2HZ   LYS  50          2HZ       LYS  50 -13.220   0.241  13.844
  389   3HZ   LYS  50          3HZ       LYS  50 -13.611  -1.367  14.196
  390    H    ARG  51           H        ARG  51 -11.824  -6.406   9.510
  391    HA   ARG  51           HA       ARG  51  -9.733  -8.339  10.121
  392   1HB   ARG  51          1HB       ARG  51 -12.265  -8.244  10.964
  393   2HB   ARG  51          2HB       ARG  51 -12.515  -9.196   9.507
  394   1HG   ARG  51          1HG       ARG  51 -10.429 -10.517  10.561
  395   2HG   ARG  51          2HG       ARG  51 -11.186  -9.910  12.035
  396   1HD   ARG  51          1HD       ARG  51 -13.207 -10.915  10.285
  397   2HD   ARG  51          2HD       ARG  51 -11.944 -12.132  10.465
  398    HE   ARG  51           HE       ARG  51 -13.787 -11.226  12.485
  399   1HH1  ARG  51          1HH1      ARG  51 -10.727 -12.762  11.857
  400   2HH1  ARG  51          2HH1      ARG  51 -10.678 -13.582  13.382
  401   1HH2  ARG  51          1HH2      ARG  51 -13.733 -12.299  14.497
  402   2HH2  ARG  51          2HH2      ARG  51 -12.389 -13.318  14.883
  403    H    THR  52           H        THR  52  -9.285  -7.131   7.700
  404    HA   THR  52           HA       THR  52 -10.166  -9.091   5.693
  405    HB   THR  52           HB       THR  52  -8.654  -6.692   4.830
  406    HG1  THR  52           HG1      THR  52 -10.868  -5.609   4.916
  407   1HG2  THR  52          1HG2      THR  52 -11.044  -8.244   3.856
  408   2HG2  THR  52          2HG2      THR  52  -9.449  -8.114   3.115
  409   3HG2  THR  52          3HG2      THR  52 -10.535  -6.725   3.119
  410    H    SER  53           H        SER  53  -8.790 -10.682   5.287
  411    HA   SER  53           HA       SER  53  -6.031 -10.547   6.049
  412   1HB   SER  53          1HB       SER  53  -6.045 -12.819   4.718
  413   2HB   SER  53          2HB       SER  53  -6.851 -12.702   6.282
  414    HG   SER  53           HG       SER  53  -8.737 -12.900   5.337
  415    H    LEU  54           H        LEU  54  -4.456 -11.576   4.275
  416    HA   LEU  54           HA       LEU  54  -3.851  -9.578   2.465
  417   1HB   LEU  54          1HB       LEU  54  -2.273 -11.301   3.177
  418   2HB   LEU  54          2HB       LEU  54  -3.180 -12.512   2.273
  419    HG   LEU  54           HG       LEU  54  -2.604 -11.293   0.181
  420   1HD1  LEU  54          1HD1      LEU  54  -0.547  -9.804   1.764
  421   2HD1  LEU  54          2HD1      LEU  54  -2.155  -9.127   1.510
  422   3HD1  LEU  54          3HD1      LEU  54  -1.129  -9.505   0.126
  423   1HD2  LEU  54          1HD2      LEU  54  -0.114 -11.892   0.318
  424   2HD2  LEU  54          2HD2      LEU  54  -1.291 -13.177   0.594
  425   3HD2  LEU  54          3HD2      LEU  54  -0.471 -12.422   1.962
  426    H    ALA  55           H        ALA  55  -6.026 -12.280   2.130
  427    HA   ALA  55           HA       ALA  55  -6.286 -12.468  -0.620
  428   1HB   ALA  55          1HB       ALA  55  -8.546 -12.706   1.359
  429   2HB   ALA  55          2HB       ALA  55  -8.440 -13.449  -0.237
  430   3HB   ALA  55          3HB       ALA  55  -7.353 -13.968   1.051
  431    H    GLY  56           H        GLY  56  -7.518 -10.038   1.575
  432   1HA   GLY  56          1HA       GLY  56  -9.389  -8.878  -0.236
  433   2HA   GLY  56          2HA       GLY  56  -8.758  -8.131   1.224
  434    H    MET  57           H        MET  57  -6.070  -8.002   0.695
  435    HA   MET  57           HA       MET  57  -5.964  -5.762  -1.070
  436   1HB   MET  57          1HB       MET  57  -3.722  -7.289   0.265
  437   2HB   MET  57          2HB       MET  57  -3.561  -5.728  -0.528
  438   1HG   MET  57          1HG       MET  57  -5.597  -5.910   1.597
  439   2HG   MET  57          2HG       MET  57  -3.913  -6.024   2.106
  440   1HE   MET  57          1HE       MET  57  -6.514  -4.298   0.165
  441   2HE   MET  57          2HE       MET  57  -6.293  -2.583   0.510
  442   3HE   MET  57          3HE       MET  57  -5.452  -3.324  -0.853
  443    H    LYS  58           H        LYS  58  -4.582  -9.038  -1.180
  444    HA   LYS  58           HA       LYS  58  -3.247  -8.849  -3.605
  445   1HB   LYS  58          1HB       LYS  58  -3.574 -10.813  -1.785
  446   2HB   LYS  58          2HB       LYS  58  -4.638 -11.407  -3.053
  447   1HG   LYS  58          1HG       LYS  58  -2.914 -12.137  -4.231
  448   2HG   LYS  58          2HG       LYS  58  -2.152 -10.546  -4.191
  449   1HD   LYS  58          1HD       LYS  58  -0.628 -12.072  -3.189
  450   2HD   LYS  58          2HD       LYS  58  -1.329 -11.114  -1.883
  451   1HE   LYS  58          1HE       LYS  58  -2.449 -12.882  -1.005
  452   2HE   LYS  58          2HE       LYS  58  -2.722 -13.628  -2.579
  453   1HZ   LYS  58          1HZ       LYS  58  -0.487 -14.431  -2.604
  454   2HZ   LYS  58          2HZ       LYS  58  -1.186 -14.885  -1.132
  455   3HZ   LYS  58          3HZ       LYS  58  -0.100 -13.589  -1.189
  456    H    LYS  59           H        LYS  59  -6.647  -9.206  -2.944
  457    HA   LYS  59           HA       LYS  59  -7.540 -10.156  -5.417
  458   1HB   LYS  59          1HB       LYS  59  -8.717  -8.826  -3.088
  459   2HB   LYS  59          2HB       LYS  59  -9.549  -8.461  -4.593
  460   1HG   LYS  59          1HG       LYS  59  -9.858 -10.836  -5.018
  461   2HG   LYS  59          2HG       LYS  59  -8.987 -11.223  -3.531
  462   1HD   LYS  59          1HD       LYS  59 -10.729  -9.864  -2.306
  463   2HD   LYS  59          2HD       LYS  59 -11.643  -9.829  -3.816
  464   1HE   LYS  59          1HE       LYS  59 -10.696 -12.424  -2.658
  465   2HE   LYS  59          2HE       LYS  59 -12.167 -11.660  -2.060
  466   1HZ   LYS  59          1HZ       LYS  59 -11.689 -12.277  -4.922
  467   2HZ   LYS  59          2HZ       LYS  59 -13.139 -11.777  -4.209
  468   3HZ   LYS  59          3HZ       LYS  59 -12.514 -13.312  -3.867
  469    H    LEU  60           H        LEU  60  -6.580  -6.953  -4.393
  470    HA   LEU  60           HA       LEU  60  -7.601  -5.653  -6.752
  471   1HB   LEU  60          1HB       LEU  60  -5.853  -4.760  -4.477
  472   2HB   LEU  60          2HB       LEU  60  -6.203  -3.721  -5.856
  473    HG   LEU  60           HG       LEU  60  -8.667  -4.067  -5.266
  474   1HD1  LEU  60          1HD1      LEU  60  -9.041  -5.603  -3.693
  475   2HD1  LEU  60          2HD1      LEU  60  -8.504  -4.377  -2.545
  476   3HD1  LEU  60          3HD1      LEU  60  -7.365  -5.581  -3.146
  477   1HD2  LEU  60          1HD2      LEU  60  -6.739  -2.228  -4.407
  478   2HD2  LEU  60          2HD2      LEU  60  -7.714  -2.601  -2.985
  479   3HD2  LEU  60          3HD2      LEU  60  -8.489  -2.008  -4.455
  480    H    ILE  61           H        ILE  61  -4.475  -6.800  -5.588
  481    HA   ILE  61           HA       ILE  61  -3.460  -6.639  -8.328
  482    HB   ILE  61           HB       ILE  61  -1.855  -5.655  -5.968
  483   1HG1  ILE  61          1HG1      ILE  61  -2.090  -3.472  -7.485
  484   2HG1  ILE  61          2HG1      ILE  61  -3.605  -4.251  -7.929
  485   1HG2  ILE  61          1HG2      ILE  61  -1.259  -6.226  -8.796
  486   2HG2  ILE  61          2HG2      ILE  61  -0.609  -4.714  -8.163
  487   3HG2  ILE  61          3HG2      ILE  61  -0.202  -6.243  -7.384
  488   1HD1  ILE  61          1HD1      ILE  61  -4.346  -3.053  -6.168
  489   2HD1  ILE  61          2HD1      ILE  61  -3.786  -4.472  -5.282
  490   3HD1  ILE  61          3HD1      ILE  61  -2.771  -3.032  -5.375
  491    HA   PRO  62           HA       PRO  62  -2.555 -10.700  -6.297
  492   1HB   PRO  62          1HB       PRO  62  -3.241 -12.187  -8.462
  493   2HB   PRO  62          2HB       PRO  62  -4.415 -11.648  -7.256
  494   1HG   PRO  62          1HG       PRO  62  -3.788 -10.482  -9.940
  495   2HG   PRO  62          2HG       PRO  62  -5.367 -10.747  -9.177
  496   1HD   PRO  62          1HD       PRO  62  -4.161  -8.323  -9.225
  497   2HD   PRO  62          2HD       PRO  62  -5.203  -8.845  -7.886
  498    H    GLY  63           H        GLY  63  -0.371 -10.770  -6.235
  499   1HA   GLY  63          1HA       GLY  63   1.343 -12.083  -7.640
  500   2HA   GLY  63          2HA       GLY  63   1.099 -10.772  -8.786
  501    H    ALA  64           H        ALA  64   0.892  -8.666  -6.875
  502    HA   ALA  64           HA       ALA  64   3.593  -7.967  -6.597
  503   1HB   ALA  64          1HB       ALA  64   1.129  -6.845  -5.275
  504   2HB   ALA  64          2HB       ALA  64   2.731  -6.115  -5.160
  505   3HB   ALA  64          3HB       ALA  64   1.935  -6.252  -6.728
  506    H    HIS  65           H        HIS  65   4.607  -7.327  -4.469
  507    HA   HIS  65           HA       HIS  65   4.417  -9.603  -2.648
  508   1HB   HIS  65          1HB       HIS  65   6.617  -8.711  -3.671
  509   2HB   HIS  65          2HB       HIS  65   6.477  -7.415  -2.487
  510    HD1  HIS  65           HD1      HIS  65   7.549 -10.901  -2.875
  511    HD2  HIS  65           HD2      HIS  65   6.605  -8.332   0.251
  512    HE1  HIS  65           HE1      HIS  65   8.471 -11.993  -0.805
  513    H    PHE  66           H        PHE  66   3.173  -9.427  -0.916
  514    HA   PHE  66           HA       PHE  66   2.800  -6.767   0.290
  515   1HB   PHE  66          1HB       PHE  66   0.977  -9.056  -0.164
  516   2HB   PHE  66          2HB       PHE  66   0.797  -8.221   1.376
  517    HD1  PHE  66           HD1      PHE  66   0.822  -7.707  -2.291
  518    HD2  PHE  66           HD2      PHE  66  -0.331  -6.178   1.510
  519    HE1  PHE  66           HE1      PHE  66  -0.509  -5.960  -3.401
  520    HE2  PHE  66           HE2      PHE  66  -1.665  -4.430   0.406
  521    HZ   PHE  66           HZ       PHE  66  -1.756  -4.319  -2.052
  522    H    GLU  67           H        GLU  67   2.573  -6.690   2.635
  523    HA   GLU  67           HA       GLU  67   3.558  -8.939   4.165
  524   1HB   GLU  67          1HB       GLU  67   5.311  -6.792   3.327
  525   2HB   GLU  67          2HB       GLU  67   5.199  -6.866   5.080
  526   1HG   GLU  67          1HG       GLU  67   6.006  -9.073   5.144
  527   2HG   GLU  67          2HG       GLU  67   5.777  -9.289   3.410
  528    H    LYS  68           H        LYS  68   2.144  -9.009   5.773
  529    HA   LYS  68           HA       LYS  68   1.319  -6.475   7.033
  530   1HB   LYS  68          1HB       LYS  68  -0.467  -7.803   5.815
  531   2HB   LYS  68          2HB       LYS  68  -0.261  -9.046   7.043
  532   1HG   LYS  68          1HG       LYS  68  -0.617  -6.793   8.552
  533   2HG   LYS  68          2HG       LYS  68  -1.673  -6.498   7.168
  534   1HD   LYS  68          1HD       LYS  68  -2.569  -8.847   7.546
  535   2HD   LYS  68          2HD       LYS  68  -1.723  -8.809   9.095
  536   1HE   LYS  68          1HE       LYS  68  -3.591  -6.600   8.324
  537   2HE   LYS  68          2HE       LYS  68  -4.218  -8.108   8.988
  538   1HZ   LYS  68          1HZ       LYS  68  -2.345  -6.210  10.285
  539   2HZ   LYS  68          2HZ       LYS  68  -2.666  -7.755  10.893
  540   3HZ   LYS  68          3HZ       LYS  68  -3.911  -6.615  10.781
  541    H    ARG  69           H        ARG  69   3.581  -8.441   7.579
  542    HA   ARG  69           HA       ARG  69   2.947  -9.630  10.111
  543   1HB   ARG  69          1HB       ARG  69   5.263  -9.518   8.305
  544   2HB   ARG  69          2HB       ARG  69   5.682  -9.578  10.012
  545   1HG   ARG  69          1HG       ARG  69   5.595 -11.801   9.583
  546   2HG   ARG  69          2HG       ARG  69   3.901 -11.537  10.001
  547   1HD   ARG  69          1HD       ARG  69   3.235 -12.125   7.962
  548   2HD   ARG  69          2HD       ARG  69   4.364 -11.000   7.208
  549    HE   ARG  69           HE       ARG  69   5.633 -13.388   8.148
  550   1HH1  ARG  69          1HH1      ARG  69   3.822 -11.985   5.527
  551   2HH1  ARG  69          2HH1      ARG  69   4.440 -13.084   4.339
  552   1HH2  ARG  69          1HH2      ARG  69   6.454 -14.841   6.593
  553   2HH2  ARG  69          2HH2      ARG  69   5.936 -14.709   4.947
  554    H    ARG  70           H        ARG  70   3.336  -6.502   9.256
  555    HA   ARG  70           HA       ARG  70   3.620  -4.583  10.448
  556   1HB   ARG  70          1HB       ARG  70   2.500  -6.127  12.248
  557   2HB   ARG  70          2HB       ARG  70   4.106  -6.128  12.967
  558   1HG   ARG  70          1HG       ARG  70   3.982  -3.594  12.882
  559   2HG   ARG  70          2HG       ARG  70   2.266  -3.800  12.526
  560   1HD   ARG  70          1HD       ARG  70   2.283  -3.559  14.831
  561   2HD   ARG  70          2HD       ARG  70   2.255  -5.310  14.623
  562    HE   ARG  70           HE       ARG  70   4.920  -4.547  14.781
  563   1HH1  ARG  70          1HH1      ARG  70   2.084  -4.505  16.799
  564   2HH1  ARG  70          2HH1      ARG  70   2.975  -4.638  18.279
  565   1HH2  ARG  70          1HH2      ARG  70   6.105  -4.722  16.722
  566   2HH2  ARG  70          2HH2      ARG  70   5.262  -4.760  18.234
  567    H    GLY  71           H        GLY  71   5.772  -5.376   9.081
  568   1HA   GLY  71          1HA       GLY  71   8.120  -5.716  10.669
  569   2HA   GLY  71          2HA       GLY  71   8.071  -5.317   8.958
  570    H    THR  72           H        THR  72   6.210  -3.002   9.957
  571    HA   THR  72           HA       THR  72   8.210  -1.258  11.162
  572    HB   THR  72           HB       THR  72   8.616  -1.001   8.758
  573    HG1  THR  72           HG1      THR  72   8.530   1.221   8.793
  574   1HG2  THR  72          1HG2      THR  72   6.372  -1.618   7.960
  575   2HG2  THR  72          2HG2      THR  72   6.902  -0.075   7.289
  576   3HG2  THR  72          3HG2      THR  72   5.734  -0.108   8.609
  577    H    GLN  73           H        GLN  73   5.351  -2.440  11.506
  578    HA   GLN  73           HA       GLN  73   3.316  -1.781  12.309
  579   1HB   GLN  73          1HB       GLN  73   4.849   0.491  13.563
  580   2HB   GLN  73          2HB       GLN  73   3.412  -0.315  14.180
  581   1HG   GLN  73          1HG       GLN  73   4.737  -1.598  15.396
  582   2HG   GLN  73          2HG       GLN  73   5.316  -2.331  13.902
  583   1HE2  GLN  73          1HE2      GLN  73   5.925   0.135  16.305
  584   2HE2  GLN  73          2HE2      GLN  73   7.604   0.336  15.955
  585    H    GLY  74           H        GLY  74   2.284   0.732  12.972
  586   1HA   GLY  74          1HA       GLY  74   1.565   1.674  10.349
  587   2HA   GLY  74          2HA       GLY  74   0.944   2.272  11.881
  588    H    GLU  75           H        GLU  75   4.070   2.428  12.460
  589    HA   GLU  75           HA       GLU  75   4.271   5.205  12.261
  590   1HB   GLU  75          1HB       GLU  75   6.361   4.981  13.180
  591   2HB   GLU  75          2HB       GLU  75   5.680   3.414  13.595
  592   1HG   GLU  75          1HG       GLU  75   6.730   2.741  11.267
  593   2HG   GLU  75          2HG       GLU  75   7.781   4.111  11.621
  594    H    ALA  76           H        ALA  76   4.881   2.726   9.931
  595    HA   ALA  76           HA       ALA  76   6.635   4.097   8.211
  596   1HB   ALA  76          1HB       ALA  76   6.603   2.004   7.436
  597   2HB   ALA  76          2HB       ALA  76   5.004   1.686   8.109
  598   3HB   ALA  76          3HB       ALA  76   5.160   2.486   6.545
  599    H    ARG  77           H        ARG  77   3.383   4.670   8.957
  600    HA   ARG  77           HA       ARG  77   2.553   5.741   6.437
  601   1HB   ARG  77          1HB       ARG  77   1.426   5.959   9.228
  602   2HB   ARG  77          2HB       ARG  77   0.677   6.724   7.832
  603   1HG   ARG  77          1HG       ARG  77   1.062   4.095   7.042
  604   2HG   ARG  77          2HG       ARG  77   0.552   3.981   8.728
  605   1HD   ARG  77          1HD       ARG  77  -0.927   5.823   6.919
  606   2HD   ARG  77          2HD       ARG  77  -1.199   4.088   6.753
  607    HE   ARG  77           HE       ARG  77  -1.394   4.870   9.467
  608   1HH1  ARG  77          1HH1      ARG  77  -3.110   5.006   6.440
  609   2HH1  ARG  77          2HH1      ARG  77  -4.674   5.082   7.181
  610   1HH2  ARG  77          1HH2      ARG  77  -3.449   4.969  10.454
  611   2HH2  ARG  77          2HH2      ARG  77  -4.866   5.061   9.464
  612    H    ALA  78           H        ALA  78   4.657   6.839   8.789
  613    HA   ALA  78           HA       ALA  78   4.082   9.669   8.360
  614   1HB   ALA  78          1HB       ALA  78   5.503   8.107  10.381
  615   2HB   ALA  78          2HB       ALA  78   6.330   9.593   9.913
  616   3HB   ALA  78          3HB       ALA  78   4.675   9.659  10.518
  617    H    TYR  79           H        TYR  79   6.985   7.592   8.218
  618    HA   TYR  79           HA       TYR  79   8.582   9.399   6.807
  619   1HB   TYR  79          1HB       TYR  79  10.152   7.744   6.788
  620   2HB   TYR  79          2HB       TYR  79   9.065   7.039   7.979
  621    HD1  TYR  79           HD2      TYR  79   7.208   5.462   7.013
  622    HD2  TYR  79           HD1      TYR  79  10.788   6.481   4.952
  623    HE1  TYR  79           HE2      TYR  79   6.963   3.458   5.610
  624    HE2  TYR  79           HE1      TYR  79  10.552   4.480   3.541
  625    HH   TYR  79           HH       TYR  79   7.701   2.416   3.743
  626    H    SER  80           H        SER  80   6.168   7.130   5.718
  627    HA   SER  80           HA       SER  80   5.478   6.496   3.617
  628   1HB   SER  80          1HB       SER  80   4.723   8.387   2.281
  629   2HB   SER  80          2HB       SER  80   4.422   8.714   3.988
  630    HG   SER  80           HG       SER  80   6.002  10.188   4.005
  631    H    MET  81           H        MET  81   7.325   5.284   2.995
  632    HA   MET  81           HA       MET  81   9.058   4.699   1.644
  633   1HB   MET  81          1HB       MET  81   7.545   6.723   0.079
  634   2HB   MET  81          2HB       MET  81   9.138   6.276  -0.516
  635   1HG   MET  81          1HG       MET  81   7.418   4.941  -1.570
  636   2HG   MET  81          2HG       MET  81   8.469   3.935  -0.576
  637   1HE   MET  81          1HE       MET  81   5.545   6.195  -0.488
  638   2HE   MET  81          2HE       MET  81   4.189   5.190   0.021
  639   3HE   MET  81          3HE       MET  81   5.188   6.000   1.229
  640    H    LYS  82           H        LYS  82  11.003   5.750   0.316
  641    HA   LYS  82           HA       LYS  82  12.191   7.748   2.121
  642   1HB   LYS  82          1HB       LYS  82  13.165   5.314   1.641
  643   2HB   LYS  82          2HB       LYS  82  13.877   6.143   0.262
  644   1HG   LYS  82          1HG       LYS  82  15.026   7.677   1.694
  645   2HG   LYS  82          2HG       LYS  82  14.188   7.049   3.115
  646   1HD   LYS  82          1HD       LYS  82  15.477   5.171   3.213
  647   2HD   LYS  82          2HD       LYS  82  15.719   5.115   1.465
  648   1HE   LYS  82          1HE       LYS  82  17.821   5.696   2.243
  649   2HE   LYS  82          2HE       LYS  82  17.120   7.262   1.841
  650   1HZ   LYS  82          1HZ       LYS  82  18.048   7.573   3.930
  651   2HZ   LYS  82          2HZ       LYS  82  17.542   6.065   4.506
  652   3HZ   LYS  82          3HZ       LYS  82  16.414   7.305   4.280
  653    H    GLU  83           H        GLU  83  12.516   9.721   1.346
  654    HA   GLU  83           HA       GLU  83  11.830  10.556  -1.208
  655   1HB   GLU  83          1HB       GLU  83  12.665  11.782   1.132
  656   2HB   GLU  83          2HB       GLU  83  13.929  12.194  -0.018
  657   1HG   GLU  83          1HG       GLU  83  11.213  12.519  -1.052
  658   2HG   GLU  83          2HG       GLU  83  11.605  13.561   0.314
  659    H    ASP  84           H        ASP  84  14.883   9.367   0.023
  660    HA   ASP  84           HA       ASP  84  16.593  10.193  -2.016
  661   1HB   ASP  84          1HB       ASP  84  16.632   7.754  -0.241
  662   2HB   ASP  84          2HB       ASP  84  17.925   8.114  -1.381
  663    H    THR  85           H        THR  85  14.257   7.606  -1.917
  664    HA   THR  85           HA       THR  85  15.000   6.883  -4.677
  665    HB   THR  85           HB       THR  85  13.565   4.725  -3.840
  666    HG1  THR  85           HG1      THR  85  13.702   4.510  -1.743
  667   1HG2  THR  85          1HG2      THR  85  15.770   3.597  -3.582
  668   2HG2  THR  85          2HG2      THR  85  16.543   5.181  -3.649
  669   3HG2  THR  85          3HG2      THR  85  15.648   4.576  -5.042
  670    H    ARG  86           H        ARG  86  12.893   8.691  -3.146
  671    HA   ARG  86           HA       ARG  86  10.408   7.666  -4.200
  672   1HB   ARG  86          1HB       ARG  86  10.846   9.118  -2.047
  673   2HB   ARG  86          2HB       ARG  86  10.711  10.459  -3.177
  674   1HG   ARG  86          1HG       ARG  86   8.487  10.141  -3.510
  675   2HG   ARG  86          2HG       ARG  86   8.584   8.399  -3.244
  676   1HD   ARG  86          1HD       ARG  86   7.657   8.847  -1.254
  677   2HD   ARG  86          2HD       ARG  86   9.273   9.381  -0.794
  678    HE   ARG  86           HE       ARG  86   7.647  11.425  -2.014
  679   1HH1  ARG  86          1HH1      ARG  86   8.568   9.859   0.956
  680   2HH1  ARG  86          2HH1      ARG  86   8.135  11.208   1.954
  681   1HH2  ARG  86          1HH2      ARG  86   7.072  13.207  -0.711
  682   2HH2  ARG  86          2HH2      ARG  86   7.283  13.111   1.004
  683    H    LEU  87           H        LEU  87   9.559   8.102  -6.130
  684    HA   LEU  87           HA       LEU  87  10.893  10.100  -7.812
  685   1HB   LEU  87          1HB       LEU  87   9.943   7.477  -8.271
  686   2HB   LEU  87          2HB       LEU  87   8.948   8.567  -9.234
  687    HG   LEU  87           HG       LEU  87  11.945   8.261  -9.367
  688   1HD1  LEU  87          1HD1      LEU  87  10.948   6.460 -10.501
  689   2HD1  LEU  87          2HD1      LEU  87  11.341   7.639 -11.752
  690   3HD1  LEU  87          3HD1      LEU  87   9.680   7.481 -11.180
  691   1HD2  LEU  87          1HD2      LEU  87  10.081  10.248 -10.626
  692   2HD2  LEU  87          2HD2      LEU  87  11.622   9.820 -11.369
  693   3HD2  LEU  87          3HD2      LEU  87  11.589  10.539  -9.759
  694    H    GLU  88           H        GLU  88   7.578   8.891  -7.263
  695    HA   GLU  88           HA       GLU  88   6.625  11.655  -7.634
  696   1HB   GLU  88          1HB       GLU  88   6.033   9.488  -9.255
  697   2HB   GLU  88          2HB       GLU  88   4.639   9.590  -8.188
  698   1HG   GLU  88          1HG       GLU  88   4.198  10.863 -10.159
  699   2HG   GLU  88          2HG       GLU  88   4.394  11.971  -8.803
  700    H    GLY  89           H        GLY  89   4.266  11.825  -6.734
  701   1HA   GLY  89          1HA       GLY  89   2.737  11.383  -5.006
  702   2HA   GLY  89          2HA       GLY  89   3.870  10.221  -4.330
  703    HA   PRO  90           HA       PRO  90   3.178  10.087  -2.389
  704   1HB   PRO  90          1HB       PRO  90   1.691  10.977  -0.299
  705   2HB   PRO  90          2HB       PRO  90   3.397  10.537  -0.147
  706   1HG   PRO  90          1HG       PRO  90   2.158  13.247  -0.436
  707   2HG   PRO  90          2HG       PRO  90   3.471  12.726   0.635
  708   1HD   PRO  90          1HD       PRO  90   3.921  14.055  -1.681
  709   2HD   PRO  90          2HD       PRO  90   5.053  12.848  -1.037
  710    H    TRP  91           H        TRP  91   0.874   9.417  -2.209
  711    HA   TRP  91           HA       TRP  91  -1.019  11.316  -3.386
  712   1HB   TRP  91          1HB       TRP  91  -0.256   8.637  -4.535
  713   2HB   TRP  91          2HB       TRP  91  -1.807   9.392  -4.893
  714    HD1  TRP  91           HD1      TRP  91  -0.712  12.406  -5.200
  715    HE1  TRP  91           HE1      TRP  91   0.635  13.020  -7.305
  716    HE3  TRP  91           HE3      TRP  91   0.777   7.722  -6.606
  717    HZ2  TRP  91           HZ2      TRP  91   2.130  11.694  -9.299
  718    HZ3  TRP  91           HZ3      TRP  91   2.163   7.481  -8.625
  719    HH2  TRP  91           HH2      TRP  91   2.824   9.427  -9.943
  720    H    GLU  92           H        GLU  92  -2.967  11.227  -2.456
  721    HA   GLU  92           HA       GLU  92  -3.599   8.864  -0.810
  722   1HB   GLU  92          1HB       GLU  92  -4.115  11.789  -0.326
  723   2HB   GLU  92          2HB       GLU  92  -5.039  10.544   0.502
  724   1HG   GLU  92          1HG       GLU  92  -3.427  10.265   1.986
  725   2HG   GLU  92          2HG       GLU  92  -2.249   9.958   0.711
  726    H    TYR  93           H        TYR  93  -5.566   7.926  -1.031
  727    HA   TYR  93           HA       TYR  93  -7.604   9.256  -2.654
  728   1HB   TYR  93          1HB       TYR  93  -6.456   6.522  -3.238
  729   2HB   TYR  93          2HB       TYR  93  -7.953   7.126  -3.940
  730    HD1  TYR  93           HD1      TYR  93  -7.875   9.118  -5.456
  731    HD2  TYR  93           HD2      TYR  93  -4.347   7.159  -4.110
  732    HE1  TYR  93           HE1      TYR  93  -6.599  10.186  -7.267
  733    HE2  TYR  93           HE2      TYR  93  -3.060   8.222  -5.917
  734    HH   TYR  93           HH       TYR  93  -3.805  10.760  -7.458
  735    H    GLY  94           H        GLY  94  -9.719   8.171  -2.531
  736   1HA   GLY  94          1HA       GLY  94 -11.297   6.789  -1.471
  737   2HA   GLY  94          2HA       GLY  94 -10.060   6.292  -0.326
  738    H    GLU  95           H        GLU  95 -11.405   6.636   1.455
  739    HA   GLU  95           HA       GLU  95 -12.937   8.862   2.016
  740   1HB   GLU  95          1HB       GLU  95 -13.097   6.937   3.423
  741   2HB   GLU  95          2HB       GLU  95 -11.398   7.039   3.862
  742   1HG   GLU  95          1HG       GLU  95 -12.830   7.788   5.676
  743   2HG   GLU  95          2HG       GLU  95 -11.815   9.099   5.079
  Start of MODEL   14
    1   1H    ALA   2          1H        ALA   2 -14.249  -0.131  19.361
    2    HA   ALA   2           HA       ALA   2 -13.615   0.958  17.434
    3   1HB   ALA   2          1HB       ALA   2 -12.567   3.187  17.545
    4   2HB   ALA   2          2HB       ALA   2 -14.084   3.104  18.442
    5   3HB   ALA   2          3HB       ALA   2 -12.546   3.067  19.304
    6    H    ARG   3           H        ARG   3 -12.269  -1.067  17.600
    7    HA   ARG   3           HA       ARG   3  -9.519  -0.804  18.365
    8   1HB   ARG   3          1HB       ARG   3 -11.293  -2.927  17.432
    9   2HB   ARG   3          2HB       ARG   3  -9.678  -3.042  16.744
   10   1HG   ARG   3          1HG       ARG   3  -9.593  -2.503  19.585
   11   2HG   ARG   3          2HG       ARG   3 -10.500  -3.971  19.216
   12   1HD   ARG   3          1HD       ARG   3  -8.484  -4.508  17.665
   13   2HD   ARG   3          2HD       ARG   3  -7.636  -3.319  18.654
   14    HE   ARG   3           HE       ARG   3  -8.408  -5.976  19.421
   15   1HH1  ARG   3          1HH1      ARG   3  -7.657  -2.776  20.568
   16   2HH1  ARG   3          2HH1      ARG   3  -7.187  -3.312  22.148
   17   1HH2  ARG   3          1HH2      ARG   3  -7.793  -6.693  21.497
   18   2HH2  ARG   3          2HH2      ARG   3  -7.264  -5.540  22.675
   19    H    GLN   4           H        GLN   4  -7.803  -0.266  17.152
   20    HA   GLN   4           HA       GLN   4  -8.295   0.667  14.443
   21   1HB   GLN   4          1HB       GLN   4  -6.135   1.043  16.464
   22   2HB   GLN   4          2HB       GLN   4  -5.728   1.258  14.767
   23   1HG   GLN   4          1HG       GLN   4  -8.127   2.666  15.224
   24   2HG   GLN   4          2HG       GLN   4  -7.030   3.059  16.547
   25   1HE2  GLN   4          1HE2      GLN   4  -7.906   3.752  13.401
   26   2HE2  GLN   4          2HE2      GLN   4  -6.530   4.691  12.943
   27    H    VAL   5           H        VAL   5  -7.031   0.033  12.638
   28    HA   VAL   5           HA       VAL   5  -5.931  -2.690  12.888
   29    HB   VAL   5           HB       VAL   5  -6.478  -3.033  10.542
   30   1HG1  VAL   5          1HG1      VAL   5  -9.102  -2.323  10.949
   31   2HG1  VAL   5          2HG1      VAL   5  -8.340  -3.817  11.497
   32   3HG1  VAL   5          3HG1      VAL   5  -8.464  -2.437  12.588
   33   1HG2  VAL   5          1HG2      VAL   5  -6.831  -1.359   9.125
   34   2HG2  VAL   5          2HG2      VAL   5  -8.187  -0.773  10.088
   35   3HG2  VAL   5          3HG2      VAL   5  -6.550  -0.228  10.450
   36    H    ILE   6           H        ILE   6  -4.139  -3.243  11.478
   37    HA   ILE   6           HA       ILE   6  -2.218  -1.072  11.336
   38    HB   ILE   6           HB       ILE   6  -1.797  -3.976  10.629
   39   1HG1  ILE   6          1HG1      ILE   6  -0.586  -3.671  13.030
   40   2HG1  ILE   6          2HG1      ILE   6  -1.948  -2.575  13.232
   41   1HG2  ILE   6          1HG2      ILE   6  -0.040  -2.720   9.714
   42   2HG2  ILE   6          2HG2      ILE   6   0.047  -1.659  11.119
   43   3HG2  ILE   6          3HG2      ILE   6   0.592  -3.332  11.242
   44   1HD1  ILE   6          1HD1      ILE   6  -3.175  -4.765  12.208
   45   2HD1  ILE   6          2HD1      ILE   6  -1.874  -5.494  13.149
   46   3HD1  ILE   6          3HD1      ILE   6  -3.020  -4.404  13.927
   47    H    CYS   7           H        CYS   7  -1.059  -0.496   9.464
   48    HA   CYS   7           HA       CYS   7  -2.627  -0.559   7.060
   49   1HB   CYS   7          1HB       CYS   7  -1.046   0.978   6.168
   50   2HB   CYS   7          2HB       CYS   7  -1.249   1.409   7.862
   51    HG   CYS   7           HG       CYS   7   1.484   1.522   6.733
   52    H    TRP   8           H        TRP   8  -1.830  -1.262   4.979
   53    HA   TRP   8           HA       TRP   8  -0.164  -3.672   5.222
   54   1HB   TRP   8          1HB       TRP   8  -2.262  -2.892   3.192
   55   2HB   TRP   8          2HB       TRP   8  -1.223  -4.304   3.022
   56    HD1  TRP   8           HD1      TRP   8  -3.665  -2.924   5.720
   57    HE1  TRP   8           HE1      TRP   8  -4.953  -4.923   6.705
   58    HE3  TRP   8           HE3      TRP   8  -1.440  -6.701   3.089
   59    HZ2  TRP   8           HZ2      TRP   8  -5.017  -7.729   6.408
   60    HZ3  TRP   8           HZ3      TRP   8  -2.172  -9.014   3.499
   61    HH2  TRP   8           HH2      TRP   8  -3.923  -9.515   5.125
   62    H    CYS   9           H        CYS   9   1.868  -3.438   4.585
   63    HA   CYS   9           HA       CYS   9   2.519  -1.402   2.581
   64   1HB   CYS   9          1HB       CYS   9   4.877  -1.787   3.324
   65   2HB   CYS   9          2HB       CYS   9   3.811  -1.215   4.601
   66    HG   CYS   9           HG       CYS   9   3.635  -3.568   5.954
   67    H    PHE  10           H        PHE  10   2.776  -2.009   0.547
   68    HA   PHE  10           HA       PHE  10   3.945  -4.644  -0.014
   69   1HB   PHE  10          1HB       PHE  10   2.296  -5.266  -1.514
   70   2HB   PHE  10          2HB       PHE  10   1.345  -4.428  -0.293
   71    HD1  PHE  10           HD2      PHE  10   0.980  -1.872  -0.722
   72    HD2  PHE  10           HD1      PHE  10   2.027  -4.700  -3.726
   73    HE1  PHE  10           HE2      PHE  10   0.095  -0.360  -2.449
   74    HE2  PHE  10           HE1      PHE  10   1.144  -3.192  -5.458
   75    HZ   PHE  10           HZ       PHE  10   0.175  -1.019  -4.821
   76    H    THR  11           H        THR  11   4.766  -4.818  -2.264
   77    HA   THR  11           HA       THR  11   5.530  -2.217  -3.402
   78    HB   THR  11           HB       THR  11   7.465  -4.522  -3.147
   79    HG1  THR  11           HG1      THR  11   6.760  -3.387  -1.109
   80   1HG2  THR  11          1HG2      THR  11   8.554  -3.316  -4.690
   81   2HG2  THR  11          2HG2      THR  11   8.861  -2.155  -3.398
   82   3HG2  THR  11          3HG2      THR  11   7.485  -1.930  -4.478
   83    H    LEU  12           H        LEU  12   5.001  -2.107  -5.476
   84    HA   LEU  12           HA       LEU  12   4.728  -4.614  -6.995
   85   1HB   LEU  12          1HB       LEU  12   2.636  -3.471  -6.821
   86   2HB   LEU  12          2HB       LEU  12   3.371  -1.945  -7.308
   87    HG   LEU  12           HG       LEU  12   3.588  -2.670  -9.560
   88   1HD1  LEU  12          1HD1      LEU  12   4.310  -4.864  -9.509
   89   2HD1  LEU  12          2HD1      LEU  12   2.664  -5.025 -10.120
   90   3HD1  LEU  12          3HD1      LEU  12   3.015  -5.376  -8.427
   91   1HD2  LEU  12          1HD2      LEU  12   1.144  -3.547  -9.957
   92   2HD2  LEU  12          2HD2      LEU  12   1.436  -1.903  -9.388
   93   3HD2  LEU  12          3HD2      LEU  12   0.961  -3.161  -8.246
   94    H    ASN  13           H        ASN  13   6.271  -4.991  -8.428
   95    HA   ASN  13           HA       ASN  13   7.842  -2.740  -9.460
   96   1HB   ASN  13          1HB       ASN  13   9.479  -4.473 -10.143
   97   2HB   ASN  13          2HB       ASN  13   9.147  -4.505  -8.414
   98   1HD2  ASN  13          1HD2      ASN  13   8.397  -6.322  -7.511
   99   2HD2  ASN  13          2HD2      ASN  13   7.999  -7.761  -8.381
  100    H    ASN  14           H        ASN  14   7.868  -2.196 -11.568
  101    HA   ASN  14           HA       ASN  14   7.103  -2.012 -13.709
  102   1HB   ASN  14          1HB       ASN  14   7.221  -5.023 -13.801
  103   2HB   ASN  14          2HB       ASN  14   7.524  -3.880 -15.105
  104   1HD2  ASN  14          1HD2      ASN  14   9.116  -6.066 -13.722
  105   2HD2  ASN  14          2HD2      ASN  14  10.636  -5.316 -13.383
  106    HA   PRO  15           HA       PRO  15   2.781  -3.262 -12.428
  107   1HB   PRO  15          1HB       PRO  15   1.770  -0.743 -12.431
  108   2HB   PRO  15          2HB       PRO  15   2.540  -1.467 -11.014
  109   1HG   PRO  15          1HG       PRO  15   3.680   0.436 -13.024
  110   2HG   PRO  15          2HG       PRO  15   3.852   0.437 -11.259
  111   1HD   PRO  15          1HD       PRO  15   5.779  -0.509 -12.909
  112   2HD   PRO  15          2HD       PRO  15   5.492  -1.181 -11.292
  113    H    LEU  16           H        LEU  16   0.712  -2.604 -13.607
  114    HA   LEU  16           HA       LEU  16   1.307  -2.071 -16.443
  115   1HB   LEU  16          1HB       LEU  16   0.654  -4.458 -15.761
  116   2HB   LEU  16          2HB       LEU  16  -0.961  -3.799 -15.509
  117    HG   LEU  16           HG       LEU  16  -0.698  -2.975 -17.975
  118   1HD1  LEU  16          1HD1      LEU  16   1.579  -4.811 -17.615
  119   2HD1  LEU  16          2HD1      LEU  16   1.354  -3.483 -18.753
  120   3HD1  LEU  16          3HD1      LEU  16   0.612  -5.051 -19.070
  121   1HD2  LEU  16          1HD2      LEU  16  -1.514  -5.258 -18.736
  122   2HD2  LEU  16          2HD2      LEU  16  -2.415  -4.489 -17.429
  123   3HD2  LEU  16          3HD2      LEU  16  -1.271  -5.784 -17.070
  124    H    SER  17           H        SER  17  -0.199  -0.930 -13.739
  125    HA   SER  17           HA       SER  17  -1.491   1.182 -15.040
  126   1HB   SER  17          1HB       SER  17  -3.639   0.553 -15.355
  127   2HB   SER  17          2HB       SER  17  -3.008  -1.092 -15.290
  128    HG   SER  17           HG       SER  17  -4.509  -1.145 -13.757
  129    HA   PRO  18           HA       PRO  18  -1.468   2.828 -10.974
  130   1HB   PRO  18          1HB       PRO  18  -3.595   4.514 -11.013
  131   2HB   PRO  18          2HB       PRO  18  -2.094   4.841 -11.888
  132   1HG   PRO  18          1HG       PRO  18  -4.677   3.723 -12.909
  133   2HG   PRO  18          2HG       PRO  18  -3.616   4.940 -13.643
  134   1HD   PRO  18          1HD       PRO  18  -3.622   2.348 -14.428
  135   2HD   PRO  18          2HD       PRO  18  -2.160   3.355 -14.469
  136    H    LEU  19           H        LEU  19  -2.512   2.831  -8.926
  137    HA   LEU  19           HA       LEU  19  -4.350   0.637  -8.581
  138   1HB   LEU  19          1HB       LEU  19  -3.335   2.540  -6.482
  139   2HB   LEU  19          2HB       LEU  19  -4.011   0.932  -6.235
  140    HG   LEU  19           HG       LEU  19  -1.378   1.527  -7.586
  141   1HD1  LEU  19          1HD1      LEU  19  -1.587   0.107  -4.988
  142   2HD1  LEU  19          2HD1      LEU  19  -1.766   1.861  -4.990
  143   3HD1  LEU  19          3HD1      LEU  19  -0.295   1.124  -5.625
  144   1HD2  LEU  19          1HD2      LEU  19  -1.579  -0.534  -8.396
  145   2HD2  LEU  19          2HD2      LEU  19  -3.055  -0.823  -7.474
  146   3HD2  LEU  19          3HD2      LEU  19  -1.480  -1.120  -6.736
  147    H    SER  20           H        SER  20  -6.195   0.973  -6.952
  148    HA   SER  20           HA       SER  20  -7.496   3.565  -7.159
  149   1HB   SER  20          1HB       SER  20  -9.598   2.554  -8.036
  150   2HB   SER  20          2HB       SER  20  -8.267   2.483  -9.191
  151    HG   SER  20           HG       SER  20  -7.918   0.293  -8.338
  152    H    LEU  21           H        LEU  21  -9.364   3.760  -5.761
  153    HA   LEU  21           HA       LEU  21  -8.963   2.630  -3.228
  154   1HB   LEU  21          1HB       LEU  21 -10.056   4.711  -3.337
  155   2HB   LEU  21          2HB       LEU  21 -11.265   4.106  -4.467
  156    HG   LEU  21           HG       LEU  21 -12.158   2.682  -2.603
  157   1HD1  LEU  21          1HD1      LEU  21 -11.106   4.313  -0.481
  158   2HD1  LEU  21          2HD1      LEU  21  -9.803   3.482  -1.330
  159   3HD1  LEU  21          3HD1      LEU  21 -11.136   2.556  -0.639
  160   1HD2  LEU  21          1HD2      LEU  21 -12.253   5.632  -2.761
  161   2HD2  LEU  21          2HD2      LEU  21 -12.915   4.898  -1.301
  162   3HD2  LEU  21          3HD2      LEU  21 -13.551   4.444  -2.882
  163    H    HIS  22           H        HIS  22 -10.244   1.162  -2.021
  164    HA   HIS  22           HA       HIS  22 -11.691  -0.787  -3.691
  165   1HB   HIS  22          1HB       HIS  22  -9.488  -1.469  -2.526
  166   2HB   HIS  22          2HB       HIS  22 -10.431  -1.447  -1.039
  167    HD1  HIS  22           HD1      HIS  22 -10.645  -3.877  -0.519
  168    HD2  HIS  22           HD2      HIS  22 -11.596  -3.021  -4.472
  169    HE1  HIS  22           HE1      HIS  22 -11.533  -6.025  -1.477
  170    H    ASP  23           H        ASP  23 -13.692  -1.459  -3.076
  171    HA   ASP  23           HA       ASP  23 -15.218   0.197  -1.381
  172   1HB   ASP  23          1HB       ASP  23 -15.727  -1.837  -3.255
  173   2HB   ASP  23          2HB       ASP  23 -16.444  -2.391  -1.744
  174    H    SER  24           H        SER  24 -13.306  -2.602  -0.773
  175    HA   SER  24           HA       SER  24 -14.595  -3.213   1.751
  176   1HB   SER  24          1HB       SER  24 -11.968  -4.352   0.814
  177   2HB   SER  24          2HB       SER  24 -13.168  -5.086   1.878
  178    HG   SER  24           HG       SER  24 -13.783  -6.020   0.090
  179    H    MET  25           H        MET  25 -11.610  -1.724   0.601
  180    HA   MET  25           HA       MET  25 -10.469  -1.386   3.193
  181   1HB   MET  25          1HB       MET  25  -8.718  -0.274   2.127
  182   2HB   MET  25          2HB       MET  25  -9.291  -1.389   0.894
  183   1HG   MET  25          1HG       MET  25 -10.396   0.332  -0.286
  184   2HG   MET  25          2HG       MET  25 -10.205   1.465   1.051
  185   1HE   MET  25          1HE       MET  25  -6.635  -0.261  -1.204
  186   2HE   MET  25          2HE       MET  25  -8.115  -1.089  -0.721
  187   3HE   MET  25          3HE       MET  25  -8.096  -0.094  -2.177
  188    H    LYS  26           H        LYS  26  -9.684   1.126   3.520
  189    HA   LYS  26           HA       LYS  26 -12.146   2.742   3.541
  190   1HB   LYS  26          1HB       LYS  26 -10.697   1.726   5.775
  191   2HB   LYS  26          2HB       LYS  26 -10.493   3.472   5.745
  192   1HG   LYS  26          1HG       LYS  26 -12.387   3.279   7.008
  193   2HG   LYS  26          2HG       LYS  26 -13.085   3.469   5.398
  194   1HD   LYS  26          1HD       LYS  26 -13.305   1.032   5.215
  195   2HD   LYS  26          2HD       LYS  26 -12.620   0.853   6.832
  196   1HE   LYS  26          1HE       LYS  26 -14.801   0.821   7.428
  197   2HE   LYS  26          2HE       LYS  26 -14.601   2.572   7.379
  198   1HZ   LYS  26          1HZ       LYS  26 -16.065   2.710   5.741
  199   2HZ   LYS  26          2HZ       LYS  26 -16.394   1.061   5.928
  200   3HZ   LYS  26          3HZ       LYS  26 -15.235   1.570   4.806
  201    H    TYR  27           H        TYR  27  -8.620   2.710   3.552
  202    HA   TYR  27           HA       TYR  27  -8.663   5.328   2.225
  203   1HB   TYR  27          1HB       TYR  27  -8.009   5.294   4.783
  204   2HB   TYR  27          2HB       TYR  27  -6.460   4.739   4.159
  205    HD1  TYR  27           HD1      TYR  27  -8.950   7.343   3.135
  206    HD2  TYR  27           HD2      TYR  27  -4.897   6.422   4.047
  207    HE1  TYR  27           HE1      TYR  27  -8.319   9.670   2.652
  208    HE2  TYR  27           HE2      TYR  27  -4.255   8.747   3.568
  209    HH   TYR  27           HH       TYR  27  -5.303  10.970   3.500
  210    H    LEU  28           H        LEU  28  -6.974   5.698   0.764
  211    HA   LEU  28           HA       LEU  28  -5.272   3.370   0.170
  212   1HB   LEU  28          1HB       LEU  28  -6.862   3.253  -1.520
  213   2HB   LEU  28          2HB       LEU  28  -6.980   5.006  -1.662
  214    HG   LEU  28           HG       LEU  28  -4.890   5.111  -2.837
  215   1HD1  LEU  28          1HD1      LEU  28  -4.161   2.489  -3.376
  216   2HD1  LEU  28          2HD1      LEU  28  -4.491   2.508  -1.644
  217   3HD1  LEU  28          3HD1      LEU  28  -3.314   3.629  -2.329
  218   1HD2  LEU  28          1HD2      LEU  28  -6.837   4.617  -4.189
  219   2HD2  LEU  28          2HD2      LEU  28  -6.638   2.890  -3.893
  220   3HD2  LEU  28          3HD2      LEU  28  -5.429   3.770  -4.830
  221    H    VAL  29           H        VAL  29  -3.173   3.818   0.060
  222    HA   VAL  29           HA       VAL  29  -2.310   6.518  -0.686
  223    HB   VAL  29           HB       VAL  29  -1.348   5.052   1.775
  224   1HG1  VAL  29          1HG1      VAL  29  -0.224   7.504   1.920
  225   2HG1  VAL  29          2HG1      VAL  29   0.591   6.082   1.267
  226   3HG1  VAL  29          3HG1      VAL  29  -0.185   7.233   0.178
  227   1HG2  VAL  29          1HG2      VAL  29  -3.313   7.170   1.306
  228   2HG2  VAL  29          2HG2      VAL  29  -3.111   6.095   2.690
  229   3HG2  VAL  29          3HG2      VAL  29  -2.126   7.551   2.554
  230    H    TYR  30           H        TYR  30  -0.834   6.405  -2.234
  231    HA   TYR  30           HA       TYR  30   1.242   4.384  -2.165
  232   1HB   TYR  30          1HB       TYR  30   0.748   3.292  -4.154
  233   2HB   TYR  30          2HB       TYR  30  -0.851   3.510  -3.452
  234    HD1  TYR  30           HD2      TYR  30  -2.350   5.292  -4.331
  235    HD2  TYR  30           HD1      TYR  30   1.349   4.341  -6.206
  236    HE1  TYR  30           HE2      TYR  30  -3.091   6.453  -6.369
  237    HE2  TYR  30           HE1      TYR  30   0.619   5.500  -8.249
  238    HH   TYR  30           HH       TYR  30  -2.300   7.401  -8.338
  239    H    GLN  31           H        GLN  31   2.968   4.807  -3.683
  240    HA   GLN  31           HA       GLN  31   2.919   7.404  -5.012
  241   1HB   GLN  31          1HB       GLN  31   4.188   8.438  -3.499
  242   2HB   GLN  31          2HB       GLN  31   4.169   6.994  -2.495
  243   1HG   GLN  31          1HG       GLN  31   6.120   6.140  -3.728
  244   2HG   GLN  31          2HG       GLN  31   6.157   7.636  -4.661
  245   1HE2  GLN  31          1HE2      GLN  31   8.199   6.530  -2.941
  246   2HE2  GLN  31          2HE2      GLN  31   8.501   7.708  -1.714
  247    H    THR  32           H        THR  32   4.656   7.696  -6.536
  248    HA   THR  32           HA       THR  32   5.538   5.143  -7.653
  249    HB   THR  32           HB       THR  32   6.069   7.716  -9.059
  250    HG1  THR  32           HG1      THR  32   3.911   7.941  -8.304
  251   1HG2  THR  32          1HG2      THR  32   5.318   6.291 -10.998
  252   2HG2  THR  32          2HG2      THR  32   5.212   4.940  -9.869
  253   3HG2  THR  32          3HG2      THR  32   6.765   5.722 -10.166
  254    H    GLU  33           H        GLU  33   7.642   4.563  -7.897
  255    HA   GLU  33           HA       GLU  33   9.711   6.489  -7.099
  256   1HB   GLU  33          1HB       GLU  33   9.121   3.825  -5.899
  257   2HB   GLU  33          2HB       GLU  33  10.806   4.297  -6.064
  258   1HG   GLU  33          1HG       GLU  33  10.547   6.143  -4.645
  259   2HG   GLU  33          2HG       GLU  33   8.788   6.081  -4.749
  260    H    GLN  34           H        GLN  34  11.885   5.875  -7.803
  261    HA   GLN  34           HA       GLN  34  11.770   4.485 -10.382
  262   1HB   GLN  34          1HB       GLN  34  12.843   6.922  -9.707
  263   2HB   GLN  34          2HB       GLN  34  14.258   5.878  -9.698
  264   1HG   GLN  34          1HG       GLN  34  13.385   5.083 -11.999
  265   2HG   GLN  34          2HG       GLN  34  12.436   6.568 -11.960
  266   1HE2  GLN  34          1HE2      GLN  34  15.738   5.750 -10.950
  267   2HE2  GLN  34          2HE2      GLN  34  16.511   6.984 -11.880
  268    H    GLY  35           H        GLY  35  13.063   2.760 -10.872
  269   1HA   GLY  35          1HA       GLY  35  15.332   1.910  -9.497
  270   2HA   GLY  35          2HA       GLY  35  13.953   1.129  -8.736
  271    H    GLU  36           H        GLU  36  15.675  -0.567  -9.737
  272    HA   GLU  36           HA       GLU  36  16.226  -1.997 -11.493
  273   1HB   GLU  36          1HB       GLU  36  14.134  -3.387 -12.013
  274   2HB   GLU  36          2HB       GLU  36  14.659  -3.301 -10.337
  275   1HG   GLU  36          1HG       GLU  36  12.692  -1.282 -11.217
  276   2HG   GLU  36          2HG       GLU  36  12.129  -2.948 -11.096
  277    H    ALA  37           H        ALA  37  16.840  -0.586 -13.174
  278    HA   ALA  37           HA       ALA  37  16.797   0.158 -15.326
  279   1HB   ALA  37          1HB       ALA  37  15.805  -1.221 -16.770
  280   2HB   ALA  37          2HB       ALA  37  15.228  -2.107 -15.357
  281   3HB   ALA  37          3HB       ALA  37  14.202  -0.888 -16.114
  282    H    GLY  38           H        GLY  38  15.116   1.294 -16.965
  283   1HA   GLY  38          1HA       GLY  38  14.400   3.715 -15.766
  284   2HA   GLY  38          2HA       GLY  38  13.852   3.171 -17.345
  285    H    ASN  39           H        ASN  39  12.576   0.768 -16.153
  286    HA   ASN  39           HA       ASN  39   9.976   1.646 -15.956
  287   1HB   ASN  39          1HB       ASN  39  10.983  -0.760 -14.442
  288   2HB   ASN  39          2HB       ASN  39   9.402  -0.524 -15.181
  289   1HD2  ASN  39          1HD2      ASN  39  11.967  -2.330 -15.481
  290   2HD2  ASN  39          2HD2      ASN  39  12.083  -2.497 -17.197
  291    H    ILE  40           H        ILE  40   8.514   1.459 -14.021
  292    HA   ILE  40           HA       ILE  40   9.834   2.531 -11.614
  293    HB   ILE  40           HB       ILE  40   7.660   3.794 -11.231
  294   1HG1  ILE  40          1HG1      ILE  40   7.322   3.086 -14.152
  295   2HG1  ILE  40          2HG1      ILE  40   6.243   2.657 -12.829
  296   1HG2  ILE  40          1HG2      ILE  40   8.363   5.674 -12.588
  297   2HG2  ILE  40          2HG2      ILE  40   9.771   4.852 -11.918
  298   3HG2  ILE  40          3HG2      ILE  40   9.328   4.607 -13.607
  299   1HD1  ILE  40          1HD1      ILE  40   5.071   4.443 -13.436
  300   2HD1  ILE  40          2HD1      ILE  40   6.344   5.391 -12.667
  301   3HD1  ILE  40          3HD1      ILE  40   6.394   5.092 -14.404
  302    H    HIS  41           H        HIS  41   8.462   2.310  -9.628
  303    HA   HIS  41           HA       HIS  41   6.768  -0.091  -9.712
  304   1HB   HIS  41          1HB       HIS  41   7.844  -0.553  -7.366
  305   2HB   HIS  41          2HB       HIS  41   8.680  -1.057  -8.832
  306    HD1  HIS  41           HD1      HIS  41  11.040  -0.890  -7.944
  307    HD2  HIS  41           HD2      HIS  41   8.872   2.622  -7.461
  308    HE1  HIS  41           HE1      HIS  41  12.714   0.838  -7.211
  309    H    PHE  42           H        PHE  42   5.161  -0.220  -8.103
  310    HA   PHE  42           HA       PHE  42   4.479   2.386  -6.935
  311   1HB   PHE  42          1HB       PHE  42   2.848   0.030  -7.823
  312   2HB   PHE  42          2HB       PHE  42   2.189   1.158  -6.643
  313    HD1  PHE  42           HD1      PHE  42   4.372   1.907  -9.546
  314    HD2  PHE  42           HD2      PHE  42   0.488   2.217  -7.832
  315    HE1  PHE  42           HE1      PHE  42   3.691   3.410 -11.371
  316    HE2  PHE  42           HE2      PHE  42  -0.200   3.720  -9.655
  317    HZ   PHE  42           HZ       PHE  42   1.402   4.318 -11.427
  318    H    GLN  43           H        GLN  43   4.481   2.680  -4.800
  319    HA   GLN  43           HA       GLN  43   4.290   0.363  -3.023
  320   1HB   GLN  43          1HB       GLN  43   6.635   2.130  -3.359
  321   2HB   GLN  43          2HB       GLN  43   6.164   1.801  -1.697
  322   1HG   GLN  43          1HG       GLN  43   6.616  -0.450  -1.869
  323   2HG   GLN  43          2HG       GLN  43   6.447  -0.456  -3.624
  324   1HE2  GLN  43          1HE2      GLN  43   8.161   0.255  -4.901
  325   2HE2  GLN  43          2HE2      GLN  43   9.768   0.394  -4.281
  326    H    GLY  44           H        GLY  44   3.786   0.936  -0.796
  327   1HA   GLY  44          1HA       GLY  44   3.326   3.346   0.337
  328   2HA   GLY  44          2HA       GLY  44   1.929   3.150  -0.711
  329    H    TYR  45           H        TYR  45   0.951   3.357   1.543
  330    HA   TYR  45           HA       TYR  45   0.715   0.667   2.725
  331   1HB   TYR  45          1HB       TYR  45   0.123   1.864   4.862
  332   2HB   TYR  45          2HB       TYR  45   1.792   2.064   4.341
  333    HD1  TYR  45           HD2      TYR  45   2.488   4.216   3.267
  334    HD2  TYR  45           HD1      TYR  45  -1.322   3.729   5.098
  335    HE1  TYR  45           HE2      TYR  45   2.232   6.660   3.372
  336    HE2  TYR  45           HE1      TYR  45  -1.589   6.171   5.207
  337    HH   TYR  45           HH       TYR  45   0.797   8.346   3.770
  338    H    ILE  46           H        ILE  46  -1.265  -0.196   2.817
  339    HA   ILE  46           HA       ILE  46  -3.572   1.566   2.312
  340    HB   ILE  46           HB       ILE  46  -3.197  -1.248   1.278
  341   1HG1  ILE  46          1HG1      ILE  46  -3.485   1.267  -0.356
  342   2HG1  ILE  46          2HG1      ILE  46  -1.910   0.684   0.172
  343   1HG2  ILE  46          1HG2      ILE  46  -5.473   0.686   0.864
  344   2HG2  ILE  46          2HG2      ILE  46  -5.320  -0.911   0.133
  345   3HG2  ILE  46          3HG2      ILE  46  -5.518  -0.756   1.878
  346   1HD1  ILE  46          1HD1      ILE  46  -1.888  -0.990  -1.322
  347   2HD1  ILE  46          2HD1      ILE  46  -3.617  -1.300  -1.165
  348   3HD1  ILE  46          3HD1      ILE  46  -3.048   0.033  -2.169
  349    H    GLU  47           H        GLU  47  -5.150   1.461   3.773
  350    HA   GLU  47           HA       GLU  47  -5.043  -0.686   5.772
  351   1HB   GLU  47          1HB       GLU  47  -6.471   1.976   5.902
  352   2HB   GLU  47          2HB       GLU  47  -6.344   0.804   7.207
  353   1HG   GLU  47          1HG       GLU  47  -4.177   1.329   7.662
  354   2HG   GLU  47          2HG       GLU  47  -3.830   1.818   6.005
  355    H    MET  48           H        MET  48  -6.468  -2.275   5.620
  356    HA   MET  48           HA       MET  48  -8.736  -2.069   3.855
  357   1HB   MET  48          1HB       MET  48  -7.720  -4.293   5.626
  358   2HB   MET  48          2HB       MET  48  -9.154  -4.439   4.619
  359   1HG   MET  48          1HG       MET  48  -6.907  -3.473   3.094
  360   2HG   MET  48          2HG       MET  48  -6.529  -4.992   3.904
  361   1HE   MET  48          1HE       MET  48  -8.320  -3.006   1.523
  362   2HE   MET  48          2HE       MET  48  -8.709  -4.141   0.231
  363   3HE   MET  48          3HE       MET  48  -9.911  -3.765   1.467
  364    H    LYS  49           H        LYS  49 -10.810  -3.278   4.838
  365    HA   LYS  49           HA       LYS  49 -12.091  -1.460   6.488
  366   1HB   LYS  49          1HB       LYS  49 -12.824  -3.730   5.099
  367   2HB   LYS  49          2HB       LYS  49 -13.110  -4.188   6.773
  368   1HG   LYS  49          1HG       LYS  49 -14.743  -2.593   7.073
  369   2HG   LYS  49          2HG       LYS  49 -14.137  -1.575   5.765
  370   1HD   LYS  49          1HD       LYS  49 -16.186  -2.581   5.039
  371   2HD   LYS  49          2HD       LYS  49 -14.860  -3.341   4.155
  372   1HE   LYS  49          1HE       LYS  49 -16.167  -5.151   4.784
  373   2HE   LYS  49          2HE       LYS  49 -14.928  -5.109   6.037
  374   1HZ   LYS  49          1HZ       LYS  49 -17.326  -3.564   6.576
  375   2HZ   LYS  49          2HZ       LYS  49 -16.414  -4.544   7.609
  376   3HZ   LYS  49          3HZ       LYS  49 -17.532  -5.243   6.549
  377    H    LYS  50           H        LYS  50 -10.969  -4.718   7.422
  378    HA   LYS  50           HA       LYS  50  -9.761  -3.960   9.815
  379   1HB   LYS  50          1HB       LYS  50 -12.636  -4.049   9.961
  380   2HB   LYS  50          2HB       LYS  50 -11.947  -5.294  10.995
  381   1HG   LYS  50          1HG       LYS  50 -10.700  -3.692  12.231
  382   2HG   LYS  50          2HG       LYS  50 -11.093  -2.412  11.081
  383   1HD   LYS  50          1HD       LYS  50 -12.626  -1.946  12.710
  384   2HD   LYS  50          2HD       LYS  50 -13.568  -3.078  11.737
  385   1HE   LYS  50          1HE       LYS  50 -12.932  -4.899  13.234
  386   2HE   LYS  50          2HE       LYS  50 -11.966  -3.781  14.196
  387   1HZ   LYS  50          1HZ       LYS  50 -14.897  -3.965  13.964
  388   2HZ   LYS  50          2HZ       LYS  50 -14.174  -2.506  14.421
  389   3HZ   LYS  50          3HZ       LYS  50 -13.940  -3.895  15.357
  390    H    ARG  51           H        ARG  51 -12.106  -6.583   9.272
  391    HA   ARG  51           HA       ARG  51 -10.022  -8.529   9.857
  392   1HB   ARG  51          1HB       ARG  51 -12.520  -8.500  10.703
  393   2HB   ARG  51          2HB       ARG  51 -12.826  -9.300   9.168
  394   1HG   ARG  51          1HG       ARG  51 -12.442 -11.166  10.346
  395   2HG   ARG  51          2HG       ARG  51 -10.746 -10.761  10.077
  396   1HD   ARG  51          1HD       ARG  51 -10.980  -9.376  12.248
  397   2HD   ARG  51          2HD       ARG  51 -12.424 -10.350  12.523
  398    HE   ARG  51           HE       ARG  51  -9.689 -11.203  12.744
  399   1HH1  ARG  51          1HH1      ARG  51 -12.972 -12.226  12.201
  400   2HH1  ARG  51          2HH1      ARG  51 -12.694 -13.849  12.740
  401   1HH2  ARG  51          1HH2      ARG  51  -9.310 -13.336  13.457
  402   2HH2  ARG  51          2HH2      ARG  51 -10.610 -14.479  13.455
  403    H    THR  52           H        THR  52  -9.474  -7.273   7.507
  404    HA   THR  52           HA       THR  52 -10.306  -9.170   5.416
  405    HB   THR  52           HB       THR  52  -8.825  -6.743   4.612
  406    HG1  THR  52           HG1      THR  52 -11.279  -6.660   5.985
  407   1HG2  THR  52          1HG2      THR  52 -10.624  -6.721   2.882
  408   2HG2  THR  52          2HG2      THR  52 -11.313  -8.154   3.646
  409   3HG2  THR  52          3HG2      THR  52  -9.702  -8.224   2.931
  410    H    SER  53           H        SER  53  -8.887 -10.719   4.995
  411    HA   SER  53           HA       SER  53  -6.140 -10.527   5.805
  412   1HB   SER  53          1HB       SER  53  -6.085 -12.787   4.452
  413   2HB   SER  53          2HB       SER  53  -6.905 -12.704   6.011
  414    HG   SER  53           HG       SER  53  -8.810 -12.833   5.040
  415    H    LEU  54           H        LEU  54  -4.523 -11.504   4.037
  416    HA   LEU  54           HA       LEU  54  -3.946  -9.476   2.252
  417   1HB   LEU  54          1HB       LEU  54  -2.369 -11.224   2.989
  418   2HB   LEU  54          2HB       LEU  54  -3.213 -12.387   1.968
  419    HG   LEU  54           HG       LEU  54  -2.479 -11.275  -0.020
  420   1HD1  LEU  54          1HD1      LEU  54  -1.216  -9.202   1.767
  421   2HD1  LEU  54          2HD1      LEU  54  -2.679  -8.971   0.812
  422   3HD1  LEU  54          3HD1      LEU  54  -1.137  -9.261   0.006
  423   1HD2  LEU  54          1HD2      LEU  54  -0.325 -11.712   2.030
  424   2HD2  LEU  54          2HD2      LEU  54   0.035 -11.333   0.345
  425   3HD2  LEU  54          3HD2      LEU  54  -0.860 -12.799   0.748
  426    H    ALA  55           H        ALA  55  -6.070 -12.209   1.875
  427    HA   ALA  55           HA       ALA  55  -6.300 -12.391  -0.876
  428   1HB   ALA  55          1HB       ALA  55  -7.372 -13.904   0.781
  429   2HB   ALA  55          2HB       ALA  55  -8.582 -12.654   1.075
  430   3HB   ALA  55          3HB       ALA  55  -8.448 -13.395  -0.520
  431    H    GLY  56           H        GLY  56  -7.600  -9.986   1.311
  432   1HA   GLY  56          1HA       GLY  56  -9.450  -8.838  -0.528
  433   2HA   GLY  56          2HA       GLY  56  -8.855  -8.091   0.947
  434    H    MET  57           H        MET  57  -6.153  -7.943   0.455
  435    HA   MET  57           HA       MET  57  -6.038  -5.679  -1.275
  436   1HB   MET  57          1HB       MET  57  -3.835  -7.229   0.097
  437   2HB   MET  57          2HB       MET  57  -3.612  -5.698  -0.738
  438   1HG   MET  57          1HG       MET  57  -5.674  -5.794   1.380
  439   2HG   MET  57          2HG       MET  57  -3.987  -5.871   1.885
  440   1HE   MET  57          1HE       MET  57  -5.713  -3.193  -1.063
  441   2HE   MET  57          2HE       MET  57  -6.651  -4.265  -0.023
  442   3HE   MET  57          3HE       MET  57  -6.502  -2.554   0.380
  443    H    LYS  58           H        LYS  58  -4.686  -8.962  -1.438
  444    HA   LYS  58           HA       LYS  58  -3.306  -8.745  -3.832
  445   1HB   LYS  58          1HB       LYS  58  -3.532 -10.720  -2.120
  446   2HB   LYS  58          2HB       LYS  58  -4.821 -11.249  -3.194
  447   1HG   LYS  58          1HG       LYS  58  -3.264 -11.331  -5.057
  448   2HG   LYS  58          2HG       LYS  58  -1.967 -10.744  -4.014
  449   1HD   LYS  58          1HD       LYS  58  -3.488 -13.324  -3.640
  450   2HD   LYS  58          2HD       LYS  58  -1.866 -13.178  -4.321
  451   1HE   LYS  58          1HE       LYS  58  -2.754 -12.546  -1.514
  452   2HE   LYS  58          2HE       LYS  58  -1.636 -13.807  -2.032
  453   1HZ   LYS  58          1HZ       LYS  58  -0.449 -11.616  -2.998
  454   2HZ   LYS  58          2HZ       LYS  58  -0.098 -12.290  -1.487
  455   3HZ   LYS  58          3HZ       LYS  58  -1.166 -10.984  -1.602
  456    H    LYS  59           H        LYS  59  -6.732  -9.144  -3.249
  457    HA   LYS  59           HA       LYS  59  -7.562  -9.950  -5.791
  458   1HB   LYS  59          1HB       LYS  59  -8.919  -9.753  -3.616
  459   2HB   LYS  59          2HB       LYS  59  -9.145  -8.066  -4.058
  460   1HG   LYS  59          1HG       LYS  59 -10.464  -8.580  -5.879
  461   2HG   LYS  59          2HG       LYS  59  -9.816 -10.216  -6.017
  462   1HD   LYS  59          1HD       LYS  59 -11.044 -10.951  -4.117
  463   2HD   LYS  59          2HD       LYS  59 -11.494  -9.298  -3.689
  464   1HE   LYS  59          1HE       LYS  59 -12.279 -10.303  -6.372
  465   2HE   LYS  59          2HE       LYS  59 -13.149 -10.930  -4.973
  466   1HZ   LYS  59          1HZ       LYS  59 -12.846  -8.093  -4.868
  467   2HZ   LYS  59          2HZ       LYS  59 -14.249  -9.029  -4.750
  468   3HZ   LYS  59          3HZ       LYS  59 -13.656  -8.582  -6.270
  469    H    LEU  60           H        LEU  60  -6.652  -6.808  -4.563
  470    HA   LEU  60           HA       LEU  60  -7.653  -5.367  -6.843
  471   1HB   LEU  60          1HB       LEU  60  -5.956  -4.641  -4.480
  472   2HB   LEU  60          2HB       LEU  60  -6.199  -3.515  -5.813
  473    HG   LEU  60           HG       LEU  60  -8.701  -3.801  -5.362
  474   1HD1  LEU  60          1HD1      LEU  60  -7.546  -5.445  -3.241
  475   2HD1  LEU  60          2HD1      LEU  60  -9.180  -5.425  -3.902
  476   3HD1  LEU  60          3HD1      LEU  60  -8.714  -4.255  -2.669
  477   1HD2  LEU  60          1HD2      LEU  60  -8.480  -1.790  -4.452
  478   2HD2  LEU  60          2HD2      LEU  60  -6.748  -2.087  -4.303
  479   3HD2  LEU  60          3HD2      LEU  60  -7.830  -2.485  -2.967
  480    H    ILE  61           H        ILE  61  -4.530  -6.586  -5.746
  481    HA   ILE  61           HA       ILE  61  -3.508  -6.240  -8.468
  482    HB   ILE  61           HB       ILE  61  -1.962  -5.408  -6.010
  483   1HG1  ILE  61          1HG1      ILE  61  -2.067  -3.203  -7.572
  484   2HG1  ILE  61          2HG1      ILE  61  -3.620  -3.929  -7.970
  485   1HG2  ILE  61          1HG2      ILE  61  -1.166  -6.095  -8.710
  486   2HG2  ILE  61          2HG2      ILE  61  -0.677  -4.460  -8.270
  487   3HG2  ILE  61          3HG2      ILE  61  -0.177  -5.827  -7.275
  488   1HD1  ILE  61          1HD1      ILE  61  -4.353  -2.800  -6.192
  489   2HD1  ILE  61          2HD1      ILE  61  -3.615  -4.103  -5.258
  490   3HD1  ILE  61          3HD1      ILE  61  -2.732  -2.600  -5.527
  491    HA   PRO  62           HA       PRO  62  -2.651 -10.450  -6.734
  492   1HB   PRO  62          1HB       PRO  62  -3.373 -11.772  -8.993
  493   2HB   PRO  62          2HB       PRO  62  -4.530 -11.306  -7.741
  494   1HG   PRO  62          1HG       PRO  62  -3.910  -9.960 -10.342
  495   2HG   PRO  62          2HG       PRO  62  -5.485 -10.260  -9.585
  496   1HD   PRO  62          1HD       PRO  62  -4.249  -7.853  -9.473
  497   2HD   PRO  62          2HD       PRO  62  -5.287  -8.456  -8.164
  498    H    GLY  63           H        GLY  63  -0.433 -10.294  -6.701
  499   1HA   GLY  63          1HA       GLY  63   1.364 -11.545  -7.970
  500   2HA   GLY  63          2HA       GLY  63   0.945 -10.484  -9.306
  501    H    ALA  64           H        ALA  64   1.390  -9.819  -5.841
  502    HA   ALA  64           HA       ALA  64   3.778  -8.255  -6.442
  503   1HB   ALA  64          1HB       ALA  64   2.506  -6.522  -4.768
  504   2HB   ALA  64          2HB       ALA  64   2.579  -6.363  -6.523
  505   3HB   ALA  64          3HB       ALA  64   1.172  -7.106  -5.763
  506    H    HIS  65           H        HIS  65   4.686  -7.320  -4.317
  507    HA   HIS  65           HA       HIS  65   4.671  -9.493  -2.364
  508   1HB   HIS  65          1HB       HIS  65   6.799  -8.459  -3.396
  509   2HB   HIS  65          2HB       HIS  65   6.505  -7.107  -2.306
  510    HD1  HIS  65           HD1      HIS  65   8.690  -7.637  -1.011
  511    HD2  HIS  65           HD2      HIS  65   5.874 -10.692  -0.941
  512    HE1  HIS  65           HE1      HIS  65   9.462  -9.222   0.782
  513    H    PHE  66           H        PHE  66   3.275  -9.324  -0.744
  514    HA   PHE  66           HA       PHE  66   2.729  -6.653   0.370
  515   1HB   PHE  66          1HB       PHE  66   1.003  -8.985  -0.189
  516   2HB   PHE  66          2HB       PHE  66   0.706  -8.176   1.346
  517    HD1  PHE  66           HD1      PHE  66   0.899  -7.645  -2.309
  518    HD2  PHE  66           HD2      PHE  66  -0.450  -6.138   1.436
  519    HE1  PHE  66           HE1      PHE  66  -0.414  -5.924  -3.479
  520    HE2  PHE  66           HE2      PHE  66  -1.766  -4.415   0.272
  521    HZ   PHE  66           HZ       PHE  66  -1.750  -4.307  -2.188
  522    H    GLU  67           H        GLU  67   2.357  -6.537   2.690
  523    HA   GLU  67           HA       GLU  67   3.280  -8.733   4.329
  524   1HB   GLU  67          1HB       GLU  67   5.059  -6.594   3.544
  525   2HB   GLU  67          2HB       GLU  67   4.829  -6.601   5.287
  526   1HG   GLU  67          1HG       GLU  67   5.490  -8.950   5.368
  527   2HG   GLU  67          2HG       GLU  67   5.720  -8.944   3.620
  528    H    LYS  68           H        LYS  68   1.920  -8.788   5.977
  529    HA   LYS  68           HA       LYS  68   0.886  -6.240   7.040
  530   1HB   LYS  68          1HB       LYS  68  -0.872  -7.520   5.928
  531   2HB   LYS  68          2HB       LYS  68  -0.494  -8.928   6.911
  532   1HG   LYS  68          1HG       LYS  68  -1.061  -6.579   8.518
  533   2HG   LYS  68          2HG       LYS  68  -2.400  -7.018   7.455
  534   1HD   LYS  68          1HD       LYS  68  -1.227  -9.341   8.731
  535   2HD   LYS  68          2HD       LYS  68  -1.789  -8.156   9.913
  536   1HE   LYS  68          1HE       LYS  68  -3.485  -9.085   7.608
  537   2HE   LYS  68          2HE       LYS  68  -3.467  -9.910   9.166
  538   1HZ   LYS  68          1HZ       LYS  68  -3.888  -7.439   9.981
  539   2HZ   LYS  68          2HZ       LYS  68  -5.152  -8.477   9.552
  540   3HZ   LYS  68          3HZ       LYS  68  -4.596  -7.321   8.449
  541    H    ARG  69           H        ARG  69   2.738  -8.965   7.682
  542    HA   ARG  69           HA       ARG  69   2.216  -9.696  10.271
  543   1HB   ARG  69          1HB       ARG  69   3.975 -10.684   8.815
  544   2HB   ARG  69          2HB       ARG  69   4.971  -9.264   9.105
  545   1HG   ARG  69          1HG       ARG  69   4.974  -9.794  11.513
  546   2HG   ARG  69          2HG       ARG  69   4.054 -11.259  11.164
  547   1HD   ARG  69          1HD       ARG  69   5.844 -12.337  10.291
  548   2HD   ARG  69          2HD       ARG  69   6.526 -10.865   9.600
  549    HE   ARG  69           HE       ARG  69   7.751 -10.571  11.515
  550   1HH1  ARG  69          1HH1      ARG  69   5.271 -12.946  12.087
  551   2HH1  ARG  69          2HH1      ARG  69   5.887 -13.404  13.641
  552   1HH2  ARG  69          1HH2      ARG  69   8.571 -11.165  13.559
  553   2HH2  ARG  69          2HH2      ARG  69   7.763 -12.390  14.477
  554    H    ARG  70           H        ARG  70   4.727  -7.298   9.448
  555    HA   ARG  70           HA       ARG  70   3.841  -5.278  11.158
  556   1HB   ARG  70          1HB       ARG  70   4.713  -7.360  12.678
  557   2HB   ARG  70          2HB       ARG  70   6.194  -6.428  12.511
  558   1HG   ARG  70          1HG       ARG  70   5.404  -4.684  13.739
  559   2HG   ARG  70          2HG       ARG  70   3.727  -4.968  13.266
  560   1HD   ARG  70          1HD       ARG  70   3.376  -6.057  15.168
  561   2HD   ARG  70          2HD       ARG  70   4.615  -7.231  14.725
  562    HE   ARG  70           HE       ARG  70   6.014  -5.108  15.712
  563   1HH1  ARG  70          1HH1      ARG  70   3.445  -7.129  16.911
  564   2HH1  ARG  70          2HH1      ARG  70   3.923  -6.977  18.569
  565   1HH2  ARG  70          1HH2      ARG  70   6.653  -4.900  17.892
  566   2HH2  ARG  70          2HH2      ARG  70   5.747  -5.708  19.126
  567    H    GLY  71           H        GLY  71   4.770  -5.074   8.694
  568   1HA   GLY  71          1HA       GLY  71   7.441  -4.837   8.131
  569   2HA   GLY  71          2HA       GLY  71   6.213  -3.778   7.454
  570    H    THR  72           H        THR  72   5.426  -2.118   9.263
  571    HA   THR  72           HA       THR  72   7.540  -1.166  10.972
  572    HB   THR  72           HB       THR  72   6.760   0.993   9.147
  573    HG1  THR  72           HG1      THR  72   6.986  -0.587   7.567
  574   1HG2  THR  72          1HG2      THR  72   8.473   1.688  10.460
  575   2HG2  THR  72          2HG2      THR  72   9.453   0.962   9.186
  576   3HG2  THR  72          3HG2      THR  72   9.118   0.060  10.663
  577    H    GLN  73           H        GLN  73   4.616  -1.914  10.942
  578    HA   GLN  73           HA       GLN  73   2.627  -1.208  11.813
  579   1HB   GLN  73          1HB       GLN  73   4.309   0.616  13.523
  580   2HB   GLN  73          2HB       GLN  73   2.777  -0.144  13.933
  581   1HG   GLN  73          1HG       GLN  73   3.881  -2.341  13.888
  582   2HG   GLN  73          2HG       GLN  73   5.415  -1.541  13.551
  583   1HE2  GLN  73          1HE2      GLN  73   6.411  -2.225  15.409
  584   2HE2  GLN  73          2HE2      GLN  73   5.974  -1.653  16.979
  585    H    GLY  74           H        GLY  74   1.776   1.205  12.890
  586   1HA   GLY  74          1HA       GLY  74   1.033   2.637  10.598
  587   2HA   GLY  74          2HA       GLY  74   0.861   3.210  12.251
  588    H    GLU  75           H        GLU  75   3.928   2.773  12.411
  589    HA   GLU  75           HA       GLU  75   4.665   5.451  12.108
  590   1HB   GLU  75          1HB       GLU  75   5.947   2.971  12.853
  591   2HB   GLU  75          2HB       GLU  75   7.020   3.946  11.858
  592   1HG   GLU  75          1HG       GLU  75   7.228   5.572  13.423
  593   2HG   GLU  75          2HG       GLU  75   5.605   5.319  14.064
  594    H    ALA  76           H        ALA  76   4.546   2.860   9.822
  595    HA   ALA  76           HA       ALA  76   6.373   3.798   7.907
  596   1HB   ALA  76          1HB       ALA  76   3.963   2.452   6.883
  597   2HB   ALA  76          2HB       ALA  76   5.669   2.070   6.645
  598   3HB   ALA  76          3HB       ALA  76   4.855   1.580   8.131
  599    H    ARG  77           H        ARG  77   3.358   5.034   8.890
  600    HA   ARG  77           HA       ARG  77   2.422   6.182   6.501
  601   1HB   ARG  77          1HB       ARG  77   0.966   7.475   7.848
  602   2HB   ARG  77          2HB       ARG  77   1.174   5.949   8.697
  603   1HG   ARG  77          1HG       ARG  77   2.867   7.036  10.141
  604   2HG   ARG  77          2HG       ARG  77   2.509   8.568   9.340
  605   1HD   ARG  77          1HD       ARG  77   0.511   8.803  10.385
  606   2HD   ARG  77          2HD       ARG  77   0.201   7.067  10.413
  607    HE   ARG  77           HE       ARG  77   2.302   7.581  12.168
  608   1HH1  ARG  77          1HH1      ARG  77  -1.086   8.313  11.851
  609   2HH1  ARG  77          2HH1      ARG  77  -1.356   8.421  13.559
  610   1HH2  ARG  77          1HH2      ARG  77   1.960   7.721  14.419
  611   2HH2  ARG  77          2HH2      ARG  77   0.377   8.086  15.019
  612    H    ALA  78           H        ALA  78   5.005   7.053   8.615
  613    HA   ALA  78           HA       ALA  78   5.204   9.754   7.539
  614   1HB   ALA  78          1HB       ALA  78   5.929   8.556   9.969
  615   2HB   ALA  78          2HB       ALA  78   7.438   9.013   9.177
  616   3HB   ALA  78          3HB       ALA  78   6.192  10.227   9.469
  617    H    TYR  79           H        TYR  79   7.586   7.138   8.009
  618    HA   TYR  79           HA       TYR  79   9.461   8.058   6.191
  619   1HB   TYR  79          1HB       TYR  79  10.230   6.359   7.583
  620   2HB   TYR  79          2HB       TYR  79   8.823   5.343   7.290
  621    HD1  TYR  79           HD1      TYR  79  11.296   6.961   4.998
  622    HD2  TYR  79           HD2      TYR  79   9.502   3.348   6.350
  623    HE1  TYR  79           HE1      TYR  79  12.563   5.705   3.305
  624    HE2  TYR  79           HE2      TYR  79  10.765   2.082   4.662
  625    HH   TYR  79           HH       TYR  79  12.191   2.187   2.968
  626    H    SER  80           H        SER  80   6.680   5.946   5.660
  627    HA   SER  80           HA       SER  80   5.605   5.273   3.771
  628   1HB   SER  80          1HB       SER  80   6.987   7.745   2.728
  629   2HB   SER  80          2HB       SER  80   5.897   6.780   1.733
  630    HG   SER  80           HG       SER  80   4.413   7.978   2.617
  631    H    MET  81           H        MET  81   8.227   6.535   1.835
  632    HA   MET  81           HA       MET  81   9.369   3.858   1.526
  633   1HB   MET  81          1HB       MET  81   8.454   5.588  -0.778
  634   2HB   MET  81          2HB       MET  81   9.365   4.092  -0.933
  635   1HG   MET  81          1HG       MET  81   7.544   2.837  -0.722
  636   2HG   MET  81          2HG       MET  81   6.956   3.771   0.652
  637   1HE   MET  81          1HE       MET  81   5.132   6.349  -0.122
  638   2HE   MET  81          2HE       MET  81   3.960   5.073  -0.451
  639   3HE   MET  81          3HE       MET  81   5.196   4.838   0.786
  640    H    LYS  82           H        LYS  82  11.205   4.264  -0.385
  641    HA   LYS  82           HA       LYS  82  13.180   5.813   0.946
  642   1HB   LYS  82          1HB       LYS  82  13.058   4.200  -1.558
  643   2HB   LYS  82          2HB       LYS  82  14.381   5.345  -1.378
  644   1HG   LYS  82          1HG       LYS  82  14.343   4.026   1.043
  645   2HG   LYS  82          2HG       LYS  82  13.973   2.759  -0.130
  646   1HD   LYS  82          1HD       LYS  82  16.013   2.906  -1.137
  647   2HD   LYS  82          2HD       LYS  82  16.186   4.627  -0.782
  648   1HE   LYS  82          1HE       LYS  82  17.758   3.703   0.627
  649   2HE   LYS  82          2HE       LYS  82  16.355   3.813   1.688
  650   1HZ   LYS  82          1HZ       LYS  82  17.235   1.674   1.992
  651   2HZ   LYS  82          2HZ       LYS  82  17.429   1.410   0.333
  652   3HZ   LYS  82          3HZ       LYS  82  15.878   1.449   1.008
  653    H    GLU  83           H        GLU  83  13.277   7.955   0.922
  654    HA   GLU  83           HA       GLU  83  11.911   9.594  -0.919
  655   1HB   GLU  83          1HB       GLU  83  14.101  10.160   1.073
  656   2HB   GLU  83          2HB       GLU  83  13.391  11.421   0.074
  657   1HG   GLU  83          1HG       GLU  83  11.987  11.677   1.791
  658   2HG   GLU  83          2HG       GLU  83  11.166  10.278   1.101
  659    H    ASP  84           H        ASP  84  15.197   8.374  -0.809
  660    HA   ASP  84           HA       ASP  84  16.336  10.040  -2.762
  661   1HB   ASP  84          1HB       ASP  84  16.992   7.265  -1.795
  662   2HB   ASP  84          2HB       ASP  84  17.919   8.031  -3.082
  663    H    THR  85           H        THR  85  14.482   7.061  -3.013
  664    HA   THR  85           HA       THR  85  14.768   7.076  -5.925
  665    HB   THR  85           HB       THR  85  13.499   4.904  -5.797
  666    HG1  THR  85           HG1      THR  85  13.252   3.978  -3.746
  667   1HG2  THR  85          1HG2      THR  85  15.616   4.056  -4.152
  668   2HG2  THR  85          2HG2      THR  85  16.202   5.481  -5.012
  669   3HG2  THR  85          3HG2      THR  85  15.575   4.102  -5.914
  670    H    ARG  86           H        ARG  86  12.942   8.724  -3.906
  671    HA   ARG  86           HA       ARG  86  10.278   8.189  -4.645
  672   1HB   ARG  86          1HB       ARG  86  11.366   9.757  -2.784
  673   2HB   ARG  86          2HB       ARG  86  11.093  10.982  -4.015
  674   1HG   ARG  86          1HG       ARG  86   8.901  11.032  -3.629
  675   2HG   ARG  86          2HG       ARG  86   8.779   9.272  -3.595
  676   1HD   ARG  86          1HD       ARG  86   8.144  10.127  -1.444
  677   2HD   ARG  86          2HD       ARG  86   9.698   9.308  -1.289
  678    HE   ARG  86           HE       ARG  86  10.656  11.307  -0.716
  679   1HH1  ARG  86          1HH1      ARG  86   7.531  11.899  -2.131
  680   2HH1  ARG  86          2HH1      ARG  86   7.531  13.588  -1.744
  681   1HH2  ARG  86          1HH2      ARG  86  10.668  13.529  -0.201
  682   2HH2  ARG  86          2HH2      ARG  86   9.316  14.514  -0.647
  683    H    LEU  87           H        LEU  87   9.309   8.438  -6.538
  684    HA   LEU  87           HA       LEU  87  10.482  10.297  -8.492
  685   1HB   LEU  87          1HB       LEU  87   9.627   7.614  -8.689
  686   2HB   LEU  87          2HB       LEU  87   8.498   8.583  -9.633
  687    HG   LEU  87           HG       LEU  87  11.473   8.317 -10.020
  688   1HD1  LEU  87          1HD1      LEU  87  10.595   6.567 -11.177
  689   2HD1  LEU  87          2HD1      LEU  87  10.419   7.825 -12.400
  690   3HD1  LEU  87          3HD1      LEU  87   9.036   7.357 -11.412
  691   1HD2  LEU  87          1HD2      LEU  87   9.533  10.288 -11.202
  692   2HD2  LEU  87          2HD2      LEU  87  11.062   9.870 -11.975
  693   3HD2  LEU  87          3HD2      LEU  87  11.056  10.614 -10.375
  694    H    GLU  88           H        GLU  88   7.422   9.237  -7.068
  695    HA   GLU  88           HA       GLU  88   6.302  11.872  -7.600
  696   1HB   GLU  88          1HB       GLU  88   5.674   9.672  -9.238
  697   2HB   GLU  88          2HB       GLU  88   4.287   9.892  -8.181
  698   1HG   GLU  88          1HG       GLU  88   3.854  12.027  -8.980
  699   2HG   GLU  88          2HG       GLU  88   5.480  12.216  -9.634
  700    H    GLY  89           H        GLY  89   3.976  11.939  -6.613
  701   1HA   GLY  89          1HA       GLY  89   2.525  11.422  -4.851
  702   2HA   GLY  89          2HA       GLY  89   3.656  10.191  -4.309
  703    HA   PRO  90           HA       PRO  90   3.006   9.933  -2.359
  704   1HB   PRO  90          1HB       PRO  90   1.605  10.704  -0.165
  705   2HB   PRO  90          2HB       PRO  90   3.300  10.210  -0.097
  706   1HG   PRO  90          1HG       PRO  90   2.131  12.965  -0.150
  707   2HG   PRO  90          2HG       PRO  90   3.459  12.332   0.841
  708   1HD   PRO  90          1HD       PRO  90   3.881  13.816  -1.384
  709   2HD   PRO  90          2HD       PRO  90   4.996  12.536  -0.865
  710    H    TRP  91           H        TRP  91   0.667   9.336  -2.095
  711    HA   TRP  91           HA       TRP  91  -1.183  11.359  -3.123
  712   1HB   TRP  91          1HB       TRP  91  -0.582   8.699  -4.408
  713   2HB   TRP  91          2HB       TRP  91  -2.101   9.547  -4.688
  714    HD1  TRP  91           HD1      TRP  91  -0.890  12.510  -4.922
  715    HE1  TRP  91           HE1      TRP  91   0.440  13.146  -7.031
  716    HE3  TRP  91           HE3      TRP  91   0.388   7.825  -6.518
  717    HZ2  TRP  91           HZ2      TRP  91   1.845  11.835  -9.099
  718    HZ3  TRP  91           HZ3      TRP  91   1.727   7.602  -8.570
  719    HH2  TRP  91           HH2      TRP  91   2.438   9.567  -9.833
  720    H    GLU  92           H        GLU  92  -3.176  11.246  -2.253
  721    HA   GLU  92           HA       GLU  92  -3.796   8.886  -0.599
  722   1HB   GLU  92          1HB       GLU  92  -4.082  11.804  -0.065
  723   2HB   GLU  92          2HB       GLU  92  -5.301  10.723   0.595
  724   1HG   GLU  92          1HG       GLU  92  -3.639  11.072   2.259
  725   2HG   GLU  92          2HG       GLU  92  -3.481   9.419   1.668
  726    H    TYR  93           H        TYR  93  -5.763   7.949  -0.817
  727    HA   TYR  93           HA       TYR  93  -7.814   9.293  -2.410
  728   1HB   TYR  93          1HB       TYR  93  -6.641   6.582  -3.040
  729   2HB   TYR  93          2HB       TYR  93  -8.171   7.152  -3.698
  730    HD1  TYR  93           HD1      TYR  93  -8.194   9.119  -5.229
  731    HD2  TYR  93           HD2      TYR  93  -4.564   7.317  -3.936
  732    HE1  TYR  93           HE1      TYR  93  -6.995  10.232  -7.065
  733    HE2  TYR  93           HE2      TYR  93  -3.354   8.425  -5.768
  734    HH   TYR  93           HH       TYR  93  -4.903  10.809  -7.815
  735    H    GLY  94           H        GLY  94  -9.924   8.174  -2.299
  736   1HA   GLY  94          1HA       GLY  94 -11.482   6.770  -1.238
  737   2HA   GLY  94          2HA       GLY  94 -10.239   6.293  -0.091
  738    H    GLU  95           H        GLU  95 -11.609   6.619   1.680
  739    HA   GLU  95           HA       GLU  95 -13.162   8.830   2.235
  740   1HB   GLU  95          1HB       GLU  95 -13.312   6.904   3.641
  741   2HB   GLU  95          2HB       GLU  95 -11.616   7.022   4.089
  742   1HG   GLU  95          1HG       GLU  95 -13.064   7.757   5.895
  743   2HG   GLU  95          2HG       GLU  95 -12.058   9.077   5.304
  Start of MODEL   15
    1   1H    ALA   2          1H        ALA   2 -15.581   0.640  18.853
    2    HA   ALA   2           HA       ALA   2 -14.148   1.114  16.886
    3   1HB   ALA   2          1HB       ALA   2 -13.361   3.357  17.574
    4   2HB   ALA   2          2HB       ALA   2 -15.035   3.039  18.031
    5   3HB   ALA   2          3HB       ALA   2 -13.758   2.951  19.244
    6    H    ARG   3           H        ARG   3 -12.526  -0.372  16.479
    7    HA   ARG   3           HA       ARG   3 -10.012   0.019  17.963
    8   1HB   ARG   3          1HB       ARG   3 -11.200  -2.398  16.631
    9   2HB   ARG   3          2HB       ARG   3  -9.469  -2.289  16.916
   10   1HG   ARG   3          1HG       ARG   3 -10.251  -1.713  19.364
   11   2HG   ARG   3          2HG       ARG   3 -11.698  -2.586  18.854
   12   1HD   ARG   3          1HD       ARG   3 -10.490  -4.561  18.445
   13   2HD   ARG   3          2HD       ARG   3  -8.942  -3.717  18.473
   14    HE   ARG   3           HE       ARG   3  -9.919  -3.334  20.972
   15   1HH1  ARG   3          1HH1      ARG   3  -9.398  -6.150  18.992
   16   2HH1  ARG   3          2HH1      ARG   3  -9.100  -7.201  20.337
   17   1HH2  ARG   3          1HH2      ARG   3  -9.529  -4.708  22.751
   18   2HH2  ARG   3          2HH2      ARG   3  -9.176  -6.380  22.474
   19    H    GLN   4           H        GLN   4  -8.029  -0.080  16.749
   20    HA   GLN   4           HA       GLN   4  -8.361   1.006  14.045
   21   1HB   GLN   4          1HB       GLN   4  -6.369   1.366  16.208
   22   2HB   GLN   4          2HB       GLN   4  -5.746   1.394  14.564
   23   1HG   GLN   4          1HG       GLN   4  -7.030   3.263  13.987
   24   2HG   GLN   4          2HG       GLN   4  -8.077   3.083  15.394
   25   1HE2  GLN   4          1HE2      GLN   4  -5.646   4.860  14.126
   26   2HE2  GLN   4          2HE2      GLN   4  -4.947   5.488  15.575
   27    H    VAL   5           H        VAL   5  -6.895   0.334  12.356
   28    HA   VAL   5           HA       VAL   5  -5.974  -2.447  12.698
   29    HB   VAL   5           HB       VAL   5  -6.454  -2.845  10.349
   30   1HG1  VAL   5          1HG1      VAL   5  -8.478  -2.138  12.310
   31   2HG1  VAL   5          2HG1      VAL   5  -9.066  -2.006  10.651
   32   3HG1  VAL   5          3HG1      VAL   5  -8.387  -3.528  11.229
   33   1HG2  VAL   5          1HG2      VAL   5  -6.683  -1.204   8.870
   34   2HG2  VAL   5          2HG2      VAL   5  -8.062  -0.548   9.752
   35   3HG2  VAL   5          3HG2      VAL   5  -6.426  -0.040  10.169
   36    H    ILE   6           H        ILE   6  -4.157  -3.093  11.353
   37    HA   ILE   6           HA       ILE   6  -2.159  -0.993  11.234
   38    HB   ILE   6           HB       ILE   6  -1.883  -3.947  10.667
   39   1HG1  ILE   6          1HG1      ILE   6  -0.554  -3.564  12.974
   40   2HG1  ILE   6          2HG1      ILE   6  -1.786  -2.319  13.149
   41   1HG2  ILE   6          1HG2      ILE   6  -0.013  -3.155   9.657
   42   2HG2  ILE   6          2HG2      ILE   6   0.002  -1.668  10.603
   43   3HG2  ILE   6          3HG2      ILE   6   0.585  -3.172  11.316
   44   1HD1  ILE   6          1HD1      ILE   6  -2.390  -5.204  12.560
   45   2HD1  ILE   6          2HD1      ILE   6  -2.364  -4.504  14.179
   46   3HD1  ILE   6          3HD1      ILE   6  -3.533  -3.931  12.989
   47    H    CYS   7           H        CYS   7  -0.938  -0.469   9.394
   48    HA   CYS   7           HA       CYS   7  -2.427  -0.516   6.943
   49   1HB   CYS   7          1HB       CYS   7   0.421   0.421   7.252
   50   2HB   CYS   7          2HB       CYS   7  -0.782   0.960   6.087
   51    HG   CYS   7           HG       CYS   7  -2.086   2.651   7.650
   52    H    TRP   8           H        TRP   8  -1.578  -1.266   4.892
   53    HA   TRP   8           HA       TRP   8  -0.002  -3.729   5.219
   54   1HB   TRP   8          1HB       TRP   8  -2.066  -2.942   3.158
   55   2HB   TRP   8          2HB       TRP   8  -1.048  -4.372   3.007
   56    HD1  TRP   8           HD1      TRP   8  -3.535  -2.920   5.621
   57    HE1  TRP   8           HE1      TRP   8  -4.838  -4.891   6.643
   58    HE3  TRP   8           HE3      TRP   8  -1.227  -6.773   3.178
   59    HZ2  TRP   8           HZ2      TRP   8  -4.881  -7.706   6.441
   60    HZ3  TRP   8           HZ3      TRP   8  -1.958  -9.075   3.650
   61    HH2  TRP   8           HH2      TRP   8  -3.747  -9.530   5.248
   62    H    CYS   9           H        CYS   9   2.039  -3.579   4.589
   63    HA   CYS   9           HA       CYS   9   2.795  -1.567   2.608
   64   1HB   CYS   9          1HB       CYS   9   3.961  -2.179   4.960
   65   2HB   CYS   9          2HB       CYS   9   4.867  -3.250   3.899
   66    HG   CYS   9           HG       CYS   9   6.565  -1.441   3.275
   67    H    PHE  10           H        PHE  10   2.968  -2.136   0.554
   68    HA   PHE  10           HA       PHE  10   4.025  -4.791  -0.106
   69   1HB   PHE  10          1HB       PHE  10   2.295  -5.362  -1.530
   70   2HB   PHE  10          2HB       PHE  10   1.415  -4.516  -0.261
   71    HD1  PHE  10           HD2      PHE  10   1.093  -1.946  -0.653
   72    HD2  PHE  10           HD1      PHE  10   1.938  -4.772  -3.722
   73    HE1  PHE  10           HE2      PHE  10   0.167  -0.400  -2.326
   74    HE2  PHE  10           HE1      PHE  10   1.014  -3.229  -5.401
   75    HZ   PHE  10           HZ       PHE  10   0.126  -1.040  -4.704
   76    H    THR  11           H        THR  11   4.742  -4.938  -2.391
   77    HA   THR  11           HA       THR  11   5.492  -2.331  -3.525
   78    HB   THR  11           HB       THR  11   7.453  -4.597  -3.601
   79    HG1  THR  11           HG1      THR  11   8.202  -4.107  -1.623
   80   1HG2  THR  11          1HG2      THR  11   8.751  -3.075  -4.586
   81   2HG2  THR  11          2HG2      THR  11   8.514  -1.943  -3.255
   82   3HG2  THR  11          3HG2      THR  11   7.372  -1.977  -4.598
   83    H    LEU  12           H        LEU  12   4.871  -2.186  -5.571
   84    HA   LEU  12           HA       LEU  12   4.487  -4.668  -7.106
   85   1HB   LEU  12          1HB       LEU  12   2.434  -3.476  -6.842
   86   2HB   LEU  12          2HB       LEU  12   3.188  -1.961  -7.336
   87    HG   LEU  12           HG       LEU  12   3.304  -2.662  -9.604
   88   1HD1  LEU  12          1HD1      LEU  12   2.754  -5.363  -8.469
   89   2HD1  LEU  12          2HD1      LEU  12   3.953  -4.863  -9.662
   90   3HD1  LEU  12          3HD1      LEU  12   2.256  -4.999 -10.122
   91   1HD2  LEU  12          1HD2      LEU  12   0.712  -3.111  -8.203
   92   2HD2  LEU  12          2HD2      LEU  12   0.826  -3.459  -9.928
   93   3HD2  LEU  12          3HD2      LEU  12   1.180  -1.838  -9.330
   94    H    ASN  13           H        ASN  13   5.884  -5.063  -8.679
   95    HA   ASN  13           HA       ASN  13   7.505  -2.847  -9.720
   96   1HB   ASN  13          1HB       ASN  13   8.899  -4.829 -10.644
   97   2HB   ASN  13          2HB       ASN  13   8.969  -4.484  -8.919
   98   1HD2  ASN  13          1HD2      ASN  13   7.680  -6.611 -11.366
   99   2HD2  ASN  13          2HD2      ASN  13   7.303  -7.922 -10.305
  100    H    ASN  14           H        ASN  14   7.493  -2.297 -11.834
  101    HA   ASN  14           HA       ASN  14   6.636  -2.051 -13.934
  102   1HB   ASN  14          1HB       ASN  14   8.138  -3.986 -14.266
  103   2HB   ASN  14          2HB       ASN  14   6.802  -5.073 -13.898
  104   1HD2  ASN  14          1HD2      ASN  14   7.880  -5.598 -16.175
  105   2HD2  ASN  14          2HD2      ASN  14   6.974  -4.990 -17.514
  106    HA   PRO  15           HA       PRO  15   2.326  -3.152 -12.470
  107   1HB   PRO  15          1HB       PRO  15   1.425  -0.594 -12.349
  108   2HB   PRO  15          2HB       PRO  15   2.227  -1.395 -10.993
  109   1HG   PRO  15          1HG       PRO  15   3.355   0.523 -12.995
  110   2HG   PRO  15          2HG       PRO  15   3.607   0.461 -11.241
  111   1HD   PRO  15          1HD       PRO  15   5.414  -0.511 -13.009
  112   2HD   PRO  15          2HD       PRO  15   5.173  -1.223 -11.400
  113    H    LEU  16           H        LEU  16   0.341  -2.852 -13.640
  114    HA   LEU  16           HA       LEU  16   0.800  -2.137 -16.454
  115   1HB   LEU  16          1HB       LEU  16  -1.195  -3.961 -15.134
  116   2HB   LEU  16          2HB       LEU  16  -1.314  -3.476 -16.824
  117    HG   LEU  16           HG       LEU  16   1.252  -4.682 -15.979
  118   1HD1  LEU  16          1HD1      LEU  16   0.165  -6.969 -16.388
  119   2HD1  LEU  16          2HD1      LEU  16  -1.354  -6.165 -15.993
  120   3HD1  LEU  16          3HD1      LEU  16  -0.051  -6.218 -14.806
  121   1HD2  LEU  16          1HD2      LEU  16  -0.548  -5.113 -18.361
  122   2HD2  LEU  16          2HD2      LEU  16   1.109  -5.689 -18.176
  123   3HD2  LEU  16          3HD2      LEU  16   0.783  -3.958 -18.288
  124    H    SER  17           H        SER  17  -0.503  -0.876 -13.703
  125    HA   SER  17           HA       SER  17  -1.707   1.309 -14.958
  126   1HB   SER  17          1HB       SER  17  -4.102   0.547 -13.917
  127   2HB   SER  17          2HB       SER  17  -3.657   0.350 -15.612
  128    HG   SER  17           HG       SER  17  -4.363  -1.540 -14.007
  129    HA   PRO  18           HA       PRO  18  -1.443   2.955 -10.901
  130   1HB   PRO  18          1HB       PRO  18  -3.474   4.756 -10.859
  131   2HB   PRO  18          2HB       PRO  18  -1.993   4.999 -11.794
  132   1HG   PRO  18          1HG       PRO  18  -4.672   4.025 -12.709
  133   2HG   PRO  18          2HG       PRO  18  -3.576   5.181 -13.487
  134   1HD   PRO  18          1HD       PRO  18  -3.756   2.594 -14.265
  135   2HD   PRO  18          2HD       PRO  18  -2.244   3.519 -14.367
  136    H    LEU  19           H        LEU  19  -2.329   2.903  -8.814
  137    HA   LEU  19           HA       LEU  19  -4.268   0.840  -8.380
  138   1HB   LEU  19          1HB       LEU  19  -3.150   2.737  -6.330
  139   2HB   LEU  19          2HB       LEU  19  -3.834   1.136  -6.059
  140    HG   LEU  19           HG       LEU  19  -1.208   1.761  -7.407
  141   1HD1  LEU  19          1HD1      LEU  19  -1.672   0.251  -4.853
  142   2HD1  LEU  19          2HD1      LEU  19  -1.402   1.993  -4.886
  143   3HD1  LEU  19          3HD1      LEU  19  -0.160   0.897  -5.490
  144   1HD2  LEU  19          1HD2      LEU  19  -1.328  -0.945  -6.817
  145   2HD2  LEU  19          2HD2      LEU  19  -1.447  -0.208  -8.415
  146   3HD2  LEU  19          3HD2      LEU  19  -2.911  -0.578  -7.503
  147    H    SER  20           H        SER  20  -6.097   1.205  -6.799
  148    HA   SER  20           HA       SER  20  -7.298   3.851  -6.913
  149   1HB   SER  20          1HB       SER  20  -9.435   2.954  -7.827
  150   2HB   SER  20          2HB       SER  20  -8.106   2.868  -8.982
  151    HG   SER  20           HG       SER  20  -8.826   0.868  -9.106
  152    H    LEU  21           H        LEU  21  -9.283   3.982  -5.588
  153    HA   LEU  21           HA       LEU  21  -8.893   2.809  -3.058
  154   1HB   LEU  21          1HB       LEU  21  -9.974   4.899  -3.134
  155   2HB   LEU  21          2HB       LEU  21 -11.173   4.325  -4.291
  156    HG   LEU  21           HG       LEU  21 -12.091   2.862  -2.468
  157   1HD1  LEU  21          1HD1      LEU  21 -11.015   4.477  -0.325
  158   2HD1  LEU  21          2HD1      LEU  21  -9.753   3.570  -1.157
  159   3HD1  LEU  21          3HD1      LEU  21 -11.137   2.724  -0.466
  160   1HD2  LEU  21          1HD2      LEU  21 -12.221   5.784  -2.665
  161   2HD2  LEU  21          2HD2      LEU  21 -12.779   5.126  -1.127
  162   3HD2  LEU  21          3HD2      LEU  21 -13.516   4.586  -2.636
  163    H    HIS  22           H        HIS  22 -10.190   1.315  -1.907
  164    HA   HIS  22           HA       HIS  22 -11.656  -0.566  -3.638
  165   1HB   HIS  22          1HB       HIS  22  -9.444  -1.319  -2.548
  166   2HB   HIS  22          2HB       HIS  22 -10.349  -1.337  -1.038
  167    HD1  HIS  22           HD1      HIS  22 -10.530  -3.794  -0.612
  168    HD2  HIS  22           HD2      HIS  22 -11.669  -2.766  -4.473
  169    HE1  HIS  22           HE1      HIS  22 -11.482  -5.895  -1.615
  170    H    ASP  23           H        ASP  23 -13.667  -1.201  -3.048
  171    HA   ASP  23           HA       ASP  23 -15.151   0.377  -1.261
  172   1HB   ASP  23          1HB       ASP  23 -15.661  -2.106  -2.826
  173   2HB   ASP  23          2HB       ASP  23 -16.781  -1.717  -1.523
  174    H    SER  24           H        SER  24 -13.261  -2.466  -0.782
  175    HA   SER  24           HA       SER  24 -14.512  -3.161   1.734
  176   1HB   SER  24          1HB       SER  24 -11.892  -4.247   0.715
  177   2HB   SER  24          2HB       SER  24 -13.055  -5.022   1.790
  178    HG   SER  24           HG       SER  24 -13.360  -5.916  -0.201
  179    H    MET  25           H        MET  25 -11.534  -1.629   0.618
  180    HA   MET  25           HA       MET  25 -10.412  -1.357   3.234
  181   1HB   MET  25          1HB       MET  25  -8.622  -0.276   2.206
  182   2HB   MET  25          2HB       MET  25  -9.201  -1.361   0.949
  183   1HG   MET  25          1HG       MET  25 -10.278   0.412  -0.203
  184   2HG   MET  25          2HG       MET  25 -10.022   1.522   1.141
  185   1HE   MET  25          1HE       MET  25  -8.121  -1.097  -0.706
  186   2HE   MET  25          2HE       MET  25  -7.944  -0.079  -2.135
  187   3HE   MET  25          3HE       MET  25  -6.554  -0.384  -1.092
  188    H    LYS  26           H        LYS  26  -9.598   1.119   3.632
  189    HA   LYS  26           HA       LYS  26 -12.027   2.787   3.615
  190   1HB   LYS  26          1HB       LYS  26 -10.637   1.720   5.862
  191   2HB   LYS  26          2HB       LYS  26 -10.393   3.461   5.853
  192   1HG   LYS  26          1HG       LYS  26 -12.326   3.455   6.997
  193   2HG   LYS  26          2HG       LYS  26 -13.035   3.371   5.383
  194   1HD   LYS  26          1HD       LYS  26 -13.821   1.303   5.725
  195   2HD   LYS  26          2HD       LYS  26 -12.306   0.756   6.446
  196   1HE   LYS  26          1HE       LYS  26 -14.143   2.549   7.981
  197   2HE   LYS  26          2HE       LYS  26 -14.476   0.821   7.881
  198   1HZ   LYS  26          1HZ       LYS  26 -11.901   0.790   8.542
  199   2HZ   LYS  26          2HZ       LYS  26 -13.152   0.767   9.680
  200   3HZ   LYS  26          3HZ       LYS  26 -12.373   2.222   9.309
  201    H    TYR  27           H        TYR  27  -8.500   2.701   3.706
  202    HA   TYR  27           HA       TYR  27  -8.479   5.345   2.425
  203   1HB   TYR  27          1HB       TYR  27  -7.818   5.219   4.977
  204   2HB   TYR  27          2HB       TYR  27  -6.289   4.634   4.333
  205    HD1  TYR  27           HD1      TYR  27  -8.674   7.315   3.273
  206    HD2  TYR  27           HD2      TYR  27  -4.695   6.296   4.381
  207    HE1  TYR  27           HE1      TYR  27  -7.970   9.634   2.855
  208    HE2  TYR  27           HE2      TYR  27  -3.980   8.612   3.966
  209    HH   TYR  27           HH       TYR  27  -6.295  11.143   3.209
  210    H    LEU  28           H        LEU  28  -6.780   5.715   0.973
  211    HA   LEU  28           HA       LEU  28  -5.141   3.364   0.304
  212   1HB   LEU  28          1HB       LEU  28  -6.768   3.337  -1.367
  213   2HB   LEU  28          2HB       LEU  28  -6.803   5.095  -1.489
  214    HG   LEU  28           HG       LEU  28  -4.733   5.121  -2.686
  215   1HD1  LEU  28          1HD1      LEU  28  -3.204   3.594  -2.162
  216   2HD1  LEU  28          2HD1      LEU  28  -4.070   2.490  -3.229
  217   3HD1  LEU  28          3HD1      LEU  28  -4.416   2.497  -1.500
  218   1HD2  LEU  28          1HD2      LEU  28  -6.415   2.878  -3.792
  219   2HD2  LEU  28          2HD2      LEU  28  -5.347   3.954  -4.694
  220   3HD2  LEU  28          3HD2      LEU  28  -6.810   4.590  -3.939
  221    H    VAL  29           H        VAL  29  -3.033   3.770   0.191
  222    HA   VAL  29           HA       VAL  29  -2.117   6.466  -0.501
  223    HB   VAL  29           HB       VAL  29  -1.255   4.938   1.955
  224   1HG1  VAL  29          1HG1      VAL  29   0.776   5.763   1.314
  225   2HG1  VAL  29          2HG1      VAL  29   0.072   7.117   0.428
  226   3HG1  VAL  29          3HG1      VAL  29   0.152   7.160   2.189
  227   1HG2  VAL  29          1HG2      VAL  29  -1.809   7.541   2.654
  228   2HG2  VAL  29          2HG2      VAL  29  -3.045   7.179   1.449
  229   3HG2  VAL  29          3HG2      VAL  29  -2.883   6.160   2.879
  230    H    TYR  30           H        TYR  30  -0.656   6.347  -2.063
  231    HA   TYR  30           HA       TYR  30   1.392   4.300  -2.035
  232   1HB   TYR  30          1HB       TYR  30   0.888   3.278  -4.085
  233   2HB   TYR  30          2HB       TYR  30  -0.672   3.391  -3.278
  234    HD1  TYR  30           HD2      TYR  30  -2.381   4.928  -4.080
  235    HD2  TYR  30           HD1      TYR  30   1.384   4.629  -6.040
  236    HE1  TYR  30           HE2      TYR  30  -3.302   6.124  -6.022
  237    HE2  TYR  30           HE1      TYR  30   0.473   5.825  -7.986
  238    HH   TYR  30           HH       TYR  30  -2.733   7.249  -7.931
  239    H    GLN  31           H        GLN  31   3.095   4.707  -3.591
  240    HA   GLN  31           HA       GLN  31   3.062   7.337  -4.863
  241   1HB   GLN  31          1HB       GLN  31   5.065   8.092  -3.841
  242   2HB   GLN  31          2HB       GLN  31   4.029   7.534  -2.534
  243   1HG   GLN  31          1HG       GLN  31   6.052   6.641  -1.936
  244   2HG   GLN  31          2HG       GLN  31   5.320   5.300  -2.817
  245   1HE2  GLN  31          1HE2      GLN  31   7.579   7.981  -3.086
  246   2HE2  GLN  31          2HE2      GLN  31   8.538   7.288  -4.345
  247    H    THR  32           H        THR  32   4.775   7.632  -6.428
  248    HA   THR  32           HA       THR  32   5.509   5.094  -7.676
  249    HB   THR  32           HB       THR  32   5.881   7.844  -8.859
  250    HG1  THR  32           HG1      THR  32   3.811   7.159  -9.962
  251   1HG2  THR  32          1HG2      THR  32   5.638   5.084 -10.061
  252   2HG2  THR  32          2HG2      THR  32   7.089   6.085 -10.000
  253   3HG2  THR  32          3HG2      THR  32   5.715   6.583 -10.987
  254    H    GLU  33           H        GLU  33   7.558   4.389  -7.893
  255    HA   GLU  33           HA       GLU  33   9.731   6.193  -7.060
  256   1HB   GLU  33          1HB       GLU  33   8.952   3.586  -5.973
  257   2HB   GLU  33          2HB       GLU  33  10.654   3.686  -6.401
  258   1HG   GLU  33          1HG       GLU  33  10.221   6.044  -5.065
  259   2HG   GLU  33          2HG       GLU  33   9.206   4.899  -4.191
  260    H    GLN  34           H        GLN  34  11.843   5.648  -7.923
  261    HA   GLN  34           HA       GLN  34  11.620   4.433 -10.586
  262   1HB   GLN  34          1HB       GLN  34  12.573   6.875  -9.935
  263   2HB   GLN  34          2HB       GLN  34  14.060   5.939  -9.857
  264   1HG   GLN  34          1HG       GLN  34  13.292   5.056 -12.185
  265   2HG   GLN  34          2HG       GLN  34  12.304   6.516 -12.194
  266   1HE2  GLN  34          1HE2      GLN  34  15.585   5.797 -11.051
  267   2HE2  GLN  34          2HE2      GLN  34  16.360   7.043 -11.963
  268    H    GLY  35           H        GLY  35  12.927   2.775 -11.233
  269   1HA   GLY  35          1HA       GLY  35  15.314   1.903 -10.266
  270   2HA   GLY  35          2HA       GLY  35  14.151   1.215  -9.142
  271    H    GLU  36           H        GLU  36  15.565  -0.609 -10.344
  272    HA   GLU  36           HA       GLU  36  15.664  -2.286 -11.922
  273   1HB   GLU  36          1HB       GLU  36  13.405  -3.462 -12.088
  274   2HB   GLU  36          2HB       GLU  36  14.082  -3.261 -10.478
  275   1HG   GLU  36          1HG       GLU  36  12.621  -1.376 -10.065
  276   2HG   GLU  36          2HG       GLU  36  11.982  -1.488 -11.703
  277    H    ALA  37           H        ALA  37  16.247  -1.058 -13.766
  278    HA   ALA  37           HA       ALA  37  16.057  -0.450 -15.952
  279   1HB   ALA  37          1HB       ALA  37  14.481  -1.524 -17.309
  280   2HB   ALA  37          2HB       ALA  37  14.758  -2.651 -15.980
  281   3HB   ALA  37          3HB       ALA  37  13.306  -1.650 -15.999
  282    H    GLY  38           H        GLY  38  14.614   0.855 -17.504
  283   1HA   GLY  38          1HA       GLY  38  14.039   3.322 -16.404
  284   2HA   GLY  38          2HA       GLY  38  13.395   2.754 -17.937
  285    H    ASN  39           H        ASN  39  11.989   0.507 -16.597
  286    HA   ASN  39           HA       ASN  39   9.482   1.673 -16.295
  287   1HB   ASN  39          1HB       ASN  39  10.271  -0.901 -14.939
  288   2HB   ASN  39          2HB       ASN  39   8.704  -0.457 -15.609
  289   1HD2  ASN  39          1HD2      ASN  39  11.320  -2.325 -16.098
  290   2HD2  ASN  39          2HD2      ASN  39  11.254  -2.498 -17.815
  291    H    ILE  40           H        ILE  40   8.106   1.530 -14.288
  292    HA   ILE  40           HA       ILE  40   9.656   2.379 -11.928
  293    HB   ILE  40           HB       ILE  40   7.569   3.741 -11.351
  294   1HG1  ILE  40          1HG1      ILE  40   7.089   3.287 -14.304
  295   2HG1  ILE  40          2HG1      ILE  40   6.051   2.758 -12.985
  296   1HG2  ILE  40          1HG2      ILE  40   8.331   5.649 -12.668
  297   2HG2  ILE  40          2HG2      ILE  40   9.695   4.733 -12.029
  298   3HG2  ILE  40          3HG2      ILE  40   9.237   4.566 -13.724
  299   1HD1  ILE  40          1HD1      ILE  40   6.123   5.276 -14.363
  300   2HD1  ILE  40          2HD1      ILE  40   4.922   4.642 -13.238
  301   3HD1  ILE  40          3HD1      ILE  40   6.335   5.503 -12.627
  302    H    HIS  41           H        HIS  41   8.365   2.191  -9.864
  303    HA   HIS  41           HA       HIS  41   6.569  -0.138  -9.925
  304   1HB   HIS  41          1HB       HIS  41   7.749  -0.585  -7.580
  305   2HB   HIS  41          2HB       HIS  41   8.393  -1.237  -9.084
  306    HD1  HIS  41           HD1      HIS  41  10.848  -1.208  -8.608
  307    HD2  HIS  41           HD2      HIS  41   9.027   2.429  -7.765
  308    HE1  HIS  41           HE1      HIS  41  12.727   0.378  -8.083
  309    H    PHE  42           H        PHE  42   5.018  -0.238  -8.257
  310    HA   PHE  42           HA       PHE  42   4.505   2.363  -6.987
  311   1HB   PHE  42          1HB       PHE  42   2.712   0.175  -7.978
  312   2HB   PHE  42          2HB       PHE  42   2.142   1.268  -6.721
  313    HD1  PHE  42           HD1      PHE  42   4.270   1.941  -9.696
  314    HD2  PHE  42           HD2      PHE  42   0.558   2.618  -7.726
  315    HE1  PHE  42           HE1      PHE  42   3.663   3.594 -11.415
  316    HE2  PHE  42           HE2      PHE  42  -0.055   4.271  -9.441
  317    HZ   PHE  42           HZ       PHE  42   1.497   4.760 -11.289
  318    H    GLN  43           H        GLN  43   4.628   2.541  -4.848
  319    HA   GLN  43           HA       GLN  43   4.197   0.195  -3.164
  320   1HB   GLN  43          1HB       GLN  43   6.292   1.143  -1.832
  321   2HB   GLN  43          2HB       GLN  43   6.469  -0.043  -3.118
  322   1HG   GLN  43          1HG       GLN  43   6.526   2.752  -4.003
  323   2HG   GLN  43          2HG       GLN  43   7.856   2.272  -2.950
  324   1HE2  GLN  43          1HE2      GLN  43   9.562   1.493  -3.943
  325   2HE2  GLN  43          2HE2      GLN  43   9.583   0.717  -5.486
  326    H    GLY  44           H        GLY  44   3.580   0.672  -1.031
  327   1HA   GLY  44          1HA       GLY  44   3.616   3.136   0.230
  328   2HA   GLY  44          2HA       GLY  44   2.144   3.109  -0.729
  329    H    TYR  45           H        TYR  45   0.989   3.267   1.282
  330    HA   TYR  45           HA       TYR  45   0.801   0.674   2.671
  331   1HB   TYR  45          1HB       TYR  45   0.931   3.445   3.746
  332   2HB   TYR  45          2HB       TYR  45  -0.138   2.311   4.563
  333    HD1  TYR  45           HD2      TYR  45   1.008  -0.068   5.026
  334    HD2  TYR  45           HD1      TYR  45   3.095   3.606   4.519
  335    HE1  TYR  45           HE2      TYR  45   2.926  -0.994   6.255
  336    HE2  TYR  45           HE1      TYR  45   5.019   2.689   5.746
  337    HH   TYR  45           HH       TYR  45   5.958   0.374   6.232
  338    H    ILE  46           H        ILE  46  -1.221  -0.130   3.083
  339    HA   ILE  46           HA       ILE  46  -3.539   1.482   2.290
  340    HB   ILE  46           HB       ILE  46  -3.079  -1.349   1.340
  341   1HG1  ILE  46          1HG1      ILE  46  -3.223   1.173  -0.316
  342   2HG1  ILE  46          2HG1      ILE  46  -1.706   0.457   0.215
  343   1HG2  ILE  46          1HG2      ILE  46  -5.146  -1.083   0.113
  344   2HG2  ILE  46          2HG2      ILE  46  -5.429  -0.797   1.829
  345   3HG2  ILE  46          3HG2      ILE  46  -5.322   0.565   0.714
  346   1HD1  ILE  46          1HD1      ILE  46  -3.762  -0.882  -1.525
  347   2HD1  ILE  46          2HD1      ILE  46  -2.246  -0.166  -2.073
  348   3HD1  ILE  46          3HD1      ILE  46  -2.224  -1.575  -1.013
  349    H    GLU  47           H        GLU  47  -5.114   1.378   3.748
  350    HA   GLU  47           HA       GLU  47  -5.018  -0.768   5.751
  351   1HB   GLU  47          1HB       GLU  47  -6.448   1.893   5.884
  352   2HB   GLU  47          2HB       GLU  47  -6.313   0.719   7.186
  353   1HG   GLU  47          1HG       GLU  47  -4.114   1.215   7.597
  354   2HG   GLU  47          2HG       GLU  47  -3.828   1.805   5.961
  355    H    MET  48           H        MET  48  -6.453  -2.348   5.592
  356    HA   MET  48           HA       MET  48  -8.702  -2.136   3.804
  357   1HB   MET  48          1HB       MET  48  -7.725  -4.359   5.599
  358   2HB   MET  48          2HB       MET  48  -9.142  -4.499   4.566
  359   1HG   MET  48          1HG       MET  48  -6.838  -3.556   3.098
  360   2HG   MET  48          2HG       MET  48  -6.526  -5.096   3.895
  361   1HE   MET  48          1HE       MET  48  -8.272  -3.014   1.536
  362   2HE   MET  48          2HE       MET  48  -8.696  -4.106   0.218
  363   3HE   MET  48          3HE       MET  48  -9.871  -3.756   1.486
  364    H    LYS  49           H        LYS  49 -10.793  -3.328   4.769
  365    HA   LYS  49           HA       LYS  49 -12.092  -1.499   6.385
  366   1HB   LYS  49          1HB       LYS  49 -12.803  -3.795   5.030
  367   2HB   LYS  49          2HB       LYS  49 -13.102  -4.226   6.708
  368   1HG   LYS  49          1HG       LYS  49 -14.771  -2.681   6.955
  369   2HG   LYS  49          2HG       LYS  49 -14.125  -1.620   5.702
  370   1HD   LYS  49          1HD       LYS  49 -14.710  -3.782   4.215
  371   2HD   LYS  49          2HD       LYS  49 -15.931  -3.949   5.479
  372   1HE   LYS  49          1HE       LYS  49 -15.825  -1.220   4.663
  373   2HE   LYS  49          2HE       LYS  49 -15.947  -2.232   3.224
  374   1HZ   LYS  49          1HZ       LYS  49 -17.712  -2.908   5.437
  375   2HZ   LYS  49          2HZ       LYS  49 -18.010  -2.919   3.772
  376   3HZ   LYS  49          3HZ       LYS  49 -18.051  -1.461   4.628
  377    H    LYS  50           H        LYS  50 -10.974  -4.738   7.386
  378    HA   LYS  50           HA       LYS  50  -9.800  -3.918   9.784
  379   1HB   LYS  50          1HB       LYS  50 -12.693  -4.163   9.881
  380   2HB   LYS  50          2HB       LYS  50 -11.914  -5.263  11.011
  381   1HG   LYS  50          1HG       LYS  50 -10.974  -2.451  10.955
  382   2HG   LYS  50          2HG       LYS  50 -12.553  -2.785  11.671
  383   1HD   LYS  50          1HD       LYS  50 -10.261  -4.507  12.465
  384   2HD   LYS  50          2HD       LYS  50 -10.324  -2.862  13.102
  385   1HE   LYS  50          1HE       LYS  50 -12.446  -3.250  14.109
  386   2HE   LYS  50          2HE       LYS  50 -12.631  -4.789  13.270
  387   1HZ   LYS  50          1HZ       LYS  50 -11.968  -5.427  15.366
  388   2HZ   LYS  50          2HZ       LYS  50 -10.905  -4.127  15.561
  389   3HZ   LYS  50          3HZ       LYS  50 -10.492  -5.411  14.540
  390    H    ARG  51           H        ARG  51 -12.081  -6.604   9.320
  391    HA   ARG  51           HA       ARG  51  -9.951  -8.489   9.919
  392   1HB   ARG  51          1HB       ARG  51 -12.452  -8.504  10.760
  393   2HB   ARG  51          2HB       ARG  51 -12.733  -9.342   9.240
  394   1HG   ARG  51          1HG       ARG  51 -10.573 -10.681  10.256
  395   2HG   ARG  51          2HG       ARG  51 -11.502 -10.289  11.704
  396   1HD   ARG  51          1HD       ARG  51 -13.432 -11.391  10.867
  397   2HD   ARG  51          2HD       ARG  51 -12.726 -11.544   9.259
  398    HE   ARG  51           HE       ARG  51 -11.076 -12.878  11.084
  399   1HH1  ARG  51          1HH1      ARG  51 -14.255 -13.142   9.690
  400   2HH1  ARG  51          2HH1      ARG  51 -14.314 -14.869   9.824
  401   1HH2  ARG  51          1HH2      ARG  51 -11.141 -15.151  11.267
  402   2HH2  ARG  51          2HH2      ARG  51 -12.542 -16.010  10.723
  403    H    THR  52           H        THR  52  -9.365  -7.308   7.573
  404    HA   THR  52           HA       THR  52 -10.177  -9.237   5.502
  405    HB   THR  52           HB       THR  52  -8.722  -6.782   4.703
  406    HG1  THR  52           HG1      THR  52 -11.191  -6.769   6.024
  407   1HG2  THR  52          1HG2      THR  52  -9.451  -8.267   2.982
  408   2HG2  THR  52          2HG2      THR  52 -10.497  -6.848   2.920
  409   3HG2  THR  52          3HG2      THR  52 -11.079  -8.342   3.654
  410    H    SER  53           H        SER  53  -8.739 -10.781   5.128
  411    HA   SER  53           HA       SER  53  -5.999 -10.539   5.949
  412   1HB   SER  53          1HB       SER  53  -5.913 -12.830   4.649
  413   2HB   SER  53          2HB       SER  53  -6.739 -12.719   6.203
  414    HG   SER  53           HG       SER  53  -7.753 -13.488   3.902
  415    H    LEU  54           H        LEU  54  -4.365 -11.545   4.211
  416    HA   LEU  54           HA       LEU  54  -3.791  -9.555   2.386
  417   1HB   LEU  54          1HB       LEU  54  -2.193 -11.255   3.145
  418   2HB   LEU  54          2HB       LEU  54  -3.048 -12.472   2.199
  419    HG   LEU  54           HG       LEU  54  -2.379 -11.406   0.140
  420   1HD1  LEU  54          1HD1      LEU  54  -0.992  -9.440   0.074
  421   2HD1  LEU  54          2HD1      LEU  54  -0.952  -9.363   1.835
  422   3HD1  LEU  54          3HD1      LEU  54  -2.465  -9.081   0.975
  423   1HD2  LEU  54          1HD2      LEU  54  -0.829 -12.988   1.297
  424   2HD2  LEU  54          2HD2      LEU  54   0.024 -11.589   1.948
  425   3HD2  LEU  54          3HD2      LEU  54  -0.035 -11.854   0.205
  426    H    ALA  55           H        ALA  55  -5.896 -12.311   2.050
  427    HA   ALA  55           HA       ALA  55  -6.119 -12.527  -0.702
  428   1HB   ALA  55          1HB       ALA  55  -8.247 -13.565  -0.337
  429   2HB   ALA  55          2HB       ALA  55  -7.166 -14.041   0.974
  430   3HB   ALA  55          3HB       ALA  55  -8.398 -12.809   1.249
  431    H    GLY  56           H        GLY  56  -7.503 -10.148   1.474
  432   1HA   GLY  56          1HA       GLY  56  -9.360  -9.041  -0.371
  433   2HA   GLY  56          2HA       GLY  56  -8.767  -8.266   1.091
  434    H    MET  57           H        MET  57  -6.065  -8.095   0.567
  435    HA   MET  57           HA       MET  57  -5.998  -5.842  -1.180
  436   1HB   MET  57          1HB       MET  57  -3.757  -7.356   0.170
  437   2HB   MET  57          2HB       MET  57  -3.567  -5.825  -0.673
  438   1HG   MET  57          1HG       MET  57  -5.603  -5.931   1.466
  439   2HG   MET  57          2HG       MET  57  -3.913  -6.005   1.959
  440   1HE   MET  57          1HE       MET  57  -6.411  -2.673   0.393
  441   2HE   MET  57          2HE       MET  57  -5.621  -3.381  -1.016
  442   3HE   MET  57          3HE       MET  57  -6.590  -4.395   0.055
  443    H    LYS  58           H        LYS  58  -4.603  -9.108  -1.336
  444    HA   LYS  58           HA       LYS  58  -3.273  -8.878  -3.764
  445   1HB   LYS  58          1HB       LYS  58  -3.583 -10.866  -1.964
  446   2HB   LYS  58          2HB       LYS  58  -4.640 -11.454  -3.241
  447   1HG   LYS  58          1HG       LYS  58  -2.811 -11.366  -4.831
  448   2HG   LYS  58          2HG       LYS  58  -1.744 -10.704  -3.591
  449   1HD   LYS  58          1HD       LYS  58  -3.128 -13.369  -3.340
  450   2HD   LYS  58          2HD       LYS  58  -1.509 -13.176  -4.018
  451   1HE   LYS  58          1HE       LYS  58  -1.132 -11.840  -1.759
  452   2HE   LYS  58          2HE       LYS  58  -2.454 -12.873  -1.215
  453   1HZ   LYS  58          1HZ       LYS  58   0.235 -13.531  -1.433
  454   2HZ   LYS  58          2HZ       LYS  58  -0.568 -14.419  -2.626
  455   3HZ   LYS  58          3HZ       LYS  58  -1.046 -14.551  -1.009
  456    H    LYS  59           H        LYS  59  -6.669  -9.321  -3.090
  457    HA   LYS  59           HA       LYS  59  -7.544 -10.216  -5.592
  458   1HB   LYS  59          1HB       LYS  59  -8.729  -9.430  -3.174
  459   2HB   LYS  59          2HB       LYS  59  -9.429  -8.378  -4.397
  460   1HG   LYS  59          1HG       LYS  59 -10.555 -10.059  -5.397
  461   2HG   LYS  59          2HG       LYS  59  -9.293 -11.249  -5.067
  462   1HD   LYS  59          1HD       LYS  59 -10.011 -11.136  -2.640
  463   2HD   LYS  59          2HD       LYS  59 -11.417 -10.224  -3.195
  464   1HE   LYS  59          1HE       LYS  59 -11.487 -12.332  -4.888
  465   2HE   LYS  59          2HE       LYS  59 -10.784 -13.089  -3.459
  466   1HZ   LYS  59          1HZ       LYS  59 -12.981 -13.336  -3.000
  467   2HZ   LYS  59          2HZ       LYS  59 -13.448 -11.941  -3.834
  468   3HZ   LYS  59          3HZ       LYS  59 -12.749 -11.814  -2.299
  469    H    LEU  60           H        LEU  60  -6.687  -7.022  -4.454
  470    HA   LEU  60           HA       LEU  60  -7.753  -5.676  -6.768
  471   1HB   LEU  60          1HB       LEU  60  -6.092  -4.821  -4.422
  472   2HB   LEU  60          2HB       LEU  60  -6.380  -3.741  -5.785
  473    HG   LEU  60           HG       LEU  60  -8.887  -4.203  -5.302
  474   1HD1  LEU  60          1HD1      LEU  60  -7.599  -5.637  -3.157
  475   2HD1  LEU  60          2HD1      LEU  60  -9.298  -5.602  -3.628
  476   3HD1  LEU  60          3HD1      LEU  60  -8.663  -4.376  -2.532
  477   1HD2  LEU  60          1HD2      LEU  60  -7.107  -2.214  -4.574
  478   2HD2  LEU  60          2HD2      LEU  60  -7.953  -2.597  -3.074
  479   3HD2  LEU  60          3HD2      LEU  60  -8.867  -2.123  -4.507
  480    H    ILE  61           H        ILE  61  -4.596  -6.762  -5.637
  481    HA   ILE  61           HA       ILE  61  -3.566  -6.383  -8.357
  482    HB   ILE  61           HB       ILE  61  -2.019  -5.616  -5.880
  483   1HG1  ILE  61          1HG1      ILE  61  -2.187  -3.341  -7.325
  484   2HG1  ILE  61          2HG1      ILE  61  -3.731  -4.075  -7.745
  485   1HG2  ILE  61          1HG2      ILE  61  -1.296  -6.060  -8.682
  486   2HG2  ILE  61          2HG2      ILE  61  -0.721  -4.533  -8.014
  487   3HG2  ILE  61          3HG2      ILE  61  -0.288  -6.055  -7.235
  488   1HD1  ILE  61          1HD1      ILE  61  -2.816  -2.908  -5.213
  489   2HD1  ILE  61          2HD1      ILE  61  -4.433  -2.997  -5.911
  490   3HD1  ILE  61          3HD1      ILE  61  -3.757  -4.393  -5.072
  491    HA   PRO  62           HA       PRO  62  -2.690 -10.620  -6.687
  492   1HB   PRO  62          1HB       PRO  62  -3.427 -11.914  -8.957
  493   2HB   PRO  62          2HB       PRO  62  -4.575 -11.472  -7.687
  494   1HG   PRO  62          1HG       PRO  62  -3.986 -10.087 -10.275
  495   2HG   PRO  62          2HG       PRO  62  -5.553 -10.406  -9.507
  496   1HD   PRO  62          1HD       PRO  62  -4.328  -7.994  -9.374
  497   2HD   PRO  62          2HD       PRO  62  -5.350  -8.620  -8.064
  498    H    GLY  63           H        GLY  63  -0.493 -10.627  -6.669
  499   1HA   GLY  63          1HA       GLY  63   1.302 -11.789  -7.963
  500   2HA   GLY  63          2HA       GLY  63   0.866 -10.725  -9.292
  501    H    ALA  64           H        ALA  64   1.118  -9.817  -5.894
  502    HA   ALA  64           HA       ALA  64   3.558  -8.300  -6.509
  503   1HB   ALA  64          1HB       ALA  64   0.940  -7.240  -5.714
  504   2HB   ALA  64          2HB       ALA  64   2.306  -6.615  -4.788
  505   3HB   ALA  64          3HB       ALA  64   2.283  -6.452  -6.544
  506    H    HIS  65           H        HIS  65   4.559  -7.419  -4.436
  507    HA   HIS  65           HA       HIS  65   4.599  -9.591  -2.483
  508   1HB   HIS  65          1HB       HIS  65   6.694  -8.580  -3.610
  509   2HB   HIS  65          2HB       HIS  65   6.468  -7.233  -2.498
  510    HD1  HIS  65           HD1      HIS  65   8.844  -9.440  -2.570
  511    HD2  HIS  65           HD2      HIS  65   5.703  -9.175   0.137
  512    HE1  HIS  65           HE1      HIS  65   9.636 -10.633  -0.502
  513    H    PHE  66           H        PHE  66   3.306  -9.406  -0.784
  514    HA   PHE  66           HA       PHE  66   2.822  -6.724   0.332
  515   1HB   PHE  66          1HB       PHE  66   1.068  -9.068  -0.097
  516   2HB   PHE  66          2HB       PHE  66   0.846  -8.215   1.427
  517    HD1  PHE  66           HD1      PHE  66   0.898  -7.760  -2.247
  518    HD2  PHE  66           HD2      PHE  66  -0.335  -6.199   1.515
  519    HE1  PHE  66           HE1      PHE  66  -0.467  -6.069  -3.400
  520    HE2  PHE  66           HE2      PHE  66  -1.702  -4.506   0.369
  521    HZ   PHE  66           HZ       PHE  66  -1.770  -4.439  -2.092
  522    H    GLU  67           H        GLU  67   2.561  -6.592   2.670
  523    HA   GLU  67           HA       GLU  67   3.584  -8.774   4.271
  524   1HB   GLU  67          1HB       GLU  67   5.529  -7.292   3.287
  525   2HB   GLU  67          2HB       GLU  67   5.054  -6.187   4.569
  526   1HG   GLU  67          1HG       GLU  67   5.258  -8.781   5.689
  527   2HG   GLU  67          2HG       GLU  67   6.703  -8.486   4.724
  528    H    LYS  68           H        LYS  68   2.121  -8.842   5.837
  529    HA   LYS  68           HA       LYS  68   1.197  -6.302   7.012
  530   1HB   LYS  68          1HB       LYS  68  -0.511  -7.770   5.833
  531   2HB   LYS  68          2HB       LYS  68  -0.266  -8.938   7.124
  532   1HG   LYS  68          1HG       LYS  68  -0.745  -6.667   8.539
  533   2HG   LYS  68          2HG       LYS  68  -1.761  -6.423   7.116
  534   1HD   LYS  68          1HD       LYS  68  -2.631  -8.774   7.514
  535   2HD   LYS  68          2HD       LYS  68  -1.826  -8.700   9.083
  536   1HE   LYS  68          1HE       LYS  68  -3.472  -6.359   8.497
  537   2HE   LYS  68          2HE       LYS  68  -4.385  -7.866   8.555
  538   1HZ   LYS  68          1HZ       LYS  68  -2.602  -6.820  10.687
  539   2HZ   LYS  68          2HZ       LYS  68  -3.419  -8.300  10.743
  540   3HZ   LYS  68          3HZ       LYS  68  -4.293  -6.852  10.727
  541    H    ARG  69           H        ARG  69   3.555  -8.086   7.663
  542    HA   ARG  69           HA       ARG  69   2.921  -9.152  10.272
  543   1HB   ARG  69          1HB       ARG  69   4.979  -9.525   8.359
  544   2HB   ARG  69          2HB       ARG  69   5.743  -8.939   9.831
  545   1HG   ARG  69          1HG       ARG  69   4.270 -10.771  10.973
  546   2HG   ARG  69          2HG       ARG  69   4.242 -11.464   9.350
  547   1HD   ARG  69          1HD       ARG  69   6.732 -11.352   9.335
  548   2HD   ARG  69          2HD       ARG  69   6.671 -10.834  11.020
  549    HE   ARG  69           HE       ARG  69   5.246 -13.149  10.995
  550   1HH1  ARG  69          1HH1      ARG  69   8.441 -12.248   9.946
  551   2HH1  ARG  69          2HH1      ARG  69   9.121 -13.814  10.240
  552   1HH2  ARG  69          1HH2      ARG  69   6.129 -15.215  11.386
  553   2HH2  ARG  69          2HH2      ARG  69   7.804 -15.501  11.058
  554    H    ARG  70           H        ARG  70   3.137  -6.119   9.294
  555    HA   ARG  70           HA       ARG  70   3.425  -4.137  10.382
  556   1HB   ARG  70          1HB       ARG  70   2.610  -5.582  12.361
  557   2HB   ARG  70          2HB       ARG  70   4.301  -5.628  12.842
  558   1HG   ARG  70          1HG       ARG  70   4.149  -3.039  12.637
  559   2HG   ARG  70          2HG       ARG  70   2.413  -3.321  12.778
  560   1HD   ARG  70          1HD       ARG  70   4.581  -4.007  14.745
  561   2HD   ARG  70          2HD       ARG  70   3.202  -2.932  14.973
  562    HE   ARG  70           HE       ARG  70   2.130  -5.406  14.435
  563   1HH1  ARG  70          1HH1      ARG  70   4.263  -4.051  16.830
  564   2HH1  ARG  70          2HH1      ARG  70   3.774  -5.151  18.077
  565   1HH2  ARG  70          1HH2      ARG  70   1.479  -6.860  16.068
  566   2HH2  ARG  70          2HH2      ARG  70   2.191  -6.749  17.641
  567    H    GLY  71           H        GLY  71   5.339  -4.430   8.766
  568   1HA   GLY  71          1HA       GLY  71   7.939  -4.939   9.673
  569   2HA   GLY  71          2HA       GLY  71   7.529  -3.947   8.282
  570    H    THR  72           H        THR  72   5.942  -2.104   9.996
  571    HA   THR  72           HA       THR  72   7.539  -0.966  12.001
  572    HB   THR  72           HB       THR  72   9.105  -0.478  10.171
  573    HG1  THR  72           HG1      THR  72   9.272   1.098  11.640
  574   1HG2  THR  72          1HG2      THR  72   7.896   1.590   8.761
  575   2HG2  THR  72          2HG2      THR  72   6.664   0.330   8.830
  576   3HG2  THR  72          3HG2      THR  72   8.254  -0.026   8.155
  577    H    GLN  73           H        GLN  73   4.792  -1.500  11.500
  578    HA   GLN  73           HA       GLN  73   3.175   0.534  10.676
  579   1HB   GLN  73          1HB       GLN  73   2.310  -1.598  11.484
  580   2HB   GLN  73          2HB       GLN  73   2.802  -1.199  13.124
  581   1HG   GLN  73          1HG       GLN  73   0.908   0.577  11.650
  582   2HG   GLN  73          2HG       GLN  73   0.333  -0.903  12.417
  583   1HE2  GLN  73          1HE2      GLN  73  -0.060   2.031  12.962
  584   2HE2  GLN  73          2HE2      GLN  73   0.296   2.206  14.643
  585    H    GLY  74           H        GLY  74   2.647   2.539  11.326
  586   1HA   GLY  74          1HA       GLY  74   2.227   4.100  13.152
  587   2HA   GLY  74          2HA       GLY  74   3.629   3.424  13.966
  588    H    GLU  75           H        GLU  75   5.702   4.047  13.333
  589    HA   GLU  75           HA       GLU  75   6.015   6.688  12.508
  590   1HB   GLU  75          1HB       GLU  75   7.670   4.691  13.498
  591   2HB   GLU  75          2HB       GLU  75   8.340   5.039  11.911
  592   1HG   GLU  75          1HG       GLU  75   8.400   7.444  12.532
  593   2HG   GLU  75          2HG       GLU  75   7.894   6.988  14.157
  594    H    ALA  76           H        ALA  76   5.697   3.785  10.659
  595    HA   ALA  76           HA       ALA  76   6.908   4.591   8.255
  596   1HB   ALA  76          1HB       ALA  76   4.511   2.874   8.072
  597   2HB   ALA  76          2HB       ALA  76   6.125   2.650   7.398
  598   3HB   ALA  76          3HB       ALA  76   5.822   2.292   9.098
  599    H    ARG  77           H        ARG  77   4.069   5.675   9.784
  600    HA   ARG  77           HA       ARG  77   2.492   6.366   7.551
  601   1HB   ARG  77          1HB       ARG  77   2.625   7.574  10.318
  602   2HB   ARG  77          2HB       ARG  77   1.395   7.971   9.125
  603   1HG   ARG  77          1HG       ARG  77   1.878   5.188  10.160
  604   2HG   ARG  77          2HG       ARG  77   0.698   6.306  10.847
  605   1HD   ARG  77          1HD       ARG  77   0.744   5.177   8.055
  606   2HD   ARG  77          2HD       ARG  77  -0.439   4.852   9.321
  607    HE   ARG  77           HE       ARG  77  -0.335   7.149   7.585
  608   1HH1  ARG  77          1HH1      ARG  77  -1.510   5.862  10.598
  609   2HH1  ARG  77          2HH1      ARG  77  -2.820   6.990  10.719
  610   1HH2  ARG  77          1HH2      ARG  77  -2.055   8.640   7.733
  611   2HH2  ARG  77          2HH2      ARG  77  -3.129   8.569   9.088
  612    H    ALA  78           H        ALA  78   5.363   7.722   8.839
  613    HA   ALA  78           HA       ALA  78   4.978  10.187   7.278
  614   1HB   ALA  78          1HB       ALA  78   6.270   9.612   9.833
  615   2HB   ALA  78          2HB       ALA  78   7.248  10.603   8.749
  616   3HB   ALA  78          3HB       ALA  78   5.626  11.127   9.202
  617    H    TYR  79           H        TYR  79   6.725   7.250   7.441
  618    HA   TYR  79           HA       TYR  79   9.124   7.920   6.183
  619   1HB   TYR  79          1HB       TYR  79   8.146   5.638   7.189
  620   2HB   TYR  79          2HB       TYR  79   7.861   5.321   5.481
  621    HD1  TYR  79           HD2      TYR  79  10.268   6.760   4.365
  622    HD2  TYR  79           HD1      TYR  79   9.858   4.082   7.645
  623    HE1  TYR  79           HE2      TYR  79  12.616   6.081   4.096
  624    HE2  TYR  79           HE1      TYR  79  12.205   3.396   7.386
  625    HH   TYR  79           HH       TYR  79  13.940   3.366   5.699
  626    H    SER  80           H        SER  80   6.133   6.657   4.709
  627    HA   SER  80           HA       SER  80   5.409   6.637   2.542
  628   1HB   SER  80          1HB       SER  80   5.308   8.804   1.489
  629   2HB   SER  80          2HB       SER  80   5.097   9.031   3.225
  630    HG   SER  80           HG       SER  80   7.174   9.779   3.375
  631    H    MET  81           H        MET  81   7.361   5.047   2.384
  632    HA   MET  81           HA       MET  81   8.976   4.139   1.066
  633   1HB   MET  81          1HB       MET  81   7.742   6.202  -0.684
  634   2HB   MET  81          2HB       MET  81   9.276   5.519  -1.205
  635   1HG   MET  81          1HG       MET  81   7.254   4.390  -2.124
  636   2HG   MET  81          2HG       MET  81   8.377   3.329  -1.278
  637   1HE   MET  81          1HE       MET  81   4.702   5.032   0.858
  638   2HE   MET  81          2HE       MET  81   5.924   5.920  -0.053
  639   3HE   MET  81          3HE       MET  81   4.648   5.048  -0.905
  640    H    LYS  82           H        LYS  82  11.088   4.743  -0.181
  641    HA   LYS  82           HA       LYS  82  12.604   6.438   1.605
  642   1HB   LYS  82          1HB       LYS  82  13.163   4.279  -0.256
  643   2HB   LYS  82          2HB       LYS  82  14.296   5.610  -0.453
  644   1HG   LYS  82          1HG       LYS  82  14.307   5.389   2.225
  645   2HG   LYS  82          2HG       LYS  82  13.961   3.717   1.778
  646   1HD   LYS  82          1HD       LYS  82  15.926   3.833   0.217
  647   2HD   LYS  82          2HD       LYS  82  16.316   5.399   0.932
  648   1HE   LYS  82          1HE       LYS  82  17.624   4.019   2.211
  649   2HE   LYS  82          2HE       LYS  82  16.152   4.051   3.180
  650   1HZ   LYS  82          1HZ       LYS  82  16.842   1.937   1.212
  651   2HZ   LYS  82          2HZ       LYS  82  15.487   1.958   2.224
  652   3HZ   LYS  82          3HZ       LYS  82  17.035   1.801   2.887
  653    H    GLU  83           H        GLU  83  13.202   8.475   1.236
  654    HA   GLU  83           HA       GLU  83  12.222   9.926  -0.979
  655   1HB   GLU  83          1HB       GLU  83  13.936  10.501   1.368
  656   2HB   GLU  83          2HB       GLU  83  14.106  11.588  -0.002
  657   1HG   GLU  83          1HG       GLU  83  12.085  12.518   0.309
  658   2HG   GLU  83          2HG       GLU  83  11.343  10.999   0.807
  659    H    ASP  84           H        ASP  84  15.311   8.420  -0.289
  660    HA   ASP  84           HA       ASP  84  16.906   9.631  -2.216
  661   1HB   ASP  84          1HB       ASP  84  17.122   7.437  -0.450
  662   2HB   ASP  84          2HB       ASP  84  17.534   6.830  -2.051
  663    H    THR  85           H        THR  85  14.588   7.003  -2.516
  664    HA   THR  85           HA       THR  85  15.070   6.967  -5.423
  665    HB   THR  85           HB       THR  85  13.599   4.743  -5.066
  666    HG1  THR  85           HG1      THR  85  14.453   3.737  -3.123
  667   1HG2  THR  85          1HG2      THR  85  16.480   5.327  -5.191
  668   2HG2  THR  85          2HG2      THR  85  15.499   4.241  -6.176
  669   3HG2  THR  85          3HG2      THR  85  16.071   3.720  -4.592
  670    H    ARG  86           H        ARG  86  13.160   8.485  -3.398
  671    HA   ARG  86           HA       ARG  86  10.534   7.826  -4.252
  672   1HB   ARG  86          1HB       ARG  86  10.917   8.983  -2.146
  673   2HB   ARG  86          2HB       ARG  86  11.621  10.351  -2.998
  674   1HG   ARG  86          1HG       ARG  86   9.559  11.030  -3.857
  675   2HG   ARG  86          2HG       ARG  86   8.805   9.471  -3.514
  676   1HD   ARG  86          1HD       ARG  86   8.502   9.950  -1.301
  677   2HD   ARG  86          2HD       ARG  86   9.903  11.017  -1.230
  678    HE   ARG  86           HE       ARG  86   7.715  12.022  -2.816
  679   1HH1  ARG  86          1HH1      ARG  86   9.149  11.853   0.352
  680   2HH1  ARG  86          2HH1      ARG  86   8.371  13.292   0.923
  681   1HH2  ARG  86          1HH2      ARG  86   6.686  13.918  -2.076
  682   2HH2  ARG  86          2HH2      ARG  86   6.970  14.465  -0.458
  683    H    LEU  87           H        LEU  87   9.641   8.201  -6.162
  684    HA   LEU  87           HA       LEU  87  10.833  10.214  -7.923
  685   1HB   LEU  87          1HB       LEU  87   9.887   7.615  -8.339
  686   2HB   LEU  87          2HB       LEU  87   8.709   8.672  -9.115
  687    HG   LEU  87           HG       LEU  87  11.667   8.545  -9.698
  688   1HD1  LEU  87          1HD1      LEU  87   9.227   7.629 -11.201
  689   2HD1  LEU  87          2HD1      LEU  87  10.590   6.657 -10.645
  690   3HD1  LEU  87          3HD1      LEU  87  10.813   7.824 -11.949
  691   1HD2  LEU  87          1HD2      LEU  87  11.279  10.186 -11.401
  692   2HD2  LEU  87          2HD2      LEU  87  10.698  10.832  -9.866
  693   3HD2  LEU  87          3HD2      LEU  87   9.550  10.210 -11.052
  694    H    GLU  88           H        GLU  88   7.552   9.055  -7.118
  695    HA   GLU  88           HA       GLU  88   6.639  11.850  -7.249
  696   1HB   GLU  88          1HB       GLU  88   5.943   9.840  -9.052
  697   2HB   GLU  88          2HB       GLU  88   4.569   9.942  -7.960
  698   1HG   GLU  88          1HG       GLU  88   4.132  12.159  -8.518
  699   2HG   GLU  88          2HG       GLU  88   5.737  12.399  -9.205
  700    H    GLY  89           H        GLY  89   4.308  11.968  -6.273
  701   1HA   GLY  89          1HA       GLY  89   2.818  11.402  -4.554
  702   2HA   GLY  89          2HA       GLY  89   3.909  10.115  -4.062
  703    HA   PRO  90           HA       PRO  90   3.259   9.772  -2.132
  704   1HB   PRO  90          1HB       PRO  90   1.871  10.463   0.097
  705   2HB   PRO  90          2HB       PRO  90   3.556   9.930   0.141
  706   1HG   PRO  90          1HG       PRO  90   2.445  12.709   0.225
  707   2HG   PRO  90          2HG       PRO  90   3.757  11.999   1.184
  708   1HD   PRO  90          1HD       PRO  90   4.214  13.583  -0.964
  709   2HD   PRO  90          2HD       PRO  90   5.301  12.255  -0.508
  710    H    TRP  91           H        TRP  91   0.892   9.231  -1.849
  711    HA   TRP  91           HA       TRP  91  -0.903  11.336  -2.805
  712   1HB   TRP  91          1HB       TRP  91  -0.362   8.720  -4.199
  713   2HB   TRP  91          2HB       TRP  91  -1.870   9.599  -4.431
  714    HD1  TRP  91           HD1      TRP  91  -0.656  12.551  -4.577
  715    HE1  TRP  91           HE1      TRP  91   0.680  13.255  -6.661
  716    HE3  TRP  91           HE3      TRP  91   0.629   7.920  -6.318
  717    HZ2  TRP  91           HZ2      TRP  91   2.092  12.011  -8.765
  718    HZ3  TRP  91           HZ3      TRP  91   1.973   7.764  -8.373
  719    HH2  TRP  91           HH2      TRP  91   2.688   9.768  -9.570
  720    H    GLU  92           H        GLU  92  -2.909  11.229  -1.956
  721    HA   GLU  92           HA       GLU  92  -3.574   8.834  -0.372
  722   1HB   GLU  92          1HB       GLU  92  -3.891  11.748   0.223
  723   2HB   GLU  92          2HB       GLU  92  -5.041  10.606   0.904
  724   1HG   GLU  92          1HG       GLU  92  -3.394   9.519   2.158
  725   2HG   GLU  92          2HG       GLU  92  -2.085  10.238   1.223
  726    H    TYR  93           H        TYR  93  -5.553   7.931  -0.625
  727    HA   TYR  93           HA       TYR  93  -7.576   9.345  -2.192
  728   1HB   TYR  93          1HB       TYR  93  -6.489   6.609  -2.879
  729   2HB   TYR  93          2HB       TYR  93  -7.954   7.294  -3.574
  730    HD1  TYR  93           HD1      TYR  93  -7.784   9.353  -4.995
  731    HD2  TYR  93           HD2      TYR  93  -4.349   7.200  -3.705
  732    HE1  TYR  93           HE1      TYR  93  -6.447  10.451  -6.744
  733    HE2  TYR  93           HE2      TYR  93  -3.002   8.292  -5.449
  734    HH   TYR  93           HH       TYR  93  -3.910  11.001  -7.048
  735    H    GLY  94           H        GLY  94  -9.705   8.294  -2.097
  736   1HA   GLY  94          1HA       GLY  94 -11.284   6.860  -1.091
  737   2HA   GLY  94          2HA       GLY  94 -10.055   6.350   0.057
  738    H    GLU  95           H        GLU  95 -11.415   6.657   1.831
  739    HA   GLU  95           HA       GLU  95 -12.937   8.906   2.399
  740   1HB   GLU  95          1HB       GLU  95 -13.211   6.939   3.727
  741   2HB   GLU  95          2HB       GLU  95 -11.528   6.970   4.233
  742   1HG   GLU  95          1HG       GLU  95 -12.996   7.700   6.020
  743   2HG   GLU  95          2HG       GLU  95 -11.929   9.004   5.503
  Start of MODEL   16
    1   1H    ALA   2          1H        ALA   2 -14.655   0.403  18.011
    2    HA   ALA   2           HA       ALA   2 -13.413   2.138  16.904
    3   1HB   ALA   2          1HB       ALA   2 -13.825   3.801  18.623
    4   2HB   ALA   2          2HB       ALA   2 -12.711   2.978  19.715
    5   3HB   ALA   2          3HB       ALA   2 -12.105   3.731  18.239
    6    H    ARG   3           H        ARG   3 -12.471   0.103  16.269
    7    HA   ARG   3           HA       ARG   3 -10.021  -0.599  17.739
    8   1HB   ARG   3          1HB       ARG   3 -12.098  -2.199  16.694
    9   2HB   ARG   3          2HB       ARG   3 -10.689  -2.494  15.683
   10   1HG   ARG   3          1HG       ARG   3  -9.424  -2.822  17.891
   11   2HG   ARG   3          2HG       ARG   3 -11.025  -2.961  18.620
   12   1HD   ARG   3          1HD       ARG   3 -11.025  -4.580  16.309
   13   2HD   ARG   3          2HD       ARG   3  -9.524  -4.916  17.170
   14    HE   ARG   3           HE       ARG   3 -11.705  -4.907  18.968
   15   1HH1  ARG   3          1HH1      ARG   3 -10.249  -6.811  16.443
   16   2HH1  ARG   3          2HH1      ARG   3 -10.839  -8.318  17.060
   17   1HH2  ARG   3          1HH2      ARG   3 -12.487  -6.886  19.791
   18   2HH2  ARG   3          2HH2      ARG   3 -12.112  -8.360  18.964
   19    H    GLN   4           H        GLN   4  -8.127  -0.095  16.864
   20    HA   GLN   4           HA       GLN   4  -8.043   0.959  14.158
   21   1HB   GLN   4          1HB       GLN   4  -6.480   1.271  16.585
   22   2HB   GLN   4          2HB       GLN   4  -5.452   0.987  15.186
   23   1HG   GLN   4          1HG       GLN   4  -5.599   3.185  14.871
   24   2HG   GLN   4          2HG       GLN   4  -7.201   2.838  14.222
   25   1HE2  GLN   4          1HE2      GLN   4  -8.993   2.878  15.788
   26   2HE2  GLN   4          2HE2      GLN   4  -8.939   4.043  17.062
   27    H    VAL   5           H        VAL   5  -6.401   0.283  12.628
   28    HA   VAL   5           HA       VAL   5  -5.512  -2.499  12.987
   29    HB   VAL   5           HB       VAL   5  -6.028  -2.987  10.648
   30   1HG1  VAL   5          1HG1      VAL   5  -8.683  -2.311  11.075
   31   2HG1  VAL   5          2HG1      VAL   5  -7.878  -3.794  11.591
   32   3HG1  VAL   5          3HG1      VAL   5  -7.998  -2.424  12.696
   33   1HG2  VAL   5          1HG2      VAL   5  -6.528  -1.426   9.141
   34   2HG2  VAL   5          2HG2      VAL   5  -7.815  -0.767  10.151
   35   3HG2  VAL   5          3HG2      VAL   5  -6.153  -0.222  10.374
   36    H    ILE   6           H        ILE   6  -3.708  -3.118  11.616
   37    HA   ILE   6           HA       ILE   6  -1.816  -0.935  11.343
   38    HB   ILE   6           HB       ILE   6  -1.369  -3.876  10.830
   39   1HG1  ILE   6          1HG1      ILE   6  -0.142  -3.452  13.175
   40   2HG1  ILE   6          2HG1      ILE   6  -1.431  -2.264  13.328
   41   1HG2  ILE   6          1HG2      ILE   6   1.015  -2.882  11.596
   42   2HG2  ILE   6          2HG2      ILE   6   0.499  -3.009   9.915
   43   3HG2  ILE   6          3HG2      ILE   6   0.338  -1.477  10.773
   44   1HD1  ILE   6          1HD1      ILE   6  -1.519  -5.127  13.618
   45   2HD1  ILE   6          2HD1      ILE   6  -2.710  -3.908  14.074
   46   3HD1  ILE   6          3HD1      ILE   6  -2.701  -4.564  12.437
   47    H    CYS   7           H        CYS   7  -0.647  -0.474   9.440
   48    HA   CYS   7           HA       CYS   7  -2.212  -0.666   7.045
   49   1HB   CYS   7          1HB       CYS   7   0.619   0.356   7.254
   50   2HB   CYS   7          2HB       CYS   7  -0.599   0.783   6.058
   51    HG   CYS   7           HG       CYS   7  -1.811   2.649   7.413
   52    H    TRP   8           H        TRP   8  -1.360  -1.451   4.987
   53    HA   TRP   8           HA       TRP   8   0.211  -3.906   5.377
   54   1HB   TRP   8          1HB       TRP   8  -1.829  -3.145   3.284
   55   2HB   TRP   8          2HB       TRP   8  -0.812  -4.578   3.159
   56    HD1  TRP   8           HD1      TRP   8  -3.248  -3.097   5.810
   57    HE1  TRP   8           HE1      TRP   8  -4.587  -5.050   6.819
   58    HE3  TRP   8           HE3      TRP   8  -1.090  -6.966   3.257
   59    HZ2  TRP   8           HZ2      TRP   8  -4.712  -7.859   6.567
   60    HZ3  TRP   8           HZ3      TRP   8  -1.877  -9.255   3.700
   61    HH2  TRP   8           HH2      TRP   8  -3.650  -9.690   5.321
   62    H    CYS   9           H        CYS   9   2.222  -3.934   4.639
   63    HA   CYS   9           HA       CYS   9   3.079  -1.866   2.761
   64   1HB   CYS   9          1HB       CYS   9   4.263  -2.572   5.012
   65   2HB   CYS   9          2HB       CYS   9   4.970  -3.825   3.998
   66    HG   CYS   9           HG       CYS   9   5.200  -0.804   2.620
   67    H    PHE  10           H        PHE  10   3.191  -2.306   0.671
   68    HA   PHE  10           HA       PHE  10   4.043  -4.971  -0.190
   69   1HB   PHE  10          1HB       PHE  10   2.211  -5.408  -1.497
   70   2HB   PHE  10          2HB       PHE  10   1.429  -4.476  -0.225
   71    HD1  PHE  10           HD2      PHE  10   0.692  -2.195  -0.627
   72    HD2  PHE  10           HD1      PHE  10   2.486  -4.517  -3.710
   73    HE1  PHE  10           HE2      PHE  10  -0.135  -0.598  -2.306
   74    HE2  PHE  10           HE1      PHE  10   1.663  -2.923  -5.394
   75    HZ   PHE  10           HZ       PHE  10   0.349  -0.961  -4.694
   76    H    THR  11           H        THR  11   4.700  -5.020  -2.483
   77    HA   THR  11           HA       THR  11   5.503  -2.389  -3.518
   78    HB   THR  11           HB       THR  11   7.352  -4.774  -3.562
   79    HG1  THR  11           HG1      THR  11   7.935  -4.260  -1.601
   80   1HG2  THR  11          1HG2      THR  11   8.874  -2.520  -3.733
   81   2HG2  THR  11          2HG2      THR  11   7.417  -2.026  -4.595
   82   3HG2  THR  11          3HG2      THR  11   8.309  -3.454  -5.117
   83    H    LEU  12           H        LEU  12   5.452  -2.170  -5.713
   84    HA   LEU  12           HA       LEU  12   4.780  -4.557  -7.296
   85   1HB   LEU  12          1HB       LEU  12   2.715  -3.443  -7.013
   86   2HB   LEU  12          2HB       LEU  12   3.444  -1.865  -7.305
   87    HG   LEU  12           HG       LEU  12   3.593  -2.257  -9.631
   88   1HD1  LEU  12          1HD1      LEU  12   2.563  -4.658 -10.312
   89   2HD1  LEU  12          2HD1      LEU  12   3.412  -5.079  -8.826
   90   3HD1  LEU  12          3HD1      LEU  12   4.289  -4.328 -10.159
   91   1HD2  LEU  12          1HD2      LEU  12   1.314  -1.786  -8.645
   92   2HD2  LEU  12          2HD2      LEU  12   0.967  -3.502  -8.853
   93   3HD2  LEU  12          3HD2      LEU  12   1.327  -2.498 -10.258
   94    H    ASN  13           H        ASN  13   6.216  -4.870  -8.851
   95    HA   ASN  13           HA       ASN  13   7.808  -2.595  -9.796
   96   1HB   ASN  13          1HB       ASN  13   9.231  -4.481 -10.812
   97   2HB   ASN  13          2HB       ASN  13   9.249  -4.304  -9.060
   98   1HD2  ASN  13          1HD2      ASN  13   8.555  -6.342 -11.689
   99   2HD2  ASN  13          2HD2      ASN  13   7.959  -7.692 -10.789
  100    H    ASN  14           H        ASN  14   7.764  -1.913 -11.867
  101    HA   ASN  14           HA       ASN  14   6.899  -1.555 -13.947
  102   1HB   ASN  14          1HB       ASN  14   8.413  -3.524 -14.318
  103   2HB   ASN  14          2HB       ASN  14   7.005  -4.570 -14.154
  104   1HD2  ASN  14          1HD2      ASN  14   8.587  -4.522 -16.425
  105   2HD2  ASN  14          2HD2      ASN  14   7.663  -3.886 -17.739
  106    HA   PRO  15           HA       PRO  15   2.603  -2.747 -12.535
  107   1HB   PRO  15          1HB       PRO  15   1.684  -0.202 -12.321
  108   2HB   PRO  15          2HB       PRO  15   2.495  -1.045 -10.996
  109   1HG   PRO  15          1HG       PRO  15   3.604   0.952 -12.931
  110   2HG   PRO  15          2HG       PRO  15   3.861   0.828 -11.181
  111   1HD   PRO  15          1HD       PRO  15   5.671  -0.067 -12.985
  112   2HD   PRO  15          2HD       PRO  15   5.439  -0.838 -11.403
  113    H    LEU  16           H        LEU  16   0.668  -2.555 -13.739
  114    HA   LEU  16           HA       LEU  16   1.092  -1.653 -16.500
  115   1HB   LEU  16          1HB       LEU  16  -0.558  -3.774 -15.232
  116   2HB   LEU  16          2HB       LEU  16  -1.155  -3.037 -16.718
  117    HG   LEU  16           HG       LEU  16   1.215  -3.640 -17.635
  118   1HD1  LEU  16          1HD1      LEU  16   2.490  -4.542 -16.016
  119   2HD1  LEU  16          2HD1      LEU  16   1.622  -6.019 -16.432
  120   3HD1  LEU  16          3HD1      LEU  16   1.102  -5.049 -15.054
  121   1HD2  LEU  16          1HD2      LEU  16   0.173  -5.277 -18.767
  122   2HD2  LEU  16          2HD2      LEU  16  -1.257  -4.721 -17.897
  123   3HD2  LEU  16          3HD2      LEU  16  -0.344  -6.107 -17.299
  124    H    SER  17           H        SER  17  -0.295  -0.610 -13.691
  125    HA   SER  17           HA       SER  17  -1.584   1.587 -14.839
  126   1HB   SER  17          1HB       SER  17  -3.965   0.775 -13.964
  127   2HB   SER  17          2HB       SER  17  -3.425   0.445 -15.610
  128    HG   SER  17           HG       SER  17  -3.418  -1.298 -13.380
  129    HA   PRO  18           HA       PRO  18  -1.416   3.016 -10.696
  130   1HB   PRO  18          1HB       PRO  18  -3.513   4.737 -10.583
  131   2HB   PRO  18          2HB       PRO  18  -2.032   5.084 -11.484
  132   1HG   PRO  18          1HG       PRO  18  -4.663   4.065 -12.485
  133   2HG   PRO  18          2HG       PRO  18  -3.602   5.301 -13.186
  134   1HD   PRO  18          1HD       PRO  18  -3.677   2.755 -14.104
  135   2HD   PRO  18          2HD       PRO  18  -2.200   3.738 -14.136
  136    H    LEU  19           H        LEU  19  -2.352   2.861  -8.623
  137    HA   LEU  19           HA       LEU  19  -4.173   0.679  -8.305
  138   1HB   LEU  19          1HB       LEU  19  -3.207   2.592  -6.191
  139   2HB   LEU  19          2HB       LEU  19  -3.853   0.970  -5.950
  140    HG   LEU  19           HG       LEU  19  -1.219   1.652  -7.255
  141   1HD1  LEU  19          1HD1      LEU  19  -1.438   1.972  -4.751
  142   2HD1  LEU  19          2HD1      LEU  19  -0.171   0.874  -5.297
  143   3HD1  LEU  19          3HD1      LEU  19  -1.678   0.228  -4.650
  144   1HD2  LEU  19          1HD2      LEU  19  -1.424  -0.352  -8.210
  145   2HD2  LEU  19          2HD2      LEU  19  -2.850  -0.752  -7.251
  146   3HD2  LEU  19          3HD2      LEU  19  -1.237  -1.026  -6.591
  147    H    SER  20           H        SER  20  -6.026   0.935  -6.668
  148    HA   SER  20           HA       SER  20  -7.425   3.482  -6.904
  149   1HB   SER  20          1HB       SER  20  -9.506   2.334  -7.677
  150   2HB   SER  20          2HB       SER  20  -8.207   2.302  -8.869
  151    HG   SER  20           HG       SER  20  -7.776   0.173  -8.284
  152    H    LEU  21           H        LEU  21  -9.297   3.629  -5.485
  153    HA   LEU  21           HA       LEU  21  -8.773   2.542  -2.926
  154   1HB   LEU  21          1HB       LEU  21  -9.800   4.653  -2.990
  155   2HB   LEU  21          2HB       LEU  21 -11.060   4.097  -4.090
  156    HG   LEU  21           HG       LEU  21 -11.947   2.692  -2.203
  157   1HD1  LEU  21          1HD1      LEU  21  -9.554   3.669  -0.955
  158   2HD1  LEU  21          2HD1      LEU  21 -10.692   2.445  -0.393
  159   3HD1  LEU  21          3HD1      LEU  21 -10.972   4.146  -0.021
  160   1HD2  LEU  21          1HD2      LEU  21 -12.541   4.987  -0.887
  161   2HD2  LEU  21          2HD2      LEU  21 -13.326   4.457  -2.375
  162   3HD2  LEU  21          3HD2      LEU  21 -12.000   5.618  -2.443
  163    H    HIS  22           H        HIS  22 -10.051   1.118  -1.667
  164    HA   HIS  22           HA       HIS  22 -11.646  -0.772  -3.270
  165   1HB   HIS  22          1HB       HIS  22  -9.399  -1.537  -2.240
  166   2HB   HIS  22          2HB       HIS  22 -10.261  -1.512  -0.704
  167    HD1  HIS  22           HD1      HIS  22 -10.523  -3.943  -0.212
  168    HD2  HIS  22           HD2      HIS  22 -11.655  -2.989  -4.094
  169    HE1  HIS  22           HE1      HIS  22 -11.529  -6.046  -1.155
  170    H    ASP  23           H        ASP  23 -13.698  -1.094  -2.690
  171    HA   ASP  23           HA       ASP  23 -15.021   0.500  -0.843
  172   1HB   ASP  23          1HB       ASP  23 -15.685  -1.883  -2.444
  173   2HB   ASP  23          2HB       ASP  23 -16.673  -1.664  -1.003
  174    H    SER  24           H        SER  24 -13.258  -2.431  -0.372
  175    HA   SER  24           HA       SER  24 -14.441  -3.029   2.194
  176   1HB   SER  24          1HB       SER  24 -11.866  -4.198   1.158
  177   2HB   SER  24          2HB       SER  24 -13.051  -4.931   2.239
  178    HG   SER  24           HG       SER  24 -13.982  -5.709   0.538
  179    H    MET  25           H        MET  25 -11.453  -1.592   0.979
  180    HA   MET  25           HA       MET  25 -10.315  -1.267   3.597
  181   1HB   MET  25          1HB       MET  25  -8.450  -0.372   2.530
  182   2HB   MET  25          2HB       MET  25  -9.087  -1.485   1.326
  183   1HG   MET  25          1HG       MET  25  -9.979   0.260   0.030
  184   2HG   MET  25          2HG       MET  25  -9.784   1.431   1.333
  185   1HE   MET  25          1HE       MET  25  -6.529  -0.158  -1.482
  186   2HE   MET  25          2HE       MET  25  -7.762  -1.169  -0.728
  187   3HE   MET  25          3HE       MET  25  -8.227   0.050  -1.915
  188    H    LYS  26           H        LYS  26  -9.380   1.152   3.912
  189    HA   LYS  26           HA       LYS  26 -11.776   2.852   4.019
  190   1HB   LYS  26          1HB       LYS  26  -9.688   2.234   5.912
  191   2HB   LYS  26          2HB       LYS  26  -9.760   3.968   5.632
  192   1HG   LYS  26          1HG       LYS  26 -11.665   4.183   6.766
  193   2HG   LYS  26          2HG       LYS  26 -12.384   2.762   6.005
  194   1HD   LYS  26          1HD       LYS  26 -12.240   2.014   8.160
  195   2HD   LYS  26          2HD       LYS  26 -10.662   1.498   7.563
  196   1HE   LYS  26          1HE       LYS  26  -9.568   2.911   8.912
  197   2HE   LYS  26          2HE       LYS  26 -10.682   4.235   8.575
  198   1HZ   LYS  26          1HZ       LYS  26 -11.618   2.041  10.273
  199   2HZ   LYS  26          2HZ       LYS  26 -12.013   3.684  10.320
  200   3HZ   LYS  26          3HZ       LYS  26 -10.532   3.152  10.942
  201    H    TYR  27           H        TYR  27  -8.341   2.852   3.198
  202    HA   TYR  27           HA       TYR  27  -8.751   4.900   1.230
  203   1HB   TYR  27          1HB       TYR  27  -6.817   6.287   2.352
  204   2HB   TYR  27          2HB       TYR  27  -8.489   6.528   2.846
  205    HD1  TYR  27           HD1      TYR  27  -5.470   4.523   3.744
  206    HD2  TYR  27           HD2      TYR  27  -9.022   6.434   5.100
  207    HE1  TYR  27           HE1      TYR  27  -4.848   4.016   6.069
  208    HE2  TYR  27           HE2      TYR  27  -8.409   5.932   7.429
  209    HH   TYR  27           HH       TYR  27  -7.022   4.740   8.752
  210    H    LEU  28           H        LEU  28  -7.034   5.074  -0.230
  211    HA   LEU  28           HA       LEU  28  -4.975   2.989   0.068
  212   1HB   LEU  28          1HB       LEU  28  -5.886   2.272  -1.846
  213   2HB   LEU  28          2HB       LEU  28  -6.691   3.810  -2.148
  214    HG   LEU  28           HG       LEU  28  -4.492   4.683  -2.994
  215   1HD1  LEU  28          1HD1      LEU  28  -3.117   2.520  -3.814
  216   2HD1  LEU  28          2HD1      LEU  28  -3.707   1.941  -2.256
  217   3HD1  LEU  28          3HD1      LEU  28  -2.746   3.418  -2.342
  218   1HD2  LEU  28          1HD2      LEU  28  -6.222   4.028  -4.537
  219   2HD2  LEU  28          2HD2      LEU  28  -5.756   2.333  -4.399
  220   3HD2  LEU  28          3HD2      LEU  28  -4.661   3.491  -5.156
  221    H    VAL  29           H        VAL  29  -2.923   3.612   0.207
  222    HA   VAL  29           HA       VAL  29  -2.185   6.278  -0.805
  223    HB   VAL  29           HB       VAL  29  -1.262   5.016   1.780
  224   1HG1  VAL  29          1HG1      VAL  29  -0.048   7.024   0.082
  225   2HG1  VAL  29          2HG1      VAL  29  -0.387   7.646   1.699
  226   3HG1  VAL  29          3HG1      VAL  29   0.604   6.200   1.498
  227   1HG2  VAL  29          1HG2      VAL  29  -3.188   5.962   2.475
  228   2HG2  VAL  29          2HG2      VAL  29  -2.234   7.444   2.443
  229   3HG2  VAL  29          3HG2      VAL  29  -3.285   7.043   1.085
  230    H    TYR  30           H        TYR  30  -0.563   6.242  -2.211
  231    HA   TYR  30           HA       TYR  30   1.596   4.327  -1.951
  232   1HB   TYR  30          1HB       TYR  30   1.348   3.288  -4.064
  233   2HB   TYR  30          2HB       TYR  30  -0.247   3.228  -3.324
  234    HD1  TYR  30           HD1      TYR  30   1.793   4.775  -5.955
  235    HD2  TYR  30           HD2      TYR  30  -2.088   4.501  -4.233
  236    HE1  TYR  30           HE1      TYR  30   0.843   5.881  -7.936
  237    HE2  TYR  30           HE2      TYR  30  -3.049   5.605  -6.209
  238    HH   TYR  30           HH       TYR  30  -1.002   6.893  -8.772
  239    H    GLN  31           H        GLN  31   3.410   4.814  -3.339
  240    HA   GLN  31           HA       GLN  31   3.335   7.477  -4.571
  241   1HB   GLN  31          1HB       GLN  31   5.424   8.108  -3.536
  242   2HB   GLN  31          2HB       GLN  31   4.271   7.671  -2.283
  243   1HG   GLN  31          1HG       GLN  31   5.478   5.906  -1.596
  244   2HG   GLN  31          2HG       GLN  31   5.994   5.486  -3.228
  245   1HE2  GLN  31          1HE2      GLN  31   6.709   7.287  -0.370
  246   2HE2  GLN  31          2HE2      GLN  31   8.301   7.781  -0.823
  247    H    THR  32           H        THR  32   5.062   7.866  -6.102
  248    HA   THR  32           HA       THR  32   5.792   5.413  -7.505
  249    HB   THR  32           HB       THR  32   6.561   8.005  -8.690
  250    HG1  THR  32           HG1      THR  32   4.225   8.209  -9.339
  251   1HG2  THR  32          1HG2      THR  32   5.143   5.519  -9.641
  252   2HG2  THR  32          2HG2      THR  32   6.788   6.035 -10.013
  253   3HG2  THR  32          3HG2      THR  32   5.415   6.931 -10.661
  254    H    GLU  33           H        GLU  33   7.823   4.666  -7.702
  255    HA   GLU  33           HA       GLU  33  10.031   6.374  -6.774
  256   1HB   GLU  33          1HB       GLU  33   9.268   3.637  -5.875
  257   2HB   GLU  33          2HB       GLU  33  10.980   4.016  -5.998
  258   1HG   GLU  33          1HG       GLU  33  10.938   5.135  -4.092
  259   2HG   GLU  33          2HG       GLU  33   9.587   6.127  -4.639
  260    H    GLN  34           H        GLN  34  12.122   5.823  -7.631
  261    HA   GLN  34           HA       GLN  34  11.917   4.620 -10.297
  262   1HB   GLN  34          1HB       GLN  34  13.027   7.003  -9.481
  263   2HB   GLN  34          2HB       GLN  34  14.432   5.955  -9.618
  264   1HG   GLN  34          1HG       GLN  34  13.439   5.344 -11.931
  265   2HG   GLN  34          2HG       GLN  34  12.518   6.834 -11.732
  266   1HE2  GLN  34          1HE2      GLN  34  15.849   5.897 -10.949
  267   2HE2  GLN  34          2HE2      GLN  34  16.598   7.190 -11.816
  268    H    GLY  35           H        GLY  35  13.178   2.925 -10.941
  269   1HA   GLY  35          1HA       GLY  35  15.510   1.954  -9.928
  270   2HA   GLY  35          2HA       GLY  35  14.292   1.287  -8.851
  271    H    GLU  36           H        GLU  36  15.705  -0.544 -10.076
  272    HA   GLU  36           HA       GLU  36  15.788  -2.187 -11.691
  273   1HB   GLU  36          1HB       GLU  36  13.505  -3.307 -11.915
  274   2HB   GLU  36          2HB       GLU  36  14.166  -3.162 -10.293
  275   1HG   GLU  36          1HG       GLU  36  12.750  -1.234  -9.867
  276   2HG   GLU  36          2HG       GLU  36  12.107  -1.333 -11.505
  277    H    ALA  37           H        ALA  37  16.424  -0.949 -13.504
  278    HA   ALA  37           HA       ALA  37  16.277  -0.308 -15.684
  279   1HB   ALA  37          1HB       ALA  37  14.903  -2.442 -15.787
  280   2HB   ALA  37          2HB       ALA  37  13.479  -1.402 -15.740
  281   3HB   ALA  37          3HB       ALA  37  14.631  -1.261 -17.068
  282    H    GLY  38           H        GLY  38  14.896   1.086 -17.222
  283   1HA   GLY  38          1HA       GLY  38  14.438   3.560 -16.086
  284   2HA   GLY  38          2HA       GLY  38  13.766   3.045 -17.626
  285    H    ASN  39           H        ASN  39  12.157   0.916 -16.546
  286    HA   ASN  39           HA       ASN  39   9.761   2.216 -16.119
  287   1HB   ASN  39          1HB       ASN  39  10.375  -0.493 -14.941
  288   2HB   ASN  39          2HB       ASN  39   8.834   0.104 -15.550
  289   1HD2  ASN  39          1HD2      ASN  39  10.632  -2.225 -16.230
  290   2HD2  ASN  39          2HD2      ASN  39  10.791  -2.145 -17.948
  291    H    ILE  40           H        ILE  40   8.364   2.030 -14.124
  292    HA   ILE  40           HA       ILE  40   9.957   2.678 -11.730
  293    HB   ILE  40           HB       ILE  40   7.924   4.050 -11.043
  294   1HG1  ILE  40          1HG1      ILE  40   7.326   3.704 -13.988
  295   2HG1  ILE  40          2HG1      ILE  40   6.319   3.181 -12.643
  296   1HG2  ILE  40          1HG2      ILE  40   9.495   4.970 -13.447
  297   2HG2  ILE  40          2HG2      ILE  40   8.675   6.004 -12.277
  298   3HG2  ILE  40          3HG2      ILE  40  10.053   5.024 -11.775
  299   1HD1  ILE  40          1HD1      ILE  40   6.465   5.746 -13.955
  300   2HD1  ILE  40          2HD1      ILE  40   5.238   5.100 -12.864
  301   3HD1  ILE  40          3HD1      ILE  40   6.672   5.890 -12.209
  302    H    HIS  41           H        HIS  41   8.709   2.379  -9.661
  303    HA   HIS  41           HA       HIS  41   6.886   0.074  -9.833
  304   1HB   HIS  41          1HB       HIS  41   8.026  -0.560  -7.555
  305   2HB   HIS  41          2HB       HIS  41   8.785  -1.011  -9.079
  306    HD1  HIS  41           HD1      HIS  41  11.186  -0.975  -8.301
  307    HD2  HIS  41           HD2      HIS  41   9.170   2.567  -7.491
  308    HE1  HIS  41           HE1      HIS  41  12.951   0.644  -7.534
  309    H    PHE  42           H        PHE  42   5.320  -0.091  -8.192
  310    HA   PHE  42           HA       PHE  42   4.753   2.463  -6.867
  311   1HB   PHE  42          1HB       PHE  42   3.049   0.169  -7.775
  312   2HB   PHE  42          2HB       PHE  42   2.463   1.244  -6.510
  313    HD1  PHE  42           HD1      PHE  42   4.575   2.293  -9.341
  314    HD2  PHE  42           HD2      PHE  42   0.651   2.198  -7.696
  315    HE1  PHE  42           HE1      PHE  42   3.822   3.891 -11.054
  316    HE2  PHE  42           HE2      PHE  42  -0.109   3.795  -9.407
  317    HZ   PHE  42           HZ       PHE  42   1.477   4.643 -11.089
  318    H    GLN  43           H        GLN  43   4.855   2.674  -4.724
  319    HA   GLN  43           HA       GLN  43   4.676   0.310  -3.019
  320   1HB   GLN  43          1HB       GLN  43   7.131   1.650  -3.628
  321   2HB   GLN  43          2HB       GLN  43   6.747   1.913  -1.932
  322   1HG   GLN  43          1HG       GLN  43   6.751  -0.386  -1.462
  323   2HG   GLN  43          2HG       GLN  43   6.693  -0.817  -3.171
  324   1HE2  GLN  43          1HE2      GLN  43   8.603   0.049  -4.454
  325   2HE2  GLN  43          2HE2      GLN  43  10.157  -0.130  -3.720
  326    H    GLY  44           H        GLY  44   3.666   0.681  -1.116
  327   1HA   GLY  44          1HA       GLY  44   3.613   3.156   0.242
  328   2HA   GLY  44          2HA       GLY  44   2.163   3.007  -0.740
  329    H    TYR  45           H        TYR  45   1.164   3.153   1.446
  330    HA   TYR  45           HA       TYR  45   1.007   0.475   2.665
  331   1HB   TYR  45          1HB       TYR  45   1.284   3.158   3.913
  332   2HB   TYR  45          2HB       TYR  45   0.221   2.008   4.716
  333    HD1  TYR  45           HD2      TYR  45   1.203  -0.307   5.267
  334    HD2  TYR  45           HD1      TYR  45   3.590   3.067   4.259
  335    HE1  TYR  45           HE2      TYR  45   3.151  -1.377   6.322
  336    HE2  TYR  45           HE1      TYR  45   5.545   2.006   5.309
  337    HH   TYR  45           HH       TYR  45   5.651  -0.025   7.367
  338    H    ILE  46           H        ILE  46  -0.964  -0.407   2.823
  339    HA   ILE  46           HA       ILE  46  -3.296   1.321   2.311
  340    HB   ILE  46           HB       ILE  46  -2.941  -1.531   1.383
  341   1HG1  ILE  46          1HG1      ILE  46  -3.148   0.955  -0.317
  342   2HG1  ILE  46          2HG1      ILE  46  -1.605   0.268   0.177
  343   1HG2  ILE  46          1HG2      ILE  46  -5.230   0.388   1.309
  344   2HG2  ILE  46          2HG2      ILE  46  -5.054  -0.825   0.042
  345   3HG2  ILE  46          3HG2      ILE  46  -5.216  -1.326   1.725
  346   1HD1  ILE  46          1HD1      ILE  46  -3.629  -1.418  -1.229
  347   2HD1  ILE  46          2HD1      ILE  46  -2.571  -0.332  -2.131
  348   3HD1  ILE  46          3HD1      ILE  46  -1.879  -1.613  -1.136
  349    H    GLU  47           H        GLU  47  -4.818   1.277   3.828
  350    HA   GLU  47           HA       GLU  47  -4.693  -0.841   5.861
  351   1HB   GLU  47          1HB       GLU  47  -5.799   1.964   5.935
  352   2HB   GLU  47          2HB       GLU  47  -6.108   0.787   7.204
  353   1HG   GLU  47          1HG       GLU  47  -3.291   0.970   6.598
  354   2HG   GLU  47          2HG       GLU  47  -3.968   2.538   7.034
  355    H    MET  48           H        MET  48  -6.160  -2.394   5.739
  356    HA   MET  48           HA       MET  48  -8.491  -2.119   4.071
  357   1HB   MET  48          1HB       MET  48  -7.512  -4.378   5.823
  358   2HB   MET  48          2HB       MET  48  -8.947  -4.473   4.811
  359   1HG   MET  48          1HG       MET  48  -6.691  -3.571   3.277
  360   2HG   MET  48          2HG       MET  48  -6.321  -5.082   4.104
  361   1HE   MET  48          1HE       MET  48  -8.040  -3.148   1.613
  362   2HE   MET  48          2HE       MET  48  -8.678  -4.311   0.451
  363   3HE   MET  48          3HE       MET  48  -9.681  -3.769   1.797
  364    H    LYS  49           H        LYS  49 -10.564  -3.255   5.128
  365    HA   LYS  49           HA       LYS  49 -11.712  -1.400   6.839
  366   1HB   LYS  49          1HB       LYS  49 -12.578  -3.636   5.460
  367   2HB   LYS  49          2HB       LYS  49 -12.842  -4.077   7.142
  368   1HG   LYS  49          1HG       LYS  49 -14.334  -2.318   7.494
  369   2HG   LYS  49          2HG       LYS  49 -13.796  -1.454   6.051
  370   1HD   LYS  49          1HD       LYS  49 -14.667  -3.879   5.061
  371   2HD   LYS  49          2HD       LYS  49 -15.825  -3.522   6.344
  372   1HE   LYS  49          1HE       LYS  49 -15.127  -1.285   4.545
  373   2HE   LYS  49          2HE       LYS  49 -16.057  -2.601   3.829
  374   1HZ   LYS  49          1HZ       LYS  49 -17.753  -1.366   4.636
  375   2HZ   LYS  49          2HZ       LYS  49 -16.834  -0.677   5.877
  376   3HZ   LYS  49          3HZ       LYS  49 -17.436  -2.249   6.044
  377    H    LYS  50           H        LYS  50 -10.710  -4.717   7.700
  378    HA   LYS  50           HA       LYS  50  -9.384  -4.035  10.057
  379   1HB   LYS  50          1HB       LYS  50 -12.251  -4.011  10.301
  380   2HB   LYS  50          2HB       LYS  50 -11.582  -5.301  11.291
  381   1HG   LYS  50          1HG       LYS  50 -10.193  -3.755  12.480
  382   2HG   LYS  50          2HG       LYS  50 -10.651  -2.441  11.393
  383   1HD   LYS  50          1HD       LYS  50 -12.961  -3.735  12.585
  384   2HD   LYS  50          2HD       LYS  50 -11.858  -3.089  13.803
  385   1HE   LYS  50          1HE       LYS  50 -11.943  -0.905  12.777
  386   2HE   LYS  50          2HE       LYS  50 -12.923  -1.528  11.451
  387   1HZ   LYS  50          1HZ       LYS  50 -14.541  -0.666  12.770
  388   2HZ   LYS  50          2HZ       LYS  50 -13.691  -0.929  14.209
  389   3HZ   LYS  50          3HZ       LYS  50 -14.472  -2.218  13.440
  390    H    ARG  51           H        ARG  51 -11.846  -6.559   9.575
  391    HA   ARG  51           HA       ARG  51  -9.842  -8.596  10.094
  392   1HB   ARG  51          1HB       ARG  51 -12.347  -8.477  10.924
  393   2HB   ARG  51          2HB       ARG  51 -12.666  -9.252   9.378
  394   1HG   ARG  51          1HG       ARG  51 -11.026 -11.021  10.011
  395   2HG   ARG  51          2HG       ARG  51 -10.934 -10.282  11.610
  396   1HD   ARG  51          1HD       ARG  51 -13.404 -10.576  11.805
  397   2HD   ARG  51          2HD       ARG  51 -13.366 -11.475  10.288
  398    HE   ARG  51           HE       ARG  51 -11.564 -12.792  11.789
  399   1HH1  ARG  51          1HH1      ARG  51 -14.833 -11.764  12.402
  400   2HH1  ARG  51          2HH1      ARG  51 -15.182 -13.075  13.480
  401   1HH2  ARG  51          1HH2      ARG  51 -12.010 -14.522  13.207
  402   2HH2  ARG  51          2HH2      ARG  51 -13.575 -14.642  13.938
  403    H    THR  52           H        THR  52  -9.137  -7.403   7.808
  404    HA   THR  52           HA       THR  52 -10.052  -9.216   5.673
  405    HB   THR  52           HB       THR  52  -8.516  -6.864   4.825
  406    HG1  THR  52           HG1      THR  52 -11.130  -6.495   5.904
  407   1HG2  THR  52          1HG2      THR  52  -9.511  -7.974   3.070
  408   2HG2  THR  52          2HG2      THR  52 -10.718  -6.729   3.394
  409   3HG2  THR  52          3HG2      THR  52 -10.957  -8.368   3.999
  410    H    SER  53           H        SER  53  -8.661 -10.788   5.242
  411    HA   SER  53           HA       SER  53  -5.904 -10.632   6.046
  412   1HB   SER  53          1HB       SER  53  -5.903 -12.915   4.723
  413   2HB   SER  53          2HB       SER  53  -6.689 -12.794   6.297
  414    HG   SER  53           HG       SER  53  -8.273 -13.632   5.137
  415    H    LEU  54           H        LEU  54  -4.317 -11.659   4.283
  416    HA   LEU  54           HA       LEU  54  -3.733  -9.672   2.455
  417   1HB   LEU  54          1HB       LEU  54  -2.134 -11.368   3.179
  418   2HB   LEU  54          2HB       LEU  54  -3.031 -12.600   2.295
  419    HG   LEU  54           HG       LEU  54  -2.427 -11.568   0.185
  420   1HD1  LEU  54          1HD1      LEU  54  -0.833  -9.580   1.793
  421   2HD1  LEU  54          2HD1      LEU  54  -2.385  -9.234   1.030
  422   3HD1  LEU  54          3HD1      LEU  54  -0.989  -9.655   0.037
  423   1HD2  LEU  54          1HD2      LEU  54  -0.430 -12.488   2.131
  424   2HD2  LEU  54          2HD2      LEU  54   0.227 -11.612   0.749
  425   3HD2  LEU  54          3HD2      LEU  54  -0.765 -13.048   0.492
  426    H    ALA  55           H        ALA  55  -5.874 -12.404   2.140
  427    HA   ALA  55           HA       ALA  55  -6.131 -12.603  -0.613
  428   1HB   ALA  55          1HB       ALA  55  -8.261 -13.631  -0.226
  429   2HB   ALA  55          2HB       ALA  55  -7.163 -14.125   1.064
  430   3HB   ALA  55          3HB       ALA  55  -8.383 -12.889   1.369
  431    H    GLY  56           H        GLY  56  -7.464 -10.228   1.598
  432   1HA   GLY  56          1HA       GLY  56  -9.327  -9.097  -0.241
  433   2HA   GLY  56          2HA       GLY  56  -8.756  -8.355   1.246
  434    H    MET  57           H        MET  57  -6.020  -8.237   0.709
  435    HA   MET  57           HA       MET  57  -5.927  -5.901  -0.926
  436   1HB   MET  57          1HB       MET  57  -3.755  -7.535   0.391
  437   2HB   MET  57          2HB       MET  57  -3.450  -6.043  -0.489
  438   1HG   MET  57          1HG       MET  57  -5.483  -5.966   1.661
  439   2HG   MET  57          2HG       MET  57  -3.793  -6.112   2.138
  440   1HE   MET  57          1HE       MET  57  -5.530  -3.370  -0.781
  441   2HE   MET  57          2HE       MET  57  -6.436  -4.433   0.294
  442   3HE   MET  57          3HE       MET  57  -6.213  -2.735   0.716
  443    H    LYS  58           H        LYS  58  -4.572  -9.174  -1.258
  444    HA   LYS  58           HA       LYS  58  -3.309  -8.832  -3.715
  445   1HB   LYS  58          1HB       LYS  58  -3.169 -11.174  -3.837
  446   2HB   LYS  58          2HB       LYS  58  -3.213 -10.830  -2.113
  447   1HG   LYS  58          1HG       LYS  58  -5.588 -11.385  -2.056
  448   2HG   LYS  58          2HG       LYS  58  -5.553 -11.719  -3.789
  449   1HD   LYS  58          1HD       LYS  58  -5.414 -13.782  -2.486
  450   2HD   LYS  58          2HD       LYS  58  -3.937 -13.515  -3.415
  451   1HE   LYS  58          1HE       LYS  58  -2.675 -13.140  -1.558
  452   2HE   LYS  58          2HE       LYS  58  -4.017 -12.442  -0.653
  453   1HZ   LYS  58          1HZ       LYS  58  -3.181 -14.682   0.108
  454   2HZ   LYS  58          2HZ       LYS  58  -3.879 -15.329  -1.290
  455   3HZ   LYS  58          3HZ       LYS  58  -4.850 -14.557  -0.140
  456    H    LYS  59           H        LYS  59  -6.675  -9.317  -2.947
  457    HA   LYS  59           HA       LYS  59  -7.659 -10.168  -5.408
  458   1HB   LYS  59          1HB       LYS  59  -8.731  -9.174  -2.958
  459   2HB   LYS  59          2HB       LYS  59  -9.521  -8.330  -4.283
  460   1HG   LYS  59          1HG       LYS  59 -10.153 -10.458  -5.281
  461   2HG   LYS  59          2HG       LYS  59  -9.332 -11.321  -3.978
  462   1HD   LYS  59          1HD       LYS  59 -10.939  -9.733  -2.526
  463   2HD   LYS  59          2HD       LYS  59 -11.924  -9.896  -3.982
  464   1HE   LYS  59          1HE       LYS  59 -11.377 -12.435  -3.717
  465   2HE   LYS  59          2HE       LYS  59 -11.025 -11.991  -2.048
  466   1HZ   LYS  59          1HZ       LYS  59 -13.457 -10.816  -2.767
  467   2HZ   LYS  59          2HZ       LYS  59 -13.182 -12.032  -1.625
  468   3HZ   LYS  59          3HZ       LYS  59 -13.522 -12.441  -3.231
  469    H    LEU  60           H        LEU  60  -6.672  -6.989  -4.335
  470    HA   LEU  60           HA       LEU  60  -7.772  -5.643  -6.636
  471   1HB   LEU  60          1HB       LEU  60  -5.996  -4.779  -4.373
  472   2HB   LEU  60          2HB       LEU  60  -6.386  -3.712  -5.720
  473    HG   LEU  60           HG       LEU  60  -8.838  -4.130  -5.089
  474   1HD1  LEU  60          1HD1      LEU  60  -7.452  -5.632  -3.021
  475   2HD1  LEU  60          2HD1      LEU  60  -9.145  -5.673  -3.511
  476   3HD1  LEU  60          3HD1      LEU  60  -8.587  -4.449  -2.370
  477   1HD2  LEU  60          1HD2      LEU  60  -8.696  -2.073  -4.264
  478   2HD2  LEU  60          2HD2      LEU  60  -6.940  -2.243  -4.276
  479   3HD2  LEU  60          3HD2      LEU  60  -7.856  -2.652  -2.825
  480    H    ILE  61           H        ILE  61  -4.609  -6.771  -5.561
  481    HA   ILE  61           HA       ILE  61  -3.650  -6.536  -8.314
  482    HB   ILE  61           HB       ILE  61  -2.033  -5.549  -5.963
  483   1HG1  ILE  61          1HG1      ILE  61  -2.308  -3.364  -7.468
  484   2HG1  ILE  61          2HG1      ILE  61  -3.812  -4.165  -7.913
  485   1HG2  ILE  61          1HG2      ILE  61  -0.804  -4.581  -8.150
  486   2HG2  ILE  61          2HG2      ILE  61  -0.382  -6.115  -7.392
  487   3HG2  ILE  61          3HG2      ILE  61  -1.443  -6.091  -8.800
  488   1HD1  ILE  61          1HD1      ILE  61  -3.979  -4.401  -5.264
  489   2HD1  ILE  61          2HD1      ILE  61  -2.996  -2.940  -5.358
  490   3HD1  ILE  61          3HD1      ILE  61  -4.573  -2.994  -6.145
  491    HA   PRO  62           HA       PRO  62  -2.628 -10.618  -6.397
  492   1HB   PRO  62          1HB       PRO  62  -3.285 -12.063  -8.600
  493   2HB   PRO  62          2HB       PRO  62  -4.468 -11.584  -7.377
  494   1HG   PRO  62          1HG       PRO  62  -3.874 -10.333 -10.031
  495   2HG   PRO  62          2HG       PRO  62  -5.444 -10.655  -9.272
  496   1HD   PRO  62          1HD       PRO  62  -4.295  -8.203  -9.258
  497   2HD   PRO  62          2HD       PRO  62  -5.321  -8.784  -7.931
  498    H    GLY  63           H        GLY  63  -0.474 -10.844  -6.350
  499   1HA   GLY  63          1HA       GLY  63   1.254 -12.016  -7.825
  500   2HA   GLY  63          2HA       GLY  63   1.012 -10.638  -8.889
  501    H    ALA  64           H        ALA  64   0.975  -8.513  -7.236
  502    HA   ALA  64           HA       ALA  64   3.629  -7.933  -6.771
  503   1HB   ALA  64          1HB       ALA  64   2.496  -5.993  -6.726
  504   2HB   ALA  64          2HB       ALA  64   1.060  -6.728  -6.012
  505   3HB   ALA  64          3HB       ALA  64   2.426  -6.286  -4.988
  506    H    HIS  65           H        HIS  65   4.608  -7.340  -4.608
  507    HA   HIS  65           HA       HIS  65   4.328  -9.638  -2.826
  508   1HB   HIS  65          1HB       HIS  65   6.569  -8.770  -3.787
  509   2HB   HIS  65          2HB       HIS  65   6.427  -7.498  -2.577
  510    HD1  HIS  65           HD1      HIS  65   7.737 -10.814  -3.034
  511    HD2  HIS  65           HD2      HIS  65   6.173  -8.660   0.156
  512    HE1  HIS  65           HE1      HIS  65   8.511 -12.018  -0.966
  513    H    PHE  66           H        PHE  66   3.234  -9.501  -0.990
  514    HA   PHE  66           HA       PHE  66   2.799  -6.836   0.188
  515   1HB   PHE  66          1HB       PHE  66   0.978  -9.117  -0.290
  516   2HB   PHE  66          2HB       PHE  66   0.802  -8.314   1.267
  517    HD1  PHE  66           HD1      PHE  66   0.744  -7.778  -2.388
  518    HD2  PHE  66           HD2      PHE  66  -0.260  -6.225   1.446
  519    HE1  PHE  66           HE1      PHE  66  -0.594  -6.012  -3.458
  520    HE2  PHE  66           HE2      PHE  66  -1.601  -4.457   0.382
  521    HZ   PHE  66           HZ       PHE  66  -1.770  -4.349  -2.073
  522    H    GLU  67           H        GLU  67   2.571  -6.770   2.533
  523    HA   GLU  67           HA       GLU  67   3.647  -9.028   4.017
  524   1HB   GLU  67          1HB       GLU  67   5.511  -7.386   3.141
  525   2HB   GLU  67          2HB       GLU  67   4.970  -6.387   4.482
  526   1HG   GLU  67          1HG       GLU  67   5.928  -7.702   6.014
  527   2HG   GLU  67          2HG       GLU  67   5.452  -9.184   5.187
  528    H    LYS  68           H        LYS  68   2.190  -9.275   5.570
  529    HA   LYS  68           HA       LYS  68   0.831  -6.942   6.684
  530   1HB   LYS  68          1HB       LYS  68  -0.457  -8.961   5.947
  531   2HB   LYS  68          2HB       LYS  68   0.321  -9.869   7.237
  532   1HG   LYS  68          1HG       LYS  68  -0.874  -7.441   8.241
  533   2HG   LYS  68          2HG       LYS  68  -2.053  -8.442   7.391
  534   1HD   LYS  68          1HD       LYS  68  -1.930 -10.121   8.918
  535   2HD   LYS  68          2HD       LYS  68  -0.224  -9.827   9.263
  536   1HE   LYS  68          1HE       LYS  68  -0.832  -7.837  10.552
  537   2HE   LYS  68          2HE       LYS  68  -2.535  -8.131  10.204
  538   1HZ   LYS  68          1HZ       LYS  68  -0.909  -9.259  12.231
  539   2HZ   LYS  68          2HZ       LYS  68  -1.555 -10.485  11.260
  540   3HZ   LYS  68          3HZ       LYS  68  -2.584  -9.377  12.019
  541    H    ARG  69           H        ARG  69   3.682  -8.073   7.263
  542    HA   ARG  69           HA       ARG  69   3.521  -8.581  10.113
  543   1HB   ARG  69          1HB       ARG  69   5.354  -9.207   8.071
  544   2HB   ARG  69          2HB       ARG  69   6.201  -8.115   9.158
  545   1HG   ARG  69          1HG       ARG  69   6.388  -9.666  10.747
  546   2HG   ARG  69          2HG       ARG  69   4.712 -10.187  10.559
  547   1HD   ARG  69          1HD       ARG  69   6.652 -10.904   8.424
  548   2HD   ARG  69          2HD       ARG  69   6.751 -11.769   9.957
  549    HE   ARG  69           HE       ARG  69   4.680 -11.987   7.966
  550   1HH1  ARG  69          1HH1      ARG  69   5.527 -12.468  11.308
  551   2HH1  ARG  69          2HH1      ARG  69   4.307 -13.667  11.580
  552   1HH2  ARG  69          1HH2      ARG  69   3.069 -13.564   8.312
  553   2HH2  ARG  69          2HH2      ARG  69   2.909 -14.290   9.875
  554    H    ARG  70           H        ARG  70   2.991  -5.897   8.590
  555    HA   ARG  70           HA       ARG  70   3.100  -3.690   9.136
  556   1HB   ARG  70          1HB       ARG  70   4.617  -4.390  11.634
  557   2HB   ARG  70          2HB       ARG  70   3.500  -3.059  11.361
  558   1HG   ARG  70          1HG       ARG  70   1.679  -4.789  11.143
  559   2HG   ARG  70          2HG       ARG  70   2.852  -5.968  11.733
  560   1HD   ARG  70          1HD       ARG  70   2.266  -3.431  13.228
  561   2HD   ARG  70          2HD       ARG  70   1.284  -4.880  13.441
  562    HE   ARG  70           HE       ARG  70   3.835  -5.752  13.806
  563   1HH1  ARG  70          1HH1      ARG  70   1.896  -3.226  15.214
  564   2HH1  ARG  70          2HH1      ARG  70   2.688  -3.297  16.753
  565   1HH2  ARG  70          1HH2      ARG  70   4.886  -5.855  15.828
  566   2HH2  ARG  70          2HH2      ARG  70   4.389  -4.792  17.101
  567    H    GLY  71           H        GLY  71   4.562  -3.463   7.341
  568   1HA   GLY  71          1HA       GLY  71   7.292  -3.755   7.319
  569   2HA   GLY  71          2HA       GLY  71   6.443  -2.501   6.428
  570    H    THR  72           H        THR  72   5.432  -1.266   8.914
  571    HA   THR  72           HA       THR  72   7.513  -0.514  10.628
  572    HB   THR  72           HB       THR  72   7.375   1.977   9.429
  573    HG1  THR  72           HG1      THR  72   7.972   1.531   7.241
  574   1HG2  THR  72          1HG2      THR  72   9.305   0.334  10.366
  575   2HG2  THR  72          2HG2      THR  72   9.632   1.826   9.484
  576   3HG2  THR  72          3HG2      THR  72   9.655   0.279   8.639
  577    H    GLN  73           H        GLN  73   4.677  -1.074  10.636
  578    HA   GLN  73           HA       GLN  73   2.769  -0.379  11.659
  579   1HB   GLN  73          1HB       GLN  73   4.827   0.528  13.217
  580   2HB   GLN  73          2HB       GLN  73   3.939   2.014  12.904
  581   1HG   GLN  73          1HG       GLN  73   1.876   0.533  13.584
  582   2HG   GLN  73          2HG       GLN  73   3.115  -0.409  14.411
  583   1HE2  GLN  73          1HE2      GLN  73   0.860   1.522  15.207
  584   2HE2  GLN  73          2HE2      GLN  73   1.615   2.553  16.370
  585    H    GLY  74           H        GLY  74   1.737   2.098  12.291
  586   1HA   GLY  74          1HA       GLY  74   1.068   3.073   9.659
  587   2HA   GLY  74          2HA       GLY  74   0.377   3.614  11.181
  588    H    GLU  75           H        GLU  75   3.524   3.793  11.802
  589    HA   GLU  75           HA       GLU  75   3.620   6.620  11.578
  590   1HB   GLU  75          1HB       GLU  75   5.103   4.594  12.890
  591   2HB   GLU  75          2HB       GLU  75   6.242   5.511  11.913
  592   1HG   GLU  75          1HG       GLU  75   5.596   7.559  12.984
  593   2HG   GLU  75          2HG       GLU  75   4.311   6.738  13.867
  594    H    ALA  76           H        ALA  76   4.653   4.011   9.539
  595    HA   ALA  76           HA       ALA  76   6.510   5.481   7.962
  596   1HB   ALA  76          1HB       ALA  76   6.181   3.590   6.331
  597   2HB   ALA  76          2HB       ALA  76   6.700   3.118   7.950
  598   3HB   ALA  76          3HB       ALA  76   5.015   2.916   7.470
  599    H    ARG  77           H        ARG  77   3.179   5.669   8.229
  600    HA   ARG  77           HA       ARG  77   2.463   6.145   5.518
  601   1HB   ARG  77          1HB       ARG  77   1.136   6.827   8.139
  602   2HB   ARG  77          2HB       ARG  77   0.427   7.242   6.584
  603   1HG   ARG  77          1HG       ARG  77   1.196   4.429   7.291
  604   2HG   ARG  77          2HG       ARG  77  -0.382   5.112   7.692
  605   1HD   ARG  77          1HD       ARG  77   0.822   4.809   4.944
  606   2HD   ARG  77          2HD       ARG  77  -0.535   3.903   5.611
  607    HE   ARG  77           HE       ARG  77  -0.635   6.473   4.401
  608   1HH1  ARG  77          1HH1      ARG  77  -2.065   4.526   6.908
  609   2HH1  ARG  77          2HH1      ARG  77  -3.581   5.363   6.874
  610   1HH2  ARG  77          1HH2      ARG  77  -2.627   7.583   4.346
  611   2HH2  ARG  77          2HH2      ARG  77  -3.900   7.101   5.415
  612    H    ALA  78           H        ALA  78   3.920   8.066   7.988
  613    HA   ALA  78           HA       ALA  78   3.450  10.533   6.469
  614   1HB   ALA  78          1HB       ALA  78   3.075  11.293   8.536
  615   2HB   ALA  78          2HB       ALA  78   3.876   9.914   9.288
  616   3HB   ALA  78          3HB       ALA  78   4.829  11.282   8.714
  617    H    TYR  79           H        TYR  79   5.934   8.289   7.424
  618    HA   TYR  79           HA       TYR  79   8.088  10.021   6.547
  619   1HB   TYR  79          1HB       TYR  79   8.821   8.742   8.326
  620   2HB   TYR  79          2HB       TYR  79   7.907   7.325   7.822
  621    HD1  TYR  79           HD1      TYR  79  10.731   9.450   6.595
  622    HD2  TYR  79           HD2      TYR  79   9.094   5.540   6.973
  623    HE1  TYR  79           HE1      TYR  79  12.764   8.507   5.582
  624    HE2  TYR  79           HE2      TYR  79  11.124   4.587   5.962
  625    HH   TYR  79           HH       TYR  79  13.209   5.008   5.272
  626    H    SER  80           H        SER  80   6.060   7.567   5.247
  627    HA   SER  80           HA       SER  80   5.895   6.624   3.183
  628   1HB   SER  80          1HB       SER  80   7.920   8.293   1.862
  629   2HB   SER  80          2HB       SER  80   6.218   8.059   1.466
  630    HG   SER  80           HG       SER  80   7.417  10.052   2.888
  631    H    MET  81           H        MET  81   7.753   6.208   1.159
  632    HA   MET  81           HA       MET  81   9.946   4.777   2.497
  633   1HB   MET  81          1HB       MET  81   9.533   3.041   0.564
  634   2HB   MET  81          2HB       MET  81   8.608   2.957   2.057
  635   1HG   MET  81          1HG       MET  81   7.517   4.567  -0.186
  636   2HG   MET  81          2HG       MET  81   7.454   2.809  -0.301
  637   1HE   MET  81          1HE       MET  81   5.892   5.887   0.687
  638   2HE   MET  81          2HE       MET  81   4.696   4.858  -0.101
  639   3HE   MET  81          3HE       MET  81   4.444   5.390   1.562
  640    H    LYS  82           H        LYS  82  11.863   4.600   1.338
  641    HA   LYS  82           HA       LYS  82  13.505   5.321  -0.063
  642   1HB   LYS  82          1HB       LYS  82  11.362   5.448  -2.182
  643   2HB   LYS  82          2HB       LYS  82  13.084   5.170  -2.408
  644   1HG   LYS  82          1HG       LYS  82  11.228   3.283  -0.975
  645   2HG   LYS  82          2HG       LYS  82  11.701   3.137  -2.669
  646   1HD   LYS  82          1HD       LYS  82  14.112   3.410  -1.362
  647   2HD   LYS  82          2HD       LYS  82  13.161   2.425  -0.248
  648   1HE   LYS  82          1HE       LYS  82  13.278   1.779  -3.173
  649   2HE   LYS  82          2HE       LYS  82  14.550   1.246  -2.075
  650   1HZ   LYS  82          1HZ       LYS  82  12.041   0.644  -0.954
  651   2HZ   LYS  82          2HZ       LYS  82  13.271  -0.419  -1.420
  652   3HZ   LYS  82          3HZ       LYS  82  12.085   0.045  -2.535
  653    H    GLU  83           H        GLU  83  13.440   7.333   1.234
  654    HA   GLU  83           HA       GLU  83  12.064   9.634   0.347
  655   1HB   GLU  83          1HB       GLU  83  13.474   9.022   2.574
  656   2HB   GLU  83          2HB       GLU  83  14.648  10.022   1.731
  657   1HG   GLU  83          1HG       GLU  83  11.876  11.044   1.940
  658   2HG   GLU  83          2HG       GLU  83  12.862  11.032   3.401
  659    H    ASP  84           H        ASP  84  15.379   8.490  -0.199
  660    HA   ASP  84           HA       ASP  84  16.051  10.709  -1.891
  661   1HB   ASP  84          1HB       ASP  84  17.494   8.069  -1.578
  662   2HB   ASP  84          2HB       ASP  84  18.155   9.556  -2.253
  663    H    THR  85           H        THR  85  14.999   7.385  -2.359
  664    HA   THR  85           HA       THR  85  15.255   7.582  -5.245
  665    HB   THR  85           HB       THR  85  13.757   5.274  -4.390
  666    HG1  THR  85           HG1      THR  85  16.294   5.618  -3.135
  667   1HG2  THR  85          1HG2      THR  85  16.604   5.297  -5.344
  668   2HG2  THR  85          2HG2      THR  85  15.272   5.689  -6.432
  669   3HG2  THR  85          3HG2      THR  85  15.340   4.107  -5.656
  670    H    ARG  86           H        ARG  86  13.180   8.950  -3.265
  671    HA   ARG  86           HA       ARG  86  10.630   8.112  -4.156
  672   1HB   ARG  86          1HB       ARG  86  11.592   9.871  -2.244
  673   2HB   ARG  86          2HB       ARG  86  10.785  10.924  -3.398
  674   1HG   ARG  86          1HG       ARG  86   8.718   9.779  -3.120
  675   2HG   ARG  86          2HG       ARG  86   9.489   8.500  -2.180
  676   1HD   ARG  86          1HD       ARG  86   8.197  10.252  -0.875
  677   2HD   ARG  86          2HD       ARG  86   9.845   9.924  -0.340
  678    HE   ARG  86           HE       ARG  86  10.362  12.091  -0.812
  679   1HH1  ARG  86          1HH1      ARG  86   7.511  11.218  -2.609
  680   2HH1  ARG  86          2HH1      ARG  86   7.255  12.815  -3.230
  681   1HH2  ARG  86          1HH2      ARG  86  10.036  14.197  -1.624
  682   2HH2  ARG  86          2HH2      ARG  86   8.693  14.509  -2.670
  683    H    LEU  87           H        LEU  87   9.735   8.364  -6.085
  684    HA   LEU  87           HA       LEU  87  10.843  10.341  -7.931
  685   1HB   LEU  87          1HB       LEU  87   9.936   7.707  -8.216
  686   2HB   LEU  87          2HB       LEU  87   8.747   8.712  -9.043
  687    HG   LEU  87           HG       LEU  87  11.686   8.450  -9.639
  688   1HD1  LEU  87          1HD1      LEU  87  10.593   6.742 -10.743
  689   2HD1  LEU  87          2HD1      LEU  87  10.594   8.025 -11.952
  690   3HD1  LEU  87          3HD1      LEU  87   9.138   7.703 -11.011
  691   1HD2  LEU  87          1HD2      LEU  87  11.194  10.114 -11.466
  692   2HD2  LEU  87          2HD2      LEU  87  11.263  10.774  -9.832
  693   3HD2  LEU  87          3HD2      LEU  87   9.702  10.496 -10.606
  694    H    GLU  88           H        GLU  88   7.702   9.282  -6.649
  695    HA   GLU  88           HA       GLU  88   6.707  12.007  -6.970
  696   1HB   GLU  88          1HB       GLU  88   6.025   9.977  -8.778
  697   2HB   GLU  88          2HB       GLU  88   4.638  10.125  -7.708
  698   1HG   GLU  88          1HG       GLU  88   4.235  12.323  -8.321
  699   2HG   GLU  88          2HG       GLU  88   5.870  12.553  -8.940
  700    H    GLY  89           H        GLY  89   4.367  12.091  -6.007
  701   1HA   GLY  89          1HA       GLY  89   2.867  11.457  -4.313
  702   2HA   GLY  89          2HA       GLY  89   4.004  10.219  -3.799
  703    HA   PRO  90           HA       PRO  90   3.315   9.881  -1.871
  704   1HB   PRO  90          1HB       PRO  90   1.864  10.558   0.322
  705   2HB   PRO  90          2HB       PRO  90   3.563  10.076   0.404
  706   1HG   PRO  90          1HG       PRO  90   2.369  12.821   0.432
  707   2HG   PRO  90          2HG       PRO  90   3.683  12.163   1.424
  708   1HD   PRO  90          1HD       PRO  90   4.134  13.733  -0.736
  709   2HD   PRO  90          2HD       PRO  90   5.251  12.444  -0.242
  710    H    TRP  91           H        TRP  91   0.998   9.236  -1.732
  711    HA   TRP  91           HA       TRP  91  -0.864  11.285  -2.689
  712   1HB   TRP  91          1HB       TRP  91  -0.180   8.709  -4.094
  713   2HB   TRP  91          2HB       TRP  91  -1.717   9.528  -4.358
  714    HD1  TRP  91           HD1      TRP  91  -0.528  12.533  -4.381
  715    HE1  TRP  91           HE1      TRP  91   0.797  13.311  -6.445
  716    HE3  TRP  91           HE3      TRP  91   0.769   7.967  -6.280
  717    HZ2  TRP  91           HZ2      TRP  91   2.205  12.144  -8.595
  718    HZ3  TRP  91           HZ3      TRP  91   2.106   7.885  -8.344
  719    HH2  TRP  91           HH2      TRP  91   2.807   9.931  -9.477
  720    H    GLU  92           H        GLU  92  -2.953  11.017  -2.029
  721    HA   GLU  92           HA       GLU  92  -3.509   8.637  -0.381
  722   1HB   GLU  92          1HB       GLU  92  -4.405  11.495   0.015
  723   2HB   GLU  92          2HB       GLU  92  -5.058  10.133   0.916
  724   1HG   GLU  92          1HG       GLU  92  -2.469   9.728   1.387
  725   2HG   GLU  92          2HG       GLU  92  -2.433  11.472   1.132
  726    H    TYR  93           H        TYR  93  -5.585   7.749  -0.463
  727    HA   TYR  93           HA       TYR  93  -7.443   8.827  -2.449
  728   1HB   TYR  93          1HB       TYR  93  -6.305   6.029  -2.482
  729   2HB   TYR  93          2HB       TYR  93  -7.756   6.492  -3.364
  730    HD1  TYR  93           HD2      TYR  93  -4.122   7.158  -3.059
  731    HD2  TYR  93           HD1      TYR  93  -7.610   7.561  -5.461
  732    HE1  TYR  93           HE2      TYR  93  -2.730   7.907  -4.943
  733    HE2  TYR  93           HE1      TYR  93  -6.228   8.310  -7.353
  734    HH   TYR  93           HH       TYR  93  -3.050   9.291  -7.032
  735    H    GLY  94           H        GLY  94  -9.585   7.741  -2.355
  736   1HA   GLY  94          1HA       GLY  94 -11.427   7.048  -1.174
  737   2HA   GLY  94          2HA       GLY  94 -10.332   6.033  -0.247
  738    H    GLU  95           H        GLU  95 -11.218   6.373   1.751
  739    HA   GLU  95           HA       GLU  95 -11.635   7.410   3.733
  740   1HB   GLU  95          1HB       GLU  95  -9.354   7.982   3.859
  741   2HB   GLU  95          2HB       GLU  95  -9.495   9.180   2.580
  742   1HG   GLU  95          1HG       GLU  95 -11.123   9.667   4.985
  743   2HG   GLU  95          2HG       GLU  95  -9.376   9.783   5.191
  Start of MODEL   17
    1   1H    ALA   2          1H        ALA   2 -13.561   1.974  19.311
    2    HA   ALA   2           HA       ALA   2 -14.322   1.093  16.687
    3   1HB   ALA   2          1HB       ALA   2 -14.708   3.607  16.689
    4   2HB   ALA   2          2HB       ALA   2 -12.954   3.766  16.800
    5   3HB   ALA   2          3HB       ALA   2 -13.681   2.959  15.410
    6    H    ARG   3           H        ARG   3 -12.916  -0.603  16.972
    7    HA   ARG   3           HA       ARG   3 -10.279  -0.369  17.948
    8   1HB   ARG   3          1HB       ARG   3 -11.904  -2.457  16.636
    9   2HB   ARG   3          2HB       ARG   3 -10.165  -2.617  16.433
   10   1HG   ARG   3          1HG       ARG   3 -10.502  -2.066  19.134
   11   2HG   ARG   3          2HG       ARG   3 -11.813  -3.177  18.732
   12   1HD   ARG   3          1HD       ARG   3  -9.097  -3.801  17.707
   13   2HD   ARG   3          2HD       ARG   3  -9.400  -4.032  19.429
   14    HE   ARG   3           HE       ARG   3 -11.427  -5.225  17.818
   15   1HH1  ARG   3          1HH1      ARG   3  -8.195  -5.665  19.035
   16   2HH1  ARG   3          2HH1      ARG   3  -8.261  -7.394  18.959
   17   1HH2  ARG   3          1HH2      ARG   3 -11.526  -7.502  17.712
   18   2HH2  ARG   3          2HH2      ARG   3 -10.156  -8.438  18.205
   19    H    GLN   4           H        GLN   4  -8.283  -0.614  16.789
   20    HA   GLN   4           HA       GLN   4  -8.382   0.660  14.144
   21   1HB   GLN   4          1HB       GLN   4  -6.646   0.941  16.463
   22   2HB   GLN   4          2HB       GLN   4  -5.735   0.676  14.983
   23   1HG   GLN   4          1HG       GLN   4  -6.819   2.570  13.938
   24   2HG   GLN   4          2HG       GLN   4  -7.818   2.813  15.371
   25   1HE2  GLN   4          1HE2      GLN   4  -5.096   3.799  13.794
   26   2HE2  GLN   4          2HE2      GLN   4  -4.259   4.543  15.109
   27    H    VAL   5           H        VAL   5  -6.919  -0.063  12.491
   28    HA   VAL   5           HA       VAL   5  -6.135  -2.890  12.786
   29    HB   VAL   5           HB       VAL   5  -6.633  -3.232  10.420
   30   1HG1  VAL   5          1HG1      VAL   5  -8.595  -2.611  12.449
   31   2HG1  VAL   5          2HG1      VAL   5  -9.233  -2.339  10.826
   32   3HG1  VAL   5          3HG1      VAL   5  -8.575  -3.916  11.264
   33   1HG2  VAL   5          1HG2      VAL   5  -6.949  -1.571   8.973
   34   2HG2  VAL   5          2HG2      VAL   5  -8.216  -0.858   9.970
   35   3HG2  VAL   5          3HG2      VAL   5  -6.526  -0.454  10.270
   36    H    ILE   6           H        ILE   6  -4.362  -3.583  11.394
   37    HA   ILE   6           HA       ILE   6  -2.285  -1.561  11.298
   38    HB   ILE   6           HB       ILE   6  -2.183  -4.523  10.717
   39   1HG1  ILE   6          1HG1      ILE   6  -0.639  -4.123  12.906
   40   2HG1  ILE   6          2HG1      ILE   6  -1.842  -2.860  13.141
   41   1HG2  ILE   6          1HG2      ILE   6  -0.442  -3.557   9.456
   42   2HG2  ILE   6          2HG2      ILE   6  -0.035  -2.422  10.742
   43   3HG2  ILE   6          3HG2      ILE   6   0.314  -4.139  10.939
   44   1HD1  ILE   6          1HD1      ILE   6  -3.554  -4.743  12.722
   45   2HD1  ILE   6          2HD1      ILE   6  -2.203  -5.821  13.073
   46   3HD1  ILE   6          3HD1      ILE   6  -2.736  -4.652  14.281
   47    H    CYS   7           H        CYS   7  -1.145  -0.940   9.468
   48    HA   CYS   7           HA       CYS   7  -2.649  -0.974   7.021
   49   1HB   CYS   7          1HB       CYS   7  -1.093   0.608   6.210
   50   2HB   CYS   7          2HB       CYS   7  -1.262   0.972   7.923
   51    HG   CYS   7           HG       CYS   7   1.226   0.763   8.517
   52    H    TRP   8           H        TRP   8  -1.830  -1.679   4.965
   53    HA   TRP   8           HA       TRP   8  -0.111  -4.052   5.222
   54   1HB   TRP   8          1HB       TRP   8  -2.209  -3.350   3.160
   55   2HB   TRP   8          2HB       TRP   8  -1.166  -4.766   3.066
   56    HD1  TRP   8           HD1      TRP   8  -3.627  -3.284   5.692
   57    HE1  TRP   8           HE1      TRP   8  -4.939  -5.242   6.727
   58    HE3  TRP   8           HE3      TRP   8  -1.418  -7.155   3.189
   59    HZ2  TRP   8           HZ2      TRP   8  -5.026  -8.055   6.511
   60    HZ3  TRP   8           HZ3      TRP   8  -2.172  -9.449   3.661
   61    HH2  TRP   8           HH2      TRP   8  -3.939  -9.887   5.288
   62    H    CYS   9           H        CYS   9   1.925  -3.654   4.662
   63    HA   CYS   9           HA       CYS   9   2.516  -1.636   2.641
   64   1HB   CYS   9          1HB       CYS   9   3.862  -1.437   4.595
   65   2HB   CYS   9          2HB       CYS   9   4.235  -3.156   4.599
   66    HG   CYS   9           HG       CYS   9   5.294  -1.073   2.106
   67    H    PHE  10           H        PHE  10   2.681  -2.216   0.589
   68    HA   PHE  10           HA       PHE  10   3.911  -4.805  -0.056
   69   1HB   PHE  10          1HB       PHE  10   2.243  -5.420  -1.556
   70   2HB   PHE  10          2HB       PHE  10   1.314  -4.692  -0.250
   71    HD1  PHE  10           HD2      PHE  10   0.737  -2.183  -0.512
   72    HD2  PHE  10           HD1      PHE  10   1.936  -4.702  -3.727
   73    HE1  PHE  10           HE2      PHE  10  -0.289  -0.622  -2.113
   74    HE2  PHE  10           HE1      PHE  10   0.913  -3.144  -5.333
   75    HZ   PHE  10           HZ       PHE  10  -0.203  -1.102  -4.527
   76    H    THR  11           H        THR  11   4.625  -4.913  -2.363
   77    HA   THR  11           HA       THR  11   5.381  -2.261  -3.396
   78    HB   THR  11           HB       THR  11   7.234  -4.628  -3.570
   79    HG1  THR  11           HG1      THR  11   6.911  -2.752  -1.472
   80   1HG2  THR  11          1HG2      THR  11   8.804  -2.461  -3.537
   81   2HG2  THR  11          2HG2      THR  11   7.340  -1.733  -4.200
   82   3HG2  THR  11          3HG2      THR  11   8.095  -3.100  -5.020
   83    H    LEU  12           H        LEU  12   4.844  -1.959  -5.455
   84    HA   LEU  12           HA       LEU  12   4.182  -4.316  -7.084
   85   1HB   LEU  12          1HB       LEU  12   2.494  -2.413  -6.526
   86   2HB   LEU  12          2HB       LEU  12   3.361  -1.527  -7.778
   87    HG   LEU  12           HG       LEU  12   2.751  -3.191  -9.427
   88   1HD1  LEU  12          1HD1      LEU  12   2.768  -5.203  -8.164
   89   2HD1  LEU  12          2HD1      LEU  12   1.130  -4.990  -8.779
   90   3HD1  LEU  12          3HD1      LEU  12   1.494  -4.618  -7.094
   91   1HD2  LEU  12          1HD2      LEU  12   1.183  -1.409  -9.154
   92   2HD2  LEU  12          2HD2      LEU  12   0.450  -2.195  -7.756
   93   3HD2  LEU  12          3HD2      LEU  12   0.271  -2.904  -9.361
   94    H    ASN  13           H        ASN  13   5.582  -4.849  -8.612
   95    HA   ASN  13           HA       ASN  13   7.433  -2.802  -9.616
   96   1HB   ASN  13          1HB       ASN  13   7.601  -5.822  -9.657
   97   2HB   ASN  13          2HB       ASN  13   8.779  -4.755 -10.416
   98   1HD2  ASN  13          1HD2      ASN  13   9.617  -6.526  -8.564
   99   2HD2  ASN  13          2HD2      ASN  13  10.063  -5.711  -7.107
  100    H    ASN  14           H        ASN  14   7.441  -2.195 -11.702
  101    HA   ASN  14           HA       ASN  14   6.621  -1.857 -13.805
  102   1HB   ASN  14          1HB       ASN  14   8.032  -3.858 -14.157
  103   2HB   ASN  14          2HB       ASN  14   6.636  -4.883 -13.839
  104   1HD2  ASN  14          1HD2      ASN  14   5.865  -5.708 -15.630
  105   2HD2  ASN  14          2HD2      ASN  14   5.737  -4.906 -17.155
  106    HA   PRO  15           HA       PRO  15   2.246  -2.820 -12.411
  107   1HB   PRO  15          1HB       PRO  15   1.465  -0.233 -12.146
  108   2HB   PRO  15          2HB       PRO  15   2.213  -1.150 -10.833
  109   1HG   PRO  15          1HG       PRO  15   3.453   0.827 -12.708
  110   2HG   PRO  15          2HG       PRO  15   3.682   0.648 -10.959
  111   1HD   PRO  15          1HD       PRO  15   5.461  -0.303 -12.765
  112   2HD   PRO  15          2HD       PRO  15   5.168  -1.096 -11.204
  113    H    LEU  16           H        LEU  16   0.547  -2.876 -13.803
  114    HA   LEU  16           HA       LEU  16   0.993  -1.837 -16.480
  115   1HB   LEU  16          1HB       LEU  16  -1.072  -3.677 -15.298
  116   2HB   LEU  16          2HB       LEU  16  -1.140  -3.109 -16.965
  117    HG   LEU  16           HG       LEU  16   1.401  -4.369 -16.183
  118   1HD1  LEU  16          1HD1      LEU  16  -0.420  -5.688 -14.986
  119   2HD1  LEU  16          2HD1      LEU  16   0.643  -6.583 -16.072
  120   3HD1  LEU  16          3HD1      LEU  16  -0.984  -6.145 -16.594
  121   1HD2  LEU  16          1HD2      LEU  16   0.865  -3.638 -18.470
  122   2HD2  LEU  16          2HD2      LEU  16  -0.480  -4.779 -18.506
  123   3HD2  LEU  16          3HD2      LEU  16   1.177  -5.372 -18.377
  124    H    SER  17           H        SER  17  -0.399  -0.707 -13.699
  125    HA   SER  17           HA       SER  17  -1.496   1.579 -14.869
  126   1HB   SER  17          1HB       SER  17  -3.318  -0.716 -14.701
  127   2HB   SER  17          2HB       SER  17  -3.948   0.746 -13.942
  128    HG   SER  17           HG       SER  17  -3.214   0.307 -16.623
  129    HA   PRO  18           HA       PRO  18  -1.375   2.961 -10.708
  130   1HB   PRO  18          1HB       PRO  18  -3.345   4.828 -10.654
  131   2HB   PRO  18          2HB       PRO  18  -1.811   5.074 -11.497
  132   1HG   PRO  18          1HG       PRO  18  -4.470   4.255 -12.603
  133   2HG   PRO  18          2HG       PRO  18  -3.298   5.416 -13.253
  134   1HD   PRO  18          1HD       PRO  18  -3.522   2.889 -14.198
  135   2HD   PRO  18          2HD       PRO  18  -1.977   3.763 -14.167
  136    H    LEU  19           H        LEU  19  -2.357   2.795  -8.677
  137    HA   LEU  19           HA       LEU  19  -4.415   0.804  -8.486
  138   1HB   LEU  19          1HB       LEU  19  -3.373   2.435  -6.196
  139   2HB   LEU  19          2HB       LEU  19  -3.999   0.787  -6.180
  140    HG   LEU  19           HG       LEU  19  -1.409   1.546  -7.517
  141   1HD1  LEU  19          1HD1      LEU  19  -1.640   0.282  -4.806
  142   2HD1  LEU  19          2HD1      LEU  19  -1.520   2.029  -5.012
  143   3HD1  LEU  19          3HD1      LEU  19  -0.220   0.983  -5.583
  144   1HD2  LEU  19          1HD2      LEU  19  -2.971  -0.758  -7.606
  145   2HD2  LEU  19          2HD2      LEU  19  -1.667  -1.135  -6.479
  146   3HD2  LEU  19          3HD2      LEU  19  -1.290  -0.591  -8.115
  147    H    SER  20           H        SER  20  -6.230   1.186  -6.832
  148    HA   SER  20           HA       SER  20  -7.297   3.891  -6.858
  149   1HB   SER  20          1HB       SER  20  -9.465   3.159  -7.813
  150   2HB   SER  20          2HB       SER  20  -8.139   2.986  -8.963
  151    HG   SER  20           HG       SER  20  -9.082   1.062  -9.100
  152    H    LEU  21           H        LEU  21  -9.025   4.210  -5.372
  153    HA   LEU  21           HA       LEU  21  -8.769   2.931  -2.937
  154   1HB   LEU  21          1HB       LEU  21  -9.799   5.049  -2.988
  155   2HB   LEU  21          2HB       LEU  21 -11.027   4.510  -4.131
  156    HG   LEU  21           HG       LEU  21 -11.953   3.057  -2.306
  157   1HD1  LEU  21          1HD1      LEU  21  -9.574   3.797  -1.013
  158   2HD1  LEU  21          2HD1      LEU  21 -10.899   2.827  -0.371
  159   3HD1  LEU  21          3HD1      LEU  21 -10.886   4.573  -0.125
  160   1HD2  LEU  21          1HD2      LEU  21 -11.965   6.014  -2.370
  161   2HD2  LEU  21          2HD2      LEU  21 -12.653   5.247  -0.938
  162   3HD2  LEU  21          3HD2      LEU  21 -13.295   4.867  -2.537
  163    H    HIS  22           H        HIS  22 -10.090   1.454  -1.791
  164    HA   HIS  22           HA       HIS  22 -11.629  -0.363  -3.528
  165   1HB   HIS  22          1HB       HIS  22  -9.411  -1.185  -2.493
  166   2HB   HIS  22          2HB       HIS  22 -10.295  -1.221  -0.970
  167    HD1  HIS  22           HD1      HIS  22 -10.528  -3.682  -0.601
  168    HD2  HIS  22           HD2      HIS  22 -11.690  -2.537  -4.422
  169    HE1  HIS  22           HE1      HIS  22 -11.538  -5.737  -1.640
  170    H    ASP  23           H        ASP  23 -13.674  -0.821  -2.973
  171    HA   ASP  23           HA       ASP  23 -15.058   0.713  -1.097
  172   1HB   ASP  23          1HB       ASP  23 -15.693  -1.735  -2.685
  173   2HB   ASP  23          2HB       ASP  23 -16.787  -1.275  -1.383
  174    H    SER  24           H        SER  24 -13.260  -2.203  -0.721
  175    HA   SER  24           HA       SER  24 -14.498  -2.925   1.794
  176   1HB   SER  24          1HB       SER  24 -11.923  -4.069   0.728
  177   2HB   SER  24          2HB       SER  24 -13.119  -4.837   1.772
  178    HG   SER  24           HG       SER  24 -13.901  -5.607  -0.014
  179    H    MET  25           H        MET  25 -11.446  -1.522   0.682
  180    HA   MET  25           HA       MET  25 -10.293  -1.338   3.282
  181   1HB   MET  25          1HB       MET  25  -8.486  -0.278   2.257
  182   2HB   MET  25          2HB       MET  25  -9.116  -1.313   0.982
  183   1HG   MET  25          1HG       MET  25 -10.145   0.513  -0.116
  184   2HG   MET  25          2HG       MET  25  -9.863   1.581   1.256
  185   1HE   MET  25          1HE       MET  25  -8.002  -1.017  -0.692
  186   2HE   MET  25          2HE       MET  25  -7.913   0.058  -2.087
  187   3HE   MET  25          3HE       MET  25  -6.463  -0.283  -1.142
  188    H    LYS  26           H        LYS  26  -9.385   1.106   3.723
  189    HA   LYS  26           HA       LYS  26 -11.728   2.885   3.742
  190   1HB   LYS  26          1HB       LYS  26 -10.504   1.625   5.993
  191   2HB   LYS  26          2HB       LYS  26 -10.191   3.353   6.091
  192   1HG   LYS  26          1HG       LYS  26 -12.957   2.441   5.492
  193   2HG   LYS  26          2HG       LYS  26 -12.348   2.296   7.143
  194   1HD   LYS  26          1HD       LYS  26 -11.597   4.798   6.687
  195   2HD   LYS  26          2HD       LYS  26 -12.928   4.726   5.530
  196   1HE   LYS  26          1HE       LYS  26 -14.002   5.462   7.432
  197   2HE   LYS  26          2HE       LYS  26 -14.252   3.720   7.535
  198   1HZ   LYS  26          1HZ       LYS  26 -11.889   4.887   8.825
  199   2HZ   LYS  26          2HZ       LYS  26 -12.782   3.516   9.255
  200   3HZ   LYS  26          3HZ       LYS  26 -13.393   5.060   9.580
  201    H    TYR  27           H        TYR  27  -8.230   2.548   3.904
  202    HA   TYR  27           HA       TYR  27  -7.992   5.300   2.893
  203   1HB   TYR  27          1HB       TYR  27  -7.276   4.712   5.413
  204   2HB   TYR  27          2HB       TYR  27  -5.787   4.260   4.590
  205    HD1  TYR  27           HD1      TYR  27  -8.232   7.065   4.184
  206    HD2  TYR  27           HD2      TYR  27  -4.186   5.901   4.799
  207    HE1  TYR  27           HE1      TYR  27  -7.551   9.428   4.132
  208    HE2  TYR  27           HE2      TYR  27  -3.494   8.261   4.750
  209    HH   TYR  27           HH       TYR  27  -4.688  10.540   5.247
  210    H    LEU  28           H        LEU  28  -6.321   5.676   1.427
  211    HA   LEU  28           HA       LEU  28  -4.822   3.316   0.518
  212   1HB   LEU  28          1HB       LEU  28  -6.528   3.421  -1.071
  213   2HB   LEU  28          2HB       LEU  28  -6.518   5.183  -1.098
  214    HG   LEU  28           HG       LEU  28  -4.501   5.218  -2.386
  215   1HD1  LEU  28          1HD1      LEU  28  -2.999   3.618  -2.039
  216   2HD1  LEU  28          2HD1      LEU  28  -3.964   2.593  -3.101
  217   3HD1  LEU  28          3HD1      LEU  28  -4.208   2.532  -1.355
  218   1HD2  LEU  28          1HD2      LEU  28  -6.208   3.057  -3.596
  219   2HD2  LEU  28          2HD2      LEU  28  -5.275   4.305  -4.423
  220   3HD2  LEU  28          3HD2      LEU  28  -6.719   4.743  -3.508
  221    H    VAL  29           H        VAL  29  -2.712   3.684   0.376
  222    HA   VAL  29           HA       VAL  29  -1.752   6.376  -0.264
  223    HB   VAL  29           HB       VAL  29  -0.769   4.765   2.096
  224   1HG1  VAL  29          1HG1      VAL  29   0.439   7.149   2.352
  225   2HG1  VAL  29          2HG1      VAL  29   1.176   5.773   1.529
  226   3HG1  VAL  29          3HG1      VAL  29   0.374   7.036   0.594
  227   1HG2  VAL  29          1HG2      VAL  29  -1.460   6.985   3.255
  228   2HG2  VAL  29          2HG2      VAL  29  -2.474   7.208   1.829
  229   3HG2  VAL  29          3HG2      VAL  29  -2.698   5.793   2.858
  230    H    TYR  30           H        TYR  30  -0.349   6.253  -1.877
  231    HA   TYR  30           HA       TYR  30   1.667   4.177  -1.941
  232   1HB   TYR  30          1HB       TYR  30   1.044   3.102  -3.888
  233   2HB   TYR  30          2HB       TYR  30  -0.530   3.414  -3.166
  234    HD1  TYR  30           HD2      TYR  30  -1.822   5.463  -3.961
  235    HD2  TYR  30           HD1      TYR  30   1.567   3.923  -6.022
  236    HE1  TYR  30           HE2      TYR  30  -2.521   6.660  -5.993
  237    HE2  TYR  30           HE1      TYR  30   0.879   5.117  -8.059
  238    HH   TYR  30           HH       TYR  30  -1.452   5.995  -8.978
  239    H    GLN  31           H        GLN  31   3.341   4.591  -3.513
  240    HA   GLN  31           HA       GLN  31   3.296   7.205  -4.806
  241   1HB   GLN  31          1HB       GLN  31   5.682   6.485  -3.137
  242   2HB   GLN  31          2HB       GLN  31   5.196   8.060  -3.749
  243   1HG   GLN  31          1HG       GLN  31   3.299   8.058  -2.183
  244   2HG   GLN  31          2HG       GLN  31   3.858   6.514  -1.541
  245   1HE2  GLN  31          1HE2      GLN  31   3.780   7.916   0.441
  246   2HE2  GLN  31          2HE2      GLN  31   5.224   8.768   0.854
  247    H    THR  32           H        THR  32   5.021   7.491  -6.364
  248    HA   THR  32           HA       THR  32   5.836   4.923  -7.520
  249    HB   THR  32           HB       THR  32   5.699   7.685  -8.741
  250    HG1  THR  32           HG1      THR  32   4.035   6.670  -9.985
  251   1HG2  THR  32          1HG2      THR  32   7.563   6.507  -9.729
  252   2HG2  THR  32          2HG2      THR  32   6.223   6.525 -10.876
  253   3HG2  THR  32          3HG2      THR  32   6.576   5.063  -9.955
  254    H    GLU  33           H        GLU  33   7.949   4.442  -8.026
  255    HA   GLU  33           HA       GLU  33  10.014   6.394  -7.309
  256   1HB   GLU  33          1HB       GLU  33   9.472   4.731  -5.410
  257   2HB   GLU  33          2HB       GLU  33  10.256   3.529  -6.427
  258   1HG   GLU  33          1HG       GLU  33  12.173   5.343  -6.480
  259   2HG   GLU  33          2HG       GLU  33  11.420   5.830  -4.962
  260    H    GLN  34           H        GLN  34  12.076   5.987  -8.261
  261    HA   GLN  34           HA       GLN  34  11.857   4.526 -10.779
  262   1HB   GLN  34          1HB       GLN  34  13.053   6.964 -10.023
  263   2HB   GLN  34          2HB       GLN  34  14.374   5.880 -10.440
  264   1HG   GLN  34          1HG       GLN  34  12.340   5.620 -12.409
  265   2HG   GLN  34          2HG       GLN  34  12.677   7.333 -12.166
  266   1HE2  GLN  34          1HE2      GLN  34  15.269   7.504 -11.719
  267   2HE2  GLN  34          2HE2      GLN  34  16.192   6.867 -13.032
  268    H    GLY  35           H        GLY  35  12.993   2.731 -11.260
  269   1HA   GLY  35          1HA       GLY  35  15.441   1.932 -10.248
  270   2HA   GLY  35          2HA       GLY  35  14.235   1.273  -9.153
  271    H    GLU  36           H        GLU  36  15.725  -0.553 -10.310
  272    HA   GLU  36           HA       GLU  36  15.868  -2.251 -11.864
  273   1HB   GLU  36          1HB       GLU  36  13.634  -3.471 -12.029
  274   2HB   GLU  36          2HB       GLU  36  14.291  -3.230 -10.416
  275   1HG   GLU  36          1HG       GLU  36  12.795  -1.348 -10.067
  276   2HG   GLU  36          2HG       GLU  36  12.155  -1.541 -11.699
  277    H    ALA  37           H        ALA  37  16.439  -1.001 -13.709
  278    HA   ALA  37           HA       ALA  37  16.255  -0.397 -15.896
  279   1HB   ALA  37          1HB       ALA  37  14.328  -2.507 -15.530
  280   2HB   ALA  37          2HB       ALA  37  13.779  -1.357 -16.750
  281   3HB   ALA  37          3HB       ALA  37  15.347  -2.145 -16.924
  282    H    GLY  38           H        GLY  38  14.672   0.743 -17.503
  283   1HA   GLY  38          1HA       GLY  38  13.984   3.213 -16.475
  284   2HA   GLY  38          2HA       GLY  38  13.335   2.552 -17.968
  285    H    ASN  39           H        ASN  39  12.118   0.274 -16.471
  286    HA   ASN  39           HA       ASN  39   9.542   1.245 -16.190
  287   1HB   ASN  39          1HB       ASN  39  10.604  -1.115 -14.636
  288   2HB   ASN  39          2HB       ASN  39   8.968  -0.863 -15.240
  289   1HD2  ASN  39          1HD2      ASN  39  11.011  -3.005 -15.663
  290   2HD2  ASN  39          2HD2      ASN  39  11.132  -3.161 -17.379
  291    H    ILE  40           H        ILE  40   8.225   1.110 -14.112
  292    HA   ILE  40           HA       ILE  40   9.729   2.296 -11.874
  293    HB   ILE  40           HB       ILE  40   7.408   3.496 -11.471
  294   1HG1  ILE  40          1HG1      ILE  40   7.501   3.214 -14.483
  295   2HG1  ILE  40          2HG1      ILE  40   6.334   2.423 -13.429
  296   1HG2  ILE  40          1HG2      ILE  40   8.682   5.045 -13.509
  297   2HG2  ILE  40          2HG2      ILE  40   8.715   5.265 -11.760
  298   3HG2  ILE  40          3HG2      ILE  40   9.907   4.226 -12.540
  299   1HD1  ILE  40          1HD1      ILE  40   5.029   4.204 -13.482
  300   2HD1  ILE  40          2HD1      ILE  40   6.343   5.234 -12.913
  301   3HD1  ILE  40          3HD1      ILE  40   6.138   4.939 -14.639
  302    H    HIS  41           H        HIS  41   8.482   2.213  -9.790
  303    HA   HIS  41           HA       HIS  41   6.634  -0.050  -9.626
  304   1HB   HIS  41          1HB       HIS  41   8.008  -0.658  -7.459
  305   2HB   HIS  41          2HB       HIS  41   8.503  -1.265  -9.036
  306    HD1  HIS  41           HD1      HIS  41  10.983  -1.411  -8.594
  307    HD2  HIS  41           HD2      HIS  41   9.413   2.347  -7.772
  308    HE1  HIS  41           HE1      HIS  41  12.971   0.075  -8.191
  309    H    PHE  42           H        PHE  42   5.194   0.033  -7.909
  310    HA   PHE  42           HA       PHE  42   4.970   2.656  -6.648
  311   1HB   PHE  42          1HB       PHE  42   3.018   0.350  -6.793
  312   2HB   PHE  42          2HB       PHE  42   2.685   1.903  -6.034
  313    HD1  PHE  42           HD1      PHE  42   4.150   3.581  -8.138
  314    HD2  PHE  42           HD2      PHE  42   1.295   0.437  -8.422
  315    HE1  PHE  42           HE1      PHE  42   3.387   4.474 -10.301
  316    HE2  PHE  42           HE2      PHE  42   0.528   1.324 -10.585
  317    HZ   PHE  42           HZ       PHE  42   1.575   3.345 -11.528
  318    H    GLN  43           H        GLN  43   4.728   2.945  -4.417
  319    HA   GLN  43           HA       GLN  43   5.173   0.648  -2.677
  320   1HB   GLN  43          1HB       GLN  43   7.177   2.680  -3.290
  321   2HB   GLN  43          2HB       GLN  43   6.859   2.540  -1.566
  322   1HG   GLN  43          1HG       GLN  43   8.443   0.955  -1.690
  323   2HG   GLN  43          2HG       GLN  43   7.086  -0.055  -2.186
  324   1HE2  GLN  43          1HE2      GLN  43   9.885  -0.379  -2.808
  325   2HE2  GLN  43          2HE2      GLN  43  10.019  -0.328  -4.529
  326    H    GLY  44           H        GLY  44   4.241   0.845  -0.691
  327   1HA   GLY  44          1HA       GLY  44   3.708   3.041   0.821
  328   2HA   GLY  44          2HA       GLY  44   2.389   3.023  -0.340
  329    H    TYR  45           H        TYR  45   1.323   2.853   1.913
  330    HA   TYR  45           HA       TYR  45   0.952  -0.008   2.515
  331   1HB   TYR  45          1HB       TYR  45   0.233   0.968   4.843
  332   2HB   TYR  45          2HB       TYR  45   1.936   0.722   4.476
  333    HD1  TYR  45           HD1      TYR  45  -0.725   3.238   4.848
  334    HD2  TYR  45           HD2      TYR  45   3.436   2.582   4.247
  335    HE1  TYR  45           HE1      TYR  45  -0.287   5.610   5.332
  336    HE2  TYR  45           HE2      TYR  45   3.886   4.951   4.731
  337    HH   TYR  45           HH       TYR  45   2.437   7.173   4.549
  338    H    ILE  46           H        ILE  46  -1.120  -0.747   2.762
  339    HA   ILE  46           HA       ILE  46  -3.274   1.205   2.269
  340    HB   ILE  46           HB       ILE  46  -3.190  -1.655   1.302
  341   1HG1  ILE  46          1HG1      ILE  46  -3.024   0.881  -0.333
  342   2HG1  ILE  46          2HG1      ILE  46  -1.616  -0.060   0.146
  343   1HG2  ILE  46          1HG2      ILE  46  -5.174   0.521   0.666
  344   2HG2  ILE  46          2HG2      ILE  46  -5.237  -1.163   0.152
  345   3HG2  ILE  46          3HG2      ILE  46  -5.440  -0.754   1.855
  346   1HD1  ILE  46          1HD1      ILE  46  -2.620  -0.415  -2.192
  347   2HD1  ILE  46          2HD1      ILE  46  -2.177  -1.830  -1.237
  348   3HD1  ILE  46          3HD1      ILE  46  -3.866  -1.336  -1.350
  349    H    GLU  47           H        GLU  47  -4.829   1.273   3.752
  350    HA   GLU  47           HA       GLU  47  -4.884  -0.809   5.811
  351   1HB   GLU  47          1HB       GLU  47  -6.239   1.893   5.805
  352   2HB   GLU  47          2HB       GLU  47  -6.116   0.789   7.167
  353   1HG   GLU  47          1HG       GLU  47  -3.972   1.349   7.613
  354   2HG   GLU  47          2HG       GLU  47  -3.578   1.639   5.919
  355    H    MET  48           H        MET  48  -6.326  -2.378   5.609
  356    HA   MET  48           HA       MET  48  -8.591  -2.117   3.849
  357   1HB   MET  48          1HB       MET  48  -7.595  -4.357   5.607
  358   2HB   MET  48          2HB       MET  48  -9.070  -4.477   4.657
  359   1HG   MET  48          1HG       MET  48  -6.826  -3.578   3.066
  360   2HG   MET  48          2HG       MET  48  -6.516  -5.130   3.839
  361   1HE   MET  48          1HE       MET  48  -8.219  -3.015   1.503
  362   2HE   MET  48          2HE       MET  48  -8.794  -4.108   0.244
  363   3HE   MET  48          3HE       MET  48  -9.869  -3.634   1.560
  364    H    LYS  49           H        LYS  49 -10.685  -3.300   4.854
  365    HA   LYS  49           HA       LYS  49 -11.881  -1.428   6.546
  366   1HB   LYS  49          1HB       LYS  49 -12.718  -3.634   5.071
  367   2HB   LYS  49          2HB       LYS  49 -13.113  -4.056   6.732
  368   1HG   LYS  49          1HG       LYS  49 -14.566  -2.253   6.974
  369   2HG   LYS  49          2HG       LYS  49 -13.888  -1.400   5.586
  370   1HD   LYS  49          1HD       LYS  49 -16.054  -2.309   5.007
  371   2HD   LYS  49          2HD       LYS  49 -14.795  -3.155   4.104
  372   1HE   LYS  49          1HE       LYS  49 -15.630  -5.067   4.872
  373   2HE   LYS  49          2HE       LYS  49 -15.093  -4.591   6.482
  374   1HZ   LYS  49          1HZ       LYS  49 -17.220  -3.548   6.867
  375   2HZ   LYS  49          2HZ       LYS  49 -17.453  -5.164   6.425
  376   3HZ   LYS  49          3HZ       LYS  49 -17.738  -3.931   5.302
  377    H    LYS  50           H        LYS  50 -11.199  -4.832   7.371
  378    HA   LYS  50           HA       LYS  50  -9.887  -4.269   9.793
  379   1HB   LYS  50          1HB       LYS  50 -12.764  -4.140   9.903
  380   2HB   LYS  50          2HB       LYS  50 -12.183  -5.470  10.896
  381   1HG   LYS  50          1HG       LYS  50 -10.780  -3.982  12.159
  382   2HG   LYS  50          2HG       LYS  50 -11.190  -2.634  11.095
  383   1HD   LYS  50          1HD       LYS  50 -13.423  -4.076  12.418
  384   2HD   LYS  50          2HD       LYS  50 -12.415  -3.031  13.422
  385   1HE   LYS  50          1HE       LYS  50 -13.601  -1.295  12.702
  386   2HE   LYS  50          2HE       LYS  50 -12.946  -1.573  11.089
  387   1HZ   LYS  50          1HZ       LYS  50 -15.581  -2.128  12.128
  388   2HZ   LYS  50          2HZ       LYS  50 -14.921  -3.387  11.211
  389   3HZ   LYS  50          3HZ       LYS  50 -15.083  -1.844  10.536
  390    H    ARG  51           H        ARG  51 -12.434  -6.669   9.165
  391    HA   ARG  51           HA       ARG  51 -10.552  -8.807   9.704
  392   1HB   ARG  51          1HB       ARG  51 -12.969  -8.721  10.529
  393   2HB   ARG  51          2HB       ARG  51 -13.434  -9.117   8.880
  394   1HG   ARG  51          1HG       ARG  51 -13.373 -11.212   9.721
  395   2HG   ARG  51          2HG       ARG  51 -11.671 -11.069   9.277
  396   1HD   ARG  51          1HD       ARG  51 -11.000 -10.711  11.476
  397   2HD   ARG  51          2HD       ARG  51 -12.617 -10.231  11.991
  398    HE   ARG  51           HE       ARG  51 -11.570 -12.907  11.818
  399   1HH1  ARG  51          1HH1      ARG  51 -14.441 -10.940  11.870
  400   2HH1  ARG  51          2HH1      ARG  51 -15.465 -12.218  12.435
  401   1HH2  ARG  51          1HH2      ARG  51 -12.907 -14.599  12.561
  402   2HH2  ARG  51          2HH2      ARG  51 -14.591 -14.299  12.828
  403    H    THR  52           H        THR  52  -9.604  -7.645   7.531
  404    HA   THR  52           HA       THR  52 -10.460  -9.368   5.296
  405    HB   THR  52           HB       THR  52  -8.894  -6.947   4.648
  406    HG1  THR  52           HG1      THR  52 -11.594  -6.815   5.556
  407   1HG2  THR  52          1HG2      THR  52 -11.360  -8.252   3.492
  408   2HG2  THR  52          2HG2      THR  52  -9.707  -8.402   2.893
  409   3HG2  THR  52          3HG2      THR  52 -10.543  -6.852   2.800
  410    H    SER  53           H        SER  53  -9.049 -10.937   4.921
  411    HA   SER  53           HA       SER  53  -6.331 -10.780   5.855
  412   1HB   SER  53          1HB       SER  53  -6.262 -13.063   4.542
  413   2HB   SER  53          2HB       SER  53  -7.134 -12.942   6.070
  414    HG   SER  53           HG       SER  53  -8.092 -13.658   3.722
  415    H    LEU  54           H        LEU  54  -4.679 -11.825   4.149
  416    HA   LEU  54           HA       LEU  54  -3.989  -9.837   2.366
  417   1HB   LEU  54          1HB       LEU  54  -2.487 -11.625   3.148
  418   2HB   LEU  54          2HB       LEU  54  -3.349 -12.774   2.128
  419    HG   LEU  54           HG       LEU  54  -2.607 -11.510   0.137
  420   1HD1  LEU  54          1HD1      LEU  54  -0.786  -9.996   1.987
  421   2HD1  LEU  54          2HD1      LEU  54  -2.326  -9.348   1.424
  422   3HD1  LEU  54          3HD1      LEU  54  -1.058  -9.741   0.263
  423   1HD2  LEU  54          1HD2      LEU  54  -0.384 -12.407   1.969
  424   2HD2  LEU  54          2HD2      LEU  54  -0.276 -12.234   0.217
  425   3HD2  LEU  54          3HD2      LEU  54  -1.345 -13.449   0.920
  426    H    ALA  55           H        ALA  55  -6.174 -12.519   1.931
  427    HA   ALA  55           HA       ALA  55  -6.334 -12.663  -0.834
  428   1HB   ALA  55          1HB       ALA  55  -8.647 -12.957   1.077
  429   2HB   ALA  55          2HB       ALA  55  -8.504 -13.653  -0.538
  430   3HB   ALA  55          3HB       ALA  55  -7.445 -14.208   0.759
  431    H    GLY  56           H        GLY  56  -7.784 -10.351   1.388
  432   1HA   GLY  56          1HA       GLY  56  -9.552  -9.147  -0.474
  433   2HA   GLY  56          2HA       GLY  56  -8.988  -8.427   1.027
  434    H    MET  57           H        MET  57  -6.260  -8.308   0.562
  435    HA   MET  57           HA       MET  57  -6.110  -5.985  -1.085
  436   1HB   MET  57          1HB       MET  57  -3.922  -7.613   0.220
  437   2HB   MET  57          2HB       MET  57  -3.692  -6.044  -0.539
  438   1HG   MET  57          1HG       MET  57  -5.768  -6.194   1.549
  439   2HG   MET  57          2HG       MET  57  -4.099  -6.379   2.082
  440   1HE   MET  57          1HE       MET  57  -6.311  -2.811   0.504
  441   2HE   MET  57          2HE       MET  57  -5.493  -3.590  -0.850
  442   3HE   MET  57          3HE       MET  57  -6.613  -4.513   0.153
  443    H    LYS  58           H        LYS  58  -4.788  -9.274  -1.362
  444    HA   LYS  58           HA       LYS  58  -3.432  -8.961  -3.773
  445   1HB   LYS  58          1HB       LYS  58  -3.766 -11.012  -2.046
  446   2HB   LYS  58          2HB       LYS  58  -4.815 -11.545  -3.354
  447   1HG   LYS  58          1HG       LYS  58  -2.990 -11.457  -4.919
  448   2HG   LYS  58          2HG       LYS  58  -1.925 -10.768  -3.691
  449   1HD   LYS  58          1HD       LYS  58  -3.223 -13.488  -3.529
  450   2HD   LYS  58          2HD       LYS  58  -1.560 -13.190  -4.040
  451   1HE   LYS  58          1HE       LYS  58  -1.440 -11.915  -1.739
  452   2HE   LYS  58          2HE       LYS  58  -2.794 -12.969  -1.336
  453   1HZ   LYS  58          1HZ       LYS  58  -0.981 -14.644  -2.479
  454   2HZ   LYS  58          2HZ       LYS  58  -1.248 -14.463  -0.818
  455   3HZ   LYS  58          3HZ       LYS  58  -0.009 -13.594  -1.575
  456    H    LYS  59           H        LYS  59  -6.831  -9.370  -3.127
  457    HA   LYS  59           HA       LYS  59  -7.709 -10.183  -5.658
  458   1HB   LYS  59          1HB       LYS  59  -8.892  -9.440  -3.219
  459   2HB   LYS  59          2HB       LYS  59  -9.584  -8.366  -4.428
  460   1HG   LYS  59          1HG       LYS  59 -10.671 -10.045  -5.502
  461   2HG   LYS  59          2HG       LYS  59  -9.453 -11.252  -5.085
  462   1HD   LYS  59          1HD       LYS  59 -10.747 -10.260  -2.711
  463   2HD   LYS  59          2HD       LYS  59 -11.943 -10.850  -3.867
  464   1HE   LYS  59          1HE       LYS  59  -9.517 -12.496  -3.322
  465   2HE   LYS  59          2HE       LYS  59 -10.818 -12.473  -2.132
  466   1HZ   LYS  59          1HZ       LYS  59 -10.911 -14.266  -3.890
  467   2HZ   LYS  59          2HZ       LYS  59 -11.315 -13.048  -4.992
  468   3HZ   LYS  59          3HZ       LYS  59 -12.323 -13.360  -3.670
  469    H    LEU  60           H        LEU  60  -6.809  -7.040  -4.420
  470    HA   LEU  60           HA       LEU  60  -7.859  -5.600  -6.682
  471   1HB   LEU  60          1HB       LEU  60  -6.162  -4.860  -4.323
  472   2HB   LEU  60          2HB       LEU  60  -6.427  -3.730  -5.649
  473    HG   LEU  60           HG       LEU  60  -8.957  -4.214  -5.144
  474   1HD1  LEU  60          1HD1      LEU  60  -9.331  -5.538  -3.405
  475   2HD1  LEU  60          2HD1      LEU  60  -8.627  -4.295  -2.371
  476   3HD1  LEU  60          3HD1      LEU  60  -7.614  -5.591  -3.008
  477   1HD2  LEU  60          1HD2      LEU  60  -7.190  -2.185  -4.557
  478   2HD2  LEU  60          2HD2      LEU  60  -7.940  -2.532  -2.999
  479   3HD2  LEU  60          3HD2      LEU  60  -8.944  -2.115  -4.389
  480    H    ILE  61           H        ILE  61  -4.714  -6.785  -5.618
  481    HA   ILE  61           HA       ILE  61  -3.710  -6.379  -8.340
  482    HB   ILE  61           HB       ILE  61  -2.169  -5.584  -5.867
  483   1HG1  ILE  61          1HG1      ILE  61  -2.274  -3.364  -7.419
  484   2HG1  ILE  61          2HG1      ILE  61  -3.832  -4.088  -7.803
  485   1HG2  ILE  61          1HG2      ILE  61  -1.373  -6.186  -8.604
  486   2HG2  ILE  61          2HG2      ILE  61  -0.838  -4.598  -8.056
  487   3HG2  ILE  61          3HG2      ILE  61  -0.394  -6.040  -7.144
  488   1HD1  ILE  61          1HD1      ILE  61  -2.911  -2.784  -5.355
  489   2HD1  ILE  61          2HD1      ILE  61  -4.538  -2.960  -6.012
  490   3HD1  ILE  61          3HD1      ILE  61  -3.807  -4.280  -5.098
  491    HA   PRO  62           HA       PRO  62  -2.820 -10.623  -6.714
  492   1HB   PRO  62          1HB       PRO  62  -3.536 -11.893  -9.004
  493   2HB   PRO  62          2HB       PRO  62  -4.695 -11.466  -7.739
  494   1HG   PRO  62          1HG       PRO  62  -4.086 -10.052 -10.307
  495   2HG   PRO  62          2HG       PRO  62  -5.659 -10.381  -9.556
  496   1HD   PRO  62          1HD       PRO  62  -4.439  -7.970  -9.385
  497   2HD   PRO  62          2HD       PRO  62  -5.471  -8.612  -8.091
  498    H    GLY  63           H        GLY  63  -0.606 -10.490  -6.677
  499   1HA   GLY  63          1HA       GLY  63   1.192 -11.689  -7.988
  500   2HA   GLY  63          2HA       GLY  63   0.772 -10.582  -9.288
  501    H    ALA  64           H        ALA  64   0.941  -9.727  -5.880
  502    HA   ALA  64           HA       ALA  64   3.403  -8.208  -6.415
  503   1HB   ALA  64          1HB       ALA  64   2.371  -6.266  -6.145
  504   2HB   ALA  64          2HB       ALA  64   0.832  -7.109  -5.959
  505   3HB   ALA  64          3HB       ALA  64   1.826  -6.765  -4.543
  506    H    HIS  65           H        HIS  65   4.413  -7.417  -4.325
  507    HA   HIS  65           HA       HIS  65   4.421  -9.643  -2.433
  508   1HB   HIS  65          1HB       HIS  65   6.530  -8.628  -3.532
  509   2HB   HIS  65          2HB       HIS  65   6.323  -7.312  -2.380
  510    HD1  HIS  65           HD1      HIS  65   7.906 -10.522  -2.735
  511    HD2  HIS  65           HD2      HIS  65   6.296  -8.342   0.415
  512    HE1  HIS  65           HE1      HIS  65   8.875 -11.539  -0.649
  513    H    PHE  66           H        PHE  66   3.068  -9.473  -0.774
  514    HA   PHE  66           HA       PHE  66   2.634  -6.820   0.425
  515   1HB   PHE  66          1HB       PHE  66   0.865  -9.151  -0.040
  516   2HB   PHE  66          2HB       PHE  66   0.641  -8.298   1.484
  517    HD1  PHE  66           HD1      PHE  66   0.720  -7.839  -2.190
  518    HD2  PHE  66           HD2      PHE  66  -0.526  -6.273   1.567
  519    HE1  PHE  66           HE1      PHE  66  -0.623  -6.135  -3.349
  520    HE2  PHE  66           HE2      PHE  66  -1.872  -4.568   0.414
  521    HZ   PHE  66           HZ       PHE  66  -1.923  -4.497  -2.048
  522    H    GLU  67           H        GLU  67   2.367  -6.743   2.766
  523    HA   GLU  67           HA       GLU  67   3.440  -8.971   4.290
  524   1HB   GLU  67          1HB       GLU  67   5.317  -7.350   3.415
  525   2HB   GLU  67          2HB       GLU  67   4.756  -6.320   4.725
  526   1HG   GLU  67          1HG       GLU  67   5.673  -7.610   6.307
  527   2HG   GLU  67          2HG       GLU  67   5.238  -9.107   5.485
  528    H    LYS  68           H        LYS  68   1.985  -9.198   5.847
  529    HA   LYS  68           HA       LYS  68   0.810  -6.783   7.053
  530   1HB   LYS  68          1HB       LYS  68  -0.720  -8.456   5.929
  531   2HB   LYS  68          2HB       LYS  68  -0.283  -9.593   7.198
  532   1HG   LYS  68          1HG       LYS  68  -1.028  -7.359   8.610
  533   2HG   LYS  68          2HG       LYS  68  -2.147  -7.362   7.246
  534   1HD   LYS  68          1HD       LYS  68  -3.188  -9.251   7.935
  535   2HD   LYS  68          2HD       LYS  68  -1.702  -9.967   8.562
  536   1HE   LYS  68          1HE       LYS  68  -1.829  -8.674  10.557
  537   2HE   LYS  68          2HE       LYS  68  -3.130  -7.680   9.904
  538   1HZ   LYS  68          1HZ       LYS  68  -4.672  -9.301  10.254
  539   2HZ   LYS  68          2HZ       LYS  68  -3.622  -9.649  11.534
  540   3HZ   LYS  68          3HZ       LYS  68  -3.561 -10.570  10.116
  541    H    ARG  69           H        ARG  69   3.396  -8.209   7.690
  542    HA   ARG  69           HA       ARG  69   3.015  -9.421  10.258
  543   1HB   ARG  69          1HB       ARG  69   5.162  -9.090   8.388
  544   2HB   ARG  69          2HB       ARG  69   5.700  -8.563   9.977
  545   1HG   ARG  69          1HG       ARG  69   4.848 -10.753  10.873
  546   2HG   ARG  69          2HG       ARG  69   4.626 -11.258   9.196
  547   1HD   ARG  69          1HD       ARG  69   6.732 -12.088   9.758
  548   2HD   ARG  69          2HD       ARG  69   7.083 -10.600   8.879
  549    HE   ARG  69           HE       ARG  69   6.911 -10.158  11.689
  550   1HH1  ARG  69          1HH1      ARG  69   8.995 -11.349   9.167
  551   2HH1  ARG  69          2HH1      ARG  69  10.457 -10.997  10.029
  552   1HH2  ARG  69          1HH2      ARG  69   8.828  -9.691  12.834
  553   2HH2  ARG  69          2HH2      ARG  69  10.360 -10.055  12.115
  554    H    ARG  70           H        ARG  70   2.716  -6.309   9.300
  555    HA   ARG  70           HA       ARG  70   2.535  -4.344  10.439
  556   1HB   ARG  70          1HB       ARG  70   1.692  -5.930  12.267
  557   2HB   ARG  70          2HB       ARG  70   3.304  -5.805  12.958
  558   1HG   ARG  70          1HG       ARG  70   3.023  -3.376  13.149
  559   2HG   ARG  70          2HG       ARG  70   1.393  -3.526  12.490
  560   1HD   ARG  70          1HD       ARG  70   1.031  -3.464  14.784
  561   2HD   ARG  70          2HD       ARG  70   1.006  -5.189  14.421
  562    HE   ARG  70           HE       ARG  70   3.603  -4.241  15.171
  563   1HH1  ARG  70          1HH1      ARG  70   0.530  -5.352  16.372
  564   2HH1  ARG  70          2HH1      ARG  70   1.171  -5.894  17.888
  565   1HH2  ARG  70          1HH2      ARG  70   4.459  -4.951  17.163
  566   2HH2  ARG  70          2HH2      ARG  70   3.405  -5.665  18.337
  567    H    GLY  71           H        GLY  71   4.924  -4.954   9.151
  568   1HA   GLY  71          1HA       GLY  71   7.090  -4.206  10.954
  569   2HA   GLY  71          2HA       GLY  71   7.251  -4.660   9.264
  570    H    THR  72           H        THR  72   4.766  -2.452   9.622
  571    HA   THR  72           HA       THR  72   6.469  -0.095   9.419
  572    HB   THR  72           HB       THR  72   5.022   0.590   7.357
  573    HG1  THR  72           HG1      THR  72   4.962  -2.257   7.175
  574   1HG2  THR  72          1HG2      THR  72   7.533   0.068   7.509
  575   2HG2  THR  72          2HG2      THR  72   6.770  -0.032   5.922
  576   3HG2  THR  72          3HG2      THR  72   7.112  -1.504   6.831
  577    H    GLN  73           H        GLN  73   4.265  -1.293  11.143
  578    HA   GLN  73           HA       GLN  73   2.157   0.697  10.863
  579   1HB   GLN  73          1HB       GLN  73   1.715  -1.751  11.376
  580   2HB   GLN  73          2HB       GLN  73   2.376  -1.443  12.977
  581   1HG   GLN  73          1HG       GLN  73  -0.114  -1.377  12.825
  582   2HG   GLN  73          2HG       GLN  73   0.632   0.068  13.505
  583   1HE2  GLN  73          1HE2      GLN  73  -1.120   1.363  13.006
  584   2HE2  GLN  73          2HE2      GLN  73  -1.494   1.837  11.387
  585    H    GLY  74           H        GLY  74   3.399   2.561  11.401
  586   1HA   GLY  74          1HA       GLY  74   3.119   3.707  13.786
  587   2HA   GLY  74          2HA       GLY  74   4.535   2.710  14.080
  588    H    GLU  75           H        GLU  75   6.471   3.537  13.613
  589    HA   GLU  75           HA       GLU  75   6.810   6.203  12.878
  590   1HB   GLU  75          1HB       GLU  75   8.440   4.327  13.912
  591   2HB   GLU  75          2HB       GLU  75   9.024   4.333  12.254
  592   1HG   GLU  75          1HG       GLU  75   9.402   6.753  12.411
  593   2HG   GLU  75          2HG       GLU  75   8.862   6.713  14.089
  594    H    ALA  76           H        ALA  76   6.469   3.354  10.932
  595    HA   ALA  76           HA       ALA  76   7.617   4.284   8.536
  596   1HB   ALA  76          1HB       ALA  76   5.365   2.555   8.052
  597   2HB   ALA  76          2HB       ALA  76   7.087   2.248   7.825
  598   3HB   ALA  76          3HB       ALA  76   6.339   1.959   9.396
  599    H    ARG  77           H        ARG  77   4.793   5.234  10.165
  600    HA   ARG  77           HA       ARG  77   3.196   5.981   7.934
  601   1HB   ARG  77          1HB       ARG  77   2.635   5.702  10.518
  602   2HB   ARG  77          2HB       ARG  77   2.961   7.430  10.527
  603   1HG   ARG  77          1HG       ARG  77   1.203   7.872   9.019
  604   2HG   ARG  77          2HG       ARG  77   1.023   6.163   8.617
  605   1HD   ARG  77          1HD       ARG  77   0.730   6.744  11.466
  606   2HD   ARG  77          2HD       ARG  77  -0.475   7.538  10.454
  607    HE   ARG  77           HE       ARG  77  -0.111   4.736   9.889
  608   1HH1  ARG  77          1HH1      ARG  77  -1.816   7.095  11.798
  609   2HH1  ARG  77          2HH1      ARG  77  -3.163   6.054  12.119
  610   1HH2  ARG  77          1HH2      ARG  77  -1.878   3.355  10.305
  611   2HH2  ARG  77          2HH2      ARG  77  -3.197   3.926  11.270
  612    H    ALA  78           H        ALA  78   5.995   7.308   9.325
  613    HA   ALA  78           HA       ALA  78   5.456   9.972   8.220
  614   1HB   ALA  78          1HB       ALA  78   6.287  10.420  10.281
  615   2HB   ALA  78          2HB       ALA  78   7.231   8.932  10.347
  616   3HB   ALA  78          3HB       ALA  78   7.818  10.308   9.413
  617    H    TYR  79           H        TYR  79   8.411   8.000   8.486
  618    HA   TYR  79           HA       TYR  79   9.719   9.078   6.298
  619   1HB   TYR  79          1HB       TYR  79  11.085   7.798   7.669
  620   2HB   TYR  79          2HB       TYR  79   9.936   6.466   7.747
  621    HD1  TYR  79           HD1      TYR  79  12.269   8.201   5.421
  622    HD2  TYR  79           HD2      TYR  79  10.207   4.601   6.368
  623    HE1  TYR  79           HE1      TYR  79  13.522   7.027   3.660
  624    HE2  TYR  79           HE2      TYR  79  11.455   3.417   4.611
  625    HH   TYR  79           HH       TYR  79  12.759   3.728   2.751
  626    H    SER  80           H        SER  80   7.757   6.110   6.426
  627    HA   SER  80           HA       SER  80   6.637   4.955   4.818
  628   1HB   SER  80          1HB       SER  80   6.862   7.612   3.393
  629   2HB   SER  80          2HB       SER  80   5.951   6.243   2.754
  630    HG   SER  80           HG       SER  80   4.826   7.912   4.120
  631    H    MET  81           H        MET  81   8.413   6.916   2.489
  632    HA   MET  81           HA       MET  81  10.126   4.607   1.880
  633   1HB   MET  81          1HB       MET  81   8.823   6.317  -0.239
  634   2HB   MET  81          2HB       MET  81   9.771   4.855  -0.480
  635   1HG   MET  81          1HG       MET  81   8.022   3.520  -0.121
  636   2HG   MET  81          2HG       MET  81   7.455   4.473   1.249
  637   1HE   MET  81          1HE       MET  81   4.179   5.113  -0.189
  638   2HE   MET  81          2HE       MET  81   5.203   4.320   1.008
  639   3HE   MET  81          3HE       MET  81   5.119   6.081   0.946
  640    H    LYS  82           H        LYS  82  11.568   5.628  -0.193
  641    HA   LYS  82           HA       LYS  82  13.151   7.657   1.162
  642   1HB   LYS  82          1HB       LYS  82  13.841   5.452  -0.298
  643   2HB   LYS  82          2HB       LYS  82  14.030   6.731  -1.490
  644   1HG   LYS  82          1HG       LYS  82  15.786   7.679  -0.404
  645   2HG   LYS  82          2HG       LYS  82  15.221   7.169   1.188
  646   1HD   LYS  82          1HD       LYS  82  16.273   5.166   1.067
  647   2HD   LYS  82          2HD       LYS  82  16.002   5.010  -0.671
  648   1HE   LYS  82          1HE       LYS  82  17.929   6.089  -1.204
  649   2HE   LYS  82          2HE       LYS  82  17.857   7.143   0.208
  650   1HZ   LYS  82          1HZ       LYS  82  19.687   5.645   0.443
  651   2HZ   LYS  82          2HZ       LYS  82  18.704   4.298   0.160
  652   3HZ   LYS  82          3HZ       LYS  82  18.505   5.209   1.572
  653    H    GLU  83           H        GLU  83  12.355   9.663   0.896
  654    HA   GLU  83           HA       GLU  83  10.968  10.576  -1.380
  655   1HB   GLU  83          1HB       GLU  83  12.261  11.921   0.965
  656   2HB   GLU  83          2HB       GLU  83  11.663  12.890  -0.376
  657   1HG   GLU  83          1HG       GLU  83   9.463  11.592  -0.039
  658   2HG   GLU  83          2HG       GLU  83  10.136  11.173   1.535
  659    H    ASP  84           H        ASP  84  14.361  10.571  -0.517
  660    HA   ASP  84           HA       ASP  84  15.244  12.375  -2.516
  661   1HB   ASP  84          1HB       ASP  84  16.706  11.957  -0.681
  662   2HB   ASP  84          2HB       ASP  84  16.656  10.217  -0.948
  663    H    THR  85           H        THR  85  14.747   8.893  -2.445
  664    HA   THR  85           HA       THR  85  15.660   8.684  -5.224
  665    HB   THR  85           HB       THR  85  14.811   6.160  -4.167
  666    HG1  THR  85           HG1      THR  85  16.764   7.482  -2.567
  667   1HG2  THR  85          1HG2      THR  85  17.488   7.329  -4.920
  668   2HG2  THR  85          2HG2      THR  85  16.434   6.326  -5.916
  669   3HG2  THR  85          3HG2      THR  85  17.241   5.633  -4.510
  670    H    ARG  86           H        ARG  86  12.932   9.575  -3.860
  671    HA   ARG  86           HA       ARG  86  11.034   7.790  -5.067
  672   1HB   ARG  86          1HB       ARG  86  10.923   9.687  -3.064
  673   2HB   ARG  86          2HB       ARG  86  10.048  10.455  -4.382
  674   1HG   ARG  86          1HG       ARG  86   8.279   9.338  -3.621
  675   2HG   ARG  86          2HG       ARG  86   9.007   7.927  -4.392
  676   1HD   ARG  86          1HD       ARG  86   9.849   8.661  -1.629
  677   2HD   ARG  86          2HD       ARG  86   8.289   7.874  -1.863
  678    HE   ARG  86           HE       ARG  86  10.833   6.640  -1.971
  679   1HH1  ARG  86          1HH1      ARG  86   7.699   6.602  -3.486
  680   2HH1  ARG  86          2HH1      ARG  86   7.806   4.940  -3.965
  681   1HH2  ARG  86          1HH2      ARG  86  10.986   4.451  -2.595
  682   2HH2  ARG  86          2HH2      ARG  86   9.676   3.717  -3.457
  683    H    LEU  87           H        LEU  87   9.662   8.227  -6.821
  684    HA   LEU  87           HA       LEU  87  10.805  10.101  -8.767
  685   1HB   LEU  87          1HB       LEU  87  10.035   7.451  -8.985
  686   2HB   LEU  87          2HB       LEU  87   8.719   8.337  -9.753
  687    HG   LEU  87           HG       LEU  87  11.620   8.253 -10.543
  688   1HD1  LEU  87          1HD1      LEU  87  10.415   7.754 -12.774
  689   2HD1  LEU  87          2HD1      LEU  87   9.022   7.395 -11.755
  690   3HD1  LEU  87          3HD1      LEU  87  10.519   6.484 -11.555
  691   1HD2  LEU  87          1HD2      LEU  87  10.950   9.889 -12.325
  692   2HD2  LEU  87          2HD2      LEU  87  11.052  10.557 -10.696
  693   3HD2  LEU  87          3HD2      LEU  87   9.477  10.188 -11.401
  694    H    GLU  88           H        GLU  88   7.698   9.067  -7.398
  695    HA   GLU  88           HA       GLU  88   6.648  11.747  -7.898
  696   1HB   GLU  88          1HB       GLU  88   5.995   9.674  -9.590
  697   2HB   GLU  88          2HB       GLU  88   4.668   9.659  -8.437
  698   1HG   GLU  88          1HG       GLU  88   3.998  11.821  -8.993
  699   2HG   GLU  88          2HG       GLU  88   5.537  12.196  -9.767
  700    H    GLY  89           H        GLY  89   4.334  11.871  -6.879
  701   1HA   GLY  89          1HA       GLY  89   2.886  11.299  -5.104
  702   2HA   GLY  89          2HA       GLY  89   4.111  10.199  -4.490
  703    HA   PRO  90           HA       PRO  90   3.500  10.024  -2.520
  704   1HB   PRO  90          1HB       PRO  90   2.058  10.832  -0.366
  705   2HB   PRO  90          2HB       PRO  90   3.788  10.478  -0.286
  706   1HG   PRO  90          1HG       PRO  90   2.404  13.123  -0.511
  707   2HG   PRO  90          2HG       PRO  90   3.784  12.666   0.503
  708   1HD   PRO  90          1HD       PRO  90   4.072  14.022  -1.823
  709   2HD   PRO  90          2HD       PRO  90   5.288  12.872  -1.231
  710    H    TRP  91           H        TRP  91   1.178   9.318  -2.080
  711    HA   TRP  91           HA       TRP  91  -0.817  11.097  -3.261
  712   1HB   TRP  91          1HB       TRP  91   0.005   8.424  -4.373
  713   2HB   TRP  91          2HB       TRP  91  -1.611   9.068  -4.647
  714    HD1  TRP  91           HD1      TRP  91  -0.810  12.116  -5.160
  715    HE1  TRP  91           HE1      TRP  91   0.383  12.749  -7.351
  716    HE3  TRP  91           HE3      TRP  91   1.061   7.528  -6.420
  717    HZ2  TRP  91           HZ2      TRP  91   1.914  11.472  -9.350
  718    HZ3  TRP  91           HZ3      TRP  91   2.378   7.319  -8.488
  719    HH2  TRP  91           HH2      TRP  91   2.794   9.251  -9.921
  720    H    GLU  92           H        GLU  92  -2.611  11.059  -2.084
  721    HA   GLU  92           HA       GLU  92  -3.171   8.661  -0.464
  722   1HB   GLU  92          1HB       GLU  92  -2.541  10.534   0.953
  723   2HB   GLU  92          2HB       GLU  92  -3.740  11.559   0.177
  724   1HG   GLU  92          1HG       GLU  92  -5.066   9.249   1.140
  725   2HG   GLU  92          2HG       GLU  92  -4.039   9.869   2.431
  726    H    TYR  93           H        TYR  93  -5.171   7.785  -0.557
  727    HA   TYR  93           HA       TYR  93  -7.316   9.252  -1.898
  728   1HB   TYR  93          1HB       TYR  93  -6.264   6.558  -2.765
  729   2HB   TYR  93          2HB       TYR  93  -7.842   7.175  -3.242
  730    HD1  TYR  93           HD1      TYR  93  -7.993   9.193  -4.685
  731    HD2  TYR  93           HD2      TYR  93  -4.267   7.336  -3.806
  732    HE1  TYR  93           HE1      TYR  93  -6.961  10.382  -6.575
  733    HE2  TYR  93           HE2      TYR  93  -3.225   8.521  -5.693
  734    HH   TYR  93           HH       TYR  93  -3.643  10.614  -7.009
  735    H    GLY  94           H        GLY  94  -9.437   8.175  -1.653
  736   1HA   GLY  94          1HA       GLY  94 -10.882   6.657  -0.539
  737   2HA   GLY  94          2HA       GLY  94  -9.572   6.261   0.563
  738    H    GLU  95           H        GLU  95 -10.862   6.578   2.390
  739    HA   GLU  95           HA       GLU  95 -12.394   8.880   2.893
  740   1HB   GLU  95          1HB       GLU  95 -12.794   6.919   4.198
  741   2HB   GLU  95          2HB       GLU  95 -11.125   6.867   4.747
  742   1HG   GLU  95          1HG       GLU  95 -12.651   9.309   5.394
  743   2HG   GLU  95          2HG       GLU  95 -13.127   7.829   6.225
  Start of MODEL   18
    1   1H    ALA   2          1H        ALA   2 -15.196  -0.439  19.489
    2    HA   ALA   2           HA       ALA   2 -14.469   0.523  16.799
    3   1HB   ALA   2          1HB       ALA   2 -13.568   2.540  17.989
    4   2HB   ALA   2          2HB       ALA   2 -15.322   2.356  18.051
    5   3HB   ALA   2          3HB       ALA   2 -14.341   1.935  19.455
    6    H    ARG   3           H        ARG   3 -12.448   0.185  16.105
    7    HA   ARG   3           HA       ARG   3 -10.243  -0.154  17.927
    8   1HB   ARG   3          1HB       ARG   3 -11.656  -2.443  17.298
    9   2HB   ARG   3          2HB       ARG   3 -10.338  -2.461  16.134
   10   1HG   ARG   3          1HG       ARG   3  -9.074  -1.832  18.495
   11   2HG   ARG   3          2HG       ARG   3 -10.314  -2.988  18.989
   12   1HD   ARG   3          1HD       ARG   3  -8.527  -3.505  16.634
   13   2HD   ARG   3          2HD       ARG   3  -8.024  -3.901  18.277
   14    HE   ARG   3           HE       ARG   3 -10.586  -4.981  17.695
   15   1HH1  ARG   3          1HH1      ARG   3  -7.184  -5.454  17.133
   16   2HH1  ARG   3          2HH1      ARG   3  -7.327  -7.166  16.904
   17   1HH2  ARG   3          1HH2      ARG   3 -10.788  -7.233  17.396
   18   2HH2  ARG   3          2HH2      ARG   3  -9.377  -8.176  17.053
   19    H    GLN   4           H        GLN   4  -8.184  -0.256  16.835
   20    HA   GLN   4           HA       GLN   4  -8.318   0.953  14.164
   21   1HB   GLN   4          1HB       GLN   4  -6.645   1.373  16.513
   22   2HB   GLN   4          2HB       GLN   4  -5.698   1.176  15.044
   23   1HG   GLN   4          1HG       GLN   4  -6.914   2.979  13.983
   24   2HG   GLN   4          2HG       GLN   4  -7.942   3.149  15.406
   25   1HE2  GLN   4          1HE2      GLN   4  -7.175   5.382  15.293
   26   2HE2  GLN   4          2HE2      GLN   4  -5.678   5.785  16.055
   27    H    VAL   5           H        VAL   5  -7.018   0.217  12.474
   28    HA   VAL   5           HA       VAL   5  -5.917  -2.492  12.855
   29    HB   VAL   5           HB       VAL   5  -6.441  -2.963  10.523
   30   1HG1  VAL   5          1HG1      VAL   5  -9.090  -2.290  10.912
   31   2HG1  VAL   5          2HG1      VAL   5  -8.292  -3.757  11.483
   32   3HG1  VAL   5          3HG1      VAL   5  -8.435  -2.358  12.548
   33   1HG2  VAL   5          1HG2      VAL   5  -6.864  -1.376   9.025
   34   2HG2  VAL   5          2HG2      VAL   5  -8.214  -0.763   9.980
   35   3HG2  VAL   5          3HG2      VAL   5  -6.579  -0.177  10.286
   36    H    ILE   6           H        ILE   6  -4.108  -3.073  11.473
   37    HA   ILE   6           HA       ILE   6  -2.235  -0.871  11.235
   38    HB   ILE   6           HB       ILE   6  -1.753  -3.794  10.656
   39   1HG1  ILE   6          1HG1      ILE   6  -0.568  -3.452  13.024
   40   2HG1  ILE   6          2HG1      ILE   6  -1.840  -2.250  13.203
   41   1HG2  ILE   6          1HG2      ILE   6  -0.059  -1.370  10.759
   42   2HG2  ILE   6          2HG2      ILE   6   0.614  -2.847  11.448
   43   3HG2  ILE   6          3HG2      ILE   6   0.090  -2.819   9.764
   44   1HD1  ILE   6          1HD1      ILE   6  -3.196  -3.872  13.839
   45   2HD1  ILE   6          2HD1      ILE   6  -3.088  -4.552  12.216
   46   3HD1  ILE   6          3HD1      ILE   6  -1.976  -5.091  13.474
   47    H    CYS   7           H        CYS   7  -1.072  -0.367   9.339
   48    HA   CYS   7           HA       CYS   7  -2.638  -0.553   6.939
   49   1HB   CYS   7          1HB       CYS   7   0.169   0.519   7.075
   50   2HB   CYS   7          2HB       CYS   7  -1.143   1.007   6.010
   51    HG   CYS   7           HG       CYS   7  -0.382   2.073   9.089
   52    H    TRP   8           H        TRP   8  -1.802  -1.313   4.883
   53    HA   TRP   8           HA       TRP   8  -0.117  -3.698   5.233
   54   1HB   TRP   8          1HB       TRP   8  -2.235  -3.037   3.182
   55   2HB   TRP   8          2HB       TRP   8  -1.169  -4.434   3.057
   56    HD1  TRP   8           HD1      TRP   8  -3.618  -3.005   5.723
   57    HE1  TRP   8           HE1      TRP   8  -4.862  -4.990   6.787
   58    HE3  TRP   8           HE3      TRP   8  -1.344  -6.830   3.207
   59    HZ2  TRP   8           HZ2      TRP   8  -4.877  -7.806   6.587
   60    HZ3  TRP   8           HZ3      TRP   8  -2.030  -9.140   3.703
   61    HH2  TRP   8           HH2      TRP   8  -3.760  -9.616   5.359
   62    H    CYS   9           H        CYS   9   1.916  -3.431   4.609
   63    HA   CYS   9           HA       CYS   9   2.548  -1.467   2.538
   64   1HB   CYS   9          1HB       CYS   9   4.897  -1.801   3.262
   65   2HB   CYS   9          2HB       CYS   9   3.846  -1.294   4.578
   66    HG   CYS   9           HG       CYS   9   3.629  -4.385   4.933
   67    H    PHE  10           H        PHE  10   2.982  -2.047   0.519
   68    HA   PHE  10           HA       PHE  10   4.106  -4.687  -0.027
   69   1HB   PHE  10          1HB       PHE  10   2.440  -5.390  -1.485
   70   2HB   PHE  10          2HB       PHE  10   1.503  -4.608  -0.216
   71    HD1  PHE  10           HD2      PHE  10   1.050  -2.040  -0.621
   72    HD2  PHE  10           HD1      PHE  10   1.979  -4.862  -3.669
   73    HE1  PHE  10           HE2      PHE  10   0.009  -0.569  -2.295
   74    HE2  PHE  10           HE1      PHE  10   0.941  -3.394  -5.349
   75    HZ   PHE  10           HZ       PHE  10  -0.047  -1.245  -4.663
   76    H    THR  11           H        THR  11   4.827  -4.882  -2.320
   77    HA   THR  11           HA       THR  11   5.544  -2.265  -3.465
   78    HB   THR  11           HB       THR  11   7.423  -4.612  -3.572
   79    HG1  THR  11           HG1      THR  11   7.374  -4.270  -1.417
   80   1HG2  THR  11          1HG2      THR  11   8.869  -2.277  -3.517
   81   2HG2  THR  11          2HG2      THR  11   7.430  -1.818  -4.427
   82   3HG2  THR  11          3HG2      THR  11   8.423  -3.170  -4.970
   83    H    LEU  12           H        LEU  12   4.993  -2.048  -5.531
   84    HA   LEU  12           HA       LEU  12   4.370  -4.477  -7.070
   85   1HB   LEU  12          1HB       LEU  12   2.613  -2.644  -6.562
   86   2HB   LEU  12          2HB       LEU  12   3.453  -1.724  -7.809
   87    HG   LEU  12           HG       LEU  12   2.931  -3.430  -9.456
   88   1HD1  LEU  12          1HD1      LEU  12   1.668  -4.862  -7.130
   89   2HD1  LEU  12          2HD1      LEU  12   2.981  -5.425  -8.163
   90   3HD1  LEU  12          3HD1      LEU  12   1.351  -5.264  -8.817
   91   1HD2  LEU  12          1HD2      LEU  12   0.450  -2.711  -7.903
   92   2HD2  LEU  12          2HD2      LEU  12   0.570  -3.057  -9.628
   93   3HD2  LEU  12          3HD2      LEU  12   1.314  -1.600  -8.967
   94    H    ASN  13           H        ASN  13   5.783  -5.017  -8.583
   95    HA   ASN  13           HA       ASN  13   7.596  -2.970  -9.640
   96   1HB   ASN  13          1HB       ASN  13   7.768  -5.982  -9.889
   97   2HB   ASN  13          2HB       ASN  13   9.004  -4.822 -10.367
   98   1HD2  ASN  13          1HD2      ASN  13   9.907  -3.471  -8.646
   99   2HD2  ASN  13          2HD2      ASN  13  10.088  -4.156  -7.070
  100    H    ASN  14           H        ASN  14   7.443  -2.253 -11.667
  101    HA   ASN  14           HA       ASN  14   6.583  -1.896 -13.748
  102   1HB   ASN  14          1HB       ASN  14   8.040  -4.026 -13.970
  103   2HB   ASN  14          2HB       ASN  14   6.506  -4.883 -14.088
  104   1HD2  ASN  14          1HD2      ASN  14   7.034  -5.518 -16.200
  105   2HD2  ASN  14          2HD2      ASN  14   6.912  -4.419 -17.527
  106    HA   PRO  15           HA       PRO  15   2.279  -3.051 -12.311
  107   1HB   PRO  15          1HB       PRO  15   1.392  -0.498 -12.052
  108   2HB   PRO  15          2HB       PRO  15   2.201  -1.372 -10.745
  109   1HG   PRO  15          1HG       PRO  15   3.323   0.641 -12.656
  110   2HG   PRO  15          2HG       PRO  15   3.588   0.487 -10.910
  111   1HD   PRO  15          1HD       PRO  15   5.376  -0.401 -12.739
  112   2HD   PRO  15          2HD       PRO  15   5.144  -1.194 -11.167
  113    H    LEU  16           H        LEU  16   0.554  -3.183 -13.668
  114    HA   LEU  16           HA       LEU  16   0.918  -2.191 -16.370
  115   1HB   LEU  16          1HB       LEU  16  -0.772  -4.217 -15.038
  116   2HB   LEU  16          2HB       LEU  16  -1.457  -3.441 -16.464
  117    HG   LEU  16           HG       LEU  16   1.288  -4.545 -16.697
  118   1HD1  LEU  16          1HD1      LEU  16  -0.412  -6.171 -15.462
  119   2HD1  LEU  16          2HD1      LEU  16   0.741  -6.747 -16.665
  120   3HD1  LEU  16          3HD1      LEU  16  -0.937  -6.454 -17.122
  121   1HD2  LEU  16          1HD2      LEU  16  -0.697  -5.190 -18.715
  122   2HD2  LEU  16          2HD2      LEU  16   0.855  -4.368 -18.876
  123   3HD2  LEU  16          3HD2      LEU  16  -0.582  -3.456 -18.412
  124    H    SER  17           H        SER  17  -0.435  -1.008 -13.586
  125    HA   SER  17           HA       SER  17  -1.568   1.244 -14.790
  126   1HB   SER  17          1HB       SER  17  -3.762   0.804 -15.107
  127   2HB   SER  17          2HB       SER  17  -3.265  -0.888 -15.115
  128    HG   SER  17           HG       SER  17  -4.940  -0.581 -13.633
  129    HA   PRO  18           HA       PRO  18  -1.391   2.724 -10.665
  130   1HB   PRO  18          1HB       PRO  18  -3.384   4.567 -10.615
  131   2HB   PRO  18          2HB       PRO  18  -1.870   4.813 -11.493
  132   1HG   PRO  18          1HG       PRO  18  -4.538   3.935 -12.528
  133   2HG   PRO  18          2HG       PRO  18  -3.394   5.096 -13.226
  134   1HD   PRO  18          1HD       PRO  18  -3.604   2.545 -14.110
  135   2HD   PRO  18          2HD       PRO  18  -2.070   3.439 -14.129
  136    H    LEU  19           H        LEU  19  -2.371   2.657  -8.608
  137    HA   LEU  19           HA       LEU  19  -4.281   0.571  -8.265
  138   1HB   LEU  19          1HB       LEU  19  -3.389   2.554  -6.186
  139   2HB   LEU  19          2HB       LEU  19  -4.029   0.933  -5.925
  140    HG   LEU  19           HG       LEU  19  -1.356   1.585  -7.166
  141   1HD1  LEU  19          1HD1      LEU  19  -1.628   2.067  -4.704
  142   2HD1  LEU  19          2HD1      LEU  19  -0.362   0.915  -5.130
  143   3HD1  LEU  19          3HD1      LEU  19  -1.898   0.338  -4.484
  144   1HD2  LEU  19          1HD2      LEU  19  -2.965  -0.824  -7.084
  145   2HD2  LEU  19          2HD2      LEU  19  -1.392  -1.052  -6.319
  146   3HD2  LEU  19          3HD2      LEU  19  -1.488  -0.481  -7.986
  147    H    SER  20           H        SER  20  -6.218   0.906  -6.789
  148    HA   SER  20           HA       SER  20  -7.525   3.488  -7.084
  149   1HB   SER  20          1HB       SER  20  -9.563   2.456  -8.077
  150   2HB   SER  20          2HB       SER  20  -8.166   2.385  -9.150
  151    HG   SER  20           HG       SER  20  -9.568   0.350  -7.937
  152    H    LEU  21           H        LEU  21  -9.271   3.798  -5.664
  153    HA   LEU  21           HA       LEU  21  -9.070   2.674  -3.154
  154   1HB   LEU  21          1HB       LEU  21 -10.218   4.751  -3.504
  155   2HB   LEU  21          2HB       LEU  21 -11.441   3.959  -4.495
  156    HG   LEU  21           HG       LEU  21 -12.224   2.741  -2.488
  157   1HD1  LEU  21          1HD1      LEU  21  -9.785   3.696  -1.406
  158   2HD1  LEU  21          2HD1      LEU  21 -10.988   2.649  -0.654
  159   3HD1  LEU  21          3HD1      LEU  21 -11.107   4.399  -0.474
  160   1HD2  LEU  21          1HD2      LEU  21 -12.266   5.700  -2.731
  161   2HD2  LEU  21          2HD2      LEU  21 -12.928   4.981  -1.263
  162   3HD2  LEU  21          3HD2      LEU  21 -13.585   4.535  -2.839
  163    H    HIS  22           H        HIS  22 -10.420   1.224  -1.971
  164    HA   HIS  22           HA       HIS  22 -11.798  -0.762  -3.656
  165   1HB   HIS  22          1HB       HIS  22  -9.540  -1.433  -2.595
  166   2HB   HIS  22          2HB       HIS  22 -10.426  -1.468  -1.073
  167    HD1  HIS  22           HD1      HIS  22 -10.569  -3.916  -0.614
  168    HD2  HIS  22           HD2      HIS  22 -11.702  -2.971  -4.498
  169    HE1  HIS  22           HE1      HIS  22 -11.457  -6.054  -1.594
  170    H    ASP  23           H        ASP  23 -13.824  -1.282  -3.095
  171    HA   ASP  23           HA       ASP  23 -15.283   0.233  -1.267
  172   1HB   ASP  23          1HB       ASP  23 -15.796  -1.907  -3.100
  173   2HB   ASP  23          2HB       ASP  23 -16.608  -2.255  -1.576
  174    H    SER  24           H        SER  24 -13.341  -2.575  -0.792
  175    HA   SER  24           HA       SER  24 -14.542  -3.276   1.745
  176   1HB   SER  24          1HB       SER  24 -11.902  -4.306   0.722
  177   2HB   SER  24          2HB       SER  24 -13.055  -5.105   1.792
  178    HG   SER  24           HG       SER  24 -13.989  -4.406  -0.725
  179    H    MET  25           H        MET  25 -11.596  -1.704   0.589
  180    HA   MET  25           HA       MET  25 -10.499  -1.357   3.214
  181   1HB   MET  25          1HB       MET  25  -8.692  -0.309   2.174
  182   2HB   MET  25          2HB       MET  25  -9.245  -1.453   0.959
  183   1HG   MET  25          1HG       MET  25 -10.344   0.277  -0.268
  184   2HG   MET  25          2HG       MET  25 -10.033   1.447   1.012
  185   1HE   MET  25          1HE       MET  25  -8.334  -1.296  -0.772
  186   2HE   MET  25          2HE       MET  25  -7.814  -0.383  -2.188
  187   3HE   MET  25          3HE       MET  25  -6.655  -0.776  -0.917
  188    H    LYS  26           H        LYS  26  -9.680   1.139   3.516
  189    HA   LYS  26           HA       LYS  26 -12.097   2.816   3.381
  190   1HB   LYS  26          1HB       LYS  26 -10.806   1.806   5.709
  191   2HB   LYS  26          2HB       LYS  26 -10.531   3.542   5.654
  192   1HG   LYS  26          1HG       LYS  26 -13.133   3.546   5.123
  193   2HG   LYS  26          2HG       LYS  26 -13.047   2.026   6.017
  194   1HD   LYS  26          1HD       LYS  26 -11.679   4.410   7.156
  195   2HD   LYS  26          2HD       LYS  26 -13.440   4.340   7.240
  196   1HE   LYS  26          1HE       LYS  26 -13.402   2.360   8.513
  197   2HE   LYS  26          2HE       LYS  26 -11.706   2.057   8.140
  198   1HZ   LYS  26          1HZ       LYS  26 -12.678   3.298  10.373
  199   2HZ   LYS  26          2HZ       LYS  26 -12.083   4.573   9.434
  200   3HZ   LYS  26          3HZ       LYS  26 -11.067   3.288   9.857
  201    H    TYR  27           H        TYR  27  -8.576   2.704   3.607
  202    HA   TYR  27           HA       TYR  27  -8.485   5.311   2.253
  203   1HB   TYR  27          1HB       TYR  27  -7.902   5.252   4.820
  204   2HB   TYR  27          2HB       TYR  27  -6.366   4.609   4.247
  205    HD1  TYR  27           HD1      TYR  27  -8.627   7.292   2.952
  206    HD2  TYR  27           HD2      TYR  27  -4.752   6.254   4.371
  207    HE1  TYR  27           HE1      TYR  27  -7.850   9.579   2.487
  208    HE2  TYR  27           HE2      TYR  27  -3.965   8.538   3.911
  209    HH   TYR  27           HH       TYR  27  -5.317  10.951   3.738
  210    H    LEU  28           H        LEU  28  -6.806   5.597   0.789
  211    HA   LEU  28           HA       LEU  28  -5.139   3.231   0.253
  212   1HB   LEU  28          1HB       LEU  28  -6.755   3.135  -1.434
  213   2HB   LEU  28          2HB       LEU  28  -6.766   4.885  -1.645
  214    HG   LEU  28           HG       LEU  28  -4.674   4.826  -2.805
  215   1HD1  LEU  28          1HD1      LEU  28  -4.419   2.254  -1.494
  216   2HD1  LEU  28          2HD1      LEU  28  -3.178   3.306  -2.173
  217   3HD1  LEU  28          3HD1      LEU  28  -4.035   2.169  -3.213
  218   1HD2  LEU  28          1HD2      LEU  28  -6.502   2.630  -3.771
  219   2HD2  LEU  28          2HD2      LEU  28  -5.250   3.414  -4.735
  220   3HD2  LEU  28          3HD2      LEU  28  -6.630   4.347  -4.154
  221    H    VAL  29           H        VAL  29  -3.032   3.642   0.164
  222    HA   VAL  29           HA       VAL  29  -2.115   6.311  -0.630
  223    HB   VAL  29           HB       VAL  29  -1.176   4.880   1.860
  224   1HG1  VAL  29          1HG1      VAL  29  -0.227   7.409   0.528
  225   2HG1  VAL  29          2HG1      VAL  29   0.170   6.971   2.190
  226   3HG1  VAL  29          3HG1      VAL  29   0.703   5.947   0.856
  227   1HG2  VAL  29          1HG2      VAL  29  -1.983   7.134   2.861
  228   2HG2  VAL  29          2HG2      VAL  29  -2.943   7.249   1.385
  229   3HG2  VAL  29          3HG2      VAL  29  -3.170   5.886   2.481
  230    H    TYR  30           H        TYR  30  -0.616   6.145  -2.152
  231    HA   TYR  30           HA       TYR  30   1.406   4.069  -2.024
  232   1HB   TYR  30          1HB       TYR  30   0.955   3.054  -4.098
  233   2HB   TYR  30          2HB       TYR  30  -0.621   3.177  -3.323
  234    HD1  TYR  30           HD2      TYR  30  -2.301   4.730  -4.158
  235    HD2  TYR  30           HD1      TYR  30   1.500   4.399  -6.042
  236    HE1  TYR  30           HE2      TYR  30  -3.174   5.933  -6.117
  237    HE2  TYR  30           HE1      TYR  30   0.637   5.603  -8.006
  238    HH   TYR  30           HH       TYR  30  -2.746   6.676  -8.163
  239    H    GLN  31           H        GLN  31   3.262   4.539  -3.222
  240    HA   GLN  31           HA       GLN  31   3.301   7.141  -4.589
  241   1HB   GLN  31          1HB       GLN  31   4.547   7.987  -2.939
  242   2HB   GLN  31          2HB       GLN  31   4.654   6.421  -2.146
  243   1HG   GLN  31          1HG       GLN  31   6.541   5.825  -3.581
  244   2HG   GLN  31          2HG       GLN  31   6.436   7.400  -4.365
  245   1HE2  GLN  31          1HE2      GLN  31   5.998   9.046  -2.225
  246   2HE2  GLN  31          2HE2      GLN  31   7.378   9.033  -1.187
  247    H    THR  32           H        THR  32   4.966   7.396  -6.165
  248    HA   THR  32           HA       THR  32   5.727   4.851  -7.385
  249    HB   THR  32           HB       THR  32   5.792   7.665  -8.490
  250    HG1  THR  32           HG1      THR  32   4.099   6.723  -9.843
  251   1HG2  THR  32          1HG2      THR  32   6.288   6.599 -10.651
  252   2HG2  THR  32          2HG2      THR  32   6.420   5.037  -9.843
  253   3HG2  THR  32          3HG2      THR  32   7.573   6.320  -9.475
  254    H    GLU  33           H        GLU  33   7.766   4.131  -7.483
  255    HA   GLU  33           HA       GLU  33   9.924   5.975  -6.694
  256   1HB   GLU  33          1HB       GLU  33   9.322   3.193  -5.790
  257   2HB   GLU  33          2HB       GLU  33  11.002   3.699  -5.896
  258   1HG   GLU  33          1HG       GLU  33  10.519   5.579  -4.398
  259   2HG   GLU  33          2HG       GLU  33   8.849   5.031  -4.269
  260    H    GLN  34           H        GLN  34  12.094   5.283  -7.457
  261    HA   GLN  34           HA       GLN  34  11.911   4.463 -10.240
  262   1HB   GLN  34          1HB       GLN  34  13.588   6.211  -8.739
  263   2HB   GLN  34          2HB       GLN  34  14.604   4.972  -9.463
  264   1HG   GLN  34          1HG       GLN  34  12.877   5.735 -11.499
  265   2HG   GLN  34          2HG       GLN  34  13.305   7.239 -10.683
  266   1HE2  GLN  34          1HE2      GLN  34  14.030   6.119 -13.339
  267   2HE2  GLN  34          2HE2      GLN  34  15.756   6.164 -13.389
  268    H    GLY  35           H        GLY  35  12.476   2.522 -10.994
  269   1HA   GLY  35          1HA       GLY  35  14.267   0.834  -9.393
  270   2HA   GLY  35          2HA       GLY  35  12.683   0.204  -9.821
  271    H    GLU  36           H        GLU  36  12.844  -1.220 -11.410
  272    HA   GLU  36           HA       GLU  36  14.947  -1.750 -13.040
  273   1HB   GLU  36          1HB       GLU  36  13.125  -2.529 -14.735
  274   2HB   GLU  36          2HB       GLU  36  13.253  -3.321 -13.171
  275   1HG   GLU  36          1HG       GLU  36  11.463  -1.025 -13.151
  276   2HG   GLU  36          2HG       GLU  36  10.967  -2.292 -14.271
  277    H    ALA  37           H        ALA  37  15.999  -0.727 -14.604
  278    HA   ALA  37           HA       ALA  37  15.539   1.850 -15.429
  279   1HB   ALA  37          1HB       ALA  37  16.805  -0.181 -17.243
  280   2HB   ALA  37          2HB       ALA  37  17.186   1.533 -17.073
  281   3HB   ALA  37          3HB       ALA  37  17.605   0.404 -15.784
  282    H    GLY  38           H        GLY  38  14.021   2.791 -16.623
  283   1HA   GLY  38          1HA       GLY  38  12.804   3.022 -18.667
  284   2HA   GLY  38          2HA       GLY  38  12.798   1.271 -18.822
  285    H    ASN  39           H        ASN  39  11.984   0.767 -16.094
  286    HA   ASN  39           HA       ASN  39   9.202   1.732 -16.236
  287   1HB   ASN  39          1HB       ASN  39   9.759  -0.811 -14.818
  288   2HB   ASN  39          2HB       ASN  39   8.392  -0.363 -15.835
  289   1HD2  ASN  39          1HD2      ASN  39  11.729  -1.433 -15.843
  290   2HD2  ASN  39          2HD2      ASN  39  11.705  -2.110 -17.432
  291    H    ILE  40           H        ILE  40   8.086   1.344 -14.000
  292    HA   ILE  40           HA       ILE  40   9.915   2.095 -11.826
  293    HB   ILE  40           HB       ILE  40   8.046   3.658 -11.025
  294   1HG1  ILE  40          1HG1      ILE  40   7.303   3.400 -13.947
  295   2HG1  ILE  40          2HG1      ILE  40   6.308   2.933 -12.572
  296   1HG2  ILE  40          1HG2      ILE  40  10.289   4.302 -11.978
  297   2HG2  ILE  40          2HG2      ILE  40   9.475   4.526 -13.526
  298   3HG2  ILE  40          3HG2      ILE  40   9.016   5.512 -12.138
  299   1HD1  ILE  40          1HD1      ILE  40   5.432   4.957 -12.532
  300   2HD1  ILE  40          2HD1      ILE  40   7.027   5.649 -12.238
  301   3HD1  ILE  40          3HD1      ILE  40   6.451   5.432 -13.890
  302    H    HIS  41           H        HIS  41   8.818   1.958  -9.659
  303    HA   HIS  41           HA       HIS  41   6.807  -0.194  -9.631
  304   1HB   HIS  41          1HB       HIS  41   7.986  -0.863  -7.420
  305   2HB   HIS  41          2HB       HIS  41   8.727  -1.331  -8.948
  306    HD1  HIS  41           HD1      HIS  41  11.078  -1.434  -7.901
  307    HD2  HIS  41           HD2      HIS  41   9.272   2.298  -7.629
  308    HE1  HIS  41           HE1      HIS  41  12.905   0.148  -7.206
  309    H    PHE  42           H        PHE  42   5.380  -0.222  -7.824
  310    HA   PHE  42           HA       PHE  42   5.005   2.442  -6.653
  311   1HB   PHE  42          1HB       PHE  42   3.143   0.172  -7.272
  312   2HB   PHE  42          2HB       PHE  42   2.694   1.374  -6.066
  313    HD1  PHE  42           HD1      PHE  42   4.762   2.532  -8.776
  314    HD2  PHE  42           HD2      PHE  42   0.744   1.872  -7.536
  315    HE1  PHE  42           HE1      PHE  42   3.969   4.025 -10.564
  316    HE2  PHE  42           HE2      PHE  42  -0.056   3.363  -9.322
  317    HZ   PHE  42           HZ       PHE  42   1.557   4.442 -10.839
  318    H    GLN  43           H        GLN  43   4.832   2.760  -4.467
  319    HA   GLN  43           HA       GLN  43   4.956   0.469  -2.673
  320   1HB   GLN  43          1HB       GLN  43   7.237   2.140  -3.311
  321   2HB   GLN  43          2HB       GLN  43   6.851   2.218  -1.597
  322   1HG   GLN  43          1HG       GLN  43   7.554   0.133  -1.216
  323   2HG   GLN  43          2HG       GLN  43   6.833  -0.488  -2.700
  324   1HE2  GLN  43          1HE2      GLN  43   8.000   0.381  -4.729
  325   2HE2  GLN  43          2HE2      GLN  43   9.724   0.274  -4.688
  326    H    GLY  44           H        GLY  44   3.845   0.800  -0.835
  327   1HA   GLY  44          1HA       GLY  44   3.604   3.213   0.556
  328   2HA   GLY  44          2HA       GLY  44   2.235   3.098  -0.540
  329    H    TYR  45           H        TYR  45   1.117   3.171   1.616
  330    HA   TYR  45           HA       TYR  45   0.840   0.433   2.670
  331   1HB   TYR  45          1HB       TYR  45   0.430   1.309   4.868
  332   2HB   TYR  45          2HB       TYR  45   1.923   2.027   4.275
  333    HD1  TYR  45           HD1      TYR  45  -1.633   2.663   4.998
  334    HD2  TYR  45           HD2      TYR  45   2.098   4.385   3.896
  335    HE1  TYR  45           HE1      TYR  45  -2.542   4.904   5.446
  336    HE2  TYR  45           HE2      TYR  45   1.200   6.631   4.341
  337    HH   TYR  45           HH       TYR  45  -1.409   7.251   6.109
  338    H    ILE  46           H        ILE  46  -1.216  -0.325   3.041
  339    HA   ILE  46           HA       ILE  46  -3.456   1.460   2.389
  340    HB   ILE  46           HB       ILE  46  -3.141  -1.344   1.312
  341   1HG1  ILE  46          1HG1      ILE  46  -3.231   1.237  -0.250
  342   2HG1  ILE  46          2HG1      ILE  46  -1.721   0.488   0.259
  343   1HG2  ILE  46          1HG2      ILE  46  -5.206   0.190   0.066
  344   2HG2  ILE  46          2HG2      ILE  46  -5.325  -1.344   0.926
  345   3HG2  ILE  46          3HG2      ILE  46  -5.455   0.176   1.812
  346   1HD1  ILE  46          1HD1      ILE  46  -2.109  -1.412  -1.094
  347   2HD1  ILE  46          2HD1      ILE  46  -3.776  -0.929  -1.409
  348   3HD1  ILE  46          3HD1      ILE  46  -2.444   0.004  -2.090
  349    H    GLU  47           H        GLU  47  -5.029   1.379   3.851
  350    HA   GLU  47           HA       GLU  47  -5.020  -0.829   5.784
  351   1HB   GLU  47          1HB       GLU  47  -6.384   1.862   5.979
  352   2HB   GLU  47          2HB       GLU  47  -6.272   0.656   7.254
  353   1HG   GLU  47          1HG       GLU  47  -4.089   1.125   7.706
  354   2HG   GLU  47          2HG       GLU  47  -3.749   1.667   6.064
  355    H    MET  48           H        MET  48  -6.477  -2.376   5.538
  356    HA   MET  48           HA       MET  48  -8.733  -2.029   3.776
  357   1HB   MET  48          1HB       MET  48  -7.899  -4.382   5.483
  358   2HB   MET  48          2HB       MET  48  -9.194  -4.406   4.292
  359   1HG   MET  48          1HG       MET  48  -6.265  -3.973   3.758
  360   2HG   MET  48          2HG       MET  48  -7.211  -5.409   3.374
  361   1HE   MET  48          1HE       MET  48  -9.024  -4.726   0.250
  362   2HE   MET  48          2HE       MET  48  -8.729  -5.742   1.661
  363   3HE   MET  48          3HE       MET  48  -9.899  -4.424   1.752
  364    H    LYS  49           H        LYS  49 -10.832  -3.255   4.707
  365    HA   LYS  49           HA       LYS  49 -12.124  -1.496   6.382
  366   1HB   LYS  49          1HB       LYS  49 -12.800  -3.823   5.031
  367   2HB   LYS  49          2HB       LYS  49 -13.106  -4.221   6.716
  368   1HG   LYS  49          1HG       LYS  49 -14.764  -2.641   6.932
  369   2HG   LYS  49          2HG       LYS  49 -14.144  -1.656   5.604
  370   1HD   LYS  49          1HD       LYS  49 -16.170  -2.709   4.875
  371   2HD   LYS  49          2HD       LYS  49 -14.820  -3.473   4.034
  372   1HE   LYS  49          1HE       LYS  49 -16.133  -5.276   4.694
  373   2HE   LYS  49          2HE       LYS  49 -14.891  -5.200   5.943
  374   1HZ   LYS  49          1HZ       LYS  49 -17.474  -5.358   6.485
  375   2HZ   LYS  49          2HZ       LYS  49 -17.320  -3.675   6.436
  376   3HZ   LYS  49          3HZ       LYS  49 -16.373  -4.580   7.506
  377    H    LYS  50           H        LYS  50 -11.000  -4.745   7.345
  378    HA   LYS  50           HA       LYS  50  -9.747  -3.958   9.709
  379   1HB   LYS  50          1HB       LYS  50 -12.620  -4.030   9.894
  380   2HB   LYS  50          2HB       LYS  50 -11.924  -5.265  10.935
  381   1HG   LYS  50          1HG       LYS  50 -10.630  -3.641  12.115
  382   2HG   LYS  50          2HG       LYS  50 -11.084  -2.376  10.970
  383   1HD   LYS  50          1HD       LYS  50 -13.254  -3.828  12.395
  384   2HD   LYS  50          2HD       LYS  50 -12.307  -2.647  13.302
  385   1HE   LYS  50          1HE       LYS  50 -12.835  -1.287  11.000
  386   2HE   LYS  50          2HE       LYS  50 -14.298  -2.253  11.184
  387   1HZ   LYS  50          1HZ       LYS  50 -13.159  -0.319  13.122
  388   2HZ   LYS  50          2HZ       LYS  50 -14.406  -1.393  13.511
  389   3HZ   LYS  50          3HZ       LYS  50 -14.644  -0.220  12.316
  390    H    ARG  51           H        ARG  51 -12.114  -6.576   9.263
  391    HA   ARG  51           HA       ARG  51 -10.054  -8.529   9.871
  392   1HB   ARG  51          1HB       ARG  51 -12.517  -8.517  10.712
  393   2HB   ARG  51          2HB       ARG  51 -12.882  -9.211   9.138
  394   1HG   ARG  51          1HG       ARG  51 -11.190 -10.999   9.655
  395   2HG   ARG  51          2HG       ARG  51 -11.142 -10.361  11.300
  396   1HD   ARG  51          1HD       ARG  51 -13.864 -10.705  10.513
  397   2HD   ARG  51          2HD       ARG  51 -12.981 -12.195  10.182
  398    HE   ARG  51           HE       ARG  51 -12.381 -11.204  12.774
  399   1HH1  ARG  51          1HH1      ARG  51 -14.830 -12.871  10.946
  400   2HH1  ARG  51          2HH1      ARG  51 -15.474 -13.705  12.321
  401   1HH2  ARG  51          1HH2      ARG  51 -13.219 -12.297  14.592
  402   2HH2  ARG  51          2HH2      ARG  51 -14.558 -13.377  14.395
  403    H    THR  52           H        THR  52  -9.331  -7.380   7.573
  404    HA   THR  52           HA       THR  52 -10.148  -9.268   5.463
  405    HB   THR  52           HB       THR  52  -8.683  -6.756   4.794
  406    HG1  THR  52           HG1      THR  52 -10.712  -6.508   6.278
  407   1HG2  THR  52          1HG2      THR  52 -10.916  -8.284   3.449
  408   2HG2  THR  52          2HG2      THR  52  -9.201  -8.400   3.053
  409   3HG2  THR  52          3HG2      THR  52 -10.069  -6.890   2.780
  410    H    SER  53           H        SER  53  -8.716 -10.823   5.117
  411    HA   SER  53           HA       SER  53  -5.986 -10.593   5.986
  412   1HB   SER  53          1HB       SER  53  -5.899 -12.900   4.712
  413   2HB   SER  53          2HB       SER  53  -6.739 -12.765   6.256
  414    HG   SER  53           HG       SER  53  -7.730 -13.483   3.891
  415    H    LEU  54           H        LEU  54  -4.329 -11.621   4.289
  416    HA   LEU  54           HA       LEU  54  -3.730  -9.657   2.441
  417   1HB   LEU  54          1HB       LEU  54  -2.093 -11.261   3.208
  418   2HB   LEU  54          2HB       LEU  54  -2.967 -12.573   2.421
  419    HG   LEU  54           HG       LEU  54  -2.404 -11.665   0.236
  420   1HD1  LEU  54          1HD1      LEU  54  -0.951  -9.760  -0.024
  421   2HD1  LEU  54          2HD1      LEU  54  -0.844  -9.559   1.724
  422   3HD1  LEU  54          3HD1      LEU  54  -2.378  -9.287   0.898
  423   1HD2  LEU  54          1HD2      LEU  54  -0.703 -13.079   0.566
  424   2HD2  LEU  54          2HD2      LEU  54  -0.420 -12.503   2.209
  425   3HD2  LEU  54          3HD2      LEU  54   0.266 -11.631   0.837
  426    H    ALA  55           H        ALA  55  -5.798 -12.447   2.110
  427    HA   ALA  55           HA       ALA  55  -5.975 -12.679  -0.648
  428   1HB   ALA  55          1HB       ALA  55  -8.265 -13.019   1.281
  429   2HB   ALA  55          2HB       ALA  55  -8.082 -13.770  -0.304
  430   3HB   ALA  55          3HB       ALA  55  -7.001 -14.220   1.014
  431    H    GLY  56           H        GLY  56  -7.407 -10.314   1.502
  432   1HA   GLY  56          1HA       GLY  56  -9.274  -9.262  -0.382
  433   2HA   GLY  56          2HA       GLY  56  -8.749  -8.485   1.104
  434    H    MET  57           H        MET  57  -6.007  -8.301   0.608
  435    HA   MET  57           HA       MET  57  -5.950  -5.984  -1.053
  436   1HB   MET  57          1HB       MET  57  -3.724  -7.545   0.266
  437   2HB   MET  57          2HB       MET  57  -3.501  -6.010  -0.563
  438   1HG   MET  57          1HG       MET  57  -5.581  -6.011   1.505
  439   2HG   MET  57          2HG       MET  57  -3.941  -6.281   2.089
  440   1HE   MET  57          1HE       MET  57  -4.770  -2.678  -0.650
  441   2HE   MET  57          2HE       MET  57  -4.333  -4.297  -1.196
  442   3HE   MET  57          3HE       MET  57  -5.917  -4.006  -0.476
  443    H    LYS  58           H        LYS  58  -4.496  -9.220  -1.327
  444    HA   LYS  58           HA       LYS  58  -3.198  -8.888  -3.758
  445   1HB   LYS  58          1HB       LYS  58  -3.052 -11.234  -3.874
  446   2HB   LYS  58          2HB       LYS  58  -3.114 -10.876  -2.153
  447   1HG   LYS  58          1HG       LYS  58  -5.476 -11.453  -2.102
  448   2HG   LYS  58          2HG       LYS  58  -5.446 -11.771  -3.837
  449   1HD   LYS  58          1HD       LYS  58  -5.300 -13.842  -2.534
  450   2HD   LYS  58          2HD       LYS  58  -3.843 -13.574  -3.494
  451   1HE   LYS  58          1HE       LYS  58  -2.552 -13.107  -1.648
  452   2HE   LYS  58          2HE       LYS  58  -3.930 -12.575  -0.686
  453   1HZ   LYS  58          1HZ       LYS  58  -4.103 -15.335  -1.427
  454   2HZ   LYS  58          2HZ       LYS  58  -4.235 -14.618   0.100
  455   3HZ   LYS  58          3HZ       LYS  58  -2.710 -15.003  -0.525
  456    H    LYS  59           H        LYS  59  -6.579  -9.446  -3.073
  457    HA   LYS  59           HA       LYS  59  -7.471 -10.278  -5.578
  458   1HB   LYS  59          1HB       LYS  59  -8.797 -10.166  -3.423
  459   2HB   LYS  59          2HB       LYS  59  -8.994  -8.445  -3.725
  460   1HG   LYS  59          1HG       LYS  59 -10.475  -8.766  -5.413
  461   2HG   LYS  59          2HG       LYS  59  -9.749 -10.297  -5.908
  462   1HD   LYS  59          1HD       LYS  59 -10.931 -10.374  -3.237
  463   2HD   LYS  59          2HD       LYS  59 -12.097 -10.017  -4.513
  464   1HE   LYS  59          1HE       LYS  59 -11.089 -12.008  -5.751
  465   2HE   LYS  59          2HE       LYS  59 -10.315 -12.420  -4.222
  466   1HZ   LYS  59          1HZ       LYS  59 -12.562 -12.421  -3.210
  467   2HZ   LYS  59          2HZ       LYS  59 -12.348 -13.621  -4.382
  468   3HZ   LYS  59          3HZ       LYS  59 -13.227 -12.224  -4.753
  469    H    LEU  60           H        LEU  60  -6.599  -7.102  -4.411
  470    HA   LEU  60           HA       LEU  60  -7.700  -5.725  -6.693
  471   1HB   LEU  60          1HB       LEU  60  -5.997  -4.892  -4.366
  472   2HB   LEU  60          2HB       LEU  60  -6.334  -3.796  -5.705
  473    HG   LEU  60           HG       LEU  60  -8.787  -4.132  -5.202
  474   1HD1  LEU  60          1HD1      LEU  60  -7.610  -5.900  -3.212
  475   2HD1  LEU  60          2HD1      LEU  60  -9.262  -5.818  -3.823
  476   3HD1  LEU  60          3HD1      LEU  60  -8.748  -4.741  -2.524
  477   1HD2  LEU  60          1HD2      LEU  60  -6.859  -2.453  -4.034
  478   2HD2  LEU  60          2HD2      LEU  60  -7.951  -2.938  -2.737
  479   3HD2  LEU  60          3HD2      LEU  60  -8.593  -2.168  -4.188
  480    H    ILE  61           H        ILE  61  -4.520  -6.799  -5.606
  481    HA   ILE  61           HA       ILE  61  -3.534  -6.446  -8.341
  482    HB   ILE  61           HB       ILE  61  -2.007  -5.525  -5.903
  483   1HG1  ILE  61          1HG1      ILE  61  -2.212  -3.359  -7.537
  484   2HG1  ILE  61          2HG1      ILE  61  -3.757  -4.147  -7.842
  485   1HG2  ILE  61          1HG2      ILE  61  -0.239  -5.984  -7.195
  486   2HG2  ILE  61          2HG2      ILE  61  -1.225  -6.145  -8.648
  487   3HG2  ILE  61          3HG2      ILE  61  -0.712  -4.548  -8.102
  488   1HD1  ILE  61          1HD1      ILE  61  -2.865  -2.634  -5.545
  489   2HD1  ILE  61          2HD1      ILE  61  -4.496  -3.086  -6.042
  490   3HD1  ILE  61          3HD1      ILE  61  -3.520  -4.208  -5.094
  491    HA   PRO  62           HA       PRO  62  -2.500 -10.599  -6.560
  492   1HB   PRO  62          1HB       PRO  62  -3.207 -11.980  -8.787
  493   2HB   PRO  62          2HB       PRO  62  -4.361 -11.540  -7.523
  494   1HG   PRO  62          1HG       PRO  62  -3.834 -10.210 -10.153
  495   2HG   PRO  62          2HG       PRO  62  -5.384 -10.558  -9.366
  496   1HD   PRO  62          1HD       PRO  62  -4.239  -8.105  -9.308
  497   2HD   PRO  62          2HD       PRO  62  -5.232  -8.727  -7.975
  498    H    GLY  63           H        GLY  63  -0.297 -10.460  -6.558
  499   1HA   GLY  63          1HA       GLY  63   1.513 -11.638  -7.862
  500   2HA   GLY  63          2HA       GLY  63   1.052 -10.576  -9.184
  501    H    ALA  64           H        ALA  64   1.747 -10.138  -5.712
  502    HA   ALA  64           HA       ALA  64   4.045  -8.502  -6.300
  503   1HB   ALA  64          1HB       ALA  64   2.568  -6.791  -4.641
  504   2HB   ALA  64          2HB       ALA  64   3.035  -6.525  -6.322
  505   3HB   ALA  64          3HB       ALA  64   1.480  -7.266  -5.946
  506    H    HIS  65           H        HIS  65   4.906  -7.517  -4.175
  507    HA   HIS  65           HA       HIS  65   4.817  -9.636  -2.170
  508   1HB   HIS  65          1HB       HIS  65   6.977  -8.620  -3.161
  509   2HB   HIS  65          2HB       HIS  65   6.652  -7.252  -2.100
  510    HD1  HIS  65           HD1      HIS  65   8.827  -9.866  -2.092
  511    HD2  HIS  65           HD2      HIS  65   5.946  -8.702   0.665
  512    HE1  HIS  65           HE1      HIS  65   9.536 -10.889   0.093
  513    H    PHE  66           H        PHE  66   3.360  -9.428  -0.609
  514    HA   PHE  66           HA       PHE  66   2.763  -6.731   0.412
  515   1HB   PHE  66          1HB       PHE  66   1.092  -9.107  -0.109
  516   2HB   PHE  66          2HB       PHE  66   0.753  -8.272   1.403
  517    HD1  PHE  66           HD1      PHE  66   0.873  -7.912  -2.259
  518    HD2  PHE  66           HD2      PHE  66  -0.322  -6.159   1.431
  519    HE1  PHE  66           HE1      PHE  66  -0.455  -6.243  -3.486
  520    HE2  PHE  66           HE2      PHE  66  -1.652  -4.487   0.210
  521    HZ   PHE  66           HZ       PHE  66  -1.720  -4.528  -2.251
  522    H    GLU  67           H        GLU  67   2.347  -6.532   2.716
  523    HA   GLU  67           HA       GLU  67   3.429  -8.649   4.406
  524   1HB   GLU  67          1HB       GLU  67   4.812  -6.154   3.783
  525   2HB   GLU  67          2HB       GLU  67   4.589  -6.393   5.510
  526   1HG   GLU  67          1HG       GLU  67   5.456  -8.857   4.547
  527   2HG   GLU  67          2HG       GLU  67   6.435  -7.659   3.704
  528    H    LYS  68           H        LYS  68   2.040  -8.948   6.003
  529    HA   LYS  68           HA       LYS  68   0.435  -6.658   6.929
  530   1HB   LYS  68          1HB       LYS  68  -0.795  -8.953   7.888
  531   2HB   LYS  68          2HB       LYS  68  -1.308  -7.995   6.504
  532   1HG   LYS  68          1HG       LYS  68  -0.193  -9.427   4.985
  533   2HG   LYS  68          2HG       LYS  68   0.662 -10.255   6.288
  534   1HD   LYS  68          1HD       LYS  68  -1.996 -10.556   6.969
  535   2HD   LYS  68          2HD       LYS  68  -2.003 -10.718   5.212
  536   1HE   LYS  68          1HE       LYS  68  -0.816 -12.649   5.251
  537   2HE   LYS  68          2HE       LYS  68   0.127 -12.166   6.660
  538   1HZ   LYS  68          1HZ       LYS  68  -2.652 -13.204   6.641
  539   2HZ   LYS  68          2HZ       LYS  68  -1.896 -12.567   8.013
  540   3HZ   LYS  68          3HZ       LYS  68  -1.282 -13.963   7.281
  541    H    ARG  69           H        ARG  69   3.087  -8.314   7.762
  542    HA   ARG  69           HA       ARG  69   2.833  -9.237  10.331
  543   1HB   ARG  69          1HB       ARG  69   5.013  -8.099   8.722
  544   2HB   ARG  69          2HB       ARG  69   5.246  -7.953  10.459
  545   1HG   ARG  69          1HG       ARG  69   4.490 -10.529  10.307
  546   2HG   ARG  69          2HG       ARG  69   5.272 -10.337   8.736
  547   1HD   ARG  69          1HD       ARG  69   6.673  -9.267  11.126
  548   2HD   ARG  69          2HD       ARG  69   6.623 -11.017  10.918
  549    HE   ARG  69           HE       ARG  69   7.453  -9.621   8.555
  550   1HH1  ARG  69          1HH1      ARG  69   8.506 -10.948  11.596
  551   2HH1  ARG  69          2HH1      ARG  69  10.149 -11.156  11.086
  552   1HH2  ARG  69          1HH2      ARG  69   9.613  -9.890   7.871
  553   2HH2  ARG  69          2HH2      ARG  69  10.777 -10.553   8.967
  554    H    ARG  70           H        ARG  70   3.237  -5.881   9.277
  555    HA   ARG  70           HA       ARG  70   1.757  -4.785  11.376
  556   1HB   ARG  70          1HB       ARG  70   4.266  -5.582  12.263
  557   2HB   ARG  70          2HB       ARG  70   4.451  -3.858  11.972
  558   1HG   ARG  70          1HG       ARG  70   3.592  -3.547  13.993
  559   2HG   ARG  70          2HG       ARG  70   2.042  -4.045  13.313
  560   1HD   ARG  70          1HD       ARG  70   2.202  -6.180  14.162
  561   2HD   ARG  70          2HD       ARG  70   3.963  -6.130  14.236
  562    HE   ARG  70           HE       ARG  70   2.749  -4.274  16.035
  563   1HH1  ARG  70          1HH1      ARG  70   3.615  -7.618  15.602
  564   2HH1  ARG  70          2HH1      ARG  70   3.730  -7.944  17.300
  565   1HH2  ARG  70          1HH2      ARG  70   2.898  -4.690  18.273
  566   2HH2  ARG  70          2HH2      ARG  70   3.321  -6.277  18.818
  567    H    GLY  71           H        GLY  71   2.249  -4.527   8.519
  568   1HA   GLY  71          1HA       GLY  71   2.541  -2.917   6.899
  569   2HA   GLY  71          2HA       GLY  71   1.851  -1.848   8.111
  570    H    THR  72           H        THR  72   3.047  -0.165   8.679
  571    HA   THR  72           HA       THR  72   5.975  -0.391   8.527
  572    HB   THR  72           HB       THR  72   5.503   2.258   7.897
  573    HG1  THR  72           HG1      THR  72   4.088   1.880   5.955
  574   1HG2  THR  72          1HG2      THR  72   7.238   1.328   6.740
  575   2HG2  THR  72          2HG2      THR  72   6.011   1.276   5.474
  576   3HG2  THR  72          3HG2      THR  72   6.364  -0.170   6.419
  577    H    GLN  73           H        GLN  73   3.960  -0.420  10.736
  578    HA   GLN  73           HA       GLN  73   3.639   0.461  12.813
  579   1HB   GLN  73          1HB       GLN  73   6.325   0.117  12.429
  580   2HB   GLN  73          2HB       GLN  73   6.250   1.807  12.909
  581   1HG   GLN  73          1HG       GLN  73   5.686   1.321  15.028
  582   2HG   GLN  73          2HG       GLN  73   4.669  -0.040  14.558
  583   1HE2  GLN  73          1HE2      GLN  73   5.512  -1.358  16.163
  584   2HE2  GLN  73          2HE2      GLN  73   7.104  -2.020  16.072
  585    H    GLY  74           H        GLY  74   4.514   2.737  14.091
  586   1HA   GLY  74          1HA       GLY  74   2.804   4.708  12.944
  587   2HA   GLY  74          2HA       GLY  74   3.816   4.913  14.366
  588    H    GLU  75           H        GLU  75   5.954   3.874  12.209
  589    HA   GLU  75           HA       GLU  75   7.057   6.469  11.774
  590   1HB   GLU  75          1HB       GLU  75   8.137   4.004  11.930
  591   2HB   GLU  75          2HB       GLU  75   8.071   4.185  10.182
  592   1HG   GLU  75          1HG       GLU  75   9.538   5.975  10.180
  593   2HG   GLU  75          2HG       GLU  75   9.253   6.339  11.881
  594    H    ALA  76           H        ALA  76   5.029   4.337   9.946
  595    HA   ALA  76           HA       ALA  76   5.517   5.317   7.355
  596   1HB   ALA  76          1HB       ALA  76   4.018   3.779   6.779
  597   2HB   ALA  76          2HB       ALA  76   3.868   3.394   8.494
  598   3HB   ALA  76          3HB       ALA  76   2.759   4.545   7.749
  599    H    ARG  77           H        ARG  77   4.011   6.768  10.038
  600    HA   ARG  77           HA       ARG  77   2.217   8.479   8.600
  601   1HB   ARG  77          1HB       ARG  77   3.011   8.054  11.394
  602   2HB   ARG  77          2HB       ARG  77   2.643   9.729  11.004
  603   1HG   ARG  77          1HG       ARG  77   0.591   8.953  11.667
  604   2HG   ARG  77          2HG       ARG  77   0.501   8.714   9.921
  605   1HD   ARG  77          1HD       ARG  77   0.614   6.444  10.087
  606   2HD   ARG  77          2HD       ARG  77   1.596   6.493  11.551
  607    HE   ARG  77           HE       ARG  77  -0.952   7.464  12.168
  608   1HH1  ARG  77          1HH1      ARG  77   0.594   4.492  11.221
  609   2HH1  ARG  77          2HH1      ARG  77  -0.560   3.482  12.025
  610   1HH2  ARG  77          1HH2      ARG  77  -2.479   6.144  13.232
  611   2HH2  ARG  77          2HH2      ARG  77  -2.309   4.423  13.168
  612    H    ALA  78           H        ALA  78   5.528   8.400   8.851
  613    HA   ALA  78           HA       ALA  78   5.714  11.217   8.045
  614   1HB   ALA  78          1HB       ALA  78   6.911   9.997  10.401
  615   2HB   ALA  78          2HB       ALA  78   8.092  10.798   9.364
  616   3HB   ALA  78          3HB       ALA  78   6.708  11.699   9.984
  617    H    TYR  79           H        TYR  79   7.688   8.264   8.408
  618    HA   TYR  79           HA       TYR  79   9.439   8.896   6.279
  619   1HB   TYR  79          1HB       TYR  79   9.968   7.304   8.121
  620   2HB   TYR  79          2HB       TYR  79   8.821   6.165   7.424
  621    HD1  TYR  79           HD1      TYR  79  11.412   8.328   5.825
  622    HD2  TYR  79           HD2      TYR  79  10.040   4.375   6.601
  623    HE1  TYR  79           HE1      TYR  79  13.189   7.433   4.378
  624    HE2  TYR  79           HE2      TYR  79  11.814   3.470   5.158
  625    HH   TYR  79           HH       TYR  79  14.089   4.217   4.348
  626    H    SER  80           H        SER  80   6.792   6.514   6.475
  627    HA   SER  80           HA       SER  80   5.363   5.713   4.890
  628   1HB   SER  80          1HB       SER  80   6.450   7.734   2.934
  629   2HB   SER  80          2HB       SER  80   4.841   7.013   2.984
  630    HG   SER  80           HG       SER  80   4.241   8.465   4.386
  631    H    MET  81           H        MET  81   8.060   6.803   2.836
  632    HA   MET  81           HA       MET  81   8.832   4.018   2.392
  633   1HB   MET  81          1HB       MET  81   8.462   5.878   0.055
  634   2HB   MET  81          2HB       MET  81   8.701   4.136   0.034
  635   1HG   MET  81          1HG       MET  81   6.485   4.128  -0.329
  636   2HG   MET  81          2HG       MET  81   6.424   4.244   1.429
  637   1HE   MET  81          1HE       MET  81   3.576   6.558   1.144
  638   2HE   MET  81          2HE       MET  81   3.687   5.400  -0.181
  639   3HE   MET  81          3HE       MET  81   4.182   4.929   1.446
  640    H    LYS  82           H        LYS  82  10.699   4.350   0.437
  641    HA   LYS  82           HA       LYS  82  12.799   5.709   1.883
  642   1HB   LYS  82          1HB       LYS  82  12.976   3.443   0.677
  643   2HB   LYS  82          2HB       LYS  82  13.085   4.382  -0.805
  644   1HG   LYS  82          1HG       LYS  82  15.255   4.636  -0.476
  645   2HG   LYS  82          2HG       LYS  82  14.926   5.487   1.036
  646   1HD   LYS  82          1HD       LYS  82  15.222   3.594   2.319
  647   2HD   LYS  82          2HD       LYS  82  14.833   2.503   0.987
  648   1HE   LYS  82          1HE       LYS  82  17.209   4.151   0.532
  649   2HE   LYS  82          2HE       LYS  82  17.351   3.050   1.902
  650   1HZ   LYS  82          1HZ       LYS  82  18.000   2.248  -0.450
  651   2HZ   LYS  82          2HZ       LYS  82  16.334   2.057  -0.675
  652   3HZ   LYS  82          3HZ       LYS  82  17.123   1.212   0.561
  653    H    GLU  83           H        GLU  83  12.958   7.847   1.671
  654    HA   GLU  83           HA       GLU  83  11.986   9.336  -0.513
  655   1HB   GLU  83          1HB       GLU  83  13.866   9.978   1.745
  656   2HB   GLU  83          2HB       GLU  83  13.508  11.159   0.494
  657   1HG   GLU  83          1HG       GLU  83  11.353  11.452   1.185
  658   2HG   GLU  83          2HG       GLU  83  11.236   9.832   1.870
  659    H    ASP  84           H        ASP  84  15.131   7.958   0.202
  660    HA   ASP  84           HA       ASP  84  16.705   9.309  -1.648
  661   1HB   ASP  84          1HB       ASP  84  17.208   7.386   0.154
  662   2HB   ASP  84          2HB       ASP  84  17.200   6.400  -1.306
  663    H    THR  85           H        THR  85  14.515   6.595  -2.089
  664    HA   THR  85           HA       THR  85  15.117   6.605  -4.970
  665    HB   THR  85           HB       THR  85  13.497   4.459  -3.638
  666    HG1  THR  85           HG1      THR  85  16.328   4.736  -3.646
  667   1HG2  THR  85          1HG2      THR  85  13.452   4.021  -5.877
  668   2HG2  THR  85          2HG2      THR  85  14.972   3.219  -5.481
  669   3HG2  THR  85          3HG2      THR  85  14.985   4.839  -6.178
  670    H    ARG  86           H        ARG  86  13.110   8.123  -3.016
  671    HA   ARG  86           HA       ARG  86  10.529   7.536  -4.027
  672   1HB   ARG  86          1HB       ARG  86  10.694   8.663  -1.928
  673   2HB   ARG  86          2HB       ARG  86  11.661   9.955  -2.625
  674   1HG   ARG  86          1HG       ARG  86   9.714  10.649  -3.968
  675   2HG   ARG  86          2HG       ARG  86   8.755   9.397  -3.177
  676   1HD   ARG  86          1HD       ARG  86   8.588  10.559  -1.246
  677   2HD   ARG  86          2HD       ARG  86  10.216  11.222  -1.383
  678    HE   ARG  86           HE       ARG  86   7.768  12.408  -2.333
  679   1HH1  ARG  86          1HH1      ARG  86  11.235  12.317  -2.634
  680   2HH1  ARG  86          2HH1      ARG  86  11.350  13.912  -3.301
  681   1HH2  ARG  86          1HH2      ARG  86   7.906  14.509  -3.211
  682   2HH2  ARG  86          2HH2      ARG  86   9.455  15.158  -3.628
  683    H    LEU  87           H        LEU  87   9.730   7.949  -5.970
  684    HA   LEU  87           HA       LEU  87  11.059   9.937  -7.663
  685   1HB   LEU  87          1HB       LEU  87  10.011   7.356  -8.125
  686   2HB   LEU  87          2HB       LEU  87   9.009   8.489  -9.030
  687    HG   LEU  87           HG       LEU  87  11.978   8.047  -9.301
  688   1HD1  LEU  87          1HD1      LEU  87  11.170   7.651 -11.713
  689   2HD1  LEU  87          2HD1      LEU  87   9.576   7.448 -10.986
  690   3HD1  LEU  87          3HD1      LEU  87  10.902   6.385 -10.515
  691   1HD2  LEU  87          1HD2      LEU  87  11.702  10.380  -9.531
  692   2HD2  LEU  87          2HD2      LEU  87  10.203  10.191 -10.441
  693   3HD2  LEU  87          3HD2      LEU  87  11.743   9.735 -11.172
  694    H    GLU  88           H        GLU  88   7.721   8.832  -7.037
  695    HA   GLU  88           HA       GLU  88   6.862  11.641  -7.257
  696   1HB   GLU  88          1HB       GLU  88   6.202   9.620  -9.033
  697   2HB   GLU  88          2HB       GLU  88   4.808   9.694  -7.965
  698   1HG   GLU  88          1HG       GLU  88   4.332  11.901  -8.538
  699   2HG   GLU  88          2HG       GLU  88   5.940  12.169  -9.209
  700    H    GLY  89           H        GLY  89   4.501  11.823  -6.357
  701   1HA   GLY  89          1HA       GLY  89   2.943  11.271  -4.676
  702   2HA   GLY  89          2HA       GLY  89   4.072  10.077  -4.053
  703    HA   PRO  90           HA       PRO  90   3.344   9.856  -2.126
  704   1HB   PRO  90          1HB       PRO  90   1.837  10.658  -0.015
  705   2HB   PRO  90          2HB       PRO  90   3.536  10.198   0.138
  706   1HG   PRO  90          1HG       PRO  90   2.321  12.928  -0.038
  707   2HG   PRO  90          2HG       PRO  90   3.616  12.346   1.024
  708   1HD   PRO  90          1HD       PRO  90   4.106  13.780  -1.220
  709   2HD   PRO  90          2HD       PRO  90   5.221  12.536  -0.619
  710    H    TRP  91           H        TRP  91   0.995   9.235  -1.914
  711    HA   TRP  91           HA       TRP  91  -0.841  11.190  -3.084
  712   1HB   TRP  91          1HB       TRP  91  -0.115   8.523  -4.279
  713   2HB   TRP  91          2HB       TRP  91  -1.661   9.294  -4.621
  714    HD1  TRP  91           HD1      TRP  91  -0.572  12.303  -4.894
  715    HE1  TRP  91           HE1      TRP  91   0.785  12.946  -6.984
  716    HE3  TRP  91           HE3      TRP  91   0.943   7.641  -6.344
  717    HZ2  TRP  91           HZ2      TRP  91   2.297  11.649  -8.984
  718    HZ3  TRP  91           HZ3      TRP  91   2.342   7.428  -8.357
  719    HH2  TRP  91           HH2      TRP  91   3.004   9.392  -9.649
  720    H    GLU  92           H        GLU  92  -2.841  11.089  -2.247
  721    HA   GLU  92           HA       GLU  92  -3.507   8.742  -0.593
  722   1HB   GLU  92          1HB       GLU  92  -3.979  11.672  -0.129
  723   2HB   GLU  92          2HB       GLU  92  -4.996  10.466   0.646
  724   1HG   GLU  92          1HG       GLU  92  -3.234   9.611   1.906
  725   2HG   GLU  92          2HG       GLU  92  -2.014  10.352   0.872
  726    H    TYR  93           H        TYR  93  -5.494   7.827  -0.817
  727    HA   TYR  93           HA       TYR  93  -7.471   9.140  -2.528
  728   1HB   TYR  93          1HB       TYR  93  -6.299   6.401  -3.014
  729   2HB   TYR  93          2HB       TYR  93  -7.820   6.931  -3.722
  730    HD1  TYR  93           HD1      TYR  93  -7.843   8.739  -5.398
  731    HD2  TYR  93           HD2      TYR  93  -4.195   7.196  -3.846
  732    HE1  TYR  93           HE1      TYR  93  -6.618   9.777  -7.262
  733    HE2  TYR  93           HE2      TYR  93  -2.960   8.230  -5.705
  734    HH   TYR  93           HH       TYR  93  -4.650   9.984  -8.283
  735    H    GLY  94           H        GLY  94  -9.601   8.052  -2.447
  736   1HA   GLY  94          1HA       GLY  94 -11.238   6.763  -1.381
  737   2HA   GLY  94          2HA       GLY  94 -10.034   6.242  -0.211
  738    H    GLU  95           H        GLU  95 -11.391   6.643   1.547
  739    HA   GLU  95           HA       GLU  95 -12.820   8.984   2.030
  740   1HB   GLU  95          1HB       GLU  95 -13.246   7.055   3.376
  741   2HB   GLU  95          2HB       GLU  95 -11.578   6.995   3.927
  742   1HG   GLU  95          1HG       GLU  95 -11.916   8.513   5.537
  743   2HG   GLU  95          2HG       GLU  95 -12.974   9.499   4.530
  Start of MODEL   19
    1   1H    ALA   2          1H        ALA   2 -14.514  -0.310  19.032
    2    HA   ALA   2           HA       ALA   2 -13.617   1.585  17.697
    3   1HB   ALA   2          1HB       ALA   2 -13.978   3.196  19.529
    4   2HB   ALA   2          2HB       ALA   2 -12.616   2.484  20.395
    5   3HB   ALA   2          3HB       ALA   2 -12.352   3.291  18.849
    6    H    ARG   3           H        ARG   3 -12.356   0.106  16.689
    7    HA   ARG   3           HA       ARG   3  -9.883  -0.697  18.076
    8   1HB   ARG   3          1HB       ARG   3 -11.703  -2.293  16.294
    9   2HB   ARG   3          2HB       ARG   3 -10.006  -2.723  16.469
   10   1HG   ARG   3          1HG       ARG   3 -11.118  -2.330  19.061
   11   2HG   ARG   3          2HG       ARG   3 -12.169  -3.410  18.142
   12   1HD   ARG   3          1HD       ARG   3 -10.551  -5.023  17.927
   13   2HD   ARG   3          2HD       ARG   3  -9.229  -3.864  18.055
   14    HE   ARG   3           HE       ARG   3 -10.560  -5.230  20.214
   15   1HH1  ARG   3          1HH1      ARG   3  -8.620  -2.489  19.297
   16   2HH1  ARG   3          2HH1      ARG   3  -7.975  -2.248  20.886
   17   1HH2  ARG   3          1HH2      ARG   3  -9.718  -4.924  22.311
   18   2HH2  ARG   3          2HH2      ARG   3  -8.599  -3.634  22.600
   19    H    GLN   4           H        GLN   4  -7.990  -0.821  16.820
   20    HA   GLN   4           HA       GLN   4  -8.146   0.656  14.277
   21   1HB   GLN   4          1HB       GLN   4  -6.188   0.710  16.525
   22   2HB   GLN   4          2HB       GLN   4  -5.590   0.999  14.897
   23   1HG   GLN   4          1HG       GLN   4  -7.611   2.692  14.834
   24   2HG   GLN   4          2HG       GLN   4  -7.389   2.648  16.582
   25   1HE2  GLN   4          1HE2      GLN   4  -5.678   3.172  13.541
   26   2HE2  GLN   4          2HE2      GLN   4  -4.523   4.289  14.175
   27    H    VAL   5           H        VAL   5  -6.605   0.081  12.617
   28    HA   VAL   5           HA       VAL   5  -5.662  -2.704  12.814
   29    HB   VAL   5           HB       VAL   5  -6.216  -3.057  10.472
   30   1HG1  VAL   5          1HG1      VAL   5  -8.844  -2.379  10.877
   31   2HG1  VAL   5          2HG1      VAL   5  -8.063  -3.856  11.447
   32   3HG1  VAL   5          3HG1      VAL   5  -8.206  -2.462  12.519
   33   1HG2  VAL   5          1HG2      VAL   5  -7.947  -0.818  10.015
   34   2HG2  VAL   5          2HG2      VAL   5  -6.317  -0.250  10.378
   35   3HG2  VAL   5          3HG2      VAL   5  -6.581  -1.384   9.054
   36    H    ILE   6           H        ILE   6  -3.870  -3.241  11.397
   37    HA   ILE   6           HA       ILE   6  -1.970  -1.053  11.246
   38    HB   ILE   6           HB       ILE   6  -1.528  -3.953  10.536
   39   1HG1  ILE   6          1HG1      ILE   6  -0.323  -3.728  12.909
   40   2HG1  ILE   6          2HG1      ILE   6  -1.585  -2.524  13.148
   41   1HG2  ILE   6          1HG2      ILE   6   0.352  -3.032   9.706
   42   2HG2  ILE   6          2HG2      ILE   6   0.171  -1.556  10.653
   43   3HG2  ILE   6          3HG2      ILE   6   0.849  -3.004  11.398
   44   1HD1  ILE   6          1HD1      ILE   6  -3.275  -4.088  13.044
   45   2HD1  ILE   6          2HD1      ILE   6  -2.285  -5.251  12.162
   46   3HD1  ILE   6          3HD1      ILE   6  -1.992  -4.966  13.877
   47    H    CYS   7           H        CYS   7  -0.813  -0.480   9.367
   48    HA   CYS   7           HA       CYS   7  -2.395  -0.523   6.975
   49   1HB   CYS   7          1HB       CYS   7  -0.797   0.990   6.072
   50   2HB   CYS   7          2HB       CYS   7  -0.974   1.419   7.769
   51    HG   CYS   7           HG       CYS   7   1.638  -0.275   6.354
   52    H    TRP   8           H        TRP   8  -1.639  -1.244   4.889
   53    HA   TRP   8           HA       TRP   8   0.000  -3.675   5.112
   54   1HB   TRP   8          1HB       TRP   8  -2.140  -2.874   3.136
   55   2HB   TRP   8          2HB       TRP   8  -1.103  -4.281   2.914
   56    HD1  TRP   8           HD1      TRP   8  -3.521  -2.943   5.651
   57    HE1  TRP   8           HE1      TRP   8  -4.756  -4.963   6.662
   58    HE3  TRP   8           HE3      TRP   8  -1.241  -6.688   3.022
   59    HZ2  TRP   8           HZ2      TRP   8  -4.762  -7.772   6.382
   60    HZ3  TRP   8           HZ3      TRP   8  -1.919  -9.014   3.453
   61    HH2  TRP   8           HH2      TRP   8  -3.642  -9.542   5.099
   62    H    CYS   9           H        CYS   9   2.024  -3.466   4.441
   63    HA   CYS   9           HA       CYS   9   2.663  -1.446   2.417
   64   1HB   CYS   9          1HB       CYS   9   5.018  -1.811   3.127
   65   2HB   CYS   9          2HB       CYS   9   3.975  -1.284   4.442
   66    HG   CYS   9           HG       CYS   9   4.947  -3.091   5.987
   67    H    PHE  10           H        PHE  10   3.113  -2.004   0.394
   68    HA   PHE  10           HA       PHE  10   4.202  -4.655  -0.175
   69   1HB   PHE  10          1HB       PHE  10   2.528  -5.329  -1.625
   70   2HB   PHE  10          2HB       PHE  10   1.591  -4.500  -0.388
   71    HD1  PHE  10           HD2      PHE  10   1.114  -1.980  -0.828
   72    HD2  PHE  10           HD1      PHE  10   2.234  -4.770  -3.840
   73    HE1  PHE  10           HE2      PHE  10   0.149  -0.507  -2.546
   74    HE2  PHE  10           HE1      PHE  10   1.273  -3.301  -5.564
   75    HZ   PHE  10           HZ       PHE  10   0.227  -1.167  -4.918
   76    H    THR  11           H        THR  11   4.957  -4.835  -2.452
   77    HA   THR  11           HA       THR  11   5.658  -2.226  -3.614
   78    HB   THR  11           HB       THR  11   7.614  -4.519  -3.498
   79    HG1  THR  11           HG1      THR  11   7.287  -3.847  -1.372
   80   1HG2  THR  11          1HG2      THR  11   9.089  -2.287  -3.711
   81   2HG2  THR  11          2HG2      THR  11   7.621  -1.742  -4.522
   82   3HG2  THR  11          3HG2      THR  11   8.475  -3.169  -5.109
   83    H    LEU  12           H        LEU  12   5.226  -2.089  -5.718
   84    HA   LEU  12           HA       LEU  12   4.834  -4.593  -7.222
   85   1HB   LEU  12          1HB       LEU  12   2.754  -3.425  -6.966
   86   2HB   LEU  12          2HB       LEU  12   3.484  -1.915  -7.509
   87    HG   LEU  12           HG       LEU  12   3.597  -2.670  -9.752
   88   1HD1  LEU  12          1HD1      LEU  12   4.323  -4.848  -9.754
   89   2HD1  LEU  12          2HD1      LEU  12   2.631  -5.056 -10.203
   90   3HD1  LEU  12          3HD1      LEU  12   3.146  -5.359  -8.544
   91   1HD2  LEU  12          1HD2      LEU  12   1.443  -1.908  -9.451
   92   2HD2  LEU  12          2HD2      LEU  12   1.021  -3.211  -8.340
   93   3HD2  LEU  12          3HD2      LEU  12   1.157  -3.535 -10.069
   94    H    ASN  13           H        ASN  13   6.325  -4.964  -8.712
   95    HA   ASN  13           HA       ASN  13   7.886  -2.716  -9.761
   96   1HB   ASN  13          1HB       ASN  13   9.556  -4.336 -10.392
   97   2HB   ASN  13          2HB       ASN  13   9.083  -4.652  -8.725
   98   1HD2  ASN  13          1HD2      ASN  13   7.926  -6.501  -8.235
   99   2HD2  ASN  13          2HD2      ASN  13   7.772  -7.817  -9.344
  100    H    ASN  14           H        ASN  14   7.839  -2.131 -11.857
  101    HA   ASN  14           HA       ASN  14   7.007  -1.905 -13.968
  102   1HB   ASN  14          1HB       ASN  14   8.585  -3.815 -14.249
  103   2HB   ASN  14          2HB       ASN  14   7.239  -4.922 -13.991
  104   1HD2  ASN  14          1HD2      ASN  14   8.733  -5.034 -16.275
  105   2HD2  ASN  14          2HD2      ASN  14   7.782  -4.510 -17.620
  106    HA   PRO  15           HA       PRO  15   2.724  -3.172 -12.566
  107   1HB   PRO  15          1HB       PRO  15   1.726  -0.650 -12.454
  108   2HB   PRO  15          2HB       PRO  15   2.540  -1.422 -11.088
  109   1HG   PRO  15          1HG       PRO  15   3.620   0.539 -13.075
  110   2HG   PRO  15          2HG       PRO  15   3.852   0.484 -11.318
  111   1HD   PRO  15          1HD       PRO  15   5.717  -0.417 -13.063
  112   2HD   PRO  15          2HD       PRO  15   5.483  -1.139 -11.458
  113    H    LEU  16           H        LEU  16   0.624  -2.503 -13.657
  114    HA   LEU  16           HA       LEU  16   1.125  -1.889 -16.496
  115   1HB   LEU  16          1HB       LEU  16   0.057  -4.219 -15.366
  116   2HB   LEU  16          2HB       LEU  16  -1.312  -3.359 -16.067
  117    HG   LEU  16           HG       LEU  16  -0.395  -4.992 -17.625
  118   1HD1  LEU  16          1HD1      LEU  16  -0.740  -3.667 -19.405
  119   2HD1  LEU  16          2HD1      LEU  16   0.500  -2.512 -18.919
  120   3HD1  LEU  16          3HD1      LEU  16  -1.104  -2.441 -18.190
  121   1HD2  LEU  16          1HD2      LEU  16   2.028  -4.408 -16.593
  122   2HD2  LEU  16          2HD2      LEU  16   2.086  -3.474 -18.088
  123   3HD2  LEU  16          3HD2      LEU  16   1.786  -5.212 -18.144
  124    H    SER  17           H        SER  17  -0.284  -0.801 -13.709
  125    HA   SER  17           HA       SER  17  -1.559   1.380 -14.901
  126   1HB   SER  17          1HB       SER  17  -3.949   0.581 -14.036
  127   2HB   SER  17          2HB       SER  17  -3.394   0.233 -15.673
  128    HG   SER  17           HG       SER  17  -3.314  -1.493 -13.424
  129    HA   PRO  18           HA       PRO  18  -1.432   2.868 -10.777
  130   1HB   PRO  18          1HB       PRO  18  -3.529   4.591 -10.709
  131   2HB   PRO  18          2HB       PRO  18  -2.040   4.925 -11.600
  132   1HG   PRO  18          1HG       PRO  18  -4.661   3.892 -12.612
  133   2HG   PRO  18          2HG       PRO  18  -3.593   5.118 -13.320
  134   1HD   PRO  18          1HD       PRO  18  -3.660   2.559 -14.203
  135   2HD   PRO  18          2HD       PRO  18  -2.182   3.542 -14.234
  136    H    LEU  19           H        LEU  19  -2.393   2.749  -8.711
  137    HA   LEU  19           HA       LEU  19  -4.196   0.561  -8.367
  138   1HB   LEU  19          1HB       LEU  19  -3.297   2.551  -6.294
  139   2HB   LEU  19          2HB       LEU  19  -3.936   0.933  -6.013
  140    HG   LEU  19           HG       LEU  19  -1.259   1.650  -7.201
  141   1HD1  LEU  19          1HD1      LEU  19  -0.324   0.728  -5.237
  142   2HD1  LEU  19          2HD1      LEU  19  -1.878   0.084  -4.710
  143   3HD1  LEU  19          3HD1      LEU  19  -1.600   1.825  -4.708
  144   1HD2  LEU  19          1HD2      LEU  19  -2.843  -0.829  -7.297
  145   2HD2  LEU  19          2HD2      LEU  19  -1.164  -1.018  -6.790
  146   3HD2  LEU  19          3HD2      LEU  19  -1.538  -0.270  -8.343
  147    H    SER  20           H        SER  20  -6.088   0.832  -6.779
  148    HA   SER  20           HA       SER  20  -7.519   3.350  -7.102
  149   1HB   SER  20          1HB       SER  20  -9.543   2.225  -7.959
  150   2HB   SER  20          2HB       SER  20  -8.187   2.059  -9.075
  151    HG   SER  20           HG       SER  20  -8.980   0.102  -7.177
  152    H    LEU  21           H        LEU  21  -9.366   3.543  -5.698
  153    HA   LEU  21           HA       LEU  21  -8.916   2.497  -3.123
  154   1HB   LEU  21          1HB       LEU  21  -9.988   4.588  -3.280
  155   2HB   LEU  21          2HB       LEU  21 -11.223   3.960  -4.369
  156    HG   LEU  21           HG       LEU  21 -12.099   2.606  -2.450
  157   1HD1  LEU  21          1HD1      LEU  21 -11.149   4.132  -0.302
  158   2HD1  LEU  21          2HD1      LEU  21  -9.724   3.638  -1.215
  159   3HD1  LEU  21          3HD1      LEU  21 -10.857   2.423  -0.624
  160   1HD2  LEU  21          1HD2      LEU  21 -12.173   5.538  -2.725
  161   2HD2  LEU  21          2HD2      LEU  21 -12.762   4.897  -1.191
  162   3HD2  LEU  21          3HD2      LEU  21 -13.488   4.362  -2.708
  163    H    HIS  22           H        HIS  22 -10.197   1.073  -1.864
  164    HA   HIS  22           HA       HIS  22 -11.713  -0.884  -3.463
  165   1HB   HIS  22          1HB       HIS  22  -9.469  -1.573  -2.364
  166   2HB   HIS  22          2HB       HIS  22 -10.376  -1.552  -0.854
  167    HD1  HIS  22           HD1      HIS  22 -10.593  -3.982  -0.339
  168    HD2  HIS  22           HD2      HIS  22 -11.629  -3.106  -4.265
  169    HE1  HIS  22           HE1      HIS  22 -11.516  -6.122  -1.284
  170    H    ASP  23           H        ASP  23 -13.768  -1.246  -2.917
  171    HA   ASP  23           HA       ASP  23 -15.167   0.356  -1.135
  172   1HB   ASP  23          1HB       ASP  23 -15.807  -2.312  -2.376
  173   2HB   ASP  23          2HB       ASP  23 -16.942  -1.501  -1.300
  174    H    SER  24           H        SER  24 -13.332  -2.507  -0.554
  175    HA   SER  24           HA       SER  24 -14.555  -3.084   1.997
  176   1HB   SER  24          1HB       SER  24 -11.919  -4.193   1.057
  177   2HB   SER  24          2HB       SER  24 -13.114  -4.940   2.117
  178    HG   SER  24           HG       SER  24 -14.497  -5.110   0.304
  179    H    MET  25           H        MET  25 -11.586  -1.580   0.819
  180    HA   MET  25           HA       MET  25 -10.547  -1.143   3.468
  181   1HB   MET  25          1HB       MET  25  -8.655  -0.256   2.437
  182   2HB   MET  25          2HB       MET  25  -9.220  -1.438   1.265
  183   1HG   MET  25          1HG       MET  25 -10.100   0.227  -0.146
  184   2HG   MET  25          2HG       MET  25  -9.962   1.463   1.103
  185   1HE   MET  25          1HE       MET  25  -8.124   0.161  -2.142
  186   2HE   MET  25          2HE       MET  25  -6.601  -0.349  -1.413
  187   3HE   MET  25          3HE       MET  25  -8.113  -1.123  -0.933
  188    H    LYS  26           H        LYS  26  -9.658   1.309   3.699
  189    HA   LYS  26           HA       LYS  26 -12.084   2.970   3.635
  190   1HB   LYS  26          1HB       LYS  26 -10.078   2.464   5.646
  191   2HB   LYS  26          2HB       LYS  26 -10.159   4.184   5.289
  192   1HG   LYS  26          1HG       LYS  26 -12.455   4.287   5.867
  193   2HG   LYS  26          2HG       LYS  26 -12.583   2.528   5.935
  194   1HD   LYS  26          1HD       LYS  26 -10.757   2.724   7.771
  195   2HD   LYS  26          2HD       LYS  26 -11.272   4.410   7.860
  196   1HE   LYS  26          1HE       LYS  26 -13.615   3.579   8.178
  197   2HE   LYS  26          2HE       LYS  26 -12.955   1.950   8.307
  198   1HZ   LYS  26          1HZ       LYS  26 -12.332   2.314  10.394
  199   2HZ   LYS  26          2HZ       LYS  26 -13.277   3.716  10.356
  200   3HZ   LYS  26          3HZ       LYS  26 -11.620   3.804  10.027
  201    H    TYR  27           H        TYR  27  -8.605   3.012   3.005
  202    HA   TYR  27           HA       TYR  27  -8.972   5.002   0.951
  203   1HB   TYR  27          1HB       TYR  27  -7.057   6.400   2.062
  204   2HB   TYR  27          2HB       TYR  27  -8.725   6.638   2.572
  205    HD1  TYR  27           HD1      TYR  27  -5.646   4.734   3.457
  206    HD2  TYR  27           HD2      TYR  27  -9.278   6.476   4.827
  207    HE1  TYR  27           HE1      TYR  27  -4.997   4.245   5.779
  208    HE2  TYR  27           HE2      TYR  27  -8.639   5.993   7.153
  209    HH   TYR  27           HH       TYR  27  -6.059   5.610   8.311
  210    H    LEU  28           H        LEU  28  -7.257   5.096  -0.504
  211    HA   LEU  28           HA       LEU  28  -5.217   3.007  -0.128
  212   1HB   LEU  28          1HB       LEU  28  -6.125   2.252  -2.031
  213   2HB   LEU  28          2HB       LEU  28  -6.898   3.796  -2.386
  214    HG   LEU  28           HG       LEU  28  -4.671   4.604  -3.224
  215   1HD1  LEU  28          1HD1      LEU  28  -3.925   1.925  -2.326
  216   2HD1  LEU  28          2HD1      LEU  28  -2.925   3.349  -2.610
  217   3HD1  LEU  28          3HD1      LEU  28  -3.386   2.313  -3.960
  218   1HD2  LEU  28          1HD2      LEU  28  -5.920   2.229  -4.600
  219   2HD2  LEU  28          2HD2      LEU  28  -4.848   3.404  -5.362
  220   3HD2  LEU  28          3HD2      LEU  28  -6.423   3.912  -4.752
  221    H    VAL  29           H        VAL  29  -3.156   3.606  -0.001
  222    HA   VAL  29           HA       VAL  29  -2.396   6.261  -1.030
  223    HB   VAL  29           HB       VAL  29  -1.475   4.966   1.539
  224   1HG1  VAL  29          1HG1      VAL  29  -0.394   7.415   1.631
  225   2HG1  VAL  29          2HG1      VAL  29   0.462   6.007   0.998
  226   3HG1  VAL  29          3HG1      VAL  29  -0.325   7.134  -0.108
  227   1HG2  VAL  29          1HG2      VAL  29  -3.233   6.043   2.386
  228   2HG2  VAL  29          2HG2      VAL  29  -2.362   7.539   2.049
  229   3HG2  VAL  29          3HG2      VAL  29  -3.523   6.912   0.879
  230    H    TYR  30           H        TYR  30  -0.869   6.162  -2.529
  231    HA   TYR  30           HA       TYR  30   1.301   4.243  -2.300
  232   1HB   TYR  30          1HB       TYR  30   0.993   3.216  -4.414
  233   2HB   TYR  30          2HB       TYR  30  -0.578   3.156  -3.623
  234    HD1  TYR  30           HD1      TYR  30   1.374   4.682  -6.327
  235    HD2  TYR  30           HD2      TYR  30  -2.440   4.464  -4.453
  236    HE1  TYR  30           HE1      TYR  30   0.361   5.796  -8.272
  237    HE2  TYR  30           HE2      TYR  30  -3.463   5.576  -6.394
  238    HH   TYR  30           HH       TYR  30  -1.595   6.303  -9.292
  239    H    GLN  31           H        GLN  31   3.121   4.759  -3.608
  240    HA   GLN  31           HA       GLN  31   3.029   7.367  -4.950
  241   1HB   GLN  31          1HB       GLN  31   5.354   6.634  -3.196
  242   2HB   GLN  31          2HB       GLN  31   4.894   8.216  -3.811
  243   1HG   GLN  31          1HG       GLN  31   2.840   8.042  -2.352
  244   2HG   GLN  31          2HG       GLN  31   3.605   6.641  -1.605
  245   1HE2  GLN  31          1HE2      GLN  31   3.798   7.587   0.396
  246   2HE2  GLN  31          2HE2      GLN  31   4.897   8.880   0.721
  247    H    THR  32           H        THR  32   4.818   7.735  -6.425
  248    HA   THR  32           HA       THR  32   5.641   5.241  -7.701
  249    HB   THR  32           HB       THR  32   6.328   7.871  -8.910
  250    HG1  THR  32           HG1      THR  32   4.023   7.704  -9.786
  251   1HG2  THR  32          1HG2      THR  32   6.882   5.814 -10.077
  252   2HG2  THR  32          2HG2      THR  32   5.628   6.684 -10.962
  253   3HG2  THR  32          3HG2      THR  32   5.205   5.280  -9.981
  254    H    GLU  33           H        GLU  33   7.727   4.598  -7.954
  255    HA   GLU  33           HA       GLU  33   9.864   6.376  -7.024
  256   1HB   GLU  33          1HB       GLU  33   9.190   3.659  -5.950
  257   2HB   GLU  33          2HB       GLU  33  10.858   4.215  -5.948
  258   1HG   GLU  33          1HG       GLU  33  10.498   5.357  -4.095
  259   2HG   GLU  33          2HG       GLU  33   9.229   6.286  -4.891
  260    H    GLN  34           H        GLN  34  12.048   5.524  -7.605
  261    HA   GLN  34           HA       GLN  34  11.915   4.096 -10.178
  262   1HB   GLN  34          1HB       GLN  34  12.707   6.582 -10.010
  263   2HB   GLN  34          2HB       GLN  34  14.203   5.875  -9.415
  264   1HG   GLN  34          1HG       GLN  34  14.838   5.630 -11.517
  265   2HG   GLN  34          2HG       GLN  34  13.574   4.414 -11.699
  266   1HE2  GLN  34          1HE2      GLN  34  12.020   4.784 -13.124
  267   2HE2  GLN  34          2HE2      GLN  34  11.696   6.297 -13.891
  268    H    GLY  35           H        GLY  35  13.030   2.255 -10.404
  269   1HA   GLY  35          1HA       GLY  35  15.396   1.697  -8.863
  270   2HA   GLY  35          2HA       GLY  35  14.003   0.754  -8.351
  271    H    GLU  36           H        GLU  36  14.661  -1.242  -9.003
  272    HA   GLU  36           HA       GLU  36  16.066  -1.983 -11.225
  273   1HB   GLU  36          1HB       GLU  36  14.873  -4.176 -11.075
  274   2HB   GLU  36          2HB       GLU  36  15.527  -3.607  -9.546
  275   1HG   GLU  36          1HG       GLU  36  13.191  -2.663  -9.111
  276   2HG   GLU  36          2HG       GLU  36  12.673  -3.692 -10.445
  277    H    ALA  37           H        ALA  37  15.468  -2.853 -13.286
  278    HA   ALA  37           HA       ALA  37  14.380  -2.859 -15.286
  279   1HB   ALA  37          1HB       ALA  37  12.537  -3.814 -13.847
  280   2HB   ALA  37          2HB       ALA  37  11.855  -2.188 -13.796
  281   3HB   ALA  37          3HB       ALA  37  12.022  -3.026 -15.339
  282    H    GLY  38           H        GLY  38  14.042  -1.392 -16.905
  283   1HA   GLY  38          1HA       GLY  38  14.682   1.280 -16.508
  284   2HA   GLY  38          2HA       GLY  38  13.875   0.652 -17.937
  285    H    ASN  39           H        ASN  39  11.633  -0.297 -16.119
  286    HA   ASN  39           HA       ASN  39  10.084   2.134 -16.316
  287   1HB   ASN  39          1HB       ASN  39   9.048  -0.409 -15.106
  288   2HB   ASN  39          2HB       ASN  39   8.191   0.796 -16.063
  289   1HD2  ASN  39          1HD2      ASN  39   9.677   1.067 -18.270
  290   2HD2  ASN  39          2HD2      ASN  39   9.773  -0.426 -19.135
  291    H    ILE  40           H        ILE  40   8.301   1.961 -14.260
  292    HA   ILE  40           HA       ILE  40   9.993   2.464 -11.900
  293    HB   ILE  40           HB       ILE  40   8.022   3.921 -11.158
  294   1HG1  ILE  40          1HG1      ILE  40   7.409   3.682 -14.111
  295   2HG1  ILE  40          2HG1      ILE  40   6.384   3.142 -12.785
  296   1HG2  ILE  40          1HG2      ILE  40  10.236   4.740 -11.942
  297   2HG2  ILE  40          2HG2      ILE  40   9.570   4.849 -13.570
  298   3HG2  ILE  40          3HG2      ILE  40   8.907   5.849 -12.278
  299   1HD1  ILE  40          1HD1      ILE  40   5.405   5.118 -12.764
  300   2HD1  ILE  40          2HD1      ILE  40   6.946   5.878 -12.367
  301   3HD1  ILE  40          3HD1      ILE  40   6.471   5.675 -14.053
  302    H    HIS  41           H        HIS  41   8.805   2.222  -9.793
  303    HA   HIS  41           HA       HIS  41   6.918  -0.039  -9.910
  304   1HB   HIS  41          1HB       HIS  41   7.985  -0.702  -7.664
  305   2HB   HIS  41          2HB       HIS  41   8.901  -1.030  -9.132
  306    HD1  HIS  41           HD1      HIS  41  11.106  -1.006  -7.748
  307    HD2  HIS  41           HD2      HIS  41   9.032   2.594  -7.752
  308    HE1  HIS  41           HE1      HIS  41  12.721   0.702  -6.854
  309    H    PHE  42           H        PHE  42   5.470  -0.225  -8.078
  310    HA   PHE  42           HA       PHE  42   4.829   2.411  -6.944
  311   1HB   PHE  42          1HB       PHE  42   3.151   0.051  -7.722
  312   2HB   PHE  42          2HB       PHE  42   2.560   1.181  -6.507
  313    HD1  PHE  42           HD1      PHE  42   4.555   1.895  -9.554
  314    HD2  PHE  42           HD2      PHE  42   0.804   2.266  -7.576
  315    HE1  PHE  42           HE1      PHE  42   3.765   3.393 -11.339
  316    HE2  PHE  42           HE2      PHE  42   0.008   3.764  -9.358
  317    HZ   PHE  42           HZ       PHE  42   1.489   4.329 -11.244
  318    H    GLN  43           H        GLN  43   4.799   2.722  -4.796
  319    HA   GLN  43           HA       GLN  43   4.752   0.430  -2.993
  320   1HB   GLN  43          1HB       GLN  43   7.136   1.905  -3.628
  321   2HB   GLN  43          2HB       GLN  43   6.723   2.153  -1.936
  322   1HG   GLN  43          1HG       GLN  43   7.052  -0.038  -1.387
  323   2HG   GLN  43          2HG       GLN  43   6.680  -0.616  -3.010
  324   1HE2  GLN  43          1HE2      GLN  43   8.326   0.533  -4.653
  325   2HE2  GLN  43          2HE2      GLN  43   9.982   0.271  -4.235
  326    H    GLY  44           H        GLY  44   3.677   0.827  -1.137
  327   1HA   GLY  44          1HA       GLY  44   3.505   3.316   0.161
  328   2HA   GLY  44          2HA       GLY  44   2.099   3.132  -0.878
  329    H    TYR  45           H        TYR  45   1.040   3.307   1.294
  330    HA   TYR  45           HA       TYR  45   0.852   0.636   2.525
  331   1HB   TYR  45          1HB       TYR  45   0.174   1.877   4.628
  332   2HB   TYR  45          2HB       TYR  45   1.862   2.041   4.157
  333    HD1  TYR  45           HD2      TYR  45   2.716   4.162   3.303
  334    HD2  TYR  45           HD1      TYR  45  -1.338   3.764   4.533
  335    HE1  TYR  45           HE2      TYR  45   2.495   6.612   3.348
  336    HE2  TYR  45           HE1      TYR  45  -1.570   6.212   4.580
  337    HH   TYR  45           HH       TYR  45  -0.466   8.187   3.506
  338    H    ILE  46           H        ILE  46  -1.175  -0.150   2.996
  339    HA   ILE  46           HA       ILE  46  -3.482   1.524   2.300
  340    HB   ILE  46           HB       ILE  46  -3.043  -1.288   1.290
  341   1HG1  ILE  46          1HG1      ILE  46  -3.484   1.175  -0.380
  342   2HG1  ILE  46          2HG1      ILE  46  -1.871   0.726   0.162
  343   1HG2  ILE  46          1HG2      ILE  46  -5.219  -0.622   0.007
  344   2HG2  ILE  46          2HG2      ILE  46  -5.314  -1.244   1.653
  345   3HG2  ILE  46          3HG2      ILE  46  -5.437   0.490   1.358
  346   1HD1  ILE  46          1HD1      ILE  46  -2.256  -1.510  -0.919
  347   2HD1  ILE  46          2HD1      ILE  46  -3.709  -0.815  -1.640
  348   3HD1  ILE  46          3HD1      ILE  46  -2.126  -0.135  -2.016
  349    H    GLU  47           H        GLU  47  -5.041   1.429   3.780
  350    HA   GLU  47           HA       GLU  47  -4.939  -0.740   5.762
  351   1HB   GLU  47          1HB       GLU  47  -6.362   1.906   6.042
  352   2HB   GLU  47          2HB       GLU  47  -6.006   0.742   7.310
  353   1HG   GLU  47          1HG       GLU  47  -3.575   1.169   6.895
  354   2HG   GLU  47          2HG       GLU  47  -4.059   2.483   5.824
  355    H    MET  48           H        MET  48  -6.404  -2.284   5.538
  356    HA   MET  48           HA       MET  48  -8.736  -1.906   3.888
  357   1HB   MET  48          1HB       MET  48  -7.959  -4.300   5.562
  358   2HB   MET  48          2HB       MET  48  -9.157  -4.268   4.275
  359   1HG   MET  48          1HG       MET  48  -6.183  -3.923   4.001
  360   2HG   MET  48          2HG       MET  48  -7.159  -5.283   3.451
  361   1HE   MET  48          1HE       MET  48  -9.669  -4.007   1.758
  362   2HE   MET  48          2HE       MET  48  -8.758  -4.245   0.267
  363   3HE   MET  48          3HE       MET  48  -8.599  -5.399   1.591
  364    H    LYS  49           H        LYS  49 -10.806  -3.105   4.882
  365    HA   LYS  49           HA       LYS  49 -11.980  -1.361   6.670
  366   1HB   LYS  49          1HB       LYS  49 -12.771  -3.631   5.261
  367   2HB   LYS  49          2HB       LYS  49 -13.061  -4.046   6.946
  368   1HG   LYS  49          1HG       LYS  49 -14.632  -2.381   7.227
  369   2HG   LYS  49          2HG       LYS  49 -14.014  -1.427   5.875
  370   1HD   LYS  49          1HD       LYS  49 -16.106  -2.393   5.216
  371   2HD   LYS  49          2HD       LYS  49 -14.818  -3.219   4.336
  372   1HE   LYS  49          1HE       LYS  49 -16.183  -4.962   5.046
  373   2HE   LYS  49          2HE       LYS  49 -14.904  -4.932   6.259
  374   1HZ   LYS  49          1HZ       LYS  49 -17.385  -5.053   6.973
  375   2HZ   LYS  49          2HZ       LYS  49 -17.353  -3.380   6.726
  376   3HZ   LYS  49          3HZ       LYS  49 -16.302  -4.090   7.846
  377    H    LYS  50           H        LYS  50 -10.902  -4.677   7.441
  378    HA   LYS  50           HA       LYS  50  -9.558  -4.021   9.797
  379   1HB   LYS  50          1HB       LYS  50 -12.425  -4.074  10.072
  380   2HB   LYS  50          2HB       LYS  50 -11.708  -5.362  11.032
  381   1HG   LYS  50          1HG       LYS  50 -10.379  -3.816  12.258
  382   2HG   LYS  50          2HG       LYS  50 -10.812  -2.494  11.172
  383   1HD   LYS  50          1HD       LYS  50 -13.108  -3.844  12.390
  384   2HD   LYS  50          2HD       LYS  50 -12.041  -3.048  13.550
  385   1HE   LYS  50          1HE       LYS  50 -12.620  -1.449  11.169
  386   2HE   LYS  50          2HE       LYS  50 -14.044  -1.830  12.137
  387   1HZ   LYS  50          1HZ       LYS  50 -13.446  -0.240  13.533
  388   2HZ   LYS  50          2HZ       LYS  50 -12.041   0.073  12.647
  389   3HZ   LYS  50          3HZ       LYS  50 -12.017  -1.073  13.891
  390    H    ARG  51           H        ARG  51 -11.972  -6.587   9.300
  391    HA   ARG  51           HA       ARG  51  -9.933  -8.594   9.763
  392   1HB   ARG  51          1HB       ARG  51 -12.333  -8.644  10.675
  393   2HB   ARG  51          2HB       ARG  51 -12.810  -9.121   9.051
  394   1HG   ARG  51          1HG       ARG  51 -11.961 -11.203   9.263
  395   2HG   ARG  51          2HG       ARG  51 -10.622 -10.671  10.284
  396   1HD   ARG  51          1HD       ARG  51 -13.444 -10.658  11.296
  397   2HD   ARG  51          2HD       ARG  51 -12.475 -12.130  11.328
  398    HE   ARG  51           HE       ARG  51 -10.904 -10.219  12.505
  399   1HH1  ARG  51          1HH1      ARG  51 -14.076 -11.536  13.075
  400   2HH1  ARG  51          2HH1      ARG  51 -14.018 -11.279  14.787
  401   1HH2  ARG  51          1HH2      ARG  51 -10.815  -9.876  14.758
  402   2HH2  ARG  51          2HH2      ARG  51 -12.163 -10.334  15.743
  403    H    THR  52           H        THR  52  -9.157  -7.385   7.548
  404    HA   THR  52           HA       THR  52 -10.035  -9.126   5.337
  405    HB   THR  52           HB       THR  52  -8.599  -6.512   4.939
  406    HG1  THR  52           HG1      THR  52 -11.378  -6.978   5.315
  407   1HG2  THR  52          1HG2      THR  52  -9.939  -8.527   3.257
  408   2HG2  THR  52          2HG2      THR  52  -8.624  -7.417   2.869
  409   3HG2  THR  52          3HG2      THR  52 -10.293  -6.848   2.851
  410    H    SER  53           H        SER  53  -8.629 -10.683   4.898
  411    HA   SER  53           HA       SER  53  -5.885 -10.525   5.756
  412   1HB   SER  53          1HB       SER  53  -5.857 -12.790   4.394
  413   2HB   SER  53          2HB       SER  53  -6.650 -12.696   5.966
  414    HG   SER  53           HG       SER  53  -7.920 -13.694   4.271
  415    H    LEU  54           H        LEU  54  -4.264 -11.514   4.006
  416    HA   LEU  54           HA       LEU  54  -3.669  -9.501   2.210
  417   1HB   LEU  54          1HB       LEU  54  -2.033 -11.135   2.903
  418   2HB   LEU  54          2HB       LEU  54  -2.933 -12.421   2.102
  419    HG   LEU  54           HG       LEU  54  -2.403 -11.462  -0.072
  420   1HD1  LEU  54          1HD1      LEU  54  -2.326  -9.103   0.662
  421   2HD1  LEU  54          2HD1      LEU  54  -0.934  -9.570  -0.314
  422   3HD1  LEU  54          3HD1      LEU  54  -0.774  -9.423   1.436
  423   1HD2  LEU  54          1HD2      LEU  54  -0.395 -12.380   1.840
  424   2HD2  LEU  54          2HD2      LEU  54   0.278 -11.483   0.479
  425   3HD2  LEU  54          3HD2      LEU  54  -0.718 -12.910   0.190
  426    H    ALA  55           H        ALA  55  -5.777 -12.252   1.828
  427    HA   ALA  55           HA       ALA  55  -5.990 -12.416  -0.930
  428   1HB   ALA  55          1HB       ALA  55  -8.266 -12.753   1.016
  429   2HB   ALA  55          2HB       ALA  55  -8.115 -13.472  -0.589
  430   3HB   ALA  55          3HB       ALA  55  -7.029 -13.972   0.708
  431    H    GLY  56           H        GLY  56  -7.352 -10.070   1.285
  432   1HA   GLY  56          1HA       GLY  56  -9.218  -8.941  -0.553
  433   2HA   GLY  56          2HA       GLY  56  -8.658  -8.205   0.942
  434    H    MET  57           H        MET  57  -5.918  -8.073   0.410
  435    HA   MET  57           HA       MET  57  -5.834  -5.721  -1.201
  436   1HB   MET  57          1HB       MET  57  -3.621  -7.358   0.047
  437   2HB   MET  57          2HB       MET  57  -3.381  -5.806  -0.746
  438   1HG   MET  57          1HG       MET  57  -5.429  -5.822   1.354
  439   2HG   MET  57          2HG       MET  57  -3.786  -6.137   1.905
  440   1HE   MET  57          1HE       MET  57  -4.178  -4.050  -1.323
  441   2HE   MET  57          2HE       MET  57  -5.752  -3.776  -0.577
  442   3HE   MET  57          3HE       MET  57  -4.601  -2.447  -0.721
  443    H    LYS  58           H        LYS  58  -4.456  -8.981  -1.566
  444    HA   LYS  58           HA       LYS  58  -3.187  -8.623  -4.009
  445   1HB   LYS  58          1HB       LYS  58  -3.088 -10.968  -4.176
  446   2HB   LYS  58          2HB       LYS  58  -3.118 -10.645  -2.447
  447   1HG   LYS  58          1HG       LYS  58  -5.490 -11.176  -2.373
  448   2HG   LYS  58          2HG       LYS  58  -5.489 -11.463  -4.114
  449   1HD   LYS  58          1HD       LYS  58  -5.365 -13.560  -2.852
  450   2HD   LYS  58          2HD       LYS  58  -3.916 -13.301  -3.825
  451   1HE   LYS  58          1HE       LYS  58  -2.591 -12.912  -1.991
  452   2HE   LYS  58          2HE       LYS  58  -3.937 -12.341  -1.006
  453   1HZ   LYS  58          1HZ       LYS  58  -3.766 -14.353  -0.070
  454   2HZ   LYS  58          2HZ       LYS  58  -2.931 -15.025  -1.378
  455   3HZ   LYS  58          3HZ       LYS  58  -4.617 -14.897  -1.427
  456    H    LYS  59           H        LYS  59  -6.567  -9.122  -3.281
  457    HA   LYS  59           HA       LYS  59  -7.520  -9.891  -5.783
  458   1HB   LYS  59          1HB       LYS  59  -8.629  -9.146  -3.316
  459   2HB   LYS  59          2HB       LYS  59  -9.337  -8.049  -4.494
  460   1HG   LYS  59          1HG       LYS  59 -10.110  -9.929  -5.817
  461   2HG   LYS  59          2HG       LYS  59  -9.345 -11.055  -4.694
  462   1HD   LYS  59          1HD       LYS  59 -11.035  -9.252  -3.244
  463   2HD   LYS  59          2HD       LYS  59 -11.947  -9.978  -4.569
  464   1HE   LYS  59          1HE       LYS  59 -10.230 -11.748  -2.907
  465   2HE   LYS  59          2HE       LYS  59 -11.734 -11.153  -2.205
  466   1HZ   LYS  59          1HZ       LYS  59 -11.331 -13.154  -4.211
  467   2HZ   LYS  59          2HZ       LYS  59 -12.455 -11.987  -4.694
  468   3HZ   LYS  59          3HZ       LYS  59 -12.693 -12.845  -3.255
  469    H    LEU  60           H        LEU  60  -6.558  -6.752  -4.584
  470    HA   LEU  60           HA       LEU  60  -7.650  -5.324  -6.841
  471   1HB   LEU  60          1HB       LEU  60  -5.911  -4.545  -4.521
  472   2HB   LEU  60          2HB       LEU  60  -6.264  -3.428  -5.837
  473    HG   LEU  60           HG       LEU  60  -8.712  -3.762  -5.295
  474   1HD1  LEU  60          1HD1      LEU  60  -8.644  -4.396  -2.632
  475   2HD1  LEU  60          2HD1      LEU  60  -7.496  -5.539  -3.328
  476   3HD1  LEU  60          3HD1      LEU  60  -9.151  -5.475  -3.932
  477   1HD2  LEU  60          1HD2      LEU  60  -6.757  -2.099  -4.150
  478   2HD2  LEU  60          2HD2      LEU  60  -7.821  -2.595  -2.834
  479   3HD2  LEU  60          3HD2      LEU  60  -8.493  -1.809  -4.264
  480    H    ILE  61           H        ILE  61  -4.488  -6.473  -5.782
  481    HA   ILE  61           HA       ILE  61  -3.502  -6.079  -8.513
  482    HB   ILE  61           HB       ILE  61  -1.949  -5.276  -6.050
  483   1HG1  ILE  61          1HG1      ILE  61  -2.096  -3.073  -7.670
  484   2HG1  ILE  61          2HG1      ILE  61  -3.679  -3.801  -7.917
  485   1HG2  ILE  61          1HG2      ILE  61  -0.708  -4.301  -8.350
  486   2HG2  ILE  61          2HG2      ILE  61  -0.147  -5.607  -7.307
  487   3HG2  ILE  61          3HG2      ILE  61  -1.133  -5.971  -8.723
  488   1HD1  ILE  61          1HD1      ILE  61  -3.193  -3.849  -5.149
  489   2HD1  ILE  61          2HD1      ILE  61  -2.737  -2.246  -5.728
  490   3HD1  ILE  61          3HD1      ILE  61  -4.358  -2.867  -6.038
  491    HA   PRO  62           HA       PRO  62  -2.588 -10.316  -6.878
  492   1HB   PRO  62          1HB       PRO  62  -3.316 -11.596  -9.158
  493   2HB   PRO  62          2HB       PRO  62  -4.468 -11.169  -7.887
  494   1HG   PRO  62          1HG       PRO  62  -3.882  -9.761 -10.464
  495   2HG   PRO  62          2HG       PRO  62  -5.448 -10.093  -9.701
  496   1HD   PRO  62          1HD       PRO  62  -4.235  -7.677  -9.547
  497   2HD   PRO  62          2HD       PRO  62  -5.256  -8.318  -8.243
  498    H    GLY  63           H        GLY  63  -0.372 -10.140  -6.859
  499   1HA   GLY  63          1HA       GLY  63   1.429 -11.343  -8.163
  500   2HA   GLY  63          2HA       GLY  63   0.985 -10.267  -9.479
  501    H    ALA  64           H        ALA  64   1.760  -9.938  -6.011
  502    HA   ALA  64           HA       ALA  64   4.030  -8.270  -6.600
  503   1HB   ALA  64          1HB       ALA  64   2.890  -6.348  -6.659
  504   2HB   ALA  64          2HB       ALA  64   1.443  -7.077  -5.961
  505   3HB   ALA  64          3HB       ALA  64   2.753  -6.536  -4.911
  506    H    HIS  65           H        HIS  65   4.938  -7.350  -4.464
  507    HA   HIS  65           HA       HIS  65   4.896  -9.533  -2.525
  508   1HB   HIS  65          1HB       HIS  65   7.035  -8.499  -3.537
  509   2HB   HIS  65          2HB       HIS  65   6.741  -7.158  -2.434
  510    HD1  HIS  65           HD1      HIS  65   8.086  -7.381  -0.386
  511    HD2  HIS  65           HD2      HIS  65   6.919 -11.086  -1.860
  512    HE1  HIS  65           HE1      HIS  65   9.050  -9.072   1.206
  513    H    PHE  66           H        PHE  66   3.483  -9.369  -0.919
  514    HA   PHE  66           HA       PHE  66   2.932  -6.703   0.204
  515   1HB   PHE  66          1HB       PHE  66   1.222  -9.047  -0.354
  516   2HB   PHE  66          2HB       PHE  66   0.919  -8.240   1.181
  517    HD1  PHE  66           HD1      PHE  66   1.023  -7.774  -2.475
  518    HD2  PHE  66           HD2      PHE  66  -0.167  -6.144   1.272
  519    HE1  PHE  66           HE1      PHE  66  -0.302  -6.062  -3.645
  520    HE2  PHE  66           HE2      PHE  66  -1.495  -4.431   0.109
  521    HZ   PHE  66           HZ       PHE  66  -1.565  -4.388  -2.352
  522    H    GLU  67           H        GLU  67   2.584  -6.573   2.518
  523    HA   GLU  67           HA       GLU  67   3.566  -8.769   4.143
  524   1HB   GLU  67          1HB       GLU  67   5.206  -6.474   3.439
  525   2HB   GLU  67          2HB       GLU  67   4.997  -6.618   5.179
  526   1HG   GLU  67          1HG       GLU  67   5.567  -9.175   4.546
  527   2HG   GLU  67          2HG       GLU  67   6.478  -8.323   3.301
  528    H    LYS  68           H        LYS  68   2.085  -8.933   5.679
  529    HA   LYS  68           HA       LYS  68   0.873  -6.472   6.750
  530   1HB   LYS  68          1HB       LYS  68  -0.803  -8.357   7.641
  531   2HB   LYS  68          2HB       LYS  68  -0.976  -7.605   6.060
  532   1HG   LYS  68          1HG       LYS  68  -1.237  -9.994   5.875
  533   2HG   LYS  68          2HG       LYS  68   0.239  -9.487   5.051
  534   1HD   LYS  68          1HD       LYS  68   1.526 -10.723   6.396
  535   2HD   LYS  68          2HD       LYS  68   0.699 -10.144   7.844
  536   1HE   LYS  68          1HE       LYS  68   0.188 -12.386   7.900
  537   2HE   LYS  68          2HE       LYS  68  -1.207 -11.738   7.039
  538   1HZ   LYS  68          1HZ       LYS  68   0.097 -13.800   6.137
  539   2HZ   LYS  68          2HZ       LYS  68   1.109 -12.618   5.475
  540   3HZ   LYS  68          3HZ       LYS  68  -0.534 -12.644   5.075
  541    H    ARG  69           H        ARG  69   3.400  -8.072   7.499
  542    HA   ARG  69           HA       ARG  69   2.791  -8.869  10.226
  543   1HB   ARG  69          1HB       ARG  69   4.566  -9.843   8.443
  544   2HB   ARG  69          2HB       ARG  69   5.604  -8.722   9.314
  545   1HG   ARG  69          1HG       ARG  69   5.186  -9.831  11.385
  546   2HG   ARG  69          2HG       ARG  69   3.940 -10.841  10.649
  547   1HD   ARG  69          1HD       ARG  69   6.776 -10.867   9.666
  548   2HD   ARG  69          2HD       ARG  69   6.260 -11.868  11.023
  549    HE   ARG  69           HE       ARG  69   4.555 -12.203   8.771
  550   1HH1  ARG  69          1HH1      ARG  69   7.656 -13.100  10.074
  551   2HH1  ARG  69          2HH1      ARG  69   7.741 -14.590   9.193
  552   1HH2  ARG  69          1HH2      ARG  69   4.655 -14.161   7.606
  553   2HH2  ARG  69          2HH2      ARG  69   6.034 -15.192   7.789
  554    H    ARG  70           H        ARG  70   2.912  -5.990   8.992
  555    HA   ARG  70           HA       ARG  70   3.300  -3.907   9.823
  556   1HB   ARG  70          1HB       ARG  70   4.359  -5.142  12.353
  557   2HB   ARG  70          2HB       ARG  70   3.551  -3.594  12.143
  558   1HG   ARG  70          1HG       ARG  70   1.481  -4.891  11.523
  559   2HG   ARG  70          2HG       ARG  70   2.334  -6.338  12.066
  560   1HD   ARG  70          1HD       ARG  70   2.037  -3.912  13.812
  561   2HD   ARG  70          2HD       ARG  70   0.801  -5.168  13.743
  562    HE   ARG  70           HE       ARG  70   3.072  -6.553  14.245
  563   1HH1  ARG  70          1HH1      ARG  70   1.560  -3.799  15.745
  564   2HH1  ARG  70          2HH1      ARG  70   2.169  -4.162  17.326
  565   1HH2  ARG  70          1HH2      ARG  70   3.879  -7.041  16.322
  566   2HH2  ARG  70          2HH2      ARG  70   3.489  -6.006  17.653
  567    H    GLY  71           H        GLY  71   5.021  -3.987   8.157
  568   1HA   GLY  71          1HA       GLY  71   7.681  -4.637   8.647
  569   2HA   GLY  71          2HA       GLY  71   7.145  -3.429   7.489
  570    H    THR  72           H        THR  72   5.849  -1.933   9.782
  571    HA   THR  72           HA       THR  72   7.974  -1.102  11.500
  572    HB   THR  72           HB       THR  72   7.272   1.290  10.041
  573    HG1  THR  72           HG1      THR  72   7.159  -0.013   8.211
  574   1HG2  THR  72          1HG2      THR  72   9.938   1.015   9.740
  575   2HG2  THR  72          2HG2      THR  72   9.665  -0.089  11.088
  576   3HG2  THR  72          3HG2      THR  72   9.181   1.601  11.220
  577    H    GLN  73           H        GLN  73   5.099  -1.878  11.494
  578    HA   GLN  73           HA       GLN  73   3.116  -1.281  12.452
  579   1HB   GLN  73          1HB       GLN  73   5.135  -0.910  14.260
  580   2HB   GLN  73          2HB       GLN  73   4.337   0.657  14.294
  581   1HG   GLN  73          1HG       GLN  73   2.199  -0.975  14.444
  582   2HG   GLN  73          2HG       GLN  73   3.414  -1.962  15.255
  583   1HE2  GLN  73          1HE2      GLN  73   4.606  -0.931  17.019
  584   2HE2  GLN  73          2HE2      GLN  73   3.784   0.217  18.014
  585    H    GLY  74           H        GLY  74   2.214   1.046  13.664
  586   1HA   GLY  74          1HA       GLY  74   1.328   2.553  11.492
  587   2HA   GLY  74          2HA       GLY  74   1.259   3.073  13.169
  588    H    GLU  75           H        GLU  75   4.316   2.725  13.175
  589    HA   GLU  75           HA       GLU  75   4.986   5.414  12.873
  590   1HB   GLU  75          1HB       GLU  75   6.250   3.165  13.834
  591   2HB   GLU  75          2HB       GLU  75   7.215   3.570  12.421
  592   1HG   GLU  75          1HG       GLU  75   7.622   5.784  13.275
  593   2HG   GLU  75          2HG       GLU  75   6.548   5.488  14.641
  594    H    ALA  76           H        ALA  76   4.809   2.861  10.543
  595    HA   ALA  76           HA       ALA  76   6.497   3.900   8.551
  596   1HB   ALA  76          1HB       ALA  76   4.906   1.658   8.837
  597   2HB   ALA  76          2HB       ALA  76   4.177   2.523   7.483
  598   3HB   ALA  76          3HB       ALA  76   5.882   2.077   7.428
  599    H    ARG  77           H        ARG  77   3.502   5.005   9.723
  600    HA   ARG  77           HA       ARG  77   2.380   6.147   7.414
  601   1HB   ARG  77          1HB       ARG  77   1.223   5.855   9.616
  602   2HB   ARG  77          2HB       ARG  77   2.172   7.198  10.239
  603   1HG   ARG  77          1HG       ARG  77   1.123   8.737   8.776
  604   2HG   ARG  77          2HG       ARG  77   0.370   7.438   7.847
  605   1HD   ARG  77          1HD       ARG  77  -1.411   7.558   9.167
  606   2HD   ARG  77          2HD       ARG  77  -0.405   7.086  10.536
  607    HE   ARG  77           HE       ARG  77   0.013   9.780  10.226
  608   1HH1  ARG  77          1HH1      ARG  77  -2.738   7.719  10.779
  609   2HH1  ARG  77          2HH1      ARG  77  -3.623   8.919  11.663
  610   1HH2  ARG  77          1HH2      ARG  77  -1.143  11.367  11.387
  611   2HH2  ARG  77          2HH2      ARG  77  -2.715  10.994  12.007
  612    H    ALA  78           H        ALA  78   5.040   7.107   9.402
  613    HA   ALA  78           HA       ALA  78   5.078   9.825   8.377
  614   1HB   ALA  78          1HB       ALA  78   7.480   9.258   9.741
  615   2HB   ALA  78          2HB       ALA  78   6.104  10.208  10.306
  616   3HB   ALA  78          3HB       ALA  78   6.178   8.478  10.641
  617    H    TYR  79           H        TYR  79   7.639   7.353   8.574
  618    HA   TYR  79           HA       TYR  79   9.226   8.407   6.549
  619   1HB   TYR  79          1HB       TYR  79  10.350   6.850   7.826
  620   2HB   TYR  79          2HB       TYR  79   8.996   5.726   7.843
  621    HD1  TYR  79           HD1      TYR  79  11.066   7.307   5.153
  622    HD2  TYR  79           HD2      TYR  79   9.525   3.721   6.846
  623    HE1  TYR  79           HE1      TYR  79  12.131   6.008   3.356
  624    HE2  TYR  79           HE2      TYR  79  10.586   2.412   5.055
  625    HH   TYR  79           HH       TYR  79  11.542   3.543   2.271
  626    H    SER  80           H        SER  80   6.952   5.669   6.339
  627    HA   SER  80           HA       SER  80   5.812   4.766   4.590
  628   1HB   SER  80          1HB       SER  80   6.201   7.569   3.535
  629   2HB   SER  80          2HB       SER  80   5.261   6.348   2.679
  630    HG   SER  80           HG       SER  80   4.106   7.820   4.182
  631    H    MET  81           H        MET  81   7.636   6.862   2.447
  632    HA   MET  81           HA       MET  81   9.148   4.510   1.516
  633   1HB   MET  81          1HB       MET  81   7.592   6.549   0.017
  634   2HB   MET  81          2HB       MET  81   9.101   6.009  -0.705
  635   1HG   MET  81          1HG       MET  81   7.277   4.703  -1.562
  636   2HG   MET  81          2HG       MET  81   8.318   3.688  -0.567
  637   1HE   MET  81          1HE       MET  81   5.615   6.224  -0.265
  638   2HE   MET  81          2HE       MET  81   4.357   5.057  -0.672
  639   3HE   MET  81          3HE       MET  81   4.521   5.633   0.987
  640    H    LYS  82           H        LYS  82  11.098   5.234   0.141
  641    HA   LYS  82           HA       LYS  82  12.613   7.115   1.763
  642   1HB   LYS  82          1HB       LYS  82  13.238   4.722   0.472
  643   2HB   LYS  82          2HB       LYS  82  14.052   5.958  -0.478
  644   1HG   LYS  82          1HG       LYS  82  15.310   6.696   1.377
  645   2HG   LYS  82          2HG       LYS  82  14.313   5.779   2.509
  646   1HD   LYS  82          1HD       LYS  82  15.145   3.762   0.978
  647   2HD   LYS  82          2HD       LYS  82  16.498   4.866   0.720
  648   1HE   LYS  82          1HE       LYS  82  16.601   5.086   3.249
  649   2HE   LYS  82          2HE       LYS  82  15.502   3.710   3.312
  650   1HZ   LYS  82          1HZ       LYS  82  18.313   3.810   2.514
  651   2HZ   LYS  82          2HZ       LYS  82  17.315   2.697   1.722
  652   3HZ   LYS  82          3HZ       LYS  82  17.484   2.634   3.404
  653    H    GLU  83           H        GLU  83  13.064   9.136   1.175
  654    HA   GLU  83           HA       GLU  83  11.945  10.313  -1.122
  655   1HB   GLU  83          1HB       GLU  83  14.123  11.322   0.715
  656   2HB   GLU  83          2HB       GLU  83  13.312  12.300  -0.500
  657   1HG   GLU  83          1HG       GLU  83  11.713  12.782   0.942
  658   2HG   GLU  83          2HG       GLU  83  11.319  11.071   1.093
  659    H    ASP  84           H        ASP  84  15.128   9.004  -0.451
  660    HA   ASP  84           HA       ASP  84  16.548  10.071  -2.602
  661   1HB   ASP  84          1HB       ASP  84  17.726   8.915  -0.860
  662   2HB   ASP  84          2HB       ASP  84  16.835   7.427  -1.168
  663    H    THR  85           H        THR  85  14.373   7.316  -2.432
  664    HA   THR  85           HA       THR  85  14.764   6.857  -5.313
  665    HB   THR  85           HB       THR  85  13.127   4.830  -4.132
  666    HG1  THR  85           HG1      THR  85  15.420   5.587  -2.673
  667   1HG2  THR  85          1HG2      THR  85  14.915   4.949  -6.108
  668   2HG2  THR  85          2HG2      THR  85  14.499   3.435  -5.304
  669   3HG2  THR  85          3HG2      THR  85  15.961   4.307  -4.842
  670    H    ARG  86           H        ARG  86  12.888   8.679  -3.499
  671    HA   ARG  86           HA       ARG  86  10.263   7.907  -4.364
  672   1HB   ARG  86          1HB       ARG  86  10.815   9.200  -2.251
  673   2HB   ARG  86          2HB       ARG  86  11.096  10.597  -3.282
  674   1HG   ARG  86          1HG       ARG  86   8.893  10.914  -3.691
  675   2HG   ARG  86          2HG       ARG  86   8.518   9.191  -3.619
  676   1HD   ARG  86          1HD       ARG  86   7.516   9.919  -1.691
  677   2HD   ARG  86          2HD       ARG  86   9.115   9.492  -1.082
  678    HE   ARG  86           HE       ARG  86   9.406  11.680  -0.531
  679   1HH1  ARG  86          1HH1      ARG  86   7.001  11.492  -3.040
  680   2HH1  ARG  86          2HH1      ARG  86   6.659  13.190  -3.020
  681   1HH2  ARG  86          1HH2      ARG  86   8.966  13.917  -0.495
  682   2HH2  ARG  86          2HH2      ARG  86   7.778  14.569  -1.573
  683    H    LEU  87           H        LEU  87   9.422   8.260  -6.301
  684    HA   LEU  87           HA       LEU  87  10.666  10.256  -8.050
  685   1HB   LEU  87          1HB       LEU  87   9.529   7.641  -8.437
  686   2HB   LEU  87          2HB       LEU  87   8.737   8.817  -9.484
  687    HG   LEU  87           HG       LEU  87  11.682   8.170  -9.398
  688   1HD1  LEU  87          1HD1      LEU  87  10.770   6.465 -10.626
  689   2HD1  LEU  87          2HD1      LEU  87  11.029   7.670 -11.886
  690   3HD1  LEU  87          3HD1      LEU  87   9.421   7.448 -11.197
  691   1HD2  LEU  87          1HD2      LEU  87  11.532  10.490  -9.840
  692   2HD2  LEU  87          2HD2      LEU  87  10.146  10.271 -10.909
  693   3HD2  LEU  87          3HD2      LEU  87  11.741   9.702 -11.404
  694    H    GLU  88           H        GLU  88   7.379   9.046  -7.356
  695    HA   GLU  88           HA       GLU  88   6.414  11.815  -7.632
  696   1HB   GLU  88          1HB       GLU  88   5.808   9.743  -9.355
  697   2HB   GLU  88          2HB       GLU  88   4.434   9.757  -8.258
  698   1HG   GLU  88          1HG       GLU  88   3.928  11.137 -10.137
  699   2HG   GLU  88          2HG       GLU  88   4.140  12.168  -8.723
  700    H    GLY  89           H        GLY  89   4.066  11.939  -6.695
  701   1HA   GLY  89          1HA       GLY  89   2.557  11.396  -4.972
  702   2HA   GLY  89          2HA       GLY  89   3.718  10.233  -4.352
  703    HA   PRO  90           HA       PRO  90   3.034  10.026  -2.409
  704   1HB   PRO  90          1HB       PRO  90   1.551  10.829  -0.281
  705   2HB   PRO  90          2HB       PRO  90   3.262  10.405  -0.154
  706   1HG   PRO  90          1HG       PRO  90   1.989  13.108  -0.346
  707   2HG   PRO  90          2HG       PRO  90   3.315  12.568   0.699
  708   1HD   PRO  90          1HD       PRO  90   3.734  13.977  -1.575
  709   2HD   PRO  90          2HD       PRO  90   4.884  12.764  -0.978
  710    H    TRP  91           H        TRP  91   0.723   9.339  -2.194
  711    HA   TRP  91           HA       TRP  91  -1.193  11.247  -3.313
  712   1HB   TRP  91          1HB       TRP  91  -0.405   8.616  -4.549
  713   2HB   TRP  91          2HB       TRP  91  -1.976   9.349  -4.863
  714    HD1  TRP  91           HD1      TRP  91  -0.959  12.391  -5.106
  715    HE1  TRP  91           HE1      TRP  91   0.350  13.093  -7.208
  716    HE3  TRP  91           HE3      TRP  91   0.635   7.784  -6.647
  717    HZ2  TRP  91           HZ2      TRP  91   1.859  11.858  -9.249
  718    HZ3  TRP  91           HZ3      TRP  91   2.007   7.632  -8.684
  719    HH2  TRP  91           HH2      TRP  91   2.605   9.628  -9.957
  720    H    GLU  92           H        GLU  92  -3.244  10.993  -2.579
  721    HA   GLU  92           HA       GLU  92  -3.752   8.673  -0.834
  722   1HB   GLU  92          1HB       GLU  92  -4.803  11.492  -0.538
  723   2HB   GLU  92          2HB       GLU  92  -5.214  10.137   0.503
  724   1HG   GLU  92          1HG       GLU  92  -2.758   9.956   1.037
  725   2HG   GLU  92          2HG       GLU  92  -2.556  11.501   0.212
  726    H    TYR  93           H        TYR  93  -5.818   7.758  -0.853
  727    HA   TYR  93           HA       TYR  93  -7.704   8.731  -2.869
  728   1HB   TYR  93          1HB       TYR  93  -6.451   5.995  -2.796
  729   2HB   TYR  93          2HB       TYR  93  -8.016   6.267  -3.554
  730    HD1  TYR  93           HD2      TYR  93  -4.489   7.469  -3.624
  731    HD2  TYR  93           HD1      TYR  93  -8.121   6.946  -5.778
  732    HE1  TYR  93           HE2      TYR  93  -3.358   8.173  -5.692
  733    HE2  TYR  93           HE1      TYR  93  -7.000   7.647  -7.851
  734    HH   TYR  93           HH       TYR  93  -5.056   8.933  -8.549
  735    H    GLY  94           H        GLY  94  -9.841   7.630  -2.700
  736   1HA   GLY  94          1HA       GLY  94 -11.673   7.014  -1.463
  737   2HA   GLY  94          2HA       GLY  94 -10.569   6.041  -0.503
  738    H    GLU  95           H        GLU  95 -11.400   6.472   1.495
  739    HA   GLU  95           HA       GLU  95 -11.787   7.600   3.432
  740   1HB   GLU  95          1HB       GLU  95  -9.510   8.198   3.482
  741   2HB   GLU  95          2HB       GLU  95  -9.689   9.331   2.150
  742   1HG   GLU  95          1HG       GLU  95 -10.698  10.943   3.495
  743   2HG   GLU  95          2HG       GLU  95 -11.081   9.777   4.761
  Start of MODEL   20
    1   1H    ALA   2          1H        ALA   2 -13.670   1.744  20.134
    2    HA   ALA   2           HA       ALA   2 -14.027  -0.089  17.852
    3   1HB   ALA   2          1HB       ALA   2 -14.457   2.510  17.667
    4   2HB   ALA   2          2HB       ALA   2 -12.703   2.545  17.474
    5   3HB   ALA   2          3HB       ALA   2 -13.695   1.605  16.359
    6    H    ARG   3           H        ARG   3 -12.106  -0.678  16.677
    7    HA   ARG   3           HA       ARG   3  -9.641  -0.471  18.276
    8   1HB   ARG   3          1HB       ARG   3 -10.849  -2.864  16.913
    9   2HB   ARG   3          2HB       ARG   3  -9.126  -2.786  17.256
   10   1HG   ARG   3          1HG       ARG   3  -9.881  -2.258  19.676
   11   2HG   ARG   3          2HG       ARG   3 -11.424  -2.939  19.155
   12   1HD   ARG   3          1HD       ARG   3  -8.836  -4.395  18.725
   13   2HD   ARG   3          2HD       ARG   3  -9.716  -4.511  20.248
   14    HE   ARG   3           HE       ARG   3 -11.554  -5.068  18.276
   15   1HH1  ARG   3          1HH1      ARG   3  -8.523  -6.396  19.358
   16   2HH1  ARG   3          2HH1      ARG   3  -8.911  -8.014  18.875
   17   1HH2  ARG   3          1HH2      ARG   3 -12.076  -7.194  17.636
   18   2HH2  ARG   3          2HH2      ARG   3 -10.931  -8.467  17.895
   19    H    GLN   4           H        GLN   4  -7.771  -0.050  17.195
   20    HA   GLN   4           HA       GLN   4  -8.020   0.912  14.489
   21   1HB   GLN   4          1HB       GLN   4  -5.772   1.733  14.755
   22   2HB   GLN   4          2HB       GLN   4  -6.678   2.096  16.218
   23   1HG   GLN   4          1HG       GLN   4  -5.663   0.112  17.288
   24   2HG   GLN   4          2HG       GLN   4  -4.687  -0.128  15.840
   25   1HE2  GLN   4          1HE2      GLN   4  -2.814   0.916  15.674
   26   2HE2  GLN   4          2HE2      GLN   4  -2.264   2.156  16.744
   27    H    VAL   5           H        VAL   5  -6.535   0.284  12.771
   28    HA   VAL   5           HA       VAL   5  -5.729  -2.547  12.957
   29    HB   VAL   5           HB       VAL   5  -6.321  -2.862  10.628
   30   1HG1  VAL   5          1HG1      VAL   5  -8.454  -3.317  11.126
   31   2HG1  VAL   5          2HG1      VAL   5  -8.096  -2.616  12.706
   32   3HG1  VAL   5          3HG1      VAL   5  -8.834  -1.625  11.447
   33   1HG2  VAL   5          1HG2      VAL   5  -7.881  -0.615  10.002
   34   2HG2  VAL   5          2HG2      VAL   5  -6.347   0.009  10.608
   35   3HG2  VAL   5          3HG2      VAL   5  -6.366  -1.117   9.251
   36    H    ILE   6           H        ILE   6  -3.980  -3.183  11.524
   37    HA   ILE   6           HA       ILE   6  -1.945  -1.118  11.389
   38    HB   ILE   6           HB       ILE   6  -1.647  -4.012  10.600
   39   1HG1  ILE   6          1HG1      ILE   6  -0.521  -3.851  13.070
   40   2HG1  ILE   6          2HG1      ILE   6  -1.884  -2.753  13.261
   41   1HG2  ILE   6          1HG2      ILE   6   0.278  -1.819  11.322
   42   2HG2  ILE   6          2HG2      ILE   6   0.735  -3.521  11.311
   43   3HG2  ILE   6          3HG2      ILE   6   0.186  -2.747   9.825
   44   1HD1  ILE   6          1HD1      ILE   6  -3.135  -4.820  12.111
   45   2HD1  ILE   6          2HD1      ILE   6  -1.835  -5.677  12.940
   46   3HD1  ILE   6          3HD1      ILE   6  -2.936  -4.647  13.855
   47    H    CYS   7           H        CYS   7  -0.772  -0.584   9.515
   48    HA   CYS   7           HA       CYS   7  -2.358  -0.543   7.121
   49   1HB   CYS   7          1HB       CYS   7  -0.725   0.937   6.241
   50   2HB   CYS   7          2HB       CYS   7  -0.871   1.343   7.947
   51    HG   CYS   7           HG       CYS   7   1.636  -0.572   6.616
   52    H    TRP   8           H        TRP   8  -1.637  -1.282   5.036
   53    HA   TRP   8           HA       TRP   8  -0.050  -3.750   5.240
   54   1HB   TRP   8          1HB       TRP   8  -2.177  -2.905   3.266
   55   2HB   TRP   8          2HB       TRP   8  -1.190  -4.351   3.073
   56    HD1  TRP   8           HD1      TRP   8  -3.562  -2.877   5.780
   57    HE1  TRP   8           HE1      TRP   8  -4.869  -4.832   6.826
   58    HE3  TRP   8           HE3      TRP   8  -1.414  -6.749   3.225
   59    HZ2  TRP   8           HZ2      TRP   8  -4.974  -7.644   6.599
   60    HZ3  TRP   8           HZ3      TRP   8  -2.174  -9.041   3.699
   61    HH2  TRP   8           HH2      TRP   8  -3.917  -9.477   5.352
   62    H    CYS   9           H        CYS   9   1.973  -3.570   4.558
   63    HA   CYS   9           HA       CYS   9   2.631  -1.565   2.526
   64   1HB   CYS   9          1HB       CYS   9   4.990  -1.996   3.210
   65   2HB   CYS   9          2HB       CYS   9   3.973  -1.425   4.528
   66    HG   CYS   9           HG       CYS   9   5.936  -3.521   5.174
   67    H    PHE  10           H        PHE  10   2.954  -2.149   0.491
   68    HA   PHE  10           HA       PHE  10   4.015  -4.813  -0.095
   69   1HB   PHE  10          1HB       PHE  10   2.318  -5.418  -1.577
   70   2HB   PHE  10          2HB       PHE  10   1.427  -4.670  -0.256
   71    HD1  PHE  10           HD2      PHE  10   0.927  -2.128  -0.528
   72    HD2  PHE  10           HD1      PHE  10   1.923  -4.737  -3.740
   73    HE1  PHE  10           HE2      PHE  10  -0.113  -0.564  -2.117
   74    HE2  PHE  10           HE1      PHE  10   0.884  -3.177  -5.334
   75    HZ   PHE  10           HZ       PHE  10  -0.137  -1.087  -4.523
   76    H    THR  11           H        THR  11   4.725  -5.006  -2.386
   77    HA   THR  11           HA       THR  11   5.509  -2.403  -3.519
   78    HB   THR  11           HB       THR  11   7.356  -4.743  -3.763
   79    HG1  THR  11           HG1      THR  11   8.395  -3.932  -1.813
   80   1HG2  THR  11          1HG2      THR  11   7.364  -2.013  -4.511
   81   2HG2  THR  11          2HG2      THR  11   8.644  -3.206  -4.733
   82   3HG2  THR  11          3HG2      THR  11   8.601  -2.219  -3.272
   83    H    LEU  12           H        LEU  12   4.820  -2.171  -5.535
   84    HA   LEU  12           HA       LEU  12   4.253  -4.586  -7.117
   85   1HB   LEU  12          1HB       LEU  12   2.285  -3.272  -6.739
   86   2HB   LEU  12          2HB       LEU  12   3.109  -1.804  -7.261
   87    HG   LEU  12           HG       LEU  12   3.049  -2.455  -9.527
   88   1HD1  LEU  12          1HD1      LEU  12   1.918  -4.785 -10.002
   89   2HD1  LEU  12          2HD1      LEU  12   2.575  -5.171  -8.412
   90   3HD1  LEU  12          3HD1      LEU  12   3.652  -4.651  -9.708
   91   1HD2  LEU  12          1HD2      LEU  12   0.520  -3.307  -9.654
   92   2HD2  LEU  12          2HD2      LEU  12   0.951  -1.645  -9.251
   93   3HD2  LEU  12          3HD2      LEU  12   0.557  -2.790  -7.968
   94    H    ASN  13           H        ASN  13   5.648  -5.029  -8.679
   95    HA   ASN  13           HA       ASN  13   7.310  -2.866  -9.759
   96   1HB   ASN  13          1HB       ASN  13   8.639  -4.853 -10.709
   97   2HB   ASN  13          2HB       ASN  13   8.703  -4.589  -8.969
   98   1HD2  ASN  13          1HD2      ASN  13   7.970  -6.132  -7.621
   99   2HD2  ASN  13          2HD2      ASN  13   7.309  -7.643  -8.136
  100    H    ASN  14           H        ASN  14   7.290  -2.318 -11.879
  101    HA   ASN  14           HA       ASN  14   6.389  -2.024 -13.955
  102   1HB   ASN  14          1HB       ASN  14   6.208  -5.022 -14.133
  103   2HB   ASN  14          2HB       ASN  14   6.611  -3.866 -15.400
  104   1HD2  ASN  14          1HD2      ASN  14   7.801  -5.960 -13.043
  105   2HD2  ASN  14          2HD2      ASN  14   9.470  -5.524 -13.142
  106    HA   PRO  15           HA       PRO  15   2.076  -2.987 -12.386
  107   1HB   PRO  15          1HB       PRO  15   1.283  -0.400 -12.162
  108   2HB   PRO  15          2HB       PRO  15   2.085  -1.276 -10.853
  109   1HG   PRO  15          1HG       PRO  15   3.239   0.659 -12.824
  110   2HG   PRO  15          2HG       PRO  15   3.533   0.530 -11.080
  111   1HD   PRO  15          1HD       PRO  15   5.254  -0.455 -12.924
  112   2HD   PRO  15          2HD       PRO  15   5.025  -1.208 -11.333
  113    H    LEU  16           H        LEU  16   0.330  -3.097 -13.714
  114    HA   LEU  16           HA       LEU  16   0.671  -2.143 -16.435
  115   1HB   LEU  16          1HB       LEU  16  -1.319  -3.953 -15.098
  116   2HB   LEU  16          2HB       LEU  16  -1.519  -3.407 -16.762
  117    HG   LEU  16           HG       LEU  16   0.951  -4.414 -16.946
  118   1HD1  LEU  16          1HD1      LEU  16  -0.312  -5.728 -14.581
  119   2HD1  LEU  16          2HD1      LEU  16   1.363  -5.238 -14.835
  120   3HD1  LEU  16          3HD1      LEU  16   0.728  -6.663 -15.657
  121   1HD2  LEU  16          1HD2      LEU  16  -1.105  -6.510 -17.026
  122   2HD2  LEU  16          2HD2      LEU  16  -0.024  -5.927 -18.292
  123   3HD2  LEU  16          3HD2      LEU  16  -1.503  -5.040 -17.916
  124    H    SER  17           H        SER  17  -0.580  -0.884 -13.655
  125    HA   SER  17           HA       SER  17  -1.730   1.351 -14.874
  126   1HB   SER  17          1HB       SER  17  -4.146   0.732 -13.908
  127   2HB   SER  17          2HB       SER  17  -3.672   0.345 -15.561
  128    HG   SER  17           HG       SER  17  -4.574  -1.355 -13.936
  129    HA   PRO  18           HA       PRO  18  -1.383   2.932 -10.798
  130   1HB   PRO  18          1HB       PRO  18  -3.346   4.806 -10.726
  131   2HB   PRO  18          2HB       PRO  18  -1.860   5.006 -11.663
  132   1HG   PRO  18          1HG       PRO  18  -4.576   4.143 -12.580
  133   2HG   PRO  18          2HG       PRO  18  -3.441   5.268 -13.349
  134   1HD   PRO  18          1HD       PRO  18  -3.719   2.699 -14.158
  135   2HD   PRO  18          2HD       PRO  18  -2.174   3.568 -14.253
  136    H    LEU  19           H        LEU  19  -2.286   2.926  -8.707
  137    HA   LEU  19           HA       LEU  19  -4.191   0.872  -8.228
  138   1HB   LEU  19          1HB       LEU  19  -3.222   2.951  -6.277
  139   2HB   LEU  19          2HB       LEU  19  -3.905   1.370  -5.902
  140    HG   LEU  19           HG       LEU  19  -1.213   1.943  -7.134
  141   1HD1  LEU  19          1HD1      LEU  19  -0.283   1.391  -5.125
  142   2HD1  LEU  19          2HD1      LEU  19  -1.644   0.378  -4.644
  143   3HD1  LEU  19          3HD1      LEU  19  -1.782   2.134  -4.568
  144   1HD2  LEU  19          1HD2      LEU  19  -1.151  -0.684  -6.612
  145   2HD2  LEU  19          2HD2      LEU  19  -1.603  -0.023  -8.184
  146   3HD2  LEU  19          3HD2      LEU  19  -2.853  -0.513  -7.040
  147    H    SER  20           H        SER  20  -6.123   1.219  -6.797
  148    HA   SER  20           HA       SER  20  -7.435   3.797  -7.094
  149   1HB   SER  20          1HB       SER  20  -8.496   1.253  -8.334
  150   2HB   SER  20          2HB       SER  20  -9.498   2.674  -8.037
  151    HG   SER  20           HG       SER  20  -8.028   2.222 -10.136
  152    H    LEU  21           H        LEU  21  -9.178   4.106  -5.672
  153    HA   LEU  21           HA       LEU  21  -8.978   2.984  -3.163
  154   1HB   LEU  21          1HB       LEU  21 -10.131   5.030  -3.404
  155   2HB   LEU  21          2HB       LEU  21 -11.277   4.334  -4.548
  156    HG   LEU  21           HG       LEU  21 -12.193   2.959  -2.669
  157   1HD1  LEU  21          1HD1      LEU  21 -11.389   4.543  -0.490
  158   2HD1  LEU  21          2HD1      LEU  21  -9.917   4.050  -1.327
  159   3HD1  LEU  21          3HD1      LEU  21 -11.063   2.832  -0.768
  160   1HD2  LEU  21          1HD2      LEU  21 -13.562   4.734  -3.139
  161   2HD2  LEU  21          2HD2      LEU  21 -12.315   5.932  -2.793
  162   3HD2  LEU  21          3HD2      LEU  21 -13.132   5.101  -1.468
  163    H    HIS  22           H        HIS  22 -10.279   1.506  -1.985
  164    HA   HIS  22           HA       HIS  22 -11.662  -0.480  -3.667
  165   1HB   HIS  22          1HB       HIS  22  -9.398  -1.131  -2.600
  166   2HB   HIS  22          2HB       HIS  22 -10.290  -1.180  -1.083
  167    HD1  HIS  22           HD1      HIS  22 -10.447  -3.623  -0.622
  168    HD2  HIS  22           HD2      HIS  22 -11.501  -2.690  -4.531
  169    HE1  HIS  22           HE1      HIS  22 -11.303  -5.768  -1.617
  170    H    ASP  23           H        ASP  23 -13.706  -0.920  -3.146
  171    HA   ASP  23           HA       ASP  23 -15.154   0.556  -1.291
  172   1HB   ASP  23          1HB       ASP  23 -15.662  -1.886  -2.900
  173   2HB   ASP  23          2HB       ASP  23 -16.742  -1.599  -1.539
  174    H    SER  24           H        SER  24 -13.237  -2.276  -0.849
  175    HA   SER  24           HA       SER  24 -14.448  -2.992   1.680
  176   1HB   SER  24          1HB       SER  24 -11.817  -4.051   0.674
  177   2HB   SER  24          2HB       SER  24 -13.014  -4.853   1.691
  178    HG   SER  24           HG       SER  24 -13.342  -5.714  -0.275
  179    H    MET  25           H        MET  25 -11.492  -1.433   0.537
  180    HA   MET  25           HA       MET  25 -10.389  -1.133   3.169
  181   1HB   MET  25          1HB       MET  25  -8.560  -0.123   2.141
  182   2HB   MET  25          2HB       MET  25  -9.142  -1.227   0.902
  183   1HG   MET  25          1HG       MET  25 -10.187   0.552  -0.293
  184   2HG   MET  25          2HG       MET  25  -9.867   1.687   1.016
  185   1HE   MET  25          1HE       MET  25  -8.177  -1.053  -0.789
  186   2HE   MET  25          2HE       MET  25  -7.682  -0.121  -2.201
  187   3HE   MET  25          3HE       MET  25  -6.500  -0.532  -0.958
  188    H    LYS  26           H        LYS  26  -9.535   1.342   3.500
  189    HA   LYS  26           HA       LYS  26 -11.940   3.042   3.406
  190   1HB   LYS  26          1HB       LYS  26 -10.554   2.048   5.692
  191   2HB   LYS  26          2HB       LYS  26 -10.304   3.787   5.617
  192   1HG   LYS  26          1HG       LYS  26 -12.729   4.122   5.497
  193   2HG   LYS  26          2HG       LYS  26 -12.965   2.376   5.607
  194   1HD   LYS  26          1HD       LYS  26 -11.833   2.388   7.797
  195   2HD   LYS  26          2HD       LYS  26 -11.674   4.142   7.687
  196   1HE   LYS  26          1HE       LYS  26 -13.945   4.494   7.955
  197   2HE   LYS  26          2HE       LYS  26 -14.365   2.871   7.412
  198   1HZ   LYS  26          1HZ       LYS  26 -12.816   3.178   9.885
  199   2HZ   LYS  26          2HZ       LYS  26 -13.919   1.973   9.451
  200   3HZ   LYS  26          3HZ       LYS  26 -14.477   3.498   9.924
  201    H    TYR  27           H        TYR  27  -8.416   2.911   3.483
  202    HA   TYR  27           HA       TYR  27  -8.360   5.488   2.080
  203   1HB   TYR  27          1HB       TYR  27  -7.745   5.488   4.659
  204   2HB   TYR  27          2HB       TYR  27  -6.196   4.910   4.054
  205    HD1  TYR  27           HD1      TYR  27  -8.687   7.617   3.389
  206    HD2  TYR  27           HD2      TYR  27  -4.590   6.476   3.505
  207    HE1  TYR  27           HE1      TYR  27  -8.034   9.932   2.873
  208    HE2  TYR  27           HE2      TYR  27  -3.926   8.788   2.991
  209    HH   TYR  27           HH       TYR  27  -6.316  11.380   2.762
  210    H    LEU  28           H        LEU  28  -6.581   5.789   0.686
  211    HA   LEU  28           HA       LEU  28  -4.945   3.397   0.185
  212   1HB   LEU  28          1HB       LEU  28  -6.512   3.252  -1.527
  213   2HB   LEU  28          2HB       LEU  28  -6.580   5.000  -1.742
  214    HG   LEU  28           HG       LEU  28  -4.481   5.008  -2.890
  215   1HD1  LEU  28          1HD1      LEU  28  -2.949   3.538  -2.213
  216   2HD1  LEU  28          2HD1      LEU  28  -3.730   2.395  -3.305
  217   3HD1  LEU  28          3HD1      LEU  28  -4.168   2.422  -1.597
  218   1HD2  LEU  28          1HD2      LEU  28  -6.278   2.784  -3.845
  219   2HD2  LEU  28          2HD2      LEU  28  -4.997   3.519  -4.808
  220   3HD2  LEU  28          3HD2      LEU  28  -6.372   4.491  -4.280
  221    H    VAL  29           H        VAL  29  -2.836   3.804   0.112
  222    HA   VAL  29           HA       VAL  29  -1.910   6.463  -0.709
  223    HB   VAL  29           HB       VAL  29  -0.986   5.041   1.792
  224   1HG1  VAL  29          1HG1      VAL  29   0.039   7.466   0.351
  225   2HG1  VAL  29          2HG1      VAL  29   0.316   7.226   2.077
  226   3HG1  VAL  29          3HG1      VAL  29   0.933   6.054   0.912
  227   1HG2  VAL  29          1HG2      VAL  29  -1.757   7.486   2.604
  228   2HG2  VAL  29          2HG2      VAL  29  -2.882   7.243   1.267
  229   3HG2  VAL  29          3HG2      VAL  29  -2.826   6.083   2.595
  230    H    TYR  30           H        TYR  30  -0.435   6.272  -2.249
  231    HA   TYR  30           HA       TYR  30   1.623   4.241  -2.096
  232   1HB   TYR  30          1HB       TYR  30   1.147   3.113  -4.099
  233   2HB   TYR  30          2HB       TYR  30  -0.420   3.251  -3.309
  234    HD1  TYR  30           HD2      TYR  30  -2.091   4.865  -4.145
  235    HD2  TYR  30           HD1      TYR  30   1.598   4.234  -6.169
  236    HE1  TYR  30           HE2      TYR  30  -3.011   5.954  -6.149
  237    HE2  TYR  30           HE1      TYR  30   0.688   5.322  -8.178
  238    HH   TYR  30           HH       TYR  30  -2.632   6.589  -8.237
  239    H    GLN  31           H        GLN  31   3.378   4.618  -3.554
  240    HA   GLN  31           HA       GLN  31   3.334   7.202  -4.941
  241   1HB   GLN  31          1HB       GLN  31   5.703   6.359  -3.288
  242   2HB   GLN  31          2HB       GLN  31   5.351   7.944  -3.965
  243   1HG   GLN  31          1HG       GLN  31   3.334   7.976  -2.413
  244   2HG   GLN  31          2HG       GLN  31   4.084   6.601  -1.605
  245   1HE2  GLN  31          1HE2      GLN  31   5.450   9.553  -3.006
  246   2HE2  GLN  31          2HE2      GLN  31   6.222  10.091  -1.557
  247    H    THR  32           H        THR  32   5.057   7.449  -6.526
  248    HA   THR  32           HA       THR  32   5.725   4.868  -7.744
  249    HB   THR  32           HB       THR  32   5.725   7.653  -8.923
  250    HG1  THR  32           HG1      THR  32   3.878   6.973  -9.949
  251   1HG2  THR  32          1HG2      THR  32   7.470   6.298  -9.953
  252   2HG2  THR  32          2HG2      THR  32   6.129   6.529 -11.076
  253   3HG2  THR  32          3HG2      THR  32   6.316   4.994 -10.229
  254    H    GLU  33           H        GLU  33   7.752   4.138  -7.833
  255    HA   GLU  33           HA       GLU  33   9.938   6.024  -7.244
  256   1HB   GLU  33          1HB       GLU  33   9.333   3.338  -6.115
  257   2HB   GLU  33          2HB       GLU  33  11.023   3.741  -6.387
  258   1HG   GLU  33          1HG       GLU  33  11.092   5.147  -4.657
  259   2HG   GLU  33          2HG       GLU  33   9.519   5.846  -5.038
  260    H    GLN  34           H        GLN  34  12.073   5.304  -8.059
  261    HA   GLN  34           HA       GLN  34  11.757   4.078 -10.706
  262   1HB   GLN  34          1HB       GLN  34  12.963   6.435  -9.974
  263   2HB   GLN  34          2HB       GLN  34  14.333   5.339 -10.094
  264   1HG   GLN  34          1HG       GLN  34  13.268   4.696 -12.379
  265   2HG   GLN  34          2HG       GLN  34  12.441   6.244 -12.212
  266   1HE2  GLN  34          1HE2      GLN  34  15.720   5.131 -11.441
  267   2HE2  GLN  34          2HE2      GLN  34  16.534   6.351 -12.354
  268    H    GLY  35           H        GLY  35  12.898   2.301 -11.324
  269   1HA   GLY  35          1HA       GLY  35  15.232   1.278 -10.308
  270   2HA   GLY  35          2HA       GLY  35  13.979   0.647  -9.249
  271    H    GLU  36           H        GLU  36  15.357  -1.219 -10.474
  272    HA   GLU  36           HA       GLU  36  15.407  -2.852 -12.100
  273   1HB   GLU  36          1HB       GLU  36  13.100  -3.915 -12.339
  274   2HB   GLU  36          2HB       GLU  36  13.754  -3.791 -10.712
  275   1HG   GLU  36          1HG       GLU  36  12.381  -1.829 -10.292
  276   2HG   GLU  36          2HG       GLU  36  11.746  -1.911 -11.934
  277    H    ALA  37           H        ALA  37  16.080  -1.568 -13.885
  278    HA   ALA  37           HA       ALA  37  15.960  -0.869 -16.048
  279   1HB   ALA  37          1HB       ALA  37  14.413  -1.872 -17.485
  280   2HB   ALA  37          2HB       ALA  37  14.621  -3.045 -16.184
  281   3HB   ALA  37          3HB       ALA  37  13.192  -2.013 -16.220
  282    H    GLY  38           H        GLY  38  14.493   0.462 -17.611
  283   1HA   GLY  38          1HA       GLY  38  13.982   2.929 -16.476
  284   2HA   GLY  38          2HA       GLY  38  13.306   2.389 -18.006
  285    H    ASN  39           H        ASN  39  11.900   0.145 -16.623
  286    HA   ASN  39           HA       ASN  39   9.397   1.281 -16.339
  287   1HB   ASN  39          1HB       ASN  39  10.263  -1.187 -14.835
  288   2HB   ASN  39          2HB       ASN  39   8.664  -0.808 -15.468
  289   1HD2  ASN  39          1HD2      ASN  39  11.050  -2.838 -15.910
  290   2HD2  ASN  39          2HD2      ASN  39  11.014  -3.048 -17.624
  291    H    ILE  40           H        ILE  40   8.049   1.107 -14.252
  292    HA   ILE  40           HA       ILE  40   9.594   2.176 -11.983
  293    HB   ILE  40           HB       ILE  40   7.273   3.426 -11.575
  294   1HG1  ILE  40          1HG1      ILE  40   7.514   3.327 -14.590
  295   2HG1  ILE  40          2HG1      ILE  40   6.277   2.497 -13.652
  296   1HG2  ILE  40          1HG2      ILE  40   8.623   5.183 -11.721
  297   2HG2  ILE  40          2HG2      ILE  40   9.845   4.125 -12.424
  298   3HG2  ILE  40          3HG2      ILE  40   8.737   5.010 -13.473
  299   1HD1  ILE  40          1HD1      ILE  40   5.270   4.447 -14.479
  300   2HD1  ILE  40          2HD1      ILE  40   5.612   4.774 -12.779
  301   3HD1  ILE  40          3HD1      ILE  40   6.653   5.447 -14.034
  302    H    HIS  41           H        HIS  41   8.339   2.085  -9.904
  303    HA   HIS  41           HA       HIS  41   6.459  -0.166  -9.815
  304   1HB   HIS  41          1HB       HIS  41   7.713  -0.794  -7.612
  305   2HB   HIS  41          2HB       HIS  41   8.365  -1.321  -9.161
  306    HD1  HIS  41           HD1      HIS  41  10.794  -1.402  -8.431
  307    HD2  HIS  41           HD2      HIS  41   9.015   2.296  -7.785
  308    HE1  HIS  41           HE1      HIS  41  12.676   0.153  -7.829
  309    H    PHE  42           H        PHE  42   5.071  -0.190  -7.982
  310    HA   PHE  42           HA       PHE  42   4.725   2.473  -6.800
  311   1HB   PHE  42          1HB       PHE  42   2.793   0.162  -7.078
  312   2HB   PHE  42          2HB       PHE  42   2.417   1.684  -6.275
  313    HD1  PHE  42           HD1      PHE  42   3.934   3.461  -8.246
  314    HD2  PHE  42           HD2      PHE  42   1.149   0.287  -8.779
  315    HE1  PHE  42           HE1      PHE  42   3.249   4.429 -10.402
  316    HE2  PHE  42           HE2      PHE  42   0.460   1.249 -10.936
  317    HZ   PHE  42           HZ       PHE  42   1.511   3.322 -11.751
  318    H    GLN  43           H        GLN  43   4.914   2.819  -4.668
  319    HA   GLN  43           HA       GLN  43   4.982   0.520  -2.852
  320   1HB   GLN  43          1HB       GLN  43   7.173   2.464  -3.376
  321   2HB   GLN  43          2HB       GLN  43   6.920   1.953  -1.713
  322   1HG   GLN  43          1HG       GLN  43   6.980  -0.225  -3.675
  323   2HG   GLN  43          2HG       GLN  43   8.490   0.669  -3.504
  324   1HE2  GLN  43          1HE2      GLN  43   6.100  -1.260  -1.831
  325   2HE2  GLN  43          2HE2      GLN  43   7.109  -1.707  -0.502
  326    H    GLY  44           H        GLY  44   3.968   0.858  -0.955
  327   1HA   GLY  44          1HA       GLY  44   3.781   3.244   0.460
  328   2HA   GLY  44          2HA       GLY  44   2.387   3.186  -0.608
  329    H    TYR  45           H        TYR  45   1.308   3.243   1.564
  330    HA   TYR  45           HA       TYR  45   0.994   0.495   2.581
  331   1HB   TYR  45          1HB       TYR  45   0.504   1.441   4.793
  332   2HB   TYR  45          2HB       TYR  45   2.111   1.905   4.246
  333    HD1  TYR  45           HD2      TYR  45   2.559   4.221   3.535
  334    HD2  TYR  45           HD1      TYR  45  -1.219   3.079   5.125
  335    HE1  TYR  45           HE2      TYR  45   2.007   6.588   3.909
  336    HE2  TYR  45           HE1      TYR  45  -1.781   5.443   5.502
  337    HH   TYR  45           HH       TYR  45  -1.155   7.557   5.194
  338    H    ILE  46           H        ILE  46  -1.073  -0.227   2.989
  339    HA   ILE  46           HA       ILE  46  -3.285   1.601   2.357
  340    HB   ILE  46           HB       ILE  46  -3.075  -1.231   1.330
  341   1HG1  ILE  46          1HG1      ILE  46  -2.995   1.343  -0.253
  342   2HG1  ILE  46          2HG1      ILE  46  -1.555   0.449   0.221
  343   1HG2  ILE  46          1HG2      ILE  46  -5.251  -1.132   0.899
  344   2HG2  ILE  46          2HG2      ILE  46  -5.317   0.377   1.808
  345   3HG2  ILE  46          3HG2      ILE  46  -5.063   0.410   0.064
  346   1HD1  ILE  46          1HD1      ILE  46  -2.115  -1.374  -1.151
  347   2HD1  ILE  46          2HD1      ILE  46  -3.762  -0.790  -1.386
  348   3HD1  ILE  46          3HD1      ILE  46  -2.409   0.069  -2.121
  349    H    GLU  47           H        GLU  47  -4.944   1.501   3.741
  350    HA   GLU  47           HA       GLU  47  -4.917  -0.651   5.744
  351   1HB   GLU  47          1HB       GLU  47  -6.390   1.966   5.987
  352   2HB   GLU  47          2HB       GLU  47  -5.962   0.838   7.265
  353   1HG   GLU  47          1HG       GLU  47  -3.537   1.563   6.107
  354   2HG   GLU  47          2HG       GLU  47  -4.472   3.055   6.194
  355    H    MET  48           H        MET  48  -6.388  -2.186   5.502
  356    HA   MET  48           HA       MET  48  -8.651  -1.827   3.756
  357   1HB   MET  48          1HB       MET  48  -7.798  -4.164   5.472
  358   2HB   MET  48          2HB       MET  48  -9.149  -4.196   4.346
  359   1HG   MET  48          1HG       MET  48  -6.244  -3.810   3.669
  360   2HG   MET  48          2HG       MET  48  -7.233  -5.231   3.340
  361   1HE   MET  48          1HE       MET  48  -9.954  -4.254   1.715
  362   2HE   MET  48          2HE       MET  48  -9.042  -4.639   0.254
  363   3HE   MET  48          3HE       MET  48  -8.785  -5.575   1.727
  364    H    LYS  49           H        LYS  49 -10.767  -2.996   4.700
  365    HA   LYS  49           HA       LYS  49 -12.007  -1.200   6.384
  366   1HB   LYS  49          1HB       LYS  49 -12.739  -3.526   5.032
  367   2HB   LYS  49          2HB       LYS  49 -13.098  -3.872   6.718
  368   1HG   LYS  49          1HG       LYS  49 -14.653  -2.156   6.872
  369   2HG   LYS  49          2HG       LYS  49 -14.012  -1.319   5.456
  370   1HD   LYS  49          1HD       LYS  49 -15.041  -2.771   3.973
  371   2HD   LYS  49          2HD       LYS  49 -15.183  -4.057   5.173
  372   1HE   LYS  49          1HE       LYS  49 -16.657  -1.477   5.532
  373   2HE   LYS  49          2HE       LYS  49 -17.297  -2.726   4.464
  374   1HZ   LYS  49          1HZ       LYS  49 -16.554  -3.960   6.848
  375   2HZ   LYS  49          2HZ       LYS  49 -18.115  -3.739   6.236
  376   3HZ   LYS  49          3HZ       LYS  49 -17.439  -2.580   7.266
  377    H    LYS  50           H        LYS  50 -11.060  -4.508   7.335
  378    HA   LYS  50           HA       LYS  50  -9.739  -3.798   9.689
  379   1HB   LYS  50          1HB       LYS  50 -12.643  -3.806   9.888
  380   2HB   LYS  50          2HB       LYS  50 -11.904  -4.944  11.007
  381   1HG   LYS  50          1HG       LYS  50 -10.622  -2.312  10.938
  382   2HG   LYS  50          2HG       LYS  50 -12.296  -2.303  11.499
  383   1HD   LYS  50          1HD       LYS  50 -10.449  -4.367  12.590
  384   2HD   LYS  50          2HD       LYS  50 -10.279  -2.705  13.161
  385   1HE   LYS  50          1HE       LYS  50 -12.056  -2.925  14.478
  386   2HE   LYS  50          2HE       LYS  50 -13.050  -3.447  13.119
  387   1HZ   LYS  50          1HZ       LYS  50 -12.958  -5.108  14.888
  388   2HZ   LYS  50          2HZ       LYS  50 -11.279  -5.215  14.719
  389   3HZ   LYS  50          3HZ       LYS  50 -12.288  -5.701  13.452
  390    H    ARG  51           H        ARG  51 -12.263  -6.270   9.285
  391    HA   ARG  51           HA       ARG  51 -10.337  -8.344   9.894
  392   1HB   ARG  51          1HB       ARG  51 -12.779  -8.215  10.716
  393   2HB   ARG  51          2HB       ARG  51 -13.204  -8.802   9.114
  394   1HG   ARG  51          1HG       ARG  51 -11.505 -10.688   9.625
  395   2HG   ARG  51          2HG       ARG  51 -11.725 -10.191  11.304
  396   1HD   ARG  51          1HD       ARG  51 -13.474 -11.585  11.305
  397   2HD   ARG  51          2HD       ARG  51 -14.301 -10.328  10.386
  398    HE   ARG  51           HE       ARG  51 -14.164 -11.643   8.508
  399   1HH1  ARG  51          1HH1      ARG  51 -12.107 -12.943  10.999
  400   2HH1  ARG  51          2HH1      ARG  51 -11.789 -14.418  10.148
  401   1HH2  ARG  51          1HH2      ARG  51 -13.752 -13.582   7.378
  402   2HH2  ARG  51          2HH2      ARG  51 -12.725 -14.780   8.088
  403    H    THR  52           H        THR  52  -9.483  -7.249   7.623
  404    HA   THR  52           HA       THR  52 -10.342  -9.108   5.503
  405    HB   THR  52           HB       THR  52  -8.869  -6.559   4.921
  406    HG1  THR  52           HG1      THR  52 -11.606  -6.886   5.548
  407   1HG2  THR  52          1HG2      THR  52  -9.125  -8.236   3.142
  408   2HG2  THR  52          2HG2      THR  52 -10.012  -6.757   2.773
  409   3HG2  THR  52          3HG2      THR  52 -10.874  -8.182   3.351
  410    H    SER  53           H        SER  53  -8.933 -10.691   5.188
  411    HA   SER  53           HA       SER  53  -6.212 -10.507   6.089
  412   1HB   SER  53          1HB       SER  53  -6.125 -12.817   4.859
  413   2HB   SER  53          2HB       SER  53  -7.057 -12.660   6.348
  414    HG   SER  53           HG       SER  53  -8.045 -13.673   4.338
  415    H    LEU  54           H        LEU  54  -4.553 -11.572   4.412
  416    HA   LEU  54           HA       LEU  54  -3.895  -9.618   2.570
  417   1HB   LEU  54          1HB       LEU  54  -2.289 -11.236   3.363
  418   2HB   LEU  54          2HB       LEU  54  -3.173 -12.544   2.580
  419    HG   LEU  54           HG       LEU  54  -2.612 -11.543   0.381
  420   1HD1  LEU  54          1HD1      LEU  54  -1.132  -9.743   0.152
  421   2HD1  LEU  54          2HD1      LEU  54  -0.664  -9.796   1.851
  422   3HD1  LEU  54          3HD1      LEU  54  -2.270  -9.228   1.397
  423   1HD2  LEU  54          1HD2      LEU  54  -1.224 -13.311   0.952
  424   2HD2  LEU  54          2HD2      LEU  54  -0.481 -12.431   2.288
  425   3HD2  LEU  54          3HD2      LEU  54  -0.081 -12.009   0.622
  426    H    ALA  55           H        ALA  55  -6.013 -12.364   2.225
  427    HA   ALA  55           HA       ALA  55  -6.149 -12.626  -0.532
  428   1HB   ALA  55          1HB       ALA  55  -8.480 -12.880   1.361
  429   2HB   ALA  55          2HB       ALA  55  -8.292 -13.653  -0.213
  430   3HB   ALA  55          3HB       ALA  55  -7.245 -14.118   1.128
  431    H    GLY  56           H        GLY  56  -7.605 -10.221   1.570
  432   1HA   GLY  56          1HA       GLY  56  -9.366  -9.134  -0.400
  433   2HA   GLY  56          2HA       GLY  56  -8.911  -8.376   1.119
  434    H    MET  57           H        MET  57  -6.152  -8.208   0.786
  435    HA   MET  57           HA       MET  57  -5.977  -5.888  -0.865
  436   1HB   MET  57          1HB       MET  57  -3.909  -7.468   0.663
  437   2HB   MET  57          2HB       MET  57  -3.520  -6.018  -0.253
  438   1HG   MET  57          1HG       MET  57  -5.745  -5.749   1.646
  439   2HG   MET  57          2HG       MET  57  -4.163  -6.044   2.363
  440   1HE   MET  57          1HE       MET  57  -4.196  -4.325  -1.083
  441   2HE   MET  57          2HE       MET  57  -5.818  -3.909  -0.529
  442   3HE   MET  57          3HE       MET  57  -4.597  -2.649  -0.709
  443    H    LYS  58           H        LYS  58  -4.559  -9.144  -1.061
  444    HA   LYS  58           HA       LYS  58  -3.082  -8.840  -3.382
  445   1HB   LYS  58          1HB       LYS  58  -3.021 -11.189  -3.527
  446   2HB   LYS  58          2HB       LYS  58  -3.200 -10.851  -1.810
  447   1HG   LYS  58          1HG       LYS  58  -5.557 -11.361  -1.914
  448   2HG   LYS  58          2HG       LYS  58  -5.458 -11.590  -3.661
  449   1HD   LYS  58          1HD       LYS  58  -5.463 -13.728  -2.451
  450   2HD   LYS  58          2HD       LYS  58  -3.963 -13.483  -3.349
  451   1HE   LYS  58          1HE       LYS  58  -4.050 -12.572  -0.524
  452   2HE   LYS  58          2HE       LYS  58  -3.991 -14.309  -0.822
  453   1HZ   LYS  58          1HZ       LYS  58  -1.966 -12.271  -1.306
  454   2HZ   LYS  58          2HZ       LYS  58  -2.075 -13.511  -2.450
  455   3HZ   LYS  58          3HZ       LYS  58  -1.786 -13.884  -0.826
  456    H    LYS  59           H        LYS  59  -6.526  -9.313  -2.975
  457    HA   LYS  59           HA       LYS  59  -7.243 -10.057  -5.559
  458   1HB   LYS  59          1HB       LYS  59  -8.681  -9.831  -3.413
  459   2HB   LYS  59          2HB       LYS  59  -8.915  -8.165  -3.928
  460   1HG   LYS  59          1HG       LYS  59 -10.425  -8.752  -5.447
  461   2HG   LYS  59          2HG       LYS  59  -9.397 -10.038  -6.084
  462   1HD   LYS  59          1HD       LYS  59 -10.137 -11.186  -3.786
  463   2HD   LYS  59          2HD       LYS  59 -11.541 -10.146  -4.041
  464   1HE   LYS  59          1HE       LYS  59 -11.988 -11.140  -6.158
  465   2HE   LYS  59          2HE       LYS  59 -10.449 -11.999  -6.149
  466   1HZ   LYS  59          1HZ       LYS  59 -12.747 -13.108  -5.422
  467   2HZ   LYS  59          2HZ       LYS  59 -12.224 -12.545  -3.915
  468   3HZ   LYS  59          3HZ       LYS  59 -11.249 -13.601  -4.808
  469    H    LEU  60           H        LEU  60  -6.438  -6.911  -4.240
  470    HA   LEU  60           HA       LEU  60  -7.255  -5.496  -6.621
  471   1HB   LEU  60          1HB       LEU  60  -5.831  -4.673  -4.106
  472   2HB   LEU  60          2HB       LEU  60  -6.087  -3.566  -5.453
  473    HG   LEU  60           HG       LEU  60  -8.574  -4.061  -5.168
  474   1HD1  LEU  60          1HD1      LEU  60  -9.103  -5.668  -3.728
  475   2HD1  LEU  60          2HD1      LEU  60  -8.620  -4.567  -2.439
  476   3HD1  LEU  60          3HD1      LEU  60  -7.461  -5.728  -3.086
  477   1HD2  LEU  60          1HD2      LEU  60  -7.929  -2.731  -2.692
  478   2HD2  LEU  60          2HD2      LEU  60  -8.620  -2.073  -4.175
  479   3HD2  LEU  60          3HD2      LEU  60  -6.869  -2.193  -3.995
  480    H    ILE  61           H        ILE  61  -4.249  -6.607  -5.156
  481    HA   ILE  61           HA       ILE  61  -2.823  -5.778  -7.599
  482    HB   ILE  61           HB       ILE  61  -1.349  -6.417  -5.083
  483   1HG1  ILE  61          1HG1      ILE  61  -3.068  -4.871  -4.322
  484   2HG1  ILE  61          2HG1      ILE  61  -1.517  -4.042  -4.393
  485   1HG2  ILE  61          1HG2      ILE  61  -0.820  -4.318  -7.173
  486   2HG2  ILE  61          2HG2      ILE  61   0.302  -4.972  -5.980
  487   3HG2  ILE  61          3HG2      ILE  61  -0.257  -5.984  -7.312
  488   1HD1  ILE  61          1HD1      ILE  61  -2.836  -3.719  -6.890
  489   2HD1  ILE  61          2HD1      ILE  61  -3.953  -3.301  -5.590
  490   3HD1  ILE  61          3HD1      ILE  61  -2.388  -2.496  -5.701
  491    HA   PRO  62           HA       PRO  62  -2.883 -10.402  -7.600
  492   1HB   PRO  62          1HB       PRO  62  -3.272 -10.614 -10.279
  493   2HB   PRO  62          2HB       PRO  62  -4.599 -10.420  -9.128
  494   1HG   PRO  62          1HG       PRO  62  -3.266  -8.363 -10.846
  495   2HG   PRO  62          2HG       PRO  62  -4.992  -8.593 -10.512
  496   1HD   PRO  62          1HD       PRO  62  -3.506  -6.707  -9.261
  497   2HD   PRO  62          2HD       PRO  62  -4.869  -7.527  -8.472
  498    H    GLY  63           H        GLY  63  -0.684 -10.573  -7.133
  499   1HA   GLY  63          1HA       GLY  63   1.295 -11.572  -8.090
  500   2HA   GLY  63          2HA       GLY  63   1.062 -10.560  -9.508
  501    H    ALA  64           H        ALA  64   1.141  -9.821  -6.026
  502    HA   ALA  64           HA       ALA  64   3.515  -8.162  -6.483
  503   1HB   ALA  64          1HB       ALA  64   2.181  -6.587  -4.743
  504   2HB   ALA  64          2HB       ALA  64   2.158  -6.365  -6.493
  505   3HB   ALA  64          3HB       ALA  64   0.840  -7.223  -5.695
  506    H    HIS  65           H        HIS  65   4.517  -7.450  -4.402
  507    HA   HIS  65           HA       HIS  65   4.452  -9.676  -2.512
  508   1HB   HIS  65          1HB       HIS  65   6.596  -8.709  -3.583
  509   2HB   HIS  65          2HB       HIS  65   6.403  -7.387  -2.436
  510    HD1  HIS  65           HD1      HIS  65   8.713  -9.646  -2.527
  511    HD2  HIS  65           HD2      HIS  65   5.522  -9.399   0.122
  512    HE1  HIS  65           HE1      HIS  65   9.431 -10.931  -0.488
  513    H    PHE  66           H        PHE  66   3.103  -9.484  -0.854
  514    HA   PHE  66           HA       PHE  66   2.707  -6.822   0.340
  515   1HB   PHE  66          1HB       PHE  66   0.886  -9.078  -0.205
  516   2HB   PHE  66          2HB       PHE  66   0.681  -8.319   1.370
  517    HD1  PHE  66           HD1      PHE  66   0.672  -7.699  -2.268
  518    HD2  PHE  66           HD2      PHE  66  -0.347  -6.210   1.587
  519    HE1  PHE  66           HE1      PHE  66  -0.637  -5.896  -3.314
  520    HE2  PHE  66           HE2      PHE  66  -1.658  -4.406   0.548
  521    HZ   PHE  66           HZ       PHE  66  -1.805  -4.248  -1.906
  522    H    GLU  67           H        GLU  67   2.452  -6.724   2.670
  523    HA   GLU  67           HA       GLU  67   3.339  -8.977   4.246
  524   1HB   GLU  67          1HB       GLU  67   5.384  -7.630   3.283
  525   2HB   GLU  67          2HB       GLU  67   4.978  -6.495   4.563
  526   1HG   GLU  67          1HG       GLU  67   6.280  -7.731   5.867
  527   2HG   GLU  67          2HG       GLU  67   4.969  -8.909   5.866
  528    H    LYS  68           H        LYS  68   1.888  -8.965   5.823
  529    HA   LYS  68           HA       LYS  68   1.066  -6.381   6.970
  530   1HB   LYS  68          1HB       LYS  68  -0.756  -7.684   5.943
  531   2HB   LYS  68          2HB       LYS  68  -0.390  -9.032   7.012
  532   1HG   LYS  68          1HG       LYS  68  -0.826  -6.579   8.485
  533   2HG   LYS  68          2HG       LYS  68  -2.207  -7.000   7.471
  534   1HD   LYS  68          1HD       LYS  68  -2.018  -9.340   8.449
  535   2HD   LYS  68          2HD       LYS  68  -0.913  -8.641   9.636
  536   1HE   LYS  68          1HE       LYS  68  -2.652  -7.984  10.847
  537   2HE   LYS  68          2HE       LYS  68  -3.188  -6.967   9.511
  538   1HZ   LYS  68          1HZ       LYS  68  -4.935  -8.286   9.304
  539   2HZ   LYS  68          2HZ       LYS  68  -4.360  -9.328  10.506
  540   3HZ   LYS  68          3HZ       LYS  68  -3.918  -9.573   8.891
  541    H    ARG  69           H        ARG  69   2.968  -9.043   7.555
  542    HA   ARG  69           HA       ARG  69   2.562  -9.820  10.148
  543   1HB   ARG  69          1HB       ARG  69   4.749  -9.858   8.285
  544   2HB   ARG  69          2HB       ARG  69   5.356  -9.479   9.892
  545   1HG   ARG  69          1HG       ARG  69   4.231 -11.488  10.764
  546   2HG   ARG  69          2HG       ARG  69   3.705 -11.877   9.125
  547   1HD   ARG  69          1HD       ARG  69   5.602 -13.057   8.995
  548   2HD   ARG  69          2HD       ARG  69   6.391 -11.493   8.793
  549    HE   ARG  69           HE       ARG  69   6.202 -11.915  11.514
  550   1HH1  ARG  69          1HH1      ARG  69   7.690 -13.488   8.787
  551   2HH1  ARG  69          2HH1      ARG  69   9.000 -14.141   9.713
  552   1HH2  ARG  69          1HH2      ARG  69   7.922 -12.771  12.744
  553   2HH2  ARG  69          2HH2      ARG  69   9.131 -13.734  11.964
  554    H    ARG  70           H        ARG  70   4.954  -7.313   9.297
  555    HA   ARG  70           HA       ARG  70   4.035  -5.330  11.017
  556   1HB   ARG  70          1HB       ARG  70   5.029  -7.431  12.502
  557   2HB   ARG  70          2HB       ARG  70   6.402  -6.336  12.411
  558   1HG   ARG  70          1HG       ARG  70   5.411  -4.763  13.699
  559   2HG   ARG  70          2HG       ARG  70   3.793  -5.133  13.099
  560   1HD   ARG  70          1HD       ARG  70   3.466  -6.138  15.067
  561   2HD   ARG  70          2HD       ARG  70   4.488  -7.429  14.436
  562    HE   ARG  70           HE       ARG  70   6.102  -5.429  15.583
  563   1HH1  ARG  70          1HH1      ARG  70   3.857  -7.933  16.483
  564   2HH1  ARG  70          2HH1      ARG  70   4.571  -8.194  18.040
  565   1HH2  ARG  70          1HH2      ARG  70   7.051  -5.764  17.630
  566   2HH2  ARG  70          2HH2      ARG  70   6.387  -6.959  18.691
  567    H    GLY  71           H        GLY  71   4.976  -5.112   8.555
  568   1HA   GLY  71          1HA       GLY  71   7.644  -4.813   8.010
  569   2HA   GLY  71          2HA       GLY  71   6.396  -3.784   7.323
  570    H    THR  72           H        THR  72   5.531  -2.360   9.483
  571    HA   THR  72           HA       THR  72   7.549  -1.312  11.139
  572    HB   THR  72           HB       THR  72   8.434  -0.485   8.956
  573    HG1  THR  72           HG1      THR  72   9.034   0.752  10.667
  574   1HG2  THR  72          1HG2      THR  72   7.277   0.933   7.569
  575   2HG2  THR  72          2HG2      THR  72   6.236   1.526   8.864
  576   3HG2  THR  72          3HG2      THR  72   5.952  -0.067   8.163
  577    H    GLN  73           H        GLN  73   4.712  -2.045  11.109
  578    HA   GLN  73           HA       GLN  73   2.679  -1.320  11.852
  579   1HB   GLN  73          1HB       GLN  73   4.599  -0.662  13.686
  580   2HB   GLN  73          2HB       GLN  73   3.806   0.887  13.433
  581   1HG   GLN  73          1HG       GLN  73   1.647  -0.664  13.729
  582   2HG   GLN  73          2HG       GLN  73   2.800  -1.578  14.701
  583   1HE2  GLN  73          1HE2      GLN  73   3.597  -0.696  16.586
  584   2HE2  GLN  73          2HE2      GLN  73   2.916   0.712  17.319
  585    H    GLY  74           H        GLY  74   1.742   1.179  12.654
  586   1HA   GLY  74          1HA       GLY  74   1.156   2.354  10.127
  587   2HA   GLY  74          2HA       GLY  74   0.662   2.971  11.697
  588    H    GLU  75           H        GLU  75   3.839   2.680  12.084
  589    HA   GLU  75           HA       GLU  75   4.391   5.409  12.057
  590   1HB   GLU  75          1HB       GLU  75   5.747   3.060  12.778
  591   2HB   GLU  75          2HB       GLU  75   6.789   3.860  11.609
  592   1HG   GLU  75          1HG       GLU  75   7.555   4.933  13.419
  593   2HG   GLU  75          2HG       GLU  75   6.141   5.954  13.165
  594    H    ALA  76           H        ALA  76   4.479   3.080   9.502
  595    HA   ALA  76           HA       ALA  76   6.242   4.356   7.727
  596   1HB   ALA  76          1HB       ALA  76   5.812   2.554   6.508
  597   2HB   ALA  76          2HB       ALA  76   4.593   2.081   7.692
  598   3HB   ALA  76          3HB       ALA  76   4.133   3.053   6.294
  599    H    ARG  77           H        ARG  77   3.136   5.245   8.793
  600    HA   ARG  77           HA       ARG  77   2.130   6.570   6.526
  601   1HB   ARG  77          1HB       ARG  77   0.573   7.606   7.988
  602   2HB   ARG  77          2HB       ARG  77   0.874   6.004   8.647
  603   1HG   ARG  77          1HG       ARG  77   1.149   7.077  10.584
  604   2HG   ARG  77          2HG       ARG  77   2.744   7.488   9.951
  605   1HD   ARG  77          1HD       ARG  77   2.201   9.636  10.100
  606   2HD   ARG  77          2HD       ARG  77   0.962   9.371   8.874
  607    HE   ARG  77           HE       ARG  77   0.136   8.679  11.542
  608   1HH1  ARG  77          1HH1      ARG  77   0.393  11.225   9.181
  609   2HH1  ARG  77          2HH1      ARG  77  -0.870  12.181   9.883
  610   1HH2  ARG  77          1HH2      ARG  77  -1.528   9.929  12.476
  611   2HH2  ARG  77          2HH2      ARG  77  -1.961  11.443  11.758
  612    H    ALA  78           H        ALA  78   4.629   7.395   8.751
  613    HA   ALA  78           HA       ALA  78   4.637  10.196   7.909
  614   1HB   ALA  78          1HB       ALA  78   6.803   9.765   9.615
  615   2HB   ALA  78          2HB       ALA  78   5.253  10.503  10.022
  616   3HB   ALA  78          3HB       ALA  78   5.496   8.773  10.263
  617    H    TYR  79           H        TYR  79   7.138   7.684   8.342
  618    HA   TYR  79           HA       TYR  79   8.968   8.938   6.580
  619   1HB   TYR  79          1HB       TYR  79  10.082   7.558   8.038
  620   2HB   TYR  79          2HB       TYR  79   8.822   6.330   8.009
  621    HD1  TYR  79           HD1      TYR  79  11.204   7.875   5.567
  622    HD2  TYR  79           HD2      TYR  79   9.436   4.316   7.087
  623    HE1  TYR  79           HE1      TYR  79  12.548   6.543   3.996
  624    HE2  TYR  79           HE2      TYR  79  10.776   2.974   5.521
  625    HH   TYR  79           HH       TYR  79  13.414   3.949   4.055
  626    H    SER  80           H        SER  80   7.023   5.972   6.210
  627    HA   SER  80           HA       SER  80   6.191   4.917   4.374
  628   1HB   SER  80          1HB       SER  80   6.290   7.757   3.575
  629   2HB   SER  80          2HB       SER  80   6.236   6.608   2.238
  630    HG   SER  80           HG       SER  80   4.204   7.439   3.561
  631    H    MET  81           H        MET  81   8.224   7.023   2.428
  632    HA   MET  81           HA       MET  81  10.111   4.811   2.010
  633   1HB   MET  81          1HB       MET  81   9.072   6.518  -0.249
  634   2HB   MET  81          2HB       MET  81  10.064   5.069  -0.361
  635   1HG   MET  81          1HG       MET  81   8.267   3.792  -0.477
  636   2HG   MET  81          2HG       MET  81   7.648   4.457   1.032
  637   1HE   MET  81          1HE       MET  81   4.464   4.929  -0.350
  638   2HE   MET  81          2HE       MET  81   5.568   4.537   0.968
  639   3HE   MET  81          3HE       MET  81   5.052   6.206   0.716
  640    H    LYS  82           H        LYS  82  11.751   5.982   0.153
  641    HA   LYS  82           HA       LYS  82  12.856   8.238   1.681
  642   1HB   LYS  82          1HB       LYS  82  14.074   6.019   0.106
  643   2HB   LYS  82          2HB       LYS  82  14.926   7.557   0.156
  644   1HG   LYS  82          1HG       LYS  82  14.299   7.127   2.793
  645   2HG   LYS  82          2HG       LYS  82  14.649   5.502   2.197
  646   1HD   LYS  82          1HD       LYS  82  16.506   7.704   1.453
  647   2HD   LYS  82          2HD       LYS  82  16.559   7.092   3.108
  648   1HE   LYS  82          1HE       LYS  82  16.457   4.837   1.436
  649   2HE   LYS  82          2HE       LYS  82  17.622   5.938   0.703
  650   1HZ   LYS  82          1HZ       LYS  82  19.089   5.498   2.291
  651   2HZ   LYS  82          2HZ       LYS  82  18.078   4.244   2.807
  652   3HZ   LYS  82          3HZ       LYS  82  17.965   5.771   3.526
  653    H    GLU  83           H        GLU  83  12.613  10.185   0.823
  654    HA   GLU  83           HA       GLU  83  11.529  10.730  -1.674
  655   1HB   GLU  83          1HB       GLU  83  12.650  12.242   0.515
  656   2HB   GLU  83          2HB       GLU  83  13.126  12.947  -1.024
  657   1HG   GLU  83          1HG       GLU  83  10.355  12.293  -1.128
  658   2HG   GLU  83          2HG       GLU  83  10.676  13.213   0.341
  659    H    ASP  84           H        ASP  84  14.872  10.313  -0.707
  660    HA   ASP  84           HA       ASP  84  16.142  11.357  -2.968
  661   1HB   ASP  84          1HB       ASP  84  17.448  10.826  -1.031
  662   2HB   ASP  84          2HB       ASP  84  16.952   9.136  -1.087
  663    H    THR  85           H        THR  85  14.680   8.215  -2.385
  664    HA   THR  85           HA       THR  85  15.391   7.388  -5.116
  665    HB   THR  85           HB       THR  85  14.242   5.175  -3.975
  666    HG1  THR  85           HG1      THR  85  15.824   6.432  -1.964
  667   1HG2  THR  85          1HG2      THR  85  17.164   5.928  -3.831
  668   2HG2  THR  85          2HG2      THR  85  16.351   5.305  -5.267
  669   3HG2  THR  85          3HG2      THR  85  16.496   4.296  -3.828
  670    H    ARG  86           H        ARG  86  13.012   9.016  -3.750
  671    HA   ARG  86           HA       ARG  86  10.747   7.527  -4.788
  672   1HB   ARG  86          1HB       ARG  86  10.943   9.143  -2.663
  673   2HB   ARG  86          2HB       ARG  86  10.445  10.334  -3.858
  674   1HG   ARG  86          1HG       ARG  86   8.345   9.582  -3.898
  675   2HG   ARG  86          2HG       ARG  86   8.852   7.892  -3.918
  676   1HD   ARG  86          1HD       ARG  86   7.703   8.147  -1.891
  677   2HD   ARG  86          2HD       ARG  86   9.409   8.205  -1.451
  678    HE   ARG  86           HE       ARG  86   8.377  10.809  -1.925
  679   1HH1  ARG  86          1HH1      ARG  86   8.435   8.231   0.414
  680   2HH1  ARG  86          2HH1      ARG  86   8.184   9.281   1.770
  681   1HH2  ARG  86          1HH2      ARG  86   8.047  12.201  -0.148
  682   2HH2  ARG  86          2HH2      ARG  86   7.963  11.538   1.449
  683    H    LEU  87           H        LEU  87   9.659   7.950  -6.634
  684    HA   LEU  87           HA       LEU  87  10.864   9.882  -8.464
  685   1HB   LEU  87          1HB       LEU  87   9.772   7.299  -8.748
  686   2HB   LEU  87          2HB       LEU  87   8.710   8.397  -9.627
  687    HG   LEU  87           HG       LEU  87  11.644   7.903 -10.095
  688   1HD1  LEU  87          1HD1      LEU  87   9.109   7.183 -11.453
  689   2HD1  LEU  87          2HD1      LEU  87  10.612   6.273 -11.295
  690   3HD1  LEU  87          3HD1      LEU  87  10.496   7.587 -12.466
  691   1HD2  LEU  87          1HD2      LEU  87   9.843  10.057 -11.177
  692   2HD2  LEU  87          2HD2      LEU  87  11.333   9.555 -11.977
  693   3HD2  LEU  87          3HD2      LEU  87  11.392  10.242 -10.354
  694    H    GLU  88           H        GLU  88   7.592   8.899  -7.435
  695    HA   GLU  88           HA       GLU  88   6.756  11.701  -7.707
  696   1HB   GLU  88          1HB       GLU  88   6.042   9.814  -9.552
  697   2HB   GLU  88          2HB       GLU  88   4.698   9.725  -8.422
  698   1HG   GLU  88          1HG       GLU  88   4.133  11.985  -8.756
  699   2HG   GLU  88          2HG       GLU  88   5.654  12.323  -9.580
  700    H    GLY  89           H        GLY  89   4.427  11.916  -6.742
  701   1HA   GLY  89          1HA       GLY  89   2.891  11.316  -5.044
  702   2HA   GLY  89          2HA       GLY  89   4.052  10.143  -4.442
  703    HA   PRO  90           HA       PRO  90   3.361   9.920  -2.499
  704   1HB   PRO  90          1HB       PRO  90   1.882  10.708  -0.363
  705   2HB   PRO  90          2HB       PRO  90   3.591  10.273  -0.241
  706   1HG   PRO  90          1HG       PRO  90   2.333  12.985  -0.404
  707   2HG   PRO  90          2HG       PRO  90   3.656  12.426   0.636
  708   1HD   PRO  90          1HD       PRO  90   4.082  13.858  -1.623
  709   2HD   PRO  90          2HD       PRO  90   5.226  12.632  -1.039
  710    H    TRP  91           H        TRP  91   1.034   9.256  -2.262
  711    HA   TRP  91           HA       TRP  91  -0.849  11.182  -3.412
  712   1HB   TRP  91          1HB       TRP  91  -0.117   8.502  -4.574
  713   2HB   TRP  91          2HB       TRP  91  -1.680   9.247  -4.898
  714    HD1  TRP  91           HD1      TRP  91  -0.623  12.266  -5.237
  715    HE1  TRP  91           HE1      TRP  91   0.677  12.889  -7.369
  716    HE3  TRP  91           HE3      TRP  91   0.891   7.595  -6.658
  717    HZ2  TRP  91           HZ2      TRP  91   2.149  11.574  -9.387
  718    HZ3  TRP  91           HZ3      TRP  91   2.242   7.363  -8.702
  719    HH2  TRP  91           HH2      TRP  91   2.856   9.313 -10.037
  720    H    GLU  92           H        GLU  92  -2.787  11.120  -2.459
  721    HA   GLU  92           HA       GLU  92  -3.435   8.763  -0.811
  722   1HB   GLU  92          1HB       GLU  92  -3.714  11.689  -0.277
  723   2HB   GLU  92          2HB       GLU  92  -4.888  10.587   0.428
  724   1HG   GLU  92          1HG       GLU  92  -3.281  10.826   2.082
  725   2HG   GLU  92          2HG       GLU  92  -2.868   9.295   1.313
  726    H    TYR  93           H        TYR  93  -5.414   7.854  -1.022
  727    HA   TYR  93           HA       TYR  93  -7.462   9.238  -2.585
  728   1HB   TYR  93          1HB       TYR  93  -6.380   6.492  -3.242
  729   2HB   TYR  93          2HB       TYR  93  -7.855   7.165  -3.928
  730    HD1  TYR  93           HD1      TYR  93  -7.694   9.244  -5.348
  731    HD2  TYR  93           HD2      TYR  93  -4.268   7.027  -4.145
  732    HE1  TYR  93           HE1      TYR  93  -6.382  10.313  -7.133
  733    HE2  TYR  93           HE2      TYR  93  -2.946   8.091  -5.925
  734    HH   TYR  93           HH       TYR  93  -3.851   9.301  -8.413
  735    H    GLY  94           H        GLY  94  -9.588   8.188  -2.439
  736   1HA   GLY  94          1HA       GLY  94 -11.114   6.703  -1.391
  737   2HA   GLY  94          2HA       GLY  94  -9.883   6.325  -0.195
  738    H    GLU  95           H        GLU  95 -11.291   6.689   1.533
  739    HA   GLU  95           HA       GLU  95 -12.875   8.961   1.901
  740   1HB   GLU  95          1HB       GLU  95 -13.244   7.048   3.285
  741   2HB   GLU  95          2HB       GLU  95 -11.592   7.087   3.885
  742   1HG   GLU  95          1HG       GLU  95 -13.101   7.898   5.574
  743   2HG   GLU  95          2HG       GLU  95 -12.066   9.211   5.016
  Start of MODEL   21
    1   1H    ALA   2          1H        ALA   2 -10.964   3.113  17.522
    2    HA   ALA   2           HA       ALA   2 -12.338   1.659  19.274
    3   1HB   ALA   2          1HB       ALA   2 -14.441   2.621  18.569
    4   2HB   ALA   2          2HB       ALA   2 -14.164   2.083  16.912
    5   3HB   ALA   2          3HB       ALA   2 -14.418   0.898  18.192
    6    H    ARG   3           H        ARG   3 -10.705   0.213  19.022
    7    HA   ARG   3           HA       ARG   3  -9.473  -1.495  18.159
    8   1HB   ARG   3          1HB       ARG   3 -12.178  -1.867  16.964
    9   2HB   ARG   3          2HB       ARG   3 -10.858  -2.842  16.331
   10   1HG   ARG   3          1HG       ARG   3 -11.509  -4.252  17.959
   11   2HG   ARG   3          2HG       ARG   3 -10.472  -3.228  18.954
   12   1HD   ARG   3          1HD       ARG   3 -12.440  -1.880  19.570
   13   2HD   ARG   3          2HD       ARG   3 -13.458  -2.961  18.619
   14    HE   ARG   3           HE       ARG   3 -12.348  -3.465  21.229
   15   1HH1  ARG   3          1HH1      ARG   3 -13.659  -4.883  18.332
   16   2HH1  ARG   3          2HH1      ARG   3 -14.136  -6.354  19.112
   17   1HH2  ARG   3          1HH2      ARG   3 -12.972  -5.398  22.267
   18   2HH2  ARG   3          2HH2      ARG   3 -13.746  -6.646  21.351
   19    H    GLN   4           H        GLN   4  -7.856  -0.317  17.157
   20    HA   GLN   4           HA       GLN   4  -8.219   0.599  14.428
   21   1HB   GLN   4          1HB       GLN   4  -6.455   1.221  16.606
   22   2HB   GLN   4          2HB       GLN   4  -5.504   0.810  15.185
   23   1HG   GLN   4          1HG       GLN   4  -6.785   2.472  13.889
   24   2HG   GLN   4          2HG       GLN   4  -7.638   2.923  15.364
   25   1HE2  GLN   4          1HE2      GLN   4  -6.921   4.818  16.013
   26   2HE2  GLN   4          2HE2      GLN   4  -5.267   5.309  16.093
   27    H    VAL   5           H        VAL   5  -6.795  -0.032  12.696
   28    HA   VAL   5           HA       VAL   5  -5.805  -2.795  12.986
   29    HB   VAL   5           HB       VAL   5  -6.333  -3.171  10.637
   30   1HG1  VAL   5          1HG1      VAL   5  -8.961  -2.426  11.047
   31   2HG1  VAL   5          2HG1      VAL   5  -8.213  -3.941  11.557
   32   3HG1  VAL   5          3HG1      VAL   5  -8.311  -2.582  12.679
   33   1HG2  VAL   5          1HG2      VAL   5  -8.034  -0.896  10.174
   34   2HG2  VAL   5          2HG2      VAL   5  -6.378  -0.378  10.490
   35   3HG2  VAL   5          3HG2      VAL   5  -6.711  -1.523   9.191
   36    H    ILE   6           H        ILE   6  -4.016  -3.390  11.578
   37    HA   ILE   6           HA       ILE   6  -2.064  -1.249  11.430
   38    HB   ILE   6           HB       ILE   6  -1.695  -4.164  10.738
   39   1HG1  ILE   6          1HG1      ILE   6  -0.483  -3.959  13.104
   40   2HG1  ILE   6          2HG1      ILE   6  -1.695  -2.704  13.337
   41   1HG2  ILE   6          1HG2      ILE   6   0.710  -3.301  11.567
   42   2HG2  ILE   6          2HG2      ILE   6   0.194  -3.272   9.882
   43   3HG2  ILE   6          3HG2      ILE   6   0.080  -1.812  10.864
   44   1HD1  ILE   6          1HD1      ILE   6  -3.447  -4.203  13.247
   45   2HD1  ILE   6          2HD1      ILE   6  -2.500  -5.416  12.385
   46   3HD1  ILE   6          3HD1      ILE   6  -2.200  -5.115  14.097
   47    H    CYS   7           H        CYS   7  -0.884  -0.705   9.557
   48    HA   CYS   7           HA       CYS   7  -2.452  -0.744   7.150
   49   1HB   CYS   7          1HB       CYS   7   0.382   0.245   7.319
   50   2HB   CYS   7          2HB       CYS   7  -0.927   0.823   6.296
   51    HG   CYS   7           HG       CYS   7  -0.175   1.635   9.476
   52    H    TRP   8           H        TRP   8  -1.633  -1.442   5.066
   53    HA   TRP   8           HA       TRP   8  -0.006  -3.879   5.319
   54   1HB   TRP   8          1HB       TRP   8  -2.107  -3.087   3.297
   55   2HB   TRP   8          2HB       TRP   8  -1.075  -4.503   3.117
   56    HD1  TRP   8           HD1      TRP   8  -3.496  -3.119   5.832
   57    HE1  TRP   8           HE1      TRP   8  -4.787  -5.114   6.821
   58    HE3  TRP   8           HE3      TRP   8  -1.300  -6.899   3.182
   59    HZ2  TRP   8           HZ2      TRP   8  -4.863  -7.919   6.519
   60    HZ3  TRP   8           HZ3      TRP   8  -2.039  -9.210   3.593
   61    HH2  TRP   8           HH2      TRP   8  -3.783  -9.708   5.227
   62    H    CYS   9           H        CYS   9   2.032  -3.638   4.702
   63    HA   CYS   9           HA       CYS   9   2.719  -1.597   2.728
   64   1HB   CYS   9          1HB       CYS   9   5.073  -2.111   3.406
   65   2HB   CYS   9          2HB       CYS   9   4.056  -1.547   4.726
   66    HG   CYS   9           HG       CYS   9   6.002  -3.860   5.089
   67    H    PHE  10           H        PHE  10   2.882  -2.136   0.665
   68    HA   PHE  10           HA       PHE  10   3.975  -4.768  -0.035
   69   1HB   PHE  10          1HB       PHE  10   2.253  -5.323  -1.477
   70   2HB   PHE  10          2HB       PHE  10   1.366  -4.509  -0.192
   71    HD1  PHE  10           HD2      PHE  10   1.005  -1.945  -0.530
   72    HD2  PHE  10           HD1      PHE  10   1.916  -4.682  -3.660
   73    HE1  PHE  10           HE2      PHE  10   0.070  -0.371  -2.173
   74    HE2  PHE  10           HE1      PHE  10   0.983  -3.112  -5.309
   75    HZ   PHE  10           HZ       PHE  10   0.057  -0.954  -4.566
   76    H    THR  11           H        THR  11   4.695  -4.873  -2.323
   77    HA   THR  11           HA       THR  11   5.437  -2.244  -3.408
   78    HB   THR  11           HB       THR  11   7.394  -4.524  -3.467
   79    HG1  THR  11           HG1      THR  11   8.063  -4.060  -1.488
   80   1HG2  THR  11          1HG2      THR  11   8.408  -3.013  -4.778
   81   2HG2  THR  11          2HG2      THR  11   8.746  -2.133  -3.288
   82   3HG2  THR  11          3HG2      THR  11   7.335  -1.715  -4.259
   83    H    LEU  12           H        LEU  12   4.808  -2.065  -5.449
   84    HA   LEU  12           HA       LEU  12   4.445  -4.519  -7.032
   85   1HB   LEU  12          1HB       LEU  12   2.378  -3.369  -6.758
   86   2HB   LEU  12          2HB       LEU  12   3.113  -1.826  -7.187
   87    HG   LEU  12           HG       LEU  12   3.262  -2.444  -9.481
   88   1HD1  LEU  12          1HD1      LEU  12   2.299  -4.735 -10.151
   89   2HD1  LEU  12          2HD1      LEU  12   2.617  -5.191  -8.478
   90   3HD1  LEU  12          3HD1      LEU  12   3.943  -4.666  -9.515
   91   1HD2  LEU  12          1HD2      LEU  12   0.653  -2.985  -8.133
   92   2HD2  LEU  12          2HD2      LEU  12   0.800  -3.209  -9.877
   93   3HD2  LEU  12          3HD2      LEU  12   1.130  -1.632  -9.159
   94    H    ASN  13           H        ASN  13   5.922  -4.877  -8.538
   95    HA   ASN  13           HA       ASN  13   7.519  -2.636  -9.539
   96   1HB   ASN  13          1HB       ASN  13   7.974  -5.605  -9.904
   97   2HB   ASN  13          2HB       ASN  13   9.100  -4.314 -10.310
   98   1HD2  ASN  13          1HD2      ASN  13   8.880  -6.675  -8.293
   99   2HD2  ASN  13          2HD2      ASN  13   9.483  -5.976  -6.833
  100    H    ASN  14           H        ASN  14   7.514  -1.998 -11.630
  101    HA   ASN  14           HA       ASN  14   6.656  -1.650 -13.714
  102   1HB   ASN  14          1HB       ASN  14   8.127  -3.609 -14.111
  103   2HB   ASN  14          2HB       ASN  14   6.753  -4.673 -13.822
  104   1HD2  ASN  14          1HD2      ASN  14   7.594  -5.295 -16.052
  105   2HD2  ASN  14          2HD2      ASN  14   6.831  -4.517 -17.392
  106    HA   PRO  15           HA       PRO  15   2.333  -2.750 -12.285
  107   1HB   PRO  15          1HB       PRO  15   1.472  -0.186 -12.044
  108   2HB   PRO  15          2HB       PRO  15   2.265  -1.061 -10.728
  109   1HG   PRO  15          1HG       PRO  15   3.417   0.930 -12.644
  110   2HG   PRO  15          2HG       PRO  15   3.672   0.782 -10.896
  111   1HD   PRO  15          1HD       PRO  15   5.460  -0.134 -12.712
  112   2HD   PRO  15          2HD       PRO  15   5.212  -0.916 -11.137
  113    H    LEU  16           H        LEU  16   0.621  -2.882 -13.656
  114    HA   LEU  16           HA       LEU  16   1.004  -1.895 -16.356
  115   1HB   LEU  16          1HB       LEU  16  -0.721  -3.903 -15.031
  116   2HB   LEU  16          2HB       LEU  16  -1.359  -3.142 -16.487
  117    HG   LEU  16           HG       LEU  16   1.366  -4.377 -16.520
  118   1HD1  LEU  16          1HD1      LEU  16  -0.558  -6.208 -17.535
  119   2HD1  LEU  16          2HD1      LEU  16  -0.994  -5.798 -15.876
  120   3HD1  LEU  16          3HD1      LEU  16   0.610  -6.438 -16.234
  121   1HD2  LEU  16          1HD2      LEU  16  -0.764  -3.685 -18.510
  122   2HD2  LEU  16          2HD2      LEU  16   0.484  -4.871 -18.894
  123   3HD2  LEU  16          3HD2      LEU  16   0.936  -3.215 -18.487
  124    H    SER  17           H        SER  17  -0.432  -0.767 -13.564
  125    HA   SER  17           HA       SER  17  -1.504   1.526 -14.744
  126   1HB   SER  17          1HB       SER  17  -3.472   0.778 -15.540
  127   2HB   SER  17          2HB       SER  17  -3.301  -0.772 -14.717
  128    HG   SER  17           HG       SER  17  -4.731  -0.069 -13.365
  129    HA   PRO  18           HA       PRO  18  -1.490   2.870 -10.569
  130   1HB   PRO  18          1HB       PRO  18  -3.452   4.746 -10.556
  131   2HB   PRO  18          2HB       PRO  18  -1.893   4.992 -11.353
  132   1HG   PRO  18          1HG       PRO  18  -4.522   4.195 -12.541
  133   2HG   PRO  18          2HG       PRO  18  -3.327   5.356 -13.147
  134   1HD   PRO  18          1HD       PRO  18  -3.536   2.837 -14.121
  135   2HD   PRO  18          2HD       PRO  18  -1.988   3.704 -14.037
  136    H    LEU  19           H        LEU  19  -2.560   2.741  -8.565
  137    HA   LEU  19           HA       LEU  19  -4.646   0.756  -8.465
  138   1HB   LEU  19          1HB       LEU  19  -3.639   2.291  -6.100
  139   2HB   LEU  19          2HB       LEU  19  -4.251   0.640  -6.171
  140    HG   LEU  19           HG       LEU  19  -1.634   1.480  -7.404
  141   1HD1  LEU  19          1HD1      LEU  19  -0.492   0.884  -5.472
  142   2HD1  LEU  19          2HD1      LEU  19  -1.885   0.049  -4.785
  143   3HD1  LEU  19          3HD1      LEU  19  -1.862   1.811  -4.861
  144   1HD2  LEU  19          1HD2      LEU  19  -1.391  -1.121  -6.821
  145   2HD2  LEU  19          2HD2      LEU  19  -2.026  -0.534  -8.359
  146   3HD2  LEU  19          3HD2      LEU  19  -3.134  -1.047  -7.085
  147    H    SER  20           H        SER  20  -6.516   1.114  -6.916
  148    HA   SER  20           HA       SER  20  -7.498   3.849  -6.811
  149   1HB   SER  20          1HB       SER  20  -8.931   1.662  -8.335
  150   2HB   SER  20          2HB       SER  20  -9.664   3.202  -7.885
  151    HG   SER  20           HG       SER  20  -8.858   3.361  -9.970
  152    H    LEU  21           H        LEU  21  -9.584   3.982  -5.605
  153    HA   LEU  21           HA       LEU  21  -9.423   2.795  -3.122
  154   1HB   LEU  21          1HB       LEU  21 -10.787   4.795  -3.768
  155   2HB   LEU  21          2HB       LEU  21 -11.982   3.686  -4.437
  156    HG   LEU  21           HG       LEU  21 -12.458   2.799  -2.251
  157   1HD1  LEU  21          1HD1      LEU  21  -9.906   4.001  -1.602
  158   2HD1  LEU  21          2HD1      LEU  21 -10.809   2.742  -0.761
  159   3HD1  LEU  21          3HD1      LEU  21 -11.158   4.441  -0.440
  160   1HD2  LEU  21          1HD2      LEU  21 -13.641   4.826  -2.904
  161   2HD2  LEU  21          2HD2      LEU  21 -12.358   5.814  -2.205
  162   3HD2  LEU  21          3HD2      LEU  21 -13.356   4.798  -1.163
  163    H    HIS  22           H        HIS  22 -11.005   1.319  -2.078
  164    HA   HIS  22           HA       HIS  22 -11.992  -0.766  -3.898
  165   1HB   HIS  22          1HB       HIS  22  -9.768  -1.386  -2.867
  166   2HB   HIS  22          2HB       HIS  22 -10.573  -1.372  -1.300
  167    HD1  HIS  22           HD1      HIS  22 -10.768  -3.757  -0.659
  168    HD2  HIS  22           HD2      HIS  22 -11.809  -3.126  -4.632
  169    HE1  HIS  22           HE1      HIS  22 -11.591  -5.979  -1.500
  170    H    ASP  23           H        ASP  23 -13.731  -2.028  -3.084
  171    HA   ASP  23           HA       ASP  23 -15.560  -0.547  -1.484
  172   1HB   ASP  23          1HB       ASP  23 -15.599  -2.989  -3.086
  173   2HB   ASP  23          2HB       ASP  23 -16.586  -3.114  -1.632
  174    H    SER  24           H        SER  24 -13.195  -2.969  -0.815
  175    HA   SER  24           HA       SER  24 -14.328  -3.539   1.817
  176   1HB   SER  24          1HB       SER  24 -11.766  -4.686   0.721
  177   2HB   SER  24          2HB       SER  24 -12.835  -5.364   1.948
  178    HG   SER  24           HG       SER  24 -13.220  -6.451   0.052
  179    H    MET  25           H        MET  25 -11.556  -1.992   0.305
  180    HA   MET  25           HA       MET  25 -10.255  -1.436   2.815
  181   1HB   MET  25          1HB       MET  25  -8.471  -0.910   1.554
  182   2HB   MET  25          2HB       MET  25  -9.392  -1.585   0.217
  183   1HG   MET  25          1HG       MET  25 -10.346   0.828   0.018
  184   2HG   MET  25          2HG       MET  25  -8.905   1.266   0.933
  185   1HE   MET  25          1HE       MET  25  -6.975  -0.723   0.245
  186   2HE   MET  25          2HE       MET  25  -7.431  -1.689  -1.158
  187   3HE   MET  25          3HE       MET  25  -6.181  -0.453  -1.306
  188    H    LYS  26           H        LYS  26  -9.638   0.860   3.348
  189    HA   LYS  26           HA       LYS  26 -12.008   2.579   3.053
  190   1HB   LYS  26          1HB       LYS  26 -10.414   1.824   5.320
  191   2HB   LYS  26          2HB       LYS  26 -10.336   3.568   5.107
  192   1HG   LYS  26          1HG       LYS  26 -13.038   2.772   4.785
  193   2HG   LYS  26          2HG       LYS  26 -12.410   2.010   6.248
  194   1HD   LYS  26          1HD       LYS  26 -11.942   4.045   7.259
  195   2HD   LYS  26          2HD       LYS  26 -11.895   4.911   5.722
  196   1HE   LYS  26          1HE       LYS  26 -14.139   5.205   5.668
  197   2HE   LYS  26          2HE       LYS  26 -14.468   3.649   6.429
  198   1HZ   LYS  26          1HZ       LYS  26 -13.676   4.666   8.546
  199   2HZ   LYS  26          2HZ       LYS  26 -15.106   5.336   7.943
  200   3HZ   LYS  26          3HZ       LYS  26 -13.643   6.165   7.763
  201    H    TYR  27           H        TYR  27  -8.459   2.692   3.221
  202    HA   TYR  27           HA       TYR  27  -8.396   4.744   1.194
  203   1HB   TYR  27          1HB       TYR  27  -7.034   6.303   2.615
  204   2HB   TYR  27          2HB       TYR  27  -8.725   6.182   3.085
  205    HD1  TYR  27           HD1      TYR  27  -5.280   5.257   3.999
  206    HD2  TYR  27           HD2      TYR  27  -9.358   5.275   5.213
  207    HE1  TYR  27           HE1      TYR  27  -4.593   4.695   6.293
  208    HE2  TYR  27           HE2      TYR  27  -8.682   4.714   7.510
  209    HH   TYR  27           HH       TYR  27  -6.742   4.862   8.948
  210    H    LEU  28           H        LEU  28  -6.635   4.512  -0.035
  211    HA   LEU  28           HA       LEU  28  -4.398   2.927   1.047
  212   1HB   LEU  28          1HB       LEU  28  -4.129   1.837  -0.984
  213   2HB   LEU  28          2HB       LEU  28  -5.878   1.903  -0.775
  214    HG   LEU  28           HG       LEU  28  -5.209   4.195  -2.240
  215   1HD1  LEU  28          1HD1      LEU  28  -3.972   3.366  -4.129
  216   2HD1  LEU  28          2HD1      LEU  28  -3.849   1.767  -3.396
  217   3HD1  LEU  28          3HD1      LEU  28  -3.014   3.138  -2.666
  218   1HD2  LEU  28          1HD2      LEU  28  -6.525   3.153  -3.969
  219   2HD2  LEU  28          2HD2      LEU  28  -7.243   2.795  -2.399
  220   3HD2  LEU  28          3HD2      LEU  28  -6.296   1.565  -3.237
  221    H    VAL  29           H        VAL  29  -2.340   3.643   0.716
  222    HA   VAL  29           HA       VAL  29  -2.003   6.130  -0.825
  223    HB   VAL  29           HB       VAL  29  -0.775   5.530   1.870
  224   1HG1  VAL  29          1HG1      VAL  29   0.137   7.191  -0.258
  225   2HG1  VAL  29          2HG1      VAL  29  -0.376   8.216   1.084
  226   3HG1  VAL  29          3HG1      VAL  29   0.837   6.962   1.345
  227   1HG2  VAL  29          1HG2      VAL  29  -2.046   7.872   2.183
  228   2HG2  VAL  29          2HG2      VAL  29  -3.097   7.125   0.980
  229   3HG2  VAL  29          3HG2      VAL  29  -2.799   6.312   2.516
  230    H    TYR  30           H        TYR  30  -0.516   5.935  -2.355
  231    HA   TYR  30           HA       TYR  30   1.821   4.233  -1.889
  232   1HB   TYR  30          1HB       TYR  30   1.603   3.046  -3.925
  233   2HB   TYR  30          2HB       TYR  30   0.010   2.984  -3.178
  234    HD1  TYR  30           HD2      TYR  30  -1.774   4.578  -4.008
  235    HD2  TYR  30           HD1      TYR  30   1.898   3.971  -6.070
  236    HE1  TYR  30           HE2      TYR  30  -2.773   5.515  -6.050
  237    HE2  TYR  30           HE1      TYR  30   0.910   4.908  -8.118
  238    HH   TYR  30           HH       TYR  30  -0.893   6.325  -8.810
  239    H    GLN  31           H        GLN  31   3.548   4.615  -3.505
  240    HA   GLN  31           HA       GLN  31   3.391   7.194  -4.870
  241   1HB   GLN  31          1HB       GLN  31   5.769   6.585  -3.136
  242   2HB   GLN  31          2HB       GLN  31   5.281   8.125  -3.830
  243   1HG   GLN  31          1HG       GLN  31   3.275   8.053  -2.325
  244   2HG   GLN  31          2HG       GLN  31   4.013   6.661  -1.534
  245   1HE2  GLN  31          1HE2      GLN  31   5.383   9.689  -2.759
  246   2HE2  GLN  31          2HE2      GLN  31   6.079  10.184  -1.257
  247    H    THR  32           H        THR  32   5.121   7.530  -6.415
  248    HA   THR  32           HA       THR  32   5.987   4.995  -7.582
  249    HB   THR  32           HB       THR  32   6.500   7.592  -8.952
  250    HG1  THR  32           HG1      THR  32   3.956   6.459  -9.256
  251   1HG2  THR  32          1HG2      THR  32   5.856   6.255 -10.923
  252   2HG2  THR  32          2HG2      THR  32   5.532   4.880  -9.866
  253   3HG2  THR  32          3HG2      THR  32   7.172   5.511 -10.015
  254    H    GLU  33           H        GLU  33   8.103   4.464  -7.975
  255    HA   GLU  33           HA       GLU  33  10.196   6.362  -7.240
  256   1HB   GLU  33          1HB       GLU  33   9.660   3.749  -5.873
  257   2HB   GLU  33          2HB       GLU  33  11.308   4.348  -6.000
  258   1HG   GLU  33          1HG       GLU  33  11.002   5.834  -4.379
  259   2HG   GLU  33          2HG       GLU  33   9.468   6.380  -5.055
  260    H    GLN  34           H        GLN  34  12.389   5.515  -7.817
  261    HA   GLN  34           HA       GLN  34  12.210   4.108 -10.374
  262   1HB   GLN  34          1HB       GLN  34  13.866   6.233  -9.305
  263   2HB   GLN  34          2HB       GLN  34  14.847   4.951 -10.001
  264   1HG   GLN  34          1HG       GLN  34  12.688   5.511 -11.769
  265   2HG   GLN  34          2HG       GLN  34  13.472   7.026 -11.325
  266   1HE2  GLN  34          1HE2      GLN  34  13.439   5.665 -13.885
  267   2HE2  GLN  34          2HE2      GLN  34  15.088   5.357 -14.296
  268    H    GLY  35           H        GLY  35  12.781   2.046 -10.550
  269   1HA   GLY  35          1HA       GLY  35  14.856   0.978  -8.773
  270   2HA   GLY  35          2HA       GLY  35  13.288   0.183  -8.791
  271    H    GLU  36           H        GLU  36  13.552  -1.695  -9.811
  272    HA   GLU  36           HA       GLU  36  15.472  -2.460 -11.583
  273   1HB   GLU  36          1HB       GLU  36  13.705  -4.072 -12.502
  274   2HB   GLU  36          2HB       GLU  36  14.058  -4.152 -10.781
  275   1HG   GLU  36          1HG       GLU  36  12.063  -2.945 -10.249
  276   2HG   GLU  36          2HG       GLU  36  11.745  -2.629 -11.954
  277    H    ALA  37           H        ALA  37  16.076  -1.805 -13.529
  278    HA   ALA  37           HA       ALA  37  16.079  -0.814 -15.579
  279   1HB   ALA  37          1HB       ALA  37  13.443  -2.183 -15.453
  280   2HB   ALA  37          2HB       ALA  37  13.753  -1.083 -16.797
  281   3HB   ALA  37          3HB       ALA  37  14.815  -2.464 -16.525
  282    H    GLY  38           H        GLY  38  14.717   0.806 -17.024
  283   1HA   GLY  38          1HA       GLY  38  14.521   3.202 -15.550
  284   2HA   GLY  38          2HA       GLY  38  14.000   2.978 -17.213
  285    H    ASN  39           H        ASN  39  12.273   0.687 -15.958
  286    HA   ASN  39           HA       ASN  39   9.839   2.053 -16.004
  287   1HB   ASN  39          1HB       ASN  39  10.397  -0.557 -14.581
  288   2HB   ASN  39          2HB       ASN  39   8.840   0.008 -15.179
  289   1HD2  ASN  39          1HD2      ASN  39  10.200  -2.439 -15.820
  290   2HD2  ASN  39          2HD2      ASN  39  10.471  -2.430 -17.526
  291    H    ILE  40           H        ILE  40   8.304   1.487 -13.904
  292    HA   ILE  40           HA       ILE  40   9.642   2.639 -11.552
  293    HB   ILE  40           HB       ILE  40   7.324   3.811 -11.191
  294   1HG1  ILE  40          1HG1      ILE  40   7.452   3.612 -14.208
  295   2HG1  ILE  40          2HG1      ILE  40   6.281   2.783 -13.188
  296   1HG2  ILE  40          1HG2      ILE  40   8.656   5.387 -13.203
  297   2HG2  ILE  40          2HG2      ILE  40   8.557   5.640 -11.461
  298   3HG2  ILE  40          3HG2      ILE  40   9.823   4.612 -12.131
  299   1HD1  ILE  40          1HD1      ILE  40   5.275   4.835 -12.544
  300   2HD1  ILE  40          2HD1      ILE  40   6.568   5.771 -13.295
  301   3HD1  ILE  40          3HD1      ILE  40   5.447   4.853 -14.299
  302    H    HIS  41           H        HIS  41   8.284   2.416  -9.551
  303    HA   HIS  41           HA       HIS  41   6.474   0.115  -9.626
  304   1HB   HIS  41          1HB       HIS  41   7.658  -0.730  -7.516
  305   2HB   HIS  41          2HB       HIS  41   8.478  -0.987  -9.054
  306    HD1  HIS  41           HD1      HIS  41  10.701  -1.164  -7.627
  307    HD2  HIS  41           HD2      HIS  41   8.872   2.566  -7.625
  308    HE1  HIS  41           HE1      HIS  41  12.439   0.436  -6.764
  309    H    PHE  42           H        PHE  42   5.206  -0.125  -7.643
  310    HA   PHE  42           HA       PHE  42   4.704   2.496  -6.413
  311   1HB   PHE  42          1HB       PHE  42   2.897   0.077  -6.621
  312   2HB   PHE  42          2HB       PHE  42   2.461   1.617  -5.887
  313    HD1  PHE  42           HD1      PHE  42   4.110   3.142  -8.138
  314    HD2  PHE  42           HD2      PHE  42   0.977   0.262  -8.128
  315    HE1  PHE  42           HE1      PHE  42   3.349   3.968 -10.327
  316    HE2  PHE  42           HE2      PHE  42   0.211   1.082 -10.318
  317    HZ   PHE  42           HZ       PHE  42   1.398   2.937 -11.420
  318    H    GLN  43           H        GLN  43   4.784   2.785  -4.245
  319    HA   GLN  43           HA       GLN  43   5.046   0.471  -2.489
  320   1HB   GLN  43          1HB       GLN  43   7.245   2.214  -3.251
  321   2HB   GLN  43          2HB       GLN  43   6.989   2.205  -1.511
  322   1HG   GLN  43          1HG       GLN  43   7.742   0.112  -1.281
  323   2HG   GLN  43          2HG       GLN  43   6.947  -0.444  -2.753
  324   1HE2  GLN  43          1HE2      GLN  43   7.967   0.400  -4.805
  325   2HE2  GLN  43          2HE2      GLN  43   9.693   0.396  -4.868
  326    H    GLY  44           H        GLY  44   4.094   0.770  -0.553
  327   1HA   GLY  44          1HA       GLY  44   3.930   3.081   0.946
  328   2HA   GLY  44          2HA       GLY  44   2.539   3.122  -0.127
  329    H    TYR  45           H        TYR  45   1.458   3.107   2.047
  330    HA   TYR  45           HA       TYR  45   1.078   0.328   2.951
  331   1HB   TYR  45          1HB       TYR  45   0.665   1.120   5.180
  332   2HB   TYR  45          2HB       TYR  45   2.182   1.825   4.632
  333    HD1  TYR  45           HD1      TYR  45  -1.369   2.519   5.338
  334    HD2  TYR  45           HD2      TYR  45   2.421   4.190   4.366
  335    HE1  TYR  45           HE1      TYR  45  -2.227   4.761   5.872
  336    HE2  TYR  45           HE2      TYR  45   1.574   6.437   4.898
  337    HH   TYR  45           HH       TYR  45  -0.409   7.640   5.166
  338    H    ILE  46           H        ILE  46  -0.999  -0.397   3.270
  339    HA   ILE  46           HA       ILE  46  -3.188   1.467   2.655
  340    HB   ILE  46           HB       ILE  46  -3.067  -1.343   1.565
  341   1HG1  ILE  46          1HG1      ILE  46  -2.565   1.252   0.092
  342   2HG1  ILE  46          2HG1      ILE  46  -1.312   0.110   0.565
  343   1HG2  ILE  46          1HG2      ILE  46  -4.812   0.108   0.037
  344   2HG2  ILE  46          2HG2      ILE  46  -5.261  -0.962   1.364
  345   3HG2  ILE  46          3HG2      ILE  46  -5.080   0.769   1.650
  346   1HD1  ILE  46          1HD1      ILE  46  -2.563   0.150  -1.841
  347   2HD1  ILE  46          2HD1      ILE  46  -1.748  -1.253  -1.148
  348   3HD1  ILE  46          3HD1      ILE  46  -3.494  -1.073  -0.977
  349    H    GLU  47           H        GLU  47  -4.789   1.385   4.088
  350    HA   GLU  47           HA       GLU  47  -4.849  -0.859   5.978
  351   1HB   GLU  47          1HB       GLU  47  -6.314   1.755   6.283
  352   2HB   GLU  47          2HB       GLU  47  -5.911   0.584   7.530
  353   1HG   GLU  47          1HG       GLU  47  -3.448   1.164   6.793
  354   2HG   GLU  47          2HG       GLU  47  -4.216   2.655   6.250
  355    H    MET  48           H        MET  48  -6.346  -2.364   5.709
  356    HA   MET  48           HA       MET  48  -8.560  -1.950   3.910
  357   1HB   MET  48          1HB       MET  48  -7.626  -4.306   5.541
  358   2HB   MET  48          2HB       MET  48  -9.113  -4.345   4.603
  359   1HG   MET  48          1HG       MET  48  -7.067  -3.391   2.904
  360   2HG   MET  48          2HG       MET  48  -6.446  -4.809   3.747
  361   1HE   MET  48          1HE       MET  48 -10.065  -3.921   1.698
  362   2HE   MET  48          2HE       MET  48  -8.498  -3.240   1.265
  363   3HE   MET  48          3HE       MET  48  -9.196  -4.534   0.291
  364    H    LYS  49           H        LYS  49 -10.697  -3.155   4.810
  365    HA   LYS  49           HA       LYS  49 -11.983  -1.369   6.466
  366   1HB   LYS  49          1HB       LYS  49 -12.659  -3.726   5.123
  367   2HB   LYS  49          2HB       LYS  49 -13.064  -4.038   6.806
  368   1HG   LYS  49          1HG       LYS  49 -14.736  -2.509   6.834
  369   2HG   LYS  49          2HG       LYS  49 -13.939  -1.449   5.670
  370   1HD   LYS  49          1HD       LYS  49 -15.640  -2.248   4.367
  371   2HD   LYS  49          2HD       LYS  49 -14.412  -3.473   4.037
  372   1HE   LYS  49          1HE       LYS  49 -16.057  -4.909   4.584
  373   2HE   LYS  49          2HE       LYS  49 -15.581  -4.522   6.236
  374   1HZ   LYS  49          1HZ       LYS  49 -17.826  -4.165   6.312
  375   2HZ   LYS  49          2HZ       LYS  49 -17.922  -3.609   4.717
  376   3HZ   LYS  49          3HZ       LYS  49 -17.292  -2.606   5.925
  377    H    LYS  50           H        LYS  50 -10.871  -4.624   7.421
  378    HA   LYS  50           HA       LYS  50  -9.679  -3.860   9.818
  379   1HB   LYS  50          1HB       LYS  50 -12.559  -3.953   9.944
  380   2HB   LYS  50          2HB       LYS  50 -11.866  -5.174  11.003
  381   1HG   LYS  50          1HG       LYS  50 -10.698  -3.572  12.264
  382   2HG   LYS  50          2HG       LYS  50 -10.954  -2.315  11.051
  383   1HD   LYS  50          1HD       LYS  50 -13.516  -3.097  11.694
  384   2HD   LYS  50          2HD       LYS  50 -12.672  -3.181  13.242
  385   1HE   LYS  50          1HE       LYS  50 -11.752  -0.842  12.540
  386   2HE   LYS  50          2HE       LYS  50 -13.143  -0.829  11.457
  387   1HZ   LYS  50          1HZ       LYS  50 -14.544  -1.289  13.436
  388   2HZ   LYS  50          2HZ       LYS  50 -13.769   0.213  13.485
  389   3HZ   LYS  50          3HZ       LYS  50 -13.180  -1.072  14.414
  390    H    ARG  51           H        ARG  51 -12.036  -6.477   9.334
  391    HA   ARG  51           HA       ARG  51  -9.943  -8.423   9.890
  392   1HB   ARG  51          1HB       ARG  51 -12.387  -8.390  10.838
  393   2HB   ARG  51          2HB       ARG  51 -12.788  -9.156   9.306
  394   1HG   ARG  51          1HG       ARG  51 -11.584 -11.070   9.797
  395   2HG   ARG  51          2HG       ARG  51 -10.595 -10.256  11.011
  396   1HD   ARG  51          1HD       ARG  51 -13.334 -10.077  11.783
  397   2HD   ARG  51          2HD       ARG  51 -12.966 -11.756  11.388
  398    HE   ARG  51           HE       ARG  51 -11.962 -10.234  13.618
  399   1HH1  ARG  51          1HH1      ARG  51 -11.455 -12.984  11.545
  400   2HH1  ARG  51          2HH1      ARG  51 -10.480 -13.836  12.696
  401   1HH2  ARG  51          1HH2      ARG  51 -10.680 -11.346  15.142
  402   2HH2  ARG  51          2HH2      ARG  51 -10.041 -12.904  14.742
  403    H    THR  52           H        THR  52  -9.212  -7.416   7.609
  404    HA   THR  52           HA       THR  52 -10.193  -9.269   5.535
  405    HB   THR  52           HB       THR  52  -8.709  -6.885   4.631
  406    HG1  THR  52           HG1      THR  52 -11.182  -6.719   5.997
  407   1HG2  THR  52          1HG2      THR  52  -9.659  -8.368   3.007
  408   2HG2  THR  52          2HG2      THR  52 -10.593  -6.872   2.976
  409   3HG2  THR  52          3HG2      THR  52 -11.238  -8.298   3.789
  410    H    SER  53           H        SER  53  -8.790 -10.836   5.127
  411    HA   SER  53           HA       SER  53  -6.037 -10.661   5.900
  412   1HB   SER  53          1HB       SER  53  -6.022 -12.924   4.536
  413   2HB   SER  53          2HB       SER  53  -6.799 -12.832   6.116
  414    HG   SER  53           HG       SER  53  -8.300 -13.746   4.830
  415    H    LEU  54           H        LEU  54  -4.438 -11.655   4.126
  416    HA   LEU  54           HA       LEU  54  -3.854  -9.640   2.332
  417   1HB   LEU  54          1HB       LEU  54  -2.292 -11.406   3.064
  418   2HB   LEU  54          2HB       LEU  54  -3.153 -12.558   2.046
  419    HG   LEU  54           HG       LEU  54  -2.412 -11.463   0.057
  420   1HD1  LEU  54          1HD1      LEU  54  -2.604  -9.153   0.875
  421   2HD1  LEU  54          2HD1      LEU  54  -1.064  -9.452   0.069
  422   3HD1  LEU  54          3HD1      LEU  54  -1.138  -9.383   1.830
  423   1HD2  LEU  54          1HD2      LEU  54  -0.745 -12.927   0.642
  424   2HD2  LEU  54          2HD2      LEU  54  -0.358 -12.066   2.132
  425   3HD2  LEU  54          3HD2      LEU  54   0.156 -11.413   0.576
  426    H    ALA  55           H        ALA  55  -5.997 -12.364   1.968
  427    HA   ALA  55           HA       ALA  55  -6.247 -12.522  -0.787
  428   1HB   ALA  55          1HB       ALA  55  -7.287 -14.064   0.865
  429   2HB   ALA  55          2HB       ALA  55  -8.506 -12.829   1.184
  430   3HB   ALA  55          3HB       ALA  55  -8.380 -13.550  -0.420
  431    H    GLY  56           H        GLY  56  -7.555 -10.162   1.448
  432   1HA   GLY  56          1HA       GLY  56  -9.431  -9.006  -0.356
  433   2HA   GLY  56          2HA       GLY  56  -8.826  -8.272   1.121
  434    H    MET  57           H        MET  57  -6.135  -8.083   0.608
  435    HA   MET  57           HA       MET  57  -6.062  -5.802  -1.103
  436   1HB   MET  57          1HB       MET  57  -3.823  -7.336   0.229
  437   2HB   MET  57          2HB       MET  57  -3.636  -5.787  -0.581
  438   1HG   MET  57          1HG       MET  57  -5.670  -5.968   1.562
  439   2HG   MET  57          2HG       MET  57  -3.974  -6.002   2.039
  440   1HE   MET  57          1HE       MET  57  -5.866  -3.282  -0.799
  441   2HE   MET  57          2HE       MET  57  -6.714  -4.459   0.204
  442   3HE   MET  57          3HE       MET  57  -6.641  -2.767   0.700
  443    H    LYS  58           H        LYS  58  -4.660  -9.063  -1.305
  444    HA   LYS  58           HA       LYS  58  -3.316  -8.796  -3.719
  445   1HB   LYS  58          1HB       LYS  58  -3.666 -10.819  -1.954
  446   2HB   LYS  58          2HB       LYS  58  -4.686 -11.379  -3.273
  447   1HG   LYS  58          1HG       LYS  58  -2.725 -11.051  -4.801
  448   2HG   LYS  58          2HG       LYS  58  -1.746 -10.758  -3.362
  449   1HD   LYS  58          1HD       LYS  58  -3.409 -13.241  -3.672
  450   2HD   LYS  58          2HD       LYS  58  -1.768 -13.132  -4.313
  451   1HE   LYS  58          1HE       LYS  58  -2.587 -12.741  -1.436
  452   2HE   LYS  58          2HE       LYS  58  -1.783 -14.162  -2.102
  453   1HZ   LYS  58          1HZ       LYS  58   0.026 -13.061  -1.357
  454   2HZ   LYS  58          2HZ       LYS  58  -0.693 -11.534  -1.475
  455   3HZ   LYS  58          3HZ       LYS  58  -0.084 -12.291  -2.860
  456    H    LYS  59           H        LYS  59  -6.718  -9.251  -3.079
  457    HA   LYS  59           HA       LYS  59  -7.583 -10.100  -5.595
  458   1HB   LYS  59          1HB       LYS  59  -8.781  -9.045  -3.183
  459   2HB   LYS  59          2HB       LYS  59  -9.582  -8.398  -4.609
  460   1HG   LYS  59          1HG       LYS  59  -9.991 -10.653  -5.423
  461   2HG   LYS  59          2HG       LYS  59  -9.151 -11.321  -4.022
  462   1HD   LYS  59          1HD       LYS  59 -10.855 -10.036  -2.613
  463   2HD   LYS  59          2HD       LYS  59 -11.767  -9.843  -4.112
  464   1HE   LYS  59          1HE       LYS  59 -10.834 -12.547  -3.221
  465   2HE   LYS  59          2HE       LYS  59 -12.305 -11.840  -2.556
  466   1HZ   LYS  59          1HZ       LYS  59 -12.984 -11.516  -4.968
  467   2HZ   LYS  59          2HZ       LYS  59 -13.013 -13.097  -4.368
  468   3HZ   LYS  59          3HZ       LYS  59 -11.737 -12.591  -5.357
  469    H    LEU  60           H        LEU  60  -6.714  -6.923  -4.416
  470    HA   LEU  60           HA       LEU  60  -7.766  -5.526  -6.697
  471   1HB   LEU  60          1HB       LEU  60  -6.014  -4.744  -4.390
  472   2HB   LEU  60          2HB       LEU  60  -6.334  -3.638  -5.724
  473    HG   LEU  60           HG       LEU  60  -8.790  -3.905  -5.195
  474   1HD1  LEU  60          1HD1      LEU  60  -7.605  -5.611  -3.109
  475   2HD1  LEU  60          2HD1      LEU  60  -9.199  -5.672  -3.860
  476   3HD1  LEU  60          3HD1      LEU  60  -8.875  -4.511  -2.573
  477   1HD2  LEU  60          1HD2      LEU  60  -8.047  -2.699  -2.763
  478   2HD2  LEU  60          2HD2      LEU  60  -8.424  -1.911  -4.295
  479   3HD2  LEU  60          3HD2      LEU  60  -6.758  -2.350  -3.916
  480    H    ILE  61           H        ILE  61  -4.606  -6.691  -5.647
  481    HA   ILE  61           HA       ILE  61  -3.637  -6.341  -8.391
  482    HB   ILE  61           HB       ILE  61  -2.046  -5.540  -5.951
  483   1HG1  ILE  61          1HG1      ILE  61  -2.159  -3.301  -7.410
  484   2HG1  ILE  61          2HG1      ILE  61  -3.685  -4.018  -7.915
  485   1HG2  ILE  61          1HG2      ILE  61  -0.787  -4.564  -8.205
  486   2HG2  ILE  61          2HG2      ILE  61  -0.292  -5.967  -7.259
  487   3HG2  ILE  61          3HG2      ILE  61  -1.308  -6.179  -8.685
  488   1HD1  ILE  61          1HD1      ILE  61  -2.920  -2.808  -5.364
  489   2HD1  ILE  61          2HD1      ILE  61  -4.502  -2.951  -6.131
  490   3HD1  ILE  61          3HD1      ILE  61  -3.834  -4.310  -5.227
  491    HA   PRO  62           HA       PRO  62  -2.763 -10.573  -6.726
  492   1HB   PRO  62          1HB       PRO  62  -3.512 -11.862  -8.995
  493   2HB   PRO  62          2HB       PRO  62  -4.655 -11.411  -7.724
  494   1HG   PRO  62          1HG       PRO  62  -4.060 -10.031 -10.313
  495   2HG   PRO  62          2HG       PRO  62  -5.628 -10.338  -9.543
  496   1HD   PRO  62          1HD       PRO  62  -4.386  -7.936  -9.411
  497   2HD   PRO  62          2HD       PRO  62  -5.411  -8.554  -8.100
  498    H    GLY  63           H        GLY  63  -0.546 -10.436  -6.713
  499   1HA   GLY  63          1HA       GLY  63   1.232 -11.669  -8.023
  500   2HA   GLY  63          2HA       GLY  63   0.804 -10.582  -9.336
  501    H    ALA  64           H        ALA  64   1.008  -9.666  -5.947
  502    HA   ALA  64           HA       ALA  64   3.469  -8.163  -6.536
  503   1HB   ALA  64          1HB       ALA  64   2.215  -6.530  -4.758
  504   2HB   ALA  64          2HB       ALA  64   2.202  -6.314  -6.509
  505   3HB   ALA  64          3HB       ALA  64   0.856  -7.127  -5.711
  506    H    HIS  65           H        HIS  65   4.476  -7.317  -4.446
  507    HA   HIS  65           HA       HIS  65   4.550  -9.537  -2.549
  508   1HB   HIS  65          1HB       HIS  65   6.628  -8.481  -3.662
  509   2HB   HIS  65          2HB       HIS  65   6.396  -7.161  -2.520
  510    HD1  HIS  65           HD1      HIS  65   8.206 -10.193  -2.861
  511    HD2  HIS  65           HD2      HIS  65   6.256  -8.310   0.287
  512    HE1  HIS  65           HE1      HIS  65   9.171 -11.204  -0.771
  513    H    PHE  66           H        PHE  66   3.224  -9.401  -0.867
  514    HA   PHE  66           HA       PHE  66   2.754  -6.757   0.341
  515   1HB   PHE  66          1HB       PHE  66   0.987  -9.072  -0.180
  516   2HB   PHE  66          2HB       PHE  66   0.763  -8.273   1.372
  517    HD1  PHE  66           HD1      PHE  66   0.839  -7.685  -2.283
  518    HD2  PHE  66           HD2      PHE  66  -0.408  -6.255   1.528
  519    HE1  PHE  66           HE1      PHE  66  -0.509  -5.944  -3.381
  520    HE2  PHE  66           HE2      PHE  66  -1.758  -4.512   0.436
  521    HZ   PHE  66           HZ       PHE  66  -1.811  -4.355  -2.021
  522    H    GLU  67           H        GLU  67   2.480  -6.705   2.680
  523    HA   GLU  67           HA       GLU  67   3.522  -8.950   4.193
  524   1HB   GLU  67          1HB       GLU  67   5.155  -6.656   3.480
  525   2HB   GLU  67          2HB       GLU  67   5.015  -6.833   5.223
  526   1HG   GLU  67          1HG       GLU  67   5.757  -9.177   5.010
  527   2HG   GLU  67          2HG       GLU  67   5.985  -8.916   3.281
  528    H    LYS  68           H        LYS  68   2.106  -9.148   5.785
  529    HA   LYS  68           HA       LYS  68   0.954  -6.712   6.971
  530   1HB   LYS  68          1HB       LYS  68  -0.625  -8.341   5.908
  531   2HB   LYS  68          2HB       LYS  68  -0.132  -9.530   7.107
  532   1HG   LYS  68          1HG       LYS  68  -2.284  -8.292   7.563
  533   2HG   LYS  68          2HG       LYS  68  -1.097  -8.309   8.870
  534   1HD   LYS  68          1HD       LYS  68  -0.387  -6.072   8.316
  535   2HD   LYS  68          2HD       LYS  68  -1.434  -6.053   6.895
  536   1HE   LYS  68          1HE       LYS  68  -2.373  -4.815   8.825
  537   2HE   LYS  68          2HE       LYS  68  -3.400  -6.140   8.278
  538   1HZ   LYS  68          1HZ       LYS  68  -2.570  -7.498  10.082
  539   2HZ   LYS  68          2HZ       LYS  68  -3.224  -6.064  10.693
  540   3HZ   LYS  68          3HZ       LYS  68  -1.546  -6.253  10.596
  541    H    ARG  69           H        ARG  69   3.508  -8.363   7.560
  542    HA   ARG  69           HA       ARG  69   3.137  -9.422  10.181
  543   1HB   ARG  69          1HB       ARG  69   5.125  -9.561   8.273
  544   2HB   ARG  69          2HB       ARG  69   5.855  -8.562   9.523
  545   1HG   ARG  69          1HG       ARG  69   5.073 -10.402  11.145
  546   2HG   ARG  69          2HG       ARG  69   4.896 -11.389   9.693
  547   1HD   ARG  69          1HD       ARG  69   7.435  -9.906  10.292
  548   2HD   ARG  69          2HD       ARG  69   7.119 -11.504  10.967
  549    HE   ARG  69           HE       ARG  69   6.682 -11.641   8.218
  550   1HH1  ARG  69          1HH1      ARG  69   9.312 -11.091  10.432
  551   2HH1  ARG  69          2HH1      ARG  69  10.515 -11.744   9.370
  552   1HH2  ARG  69          1HH2      ARG  69   8.257 -12.503   6.811
  553   2HH2  ARG  69          2HH2      ARG  69   9.914 -12.546   7.310
  554    H    ARG  70           H        ARG  70   3.060  -6.313   9.093
  555    HA   ARG  70           HA       ARG  70   3.033  -4.298  10.155
  556   1HB   ARG  70          1HB       ARG  70   3.614  -5.719  12.746
  557   2HB   ARG  70          2HB       ARG  70   2.771  -4.195  12.505
  558   1HG   ARG  70          1HG       ARG  70   0.858  -5.294  11.628
  559   2HG   ARG  70          2HG       ARG  70   1.713  -6.835  11.533
  560   1HD   ARG  70          1HD       ARG  70   1.926  -5.974  14.199
  561   2HD   ARG  70          2HD       ARG  70   0.251  -5.696  13.724
  562    HE   ARG  70           HE       ARG  70  -0.067  -7.969  13.600
  563   1HH1  ARG  70          1HH1      ARG  70   3.332  -7.273  13.884
  564   2HH1  ARG  70          2HH1      ARG  70   3.781  -8.924  14.153
  565   1HH2  ARG  70          1HH2      ARG  70   0.511 -10.147  13.954
  566   2HH2  ARG  70          2HH2      ARG  70   2.176 -10.558  14.192
  567    H    GLY  71           H        GLY  71   5.330  -4.927   8.894
  568   1HA   GLY  71          1HA       GLY  71   7.628  -4.718  10.598
  569   2HA   GLY  71          2HA       GLY  71   7.617  -4.613   8.844
  570    H    THR  72           H        THR  72   5.355  -2.471   9.739
  571    HA   THR  72           HA       THR  72   7.078  -0.291  10.543
  572    HB   THR  72           HB       THR  72   6.238   1.099   8.534
  573    HG1  THR  72           HG1      THR  72   5.809  -1.562   7.642
  574   1HG2  THR  72          1HG2      THR  72   8.600   0.104   9.037
  575   2HG2  THR  72          2HG2      THR  72   8.247   0.758   7.437
  576   3HG2  THR  72          3HG2      THR  72   8.216  -0.985   7.705
  577    H    GLN  73           H        GLN  73   4.683  -1.658  11.534
  578    HA   GLN  73           HA       GLN  73   2.323  -0.261  11.123
  579   1HB   GLN  73          1HB       GLN  73   1.741  -1.003  13.471
  580   2HB   GLN  73          2HB       GLN  73   2.229  -2.280  12.365
  581   1HG   GLN  73          1HG       GLN  73   3.807  -2.914  13.770
  582   2HG   GLN  73          2HG       GLN  73   4.551  -1.318  13.681
  583   1HE2  GLN  73          1HE2      GLN  73   1.998  -3.140  15.304
  584   2HE2  GLN  73          2HE2      GLN  73   2.083  -2.274  16.796
  585    H    GLY  74           H        GLY  74   2.340   1.923  11.066
  586   1HA   GLY  74          1HA       GLY  74   1.993   3.956  12.205
  587   2HA   GLY  74          2HA       GLY  74   2.839   3.295  13.596
  588    H    GLU  75           H        GLU  75   4.997   2.360  11.648
  589    HA   GLU  75           HA       GLU  75   6.630   4.712  11.913
  590   1HB   GLU  75          1HB       GLU  75   7.042   1.874  11.218
  591   2HB   GLU  75          2HB       GLU  75   8.150   3.000  10.448
  592   1HG   GLU  75          1HG       GLU  75   7.691   3.239  13.373
  593   2HG   GLU  75          2HG       GLU  75   8.690   1.915  12.776
  594    H    ALA  76           H        ALA  76   4.945   3.057   9.333
  595    HA   ALA  76           HA       ALA  76   6.209   4.397   7.172
  596   1HB   ALA  76          1HB       ALA  76   4.565   3.422   5.786
  597   2HB   ALA  76          2HB       ALA  76   4.886   2.244   7.059
  598   3HB   ALA  76          3HB       ALA  76   3.433   3.242   7.126
  599    H    ARG  77           H        ARG  77   4.063   5.475   9.526
  600    HA   ARG  77           HA       ARG  77   2.528   7.315   7.988
  601   1HB   ARG  77          1HB       ARG  77   2.702   6.493  10.723
  602   2HB   ARG  77          2HB       ARG  77   2.768   8.249  10.658
  603   1HG   ARG  77          1HG       ARG  77   0.678   6.805   9.098
  604   2HG   ARG  77          2HG       ARG  77   0.481   7.017  10.839
  605   1HD   ARG  77          1HD       ARG  77   1.076   9.507  10.299
  606   2HD   ARG  77          2HD       ARG  77   0.565   9.067   8.670
  607    HE   ARG  77           HE       ARG  77  -1.482   8.196  10.195
  608   1HH1  ARG  77          1HH1      ARG  77   0.195  11.240   9.987
  609   2HH1  ARG  77          2HH1      ARG  77  -1.188  12.181  10.439
  610   1HH2  ARG  77          1HH2      ARG  77  -3.309   9.424  10.791
  611   2HH2  ARG  77          2HH2      ARG  77  -3.181  11.147  10.897
  612    H    ALA  78           H        ALA  78   5.726   7.336   9.238
  613    HA   ALA  78           HA       ALA  78   5.951  10.228   8.722
  614   1HB   ALA  78          1HB       ALA  78   6.731  10.136  10.842
  615   2HB   ALA  78          2HB       ALA  78   7.205   8.442  10.712
  616   3HB   ALA  78          3HB       ALA  78   8.231   9.700  10.024
  617    H    TYR  79           H        TYR  79   8.061   7.349   8.615
  618    HA   TYR  79           HA       TYR  79   9.820   8.414   6.693
  619   1HB   TYR  79          1HB       TYR  79  10.645   6.630   8.001
  620   2HB   TYR  79          2HB       TYR  79   9.259   5.608   7.634
  621    HD1  TYR  79           HD1      TYR  79  11.388   7.558   5.285
  622    HD2  TYR  79           HD2      TYR  79  10.212   3.708   6.663
  623    HE1  TYR  79           HE1      TYR  79  12.647   6.521   3.444
  624    HE2  TYR  79           HE2      TYR  79  11.469   2.661   4.827
  625    HH   TYR  79           HH       TYR  79  12.911   3.001   3.154
  626    H    SER  80           H        SER  80   7.188   6.038   6.351
  627    HA   SER  80           HA       SER  80   5.930   5.403   4.565
  628   1HB   SER  80          1HB       SER  80   6.754   8.159   3.647
  629   2HB   SER  80          2HB       SER  80   5.655   7.138   2.721
  630    HG   SER  80           HG       SER  80   5.159   7.633   5.443
  631    H    MET  81           H        MET  81   8.012   7.275   2.467
  632    HA   MET  81           HA       MET  81   9.285   4.789   1.538
  633   1HB   MET  81          1HB       MET  81   7.655   6.725   0.043
  634   2HB   MET  81          2HB       MET  81   9.184   6.323  -0.727
  635   1HG   MET  81          1HG       MET  81   7.453   4.873  -1.546
  636   2HG   MET  81          2HG       MET  81   8.606   3.942  -0.593
  637   1HE   MET  81          1HE       MET  81   4.331   4.980   0.010
  638   2HE   MET  81          2HE       MET  81   5.190   5.942   1.213
  639   3HE   MET  81          3HE       MET  81   5.618   6.077  -0.493
  640    H    LYS  82           H        LYS  82  11.090   5.544  -0.176
  641    HA   LYS  82           HA       LYS  82  12.860   7.270   1.373
  642   1HB   LYS  82          1HB       LYS  82  13.194   5.012  -0.436
  643   2HB   LYS  82          2HB       LYS  82  14.287   6.336  -0.820
  644   1HG   LYS  82          1HG       LYS  82  14.269   5.915   2.007
  645   2HG   LYS  82          2HG       LYS  82  14.562   4.383   1.181
  646   1HD   LYS  82          1HD       LYS  82  16.042   6.791   0.251
  647   2HD   LYS  82          2HD       LYS  82  16.536   6.043   1.772
  648   1HE   LYS  82          1HE       LYS  82  16.218   3.901   0.053
  649   2HE   LYS  82          2HE       LYS  82  16.935   5.149  -0.964
  650   1HZ   LYS  82          1HZ       LYS  82  18.051   4.459   1.687
  651   2HZ   LYS  82          2HZ       LYS  82  18.796   5.301   0.423
  652   3HZ   LYS  82          3HZ       LYS  82  18.514   3.639   0.281
  653    H    GLU  83           H        GLU  83  13.039   9.347   0.884
  654    HA   GLU  83           HA       GLU  83  11.891  10.526  -1.403
  655   1HB   GLU  83          1HB       GLU  83  13.619  11.455   0.832
  656   2HB   GLU  83          2HB       GLU  83  13.545  12.467  -0.603
  657   1HG   GLU  83          1HG       GLU  83  11.810  13.385   0.488
  658   2HG   GLU  83          2HG       GLU  83  10.930  12.041  -0.238
  659    H    ASP  84           H        ASP  84  15.143   9.432  -0.674
  660    HA   ASP  84           HA       ASP  84  16.537  10.667  -2.751
  661   1HB   ASP  84          1HB       ASP  84  17.231   9.000  -0.730
  662   2HB   ASP  84          2HB       ASP  84  17.342   7.898  -2.099
  663    H    THR  85           H        THR  85  14.586   7.743  -2.719
  664    HA   THR  85           HA       THR  85  15.081   7.409  -5.601
  665    HB   THR  85           HB       THR  85  13.838   5.137  -5.069
  666    HG1  THR  85           HG1      THR  85  15.080   5.726  -2.573
  667   1HG2  THR  85          1HG2      THR  85  16.276   4.385  -4.176
  668   2HG2  THR  85          2HG2      THR  85  16.663   5.961  -4.866
  669   3HG2  THR  85          3HG2      THR  85  15.912   4.719  -5.868
  670    H    ARG  86           H        ARG  86  13.020   9.014  -3.788
  671    HA   ARG  86           HA       ARG  86  10.477   8.056  -4.655
  672   1HB   ARG  86          1HB       ARG  86  10.788   9.408  -2.605
  673   2HB   ARG  86          2HB       ARG  86  11.234  10.787  -3.602
  674   1HG   ARG  86          1HG       ARG  86   9.093  11.172  -4.278
  675   2HG   ARG  86          2HG       ARG  86   8.624   9.477  -4.129
  676   1HD   ARG  86          1HD       ARG  86   7.977   9.725  -1.997
  677   2HD   ARG  86          2HD       ARG  86   9.376  10.719  -1.593
  678    HE   ARG  86           HE       ARG  86   6.759  11.635  -2.339
  679   1HH1  ARG  86          1HH1      ARG  86  10.146  12.435  -2.247
  680   2HH1  ARG  86          2HH1      ARG  86   9.875  14.146  -2.242
  681   1HH2  ARG  86          1HH2      ARG  86   6.389  13.885  -2.332
  682   2HH2  ARG  86          2HH2      ARG  86   7.738  14.970  -2.289
  683    H    LEU  87           H        LEU  87   9.615   8.254  -6.605
  684    HA   LEU  87           HA       LEU  87  10.716  10.243  -8.453
  685   1HB   LEU  87          1HB       LEU  87   9.731   7.548  -8.705
  686   2HB   LEU  87          2HB       LEU  87   8.873   8.626  -9.804
  687    HG   LEU  87           HG       LEU  87  11.853   8.166  -9.697
  688   1HD1  LEU  87          1HD1      LEU  87   9.713   7.366 -11.655
  689   2HD1  LEU  87          2HD1      LEU  87  10.776   6.312 -10.723
  690   3HD1  LEU  87          3HD1      LEU  87  11.438   7.313 -12.016
  691   1HD2  LEU  87          1HD2      LEU  87  11.811   9.574 -11.788
  692   2HD2  LEU  87          2HD2      LEU  87  11.541  10.442 -10.276
  693   3HD2  LEU  87          3HD2      LEU  87  10.179  10.060 -11.330
  694    H    GLU  88           H        GLU  88   7.548   8.933  -7.471
  695    HA   GLU  88           HA       GLU  88   6.402  11.597  -7.965
  696   1HB   GLU  88          1HB       GLU  88   5.871   9.378  -9.522
  697   2HB   GLU  88          2HB       GLU  88   4.529   9.394  -8.386
  698   1HG   GLU  88          1HG       GLU  88   3.902  10.607 -10.347
  699   2HG   GLU  88          2HG       GLU  88   4.077  11.740  -9.009
  700    H    GLY  89           H        GLY  89   4.081  11.657  -6.962
  701   1HA   GLY  89          1HA       GLY  89   2.655  11.151  -5.159
  702   2HA   GLY  89          2HA       GLY  89   3.898  10.097  -4.500
  703    HA   PRO  90           HA       PRO  90   3.294   9.982  -2.527
  704   1HB   PRO  90          1HB       PRO  90   1.834  10.837  -0.404
  705   2HB   PRO  90          2HB       PRO  90   3.571  10.523  -0.311
  706   1HG   PRO  90          1HG       PRO  90   2.131  13.128  -0.633
  707   2HG   PRO  90          2HG       PRO  90   3.521  12.738   0.398
  708   1HD   PRO  90          1HD       PRO  90   3.781  14.014  -1.976
  709   2HD   PRO  90          2HD       PRO  90   5.021  12.912  -1.343
  710    H    TRP  91           H        TRP  91   1.048   9.165  -2.214
  711    HA   TRP  91           HA       TRP  91  -1.017  10.883  -3.379
  712   1HB   TRP  91          1HB       TRP  91  -0.121   8.216  -4.457
  713   2HB   TRP  91          2HB       TRP  91  -1.733   8.851  -4.776
  714    HD1  TRP  91           HD1      TRP  91  -0.839  11.919  -5.233
  715    HE1  TRP  91           HE1      TRP  91   0.370  12.533  -7.422
  716    HE3  TRP  91           HE3      TRP  91   0.861   7.281  -6.550
  717    HZ2  TRP  91           HZ2      TRP  91   1.848  11.224  -9.439
  718    HZ3  TRP  91           HZ3      TRP  91   2.164   7.048  -8.624
  719    HH2  TRP  91           HH2      TRP  91   2.646   8.979 -10.038
  720    H    GLU  92           H        GLU  92  -2.837  10.773  -2.242
  721    HA   GLU  92           HA       GLU  92  -3.304   8.379  -0.587
  722   1HB   GLU  92          1HB       GLU  92  -4.060  11.248  -0.005
  723   2HB   GLU  92          2HB       GLU  92  -4.505   9.868   0.988
  724   1HG   GLU  92          1HG       GLU  92  -2.620  10.086   2.111
  725   2HG   GLU  92          2HG       GLU  92  -1.713   9.754   0.636
  726    H    TYR  93           H        TYR  93  -5.276   7.423  -0.658
  727    HA   TYR  93           HA       TYR  93  -7.406   8.734  -2.194
  728   1HB   TYR  93          1HB       TYR  93  -6.384   5.922  -2.622
  729   2HB   TYR  93          2HB       TYR  93  -7.895   6.531  -3.289
  730    HD1  TYR  93           HD1      TYR  93  -7.887   8.173  -5.093
  731    HD2  TYR  93           HD2      TYR  93  -4.249   6.628  -3.518
  732    HE1  TYR  93           HE1      TYR  93  -6.677   9.045  -7.049
  733    HE2  TYR  93           HE2      TYR  93  -3.029   7.497  -5.469
  734    HH   TYR  93           HH       TYR  93  -4.594   8.612  -8.268
  735    H    GLY  94           H        GLY  94  -9.541   7.734  -1.861
  736   1HA   GLY  94          1HA       GLY  94 -11.175   6.732  -0.570
  737   2HA   GLY  94          2HA       GLY  94  -9.907   5.903   0.321
  738    H    GLU  95           H        GLU  95 -10.920   6.289   2.308
  739    HA   GLU  95           HA       GLU  95 -11.460   7.432   4.205
  740   1HB   GLU  95          1HB       GLU  95  -9.052   7.784   4.243
  741   2HB   GLU  95          2HB       GLU  95  -9.216   9.188   3.198
  742   1HG   GLU  95          1HG       GLU  95 -10.513  10.317   4.958
  743   2HG   GLU  95          2HG       GLU  95 -10.263   8.923   6.007
  Start of MODEL   22
    1   1H    ALA   2          1H        ALA   2 -14.199   2.526  19.373
    2    HA   ALA   2           HA       ALA   2 -13.568   1.853  16.913
    3   1HB   ALA   2          1HB       ALA   2 -12.507   3.918  16.559
    4   2HB   ALA   2          2HB       ALA   2 -13.602   4.192  17.914
    5   3HB   ALA   2          3HB       ALA   2 -11.877   3.972  18.206
    6    H    ARG   3           H        ARG   3 -12.542  -0.291  17.266
    7    HA   ARG   3           HA       ARG   3  -9.909  -0.605  18.165
    8   1HB   ARG   3          1HB       ARG   3 -11.907  -2.217  16.855
    9   2HB   ARG   3          2HB       ARG   3 -10.328  -2.513  16.139
   10   1HG   ARG   3          1HG       ARG   3 -10.568  -2.499  19.103
   11   2HG   ARG   3          2HG       ARG   3 -11.168  -3.893  18.203
   12   1HD   ARG   3          1HD       ARG   3  -9.069  -4.649  18.263
   13   2HD   ARG   3          2HD       ARG   3  -8.713  -3.416  17.054
   14    HE   ARG   3           HE       ARG   3  -8.536  -2.299  19.636
   15   1HH1  ARG   3          1HH1      ARG   3  -6.865  -4.489  17.507
   16   2HH1  ARG   3          2HH1      ARG   3  -5.306  -4.175  18.196
   17   1HH2  ARG   3          1HH2      ARG   3  -6.490  -1.877  20.550
   18   2HH2  ARG   3          2HH2      ARG   3  -5.094  -2.690  19.927
   19    H    GLN   4           H        GLN   4  -7.939  -0.477  17.192
   20    HA   GLN   4           HA       GLN   4  -7.861   0.912  14.622
   21   1HB   GLN   4          1HB       GLN   4  -5.556   1.455  15.178
   22   2HB   GLN   4          2HB       GLN   4  -6.618   1.887  16.511
   23   1HG   GLN   4          1HG       GLN   4  -5.851   0.160  17.853
   24   2HG   GLN   4          2HG       GLN   4  -5.208  -0.747  16.485
   25   1HE2  GLN   4          1HE2      GLN   4  -3.117  -0.577  16.057
   26   2HE2  GLN   4          2HE2      GLN   4  -2.047   0.605  16.721
   27    H    VAL   5           H        VAL   5  -6.520   0.228  12.908
   28    HA   VAL   5           HA       VAL   5  -5.751  -2.617  13.019
   29    HB   VAL   5           HB       VAL   5  -6.346  -2.848  10.674
   30   1HG1  VAL   5          1HG1      VAL   5  -8.268  -2.163  12.754
   31   2HG1  VAL   5          2HG1      VAL   5  -8.907  -1.962  11.121
   32   3HG1  VAL   5          3HG1      VAL   5  -8.252  -3.520  11.628
   33   1HG2  VAL   5          1HG2      VAL   5  -6.223  -0.037  10.674
   34   2HG2  VAL   5          2HG2      VAL   5  -6.562  -1.105   9.312
   35   3HG2  VAL   5          3HG2      VAL   5  -7.888  -0.468  10.284
   36    H    ILE   6           H        ILE   6  -4.014  -3.244  11.573
   37    HA   ILE   6           HA       ILE   6  -1.950  -1.206  11.480
   38    HB   ILE   6           HB       ILE   6  -1.734  -4.105  10.670
   39   1HG1  ILE   6          1HG1      ILE   6  -0.477  -3.906  13.087
   40   2HG1  ILE   6          2HG1      ILE   6  -1.835  -2.810  13.315
   41   1HG2  ILE   6          1HG2      ILE   6   0.177  -3.206   9.832
   42   2HG2  ILE   6          2HG2      ILE   6   0.175  -1.860  10.970
   43   3HG2  ILE   6          3HG2      ILE   6   0.711  -3.456  11.494
   44   1HD1  ILE   6          1HD1      ILE   6  -2.760  -4.759  14.032
   45   2HD1  ILE   6          2HD1      ILE   6  -3.191  -4.835  12.324
   46   3HD1  ILE   6          3HD1      ILE   6  -1.808  -5.749  12.926
   47    H    CYS   7           H        CYS   7  -0.774  -0.643   9.616
   48    HA   CYS   7           HA       CYS   7  -2.364  -0.527   7.227
   49   1HB   CYS   7          1HB       CYS   7  -0.696   0.939   6.370
   50   2HB   CYS   7          2HB       CYS   7  -0.864   1.327   8.078
   51    HG   CYS   7           HG       CYS   7   1.813   1.544   7.586
   52    H    TRP   8           H        TRP   8  -1.663  -1.232   5.126
   53    HA   TRP   8           HA       TRP   8  -0.095  -3.717   5.269
   54   1HB   TRP   8          1HB       TRP   8  -2.235  -2.826   3.330
   55   2HB   TRP   8          2HB       TRP   8  -1.265  -4.280   3.111
   56    HD1  TRP   8           HD1      TRP   8  -3.604  -2.813   5.850
   57    HE1  TRP   8           HE1      TRP   8  -4.919  -4.768   6.888
   58    HE3  TRP   8           HE3      TRP   8  -1.504  -6.678   3.244
   59    HZ2  TRP   8           HZ2      TRP   8  -5.048  -7.576   6.636
   60    HZ3  TRP   8           HZ3      TRP   8  -2.279  -8.968   3.703
   61    HH2  TRP   8           HH2      TRP   8  -4.014  -9.406   5.364
   62    H    CYS   9           H        CYS   9   1.918  -3.546   4.556
   63    HA   CYS   9           HA       CYS   9   2.561  -1.509   2.550
   64   1HB   CYS   9          1HB       CYS   9   4.929  -1.965   3.202
   65   2HB   CYS   9          2HB       CYS   9   3.929  -1.389   4.530
   66    HG   CYS   9           HG       CYS   9   5.892  -3.848   4.648
   67    H    PHE  10           H        PHE  10   2.816  -2.080   0.503
   68    HA   PHE  10           HA       PHE  10   3.857  -4.748  -0.122
   69   1HB   PHE  10          1HB       PHE  10   2.138  -5.322  -1.564
   70   2HB   PHE  10          2HB       PHE  10   1.255  -4.481  -0.294
   71    HD1  PHE  10           HD2      PHE  10   0.327  -2.269  -0.677
   72    HD2  PHE  10           HD1      PHE  10   2.382  -4.369  -3.757
   73    HE1  PHE  10           HE2      PHE  10  -0.601  -0.720  -2.348
   74    HE2  PHE  10           HE1      PHE  10   1.458  -2.823  -5.433
   75    HZ   PHE  10           HZ       PHE  10  -0.037  -0.996  -4.730
   76    H    THR  11           H        THR  11   4.555  -4.919  -2.425
   77    HA   THR  11           HA       THR  11   5.354  -2.324  -3.553
   78    HB   THR  11           HB       THR  11   7.193  -4.715  -3.341
   79    HG1  THR  11           HG1      THR  11   6.992  -3.750  -1.316
   80   1HG2  THR  11          1HG2      THR  11   8.026  -3.630  -5.170
   81   2HG2  THR  11          2HG2      THR  11   8.813  -2.679  -3.910
   82   3HG2  THR  11          3HG2      THR  11   7.352  -2.073  -4.690
   83    H    LEU  12           H        LEU  12   5.115  -2.154  -5.706
   84    HA   LEU  12           HA       LEU  12   4.589  -4.619  -7.232
   85   1HB   LEU  12          1HB       LEU  12   2.489  -3.622  -7.062
   86   2HB   LEU  12          2HB       LEU  12   3.145  -1.996  -7.235
   87    HG   LEU  12           HG       LEU  12   3.418  -2.259  -9.577
   88   1HD1  LEU  12          1HD1      LEU  12   3.278  -5.122  -8.925
   89   2HD1  LEU  12          2HD1      LEU  12   4.184  -4.283 -10.183
   90   3HD1  LEU  12          3HD1      LEU  12   2.475  -4.644 -10.421
   91   1HD2  LEU  12          1HD2      LEU  12   1.127  -1.802  -8.791
   92   2HD2  LEU  12          2HD2      LEU  12   0.791  -3.533  -8.817
   93   3HD2  LEU  12          3HD2      LEU  12   1.154  -2.681 -10.319
   94    H    ASN  13           H        ASN  13   6.067  -4.940  -8.746
   95    HA   ASN  13           HA       ASN  13   7.622  -2.669  -9.739
   96   1HB   ASN  13          1HB       ASN  13   9.221  -4.310 -10.535
   97   2HB   ASN  13          2HB       ASN  13   8.825  -4.656  -8.854
   98   1HD2  ASN  13          1HD2      ASN  13   8.058  -6.604  -8.336
   99   2HD2  ASN  13          2HD2      ASN  13   7.652  -7.842  -9.470
  100    H    ASN  14           H        ASN  14   7.603  -2.010 -11.825
  101    HA   ASN  14           HA       ASN  14   6.735  -1.646 -13.902
  102   1HB   ASN  14          1HB       ASN  14   8.155  -3.816 -14.101
  103   2HB   ASN  14          2HB       ASN  14   6.599  -4.628 -14.247
  104   1HD2  ASN  14          1HD2      ASN  14   5.169  -3.892 -15.964
  105   2HD2  ASN  14          2HD2      ASN  14   5.862  -3.314 -17.437
  106    HA   PRO  15           HA       PRO  15   2.418  -2.719 -12.452
  107   1HB   PRO  15          1HB       PRO  15   1.568  -0.149 -12.239
  108   2HB   PRO  15          2HB       PRO  15   2.366  -1.010 -10.917
  109   1HG   PRO  15          1HG       PRO  15   3.514   0.951 -12.866
  110   2HG   PRO  15          2HG       PRO  15   3.780   0.826 -11.117
  111   1HD   PRO  15          1HD       PRO  15   5.552  -0.121 -12.931
  112   2HD   PRO  15          2HD       PRO  15   5.311  -0.881 -11.345
  113    H    LEU  16           H        LEU  16   0.713  -2.883 -13.821
  114    HA   LEU  16           HA       LEU  16   1.075  -1.890 -16.526
  115   1HB   LEU  16          1HB       LEU  16  -0.889  -3.779 -15.257
  116   2HB   LEU  16          2HB       LEU  16  -1.040  -3.239 -16.928
  117    HG   LEU  16           HG       LEU  16   1.498  -4.529 -16.019
  118   1HD1  LEU  16          1HD1      LEU  16   0.600  -6.529 -15.692
  119   2HD1  LEU  16          2HD1      LEU  16  -0.280  -6.435 -17.217
  120   3HD1  LEU  16          3HD1      LEU  16  -0.995  -5.778 -15.744
  121   1HD2  LEU  16          1HD2      LEU  16   0.029  -4.091 -18.585
  122   2HD2  LEU  16          2HD2      LEU  16   1.186  -5.416 -18.446
  123   3HD2  LEU  16          3HD2      LEU  16   1.713  -3.752 -18.182
  124    H    SER  17           H        SER  17  -0.430  -0.851 -13.719
  125    HA   SER  17           HA       SER  17  -1.579   1.415 -14.925
  126   1HB   SER  17          1HB       SER  17  -3.245  -0.905 -14.986
  127   2HB   SER  17          2HB       SER  17  -3.942   0.245 -13.846
  128    HG   SER  17           HG       SER  17  -4.695   0.670 -15.930
  129    HA   PRO  18           HA       PRO  18  -1.478   2.859 -10.785
  130   1HB   PRO  18          1HB       PRO  18  -3.509   4.660 -10.747
  131   2HB   PRO  18          2HB       PRO  18  -1.988   4.945 -11.602
  132   1HG   PRO  18          1HG       PRO  18  -4.624   4.021 -12.680
  133   2HG   PRO  18          2HG       PRO  18  -3.495   5.211 -13.353
  134   1HD   PRO  18          1HD       PRO  18  -3.639   2.664 -14.261
  135   2HD   PRO  18          2HD       PRO  18  -2.125   3.590 -14.251
  136    H    LEU  19           H        LEU  19  -2.451   2.703  -8.744
  137    HA   LEU  19           HA       LEU  19  -4.354   0.603  -8.461
  138   1HB   LEU  19          1HB       LEU  19  -3.577   2.504  -6.277
  139   2HB   LEU  19          2HB       LEU  19  -4.036   0.807  -6.149
  140    HG   LEU  19           HG       LEU  19  -1.448   1.847  -7.304
  141   1HD1  LEU  19          1HD1      LEU  19  -1.839   0.308  -4.754
  142   2HD1  LEU  19          2HD1      LEU  19  -1.797   2.070  -4.806
  143   3HD1  LEU  19          3HD1      LEU  19  -0.391   1.139  -5.323
  144   1HD2  LEU  19          1HD2      LEU  19  -1.248  -0.862  -6.661
  145   2HD2  LEU  19          2HD2      LEU  19  -1.296  -0.147  -8.273
  146   3HD2  LEU  19          3HD2      LEU  19  -2.787  -0.696  -7.507
  147    H    SER  20           H        SER  20  -6.267   0.926  -6.907
  148    HA   SER  20           HA       SER  20  -7.594   3.498  -7.199
  149   1HB   SER  20          1HB       SER  20  -8.837   0.945  -8.252
  150   2HB   SER  20          2HB       SER  20  -9.617   2.526  -8.189
  151    HG   SER  20           HG       SER  20  -8.122   3.288  -9.677
  152    H    LEU  21           H        LEU  21  -9.288   3.826  -5.730
  153    HA   LEU  21           HA       LEU  21  -9.029   2.734  -3.217
  154   1HB   LEU  21          1HB       LEU  21 -10.198   4.772  -3.463
  155   2HB   LEU  21          2HB       LEU  21 -11.372   4.050  -4.561
  156    HG   LEU  21           HG       LEU  21 -12.234   2.708  -2.640
  157   1HD1  LEU  21          1HD1      LEU  21 -11.355   4.315  -0.504
  158   2HD1  LEU  21          2HD1      LEU  21  -9.914   3.800  -1.379
  159   3HD1  LEU  21          3HD1      LEU  21 -11.052   2.598  -0.770
  160   1HD2  LEU  21          1HD2      LEU  21 -13.068   4.922  -1.420
  161   2HD2  LEU  21          2HD2      LEU  21 -13.649   4.443  -3.015
  162   3HD2  LEU  21          3HD2      LEU  21 -12.379   5.658  -2.867
  163    H    HIS  22           H        HIS  22 -10.286   1.261  -1.990
  164    HA   HIS  22           HA       HIS  22 -11.652  -0.780  -3.619
  165   1HB   HIS  22          1HB       HIS  22  -9.409  -1.364  -2.474
  166   2HB   HIS  22          2HB       HIS  22 -10.337  -1.363  -0.977
  167    HD1  HIS  22           HD1      HIS  22 -10.489  -3.785  -0.421
  168    HD2  HIS  22           HD2      HIS  22 -11.443  -3.022  -4.393
  169    HE1  HIS  22           HE1      HIS  22 -11.298  -5.977  -1.352
  170    H    ASP  23           H        ASP  23 -13.691  -1.276  -3.104
  171    HA   ASP  23           HA       ASP  23 -15.204   0.273  -1.351
  172   1HB   ASP  23          1HB       ASP  23 -15.885  -1.358  -3.316
  173   2HB   ASP  23          2HB       ASP  23 -16.089  -2.507  -1.996
  174    H    SER  24           H        SER  24 -13.259  -2.509  -0.759
  175    HA   SER  24           HA       SER  24 -14.523  -3.142   1.770
  176   1HB   SER  24          1HB       SER  24 -11.871  -4.230   0.854
  177   2HB   SER  24          2HB       SER  24 -13.085  -4.996   1.878
  178    HG   SER  24           HG       SER  24 -13.459  -5.935  -0.017
  179    H    MET  25           H        MET  25 -11.566  -1.598   0.618
  180    HA   MET  25           HA       MET  25 -10.478  -1.215   3.240
  181   1HB   MET  25          1HB       MET  25  -8.673  -0.183   2.193
  182   2HB   MET  25          2HB       MET  25  -9.232  -1.318   0.972
  183   1HG   MET  25          1HG       MET  25 -10.294   0.409  -0.264
  184   2HG   MET  25          2HG       MET  25 -10.049   1.572   1.037
  185   1HE   MET  25          1HE       MET  25  -8.160  -1.128  -0.661
  186   2HE   MET  25          2HE       MET  25  -7.831  -0.193  -2.120
  187   3HE   MET  25          3HE       MET  25  -6.544  -0.480  -0.948
  188    H    LYS  26           H        LYS  26  -9.676   1.288   3.520
  189    HA   LYS  26           HA       LYS  26 -12.112   2.939   3.387
  190   1HB   LYS  26          1HB       LYS  26 -10.752   1.989   5.706
  191   2HB   LYS  26          2HB       LYS  26 -10.525   3.731   5.618
  192   1HG   LYS  26          1HG       LYS  26 -13.257   2.617   5.225
  193   2HG   LYS  26          2HG       LYS  26 -12.587   2.698   6.856
  194   1HD   LYS  26          1HD       LYS  26 -12.222   5.085   6.616
  195   2HD   LYS  26          2HD       LYS  26 -12.797   5.027   4.948
  196   1HE   LYS  26          1HE       LYS  26 -14.671   5.764   6.080
  197   2HE   LYS  26          2HE       LYS  26 -14.949   4.025   6.002
  198   1HZ   LYS  26          1HZ       LYS  26 -13.836   3.966   8.272
  199   2HZ   LYS  26          2HZ       LYS  26 -15.403   4.599   8.197
  200   3HZ   LYS  26          3HZ       LYS  26 -14.075   5.641   8.316
  201    H    TYR  27           H        TYR  27  -8.588   2.863   3.523
  202    HA   TYR  27           HA       TYR  27  -8.551   5.437   2.110
  203   1HB   TYR  27          1HB       TYR  27  -7.966   5.475   4.680
  204   2HB   TYR  27          2HB       TYR  27  -6.414   4.860   4.122
  205    HD1  TYR  27           HD1      TYR  27  -8.804   7.494   2.951
  206    HD2  TYR  27           HD2      TYR  27  -4.802   6.492   3.989
  207    HE1  TYR  27           HE1      TYR  27  -8.096   9.787   2.411
  208    HE2  TYR  27           HE2      TYR  27  -4.083   8.782   3.453
  209    HH   TYR  27           HH       TYR  27  -5.135  11.060   3.328
  210    H    LEU  28           H        LEU  28  -6.809   5.740   0.692
  211    HA   LEU  28           HA       LEU  28  -5.129   3.372   0.212
  212   1HB   LEU  28          1HB       LEU  28  -6.674   3.194  -1.509
  213   2HB   LEU  28          2HB       LEU  28  -6.795   4.940  -1.712
  214    HG   LEU  28           HG       LEU  28  -4.703   5.022  -2.866
  215   1HD1  LEU  28          1HD1      LEU  28  -3.109   3.607  -2.229
  216   2HD1  LEU  28          2HD1      LEU  28  -3.883   2.414  -3.272
  217   3HD1  LEU  28          3HD1      LEU  28  -4.279   2.472  -1.555
  218   1HD2  LEU  28          1HD2      LEU  28  -6.565   4.446  -4.263
  219   2HD2  LEU  28          2HD2      LEU  28  -6.432   2.744  -3.819
  220   3HD2  LEU  28          3HD2      LEU  28  -5.166   3.506  -4.783
  221    H    VAL  29           H        VAL  29  -3.024   3.802   0.137
  222    HA   VAL  29           HA       VAL  29  -2.131   6.476  -0.676
  223    HB   VAL  29           HB       VAL  29  -1.189   5.046   1.814
  224   1HG1  VAL  29          1HG1      VAL  29   0.000   7.168   0.175
  225   2HG1  VAL  29          2HG1      VAL  29  -0.087   7.530   1.900
  226   3HG1  VAL  29          3HG1      VAL  29   0.748   6.079   1.343
  227   1HG2  VAL  29          1HG2      VAL  29  -3.033   6.079   2.619
  228   2HG2  VAL  29          2HG2      VAL  29  -1.964   7.481   2.644
  229   3HG2  VAL  29          3HG2      VAL  29  -3.085   7.251   1.303
  230    H    TYR  30           H        TYR  30  -0.656   6.315  -2.220
  231    HA   TYR  30           HA       TYR  30   1.421   4.303  -2.093
  232   1HB   TYR  30          1HB       TYR  30   0.919   3.123  -4.025
  233   2HB   TYR  30          2HB       TYR  30  -0.683   3.381  -3.343
  234    HD1  TYR  30           HD2      TYR  30  -2.234   4.963  -4.372
  235    HD2  TYR  30           HD1      TYR  30   1.607   4.244  -6.055
  236    HE1  TYR  30           HE2      TYR  30  -2.956   6.036  -6.464
  237    HE2  TYR  30           HE1      TYR  30   0.896   5.316  -8.151
  238    HH   TYR  30           HH       TYR  30  -2.259   6.870  -8.441
  239    H    GLN  31           H        GLN  31   3.122   4.664  -3.672
  240    HA   GLN  31           HA       GLN  31   3.057   7.211  -5.086
  241   1HB   GLN  31          1HB       GLN  31   4.854   8.198  -3.997
  242   2HB   GLN  31          2HB       GLN  31   3.973   7.456  -2.669
  243   1HG   GLN  31          1HG       GLN  31   5.512   5.568  -2.689
  244   2HG   GLN  31          2HG       GLN  31   6.390   6.294  -4.034
  245   1HE2  GLN  31          1HE2      GLN  31   5.054   7.765  -1.110
  246   2HE2  GLN  31          2HE2      GLN  31   6.559   8.369  -0.514
  247    H    THR  32           H        THR  32   4.786   7.454  -6.629
  248    HA   THR  32           HA       THR  32   5.672   4.865  -7.654
  249    HB   THR  32           HB       THR  32   5.814   7.579  -8.982
  250    HG1  THR  32           HG1      THR  32   4.005   6.616 -10.209
  251   1HG2  THR  32          1HG2      THR  32   7.078   6.552 -10.503
  252   2HG2  THR  32          2HG2      THR  32   5.719   5.486 -10.858
  253   3HG2  THR  32          3HG2      THR  32   6.918   5.015  -9.654
  254    H    GLU  33           H        GLU  33   7.780   4.288  -7.907
  255    HA   GLU  33           HA       GLU  33   9.844   6.238  -7.156
  256   1HB   GLU  33          1HB       GLU  33   9.253   3.611  -5.891
  257   2HB   GLU  33          2HB       GLU  33  10.944   4.046  -6.099
  258   1HG   GLU  33          1HG       GLU  33  10.882   5.521  -4.436
  259   2HG   GLU  33          2HG       GLU  33   9.353   6.207  -4.983
  260    H    GLN  34           H        GLN  34  12.053   5.501  -7.779
  261    HA   GLN  34           HA       GLN  34  11.929   4.231 -10.411
  262   1HB   GLN  34          1HB       GLN  34  13.299   6.469  -9.417
  263   2HB   GLN  34          2HB       GLN  34  14.536   5.250  -9.696
  264   1HG   GLN  34          1HG       GLN  34  12.781   5.267 -11.929
  265   2HG   GLN  34          2HG       GLN  34  13.252   6.928 -11.574
  266   1HE2  GLN  34          1HE2      GLN  34  15.670   7.141 -11.075
  267   2HE2  GLN  34          2HE2      GLN  34  16.733   6.318 -12.159
  268    H    GLY  35           H        GLY  35  13.036   2.400 -10.940
  269   1HA   GLY  35          1HA       GLY  35  14.974   1.254  -9.119
  270   2HA   GLY  35          2HA       GLY  35  13.458   0.371  -9.215
  271    H    GLU  36           H        GLU  36  13.717  -1.373 -10.433
  272    HA   GLU  36           HA       GLU  36  15.717  -1.999 -12.157
  273   1HB   GLU  36          1HB       GLU  36  13.955  -3.444 -13.360
  274   2HB   GLU  36          2HB       GLU  36  14.246  -3.740 -11.652
  275   1HG   GLU  36          1HG       GLU  36  12.262  -2.511 -11.055
  276   2HG   GLU  36          2HG       GLU  36  11.996  -2.064 -12.739
  277    H    ALA  37           H        ALA  37  16.504  -0.893 -13.817
  278    HA   ALA  37           HA       ALA  37  16.651   0.441 -15.662
  279   1HB   ALA  37          1HB       ALA  37  15.165  -1.759 -16.292
  280   2HB   ALA  37          2HB       ALA  37  14.120  -0.444 -16.832
  281   3HB   ALA  37          3HB       ALA  37  15.766  -0.573 -17.452
  282    H    GLY  38           H        GLY  38  14.885   1.723 -17.283
  283   1HA   GLY  38          1HA       GLY  38  14.218   4.016 -15.834
  284   2HA   GLY  38          2HA       GLY  38  13.614   3.627 -17.438
  285    H    ASN  39           H        ASN  39  12.452   1.078 -16.256
  286    HA   ASN  39           HA       ASN  39   9.827   1.874 -15.999
  287   1HB   ASN  39          1HB       ASN  39  10.964  -0.521 -14.556
  288   2HB   ASN  39          2HB       ASN  39   9.342  -0.322 -15.213
  289   1HD2  ASN  39          1HD2      ASN  39  12.012  -1.985 -15.673
  290   2HD2  ASN  39          2HD2      ASN  39  12.021  -2.143 -17.393
  291    H    ILE  40           H        ILE  40   8.431   1.537 -14.002
  292    HA   ILE  40           HA       ILE  40   9.770   2.590 -11.601
  293    HB   ILE  40           HB       ILE  40   7.503   3.808 -11.218
  294   1HG1  ILE  40          1HG1      ILE  40   7.526   3.569 -14.235
  295   2HG1  ILE  40          2HG1      ILE  40   6.369   2.789 -13.162
  296   1HG2  ILE  40          1HG2      ILE  40   8.863   5.542 -11.460
  297   2HG2  ILE  40          2HG2      ILE  40   9.973   4.549 -12.403
  298   3HG2  ILE  40          3HG2      ILE  40   8.684   5.441 -13.212
  299   1HD1  ILE  40          1HD1      ILE  40   5.111   4.609 -13.074
  300   2HD1  ILE  40          2HD1      ILE  40   6.496   5.634 -12.693
  301   3HD1  ILE  40          3HD1      ILE  40   6.111   5.260 -14.373
  302    H    HIS  41           H        HIS  41   8.410   2.333  -9.614
  303    HA   HIS  41           HA       HIS  41   6.608   0.022  -9.757
  304   1HB   HIS  41          1HB       HIS  41   7.748  -0.699  -7.529
  305   2HB   HIS  41          2HB       HIS  41   8.527  -1.094  -9.058
  306    HD1  HIS  41           HD1      HIS  41  10.881  -1.155  -8.064
  307    HD2  HIS  41           HD2      HIS  41   8.938   2.476  -7.514
  308    HE1  HIS  41           HE1      HIS  41  12.651   0.439  -7.258
  309    H    PHE  42           H        PHE  42   5.156  -0.173  -7.963
  310    HA   PHE  42           HA       PHE  42   4.580   2.424  -6.735
  311   1HB   PHE  42          1HB       PHE  42   2.859  -0.034  -7.105
  312   2HB   PHE  42          2HB       PHE  42   2.336   1.422  -6.264
  313    HD1  PHE  42           HD1      PHE  42   4.269   2.853  -8.573
  314    HD2  PHE  42           HD2      PHE  42   0.702   0.537  -8.409
  315    HE1  PHE  42           HE1      PHE  42   3.543   3.826 -10.713
  316    HE2  PHE  42           HE2      PHE  42  -0.029   1.506 -10.549
  317    HZ   PHE  42           HZ       PHE  42   1.392   3.152 -11.704
  318    H    GLN  43           H        GLN  43   4.668   2.754  -4.590
  319    HA   GLN  43           HA       GLN  43   4.783   0.478  -2.771
  320   1HB   GLN  43          1HB       GLN  43   7.062   2.184  -3.462
  321   2HB   GLN  43          2HB       GLN  43   6.762   2.082  -1.732
  322   1HG   GLN  43          1HG       GLN  43   7.847   0.160  -1.707
  323   2HG   GLN  43          2HG       GLN  43   6.561  -0.537  -2.692
  324   1HE2  GLN  43          1HE2      GLN  43   9.692  -0.547  -2.513
  325   2HE2  GLN  43          2HE2      GLN  43  10.152  -0.504  -4.177
  326    H    GLY  44           H        GLY  44   3.661   0.854  -0.962
  327   1HA   GLY  44          1HA       GLY  44   3.574   3.291   0.435
  328   2HA   GLY  44          2HA       GLY  44   2.164   3.203  -0.610
  329    H    TYR  45           H        TYR  45   1.115   3.328   1.572
  330    HA   TYR  45           HA       TYR  45   0.832   0.617   2.696
  331   1HB   TYR  45          1HB       TYR  45   0.203   1.774   4.846
  332   2HB   TYR  45          2HB       TYR  45   1.887   1.960   4.368
  333    HD1  TYR  45           HD2      TYR  45   2.637   4.126   3.354
  334    HD2  TYR  45           HD1      TYR  45  -1.217   3.655   5.095
  335    HE1  TYR  45           HE2      TYR  45   2.414   6.570   3.508
  336    HE2  TYR  45           HE1      TYR  45  -1.450   6.098   5.253
  337    HH   TYR  45           HH       TYR  45   0.936   8.266   3.849
  338    H    ILE  46           H        ILE  46  -1.221  -0.123   3.130
  339    HA   ILE  46           HA       ILE  46  -3.471   1.645   2.474
  340    HB   ILE  46           HB       ILE  46  -3.201  -1.177   1.435
  341   1HG1  ILE  46          1HG1      ILE  46  -3.162   1.411  -0.127
  342   2HG1  ILE  46          2HG1      ILE  46  -1.712   0.522   0.327
  343   1HG2  ILE  46          1HG2      ILE  46  -5.480   0.335   1.945
  344   2HG2  ILE  46          2HG2      ILE  46  -5.224   0.475   0.206
  345   3HG2  ILE  46          3HG2      ILE  46  -5.371  -1.117   0.949
  346   1HD1  ILE  46          1HD1      ILE  46  -2.586   0.165  -2.015
  347   2HD1  ILE  46          2HD1      ILE  46  -2.265  -1.286  -1.065
  348   3HD1  ILE  46          3HD1      ILE  46  -3.921  -0.720  -1.277
  349    H    GLU  47           H        GLU  47  -5.068   1.543   3.917
  350    HA   GLU  47           HA       GLU  47  -5.010  -0.637   5.886
  351   1HB   GLU  47          1HB       GLU  47  -6.518   1.957   6.158
  352   2HB   GLU  47          2HB       GLU  47  -6.068   0.825   7.425
  353   1HG   GLU  47          1HG       GLU  47  -3.661   1.594   6.254
  354   2HG   GLU  47          2HG       GLU  47  -4.616   3.071   6.366
  355    H    MET  48           H        MET  48  -6.463  -2.190   5.656
  356    HA   MET  48           HA       MET  48  -8.742  -1.859   3.925
  357   1HB   MET  48          1HB       MET  48  -7.848  -4.189   5.631
  358   2HB   MET  48          2HB       MET  48  -9.203  -4.236   4.511
  359   1HG   MET  48          1HG       MET  48  -6.306  -3.810   3.824
  360   2HG   MET  48          2HG       MET  48  -7.277  -5.243   3.495
  361   1HE   MET  48          1HE       MET  48  -8.779  -5.627   1.888
  362   2HE   MET  48          2HE       MET  48  -9.989  -4.348   1.790
  363   3HE   MET  48          3HE       MET  48  -8.996  -4.733   0.383
  364    H    LYS  49           H        LYS  49 -10.832  -3.070   4.887
  365    HA   LYS  49           HA       LYS  49 -12.105  -1.298   6.561
  366   1HB   LYS  49          1HB       LYS  49 -12.815  -3.604   5.222
  367   2HB   LYS  49          2HB       LYS  49 -13.057  -4.044   6.908
  368   1HG   LYS  49          1HG       LYS  49 -14.553  -2.179   7.224
  369   2HG   LYS  49          2HG       LYS  49 -14.243  -1.614   5.581
  370   1HD   LYS  49          1HD       LYS  49 -15.206  -3.691   4.696
  371   2HD   LYS  49          2HD       LYS  49 -15.531  -4.236   6.343
  372   1HE   LYS  49          1HE       LYS  49 -16.715  -1.798   6.361
  373   2HE   LYS  49          2HE       LYS  49 -16.951  -2.268   4.679
  374   1HZ   LYS  49          1HZ       LYS  49 -18.463  -3.054   6.832
  375   2HZ   LYS  49          2HZ       LYS  49 -17.539  -4.417   6.447
  376   3HZ   LYS  49          3HZ       LYS  49 -18.520  -3.701   5.269
  377    H    LYS  50           H        LYS  50 -11.012  -4.549   7.553
  378    HA   LYS  50           HA       LYS  50  -9.690  -3.771   9.872
  379   1HB   LYS  50          1HB       LYS  50 -12.556  -3.703  10.126
  380   2HB   LYS  50          2HB       LYS  50 -11.895  -4.947  11.179
  381   1HG   LYS  50          1HG       LYS  50 -10.511  -3.369  12.304
  382   2HG   LYS  50          2HG       LYS  50 -10.899  -2.109  11.130
  383   1HD   LYS  50          1HD       LYS  50 -12.376  -1.500  12.739
  384   2HD   LYS  50          2HD       LYS  50 -13.376  -2.719  11.947
  385   1HE   LYS  50          1HE       LYS  50 -12.045  -4.290  13.658
  386   2HE   LYS  50          2HE       LYS  50 -12.010  -2.783  14.573
  387   1HZ   LYS  50          1HZ       LYS  50 -14.135  -4.591  14.269
  388   2HZ   LYS  50          2HZ       LYS  50 -14.595  -3.116  13.583
  389   3HZ   LYS  50          3HZ       LYS  50 -14.083  -3.175  15.194
  390    H    ARG  51           H        ARG  51 -12.175  -6.285   9.410
  391    HA   ARG  51           HA       ARG  51 -10.215  -8.323  10.089
  392   1HB   ARG  51          1HB       ARG  51 -12.761  -8.128  10.815
  393   2HB   ARG  51          2HB       ARG  51 -13.011  -9.004   9.311
  394   1HG   ARG  51          1HG       ARG  51 -11.978 -10.899  10.080
  395   2HG   ARG  51          2HG       ARG  51 -10.988 -10.016  11.245
  396   1HD   ARG  51          1HD       ARG  51 -12.983  -9.601  12.610
  397   2HD   ARG  51          2HD       ARG  51 -13.958 -10.501  11.449
  398    HE   ARG  51           HE       ARG  51 -11.771 -12.039  12.454
  399   1HH1  ARG  51          1HH1      ARG  51 -15.000 -10.941  13.155
  400   2HH1  ARG  51          2HH1      ARG  51 -15.361 -12.266  14.211
  401   1HH2  ARG  51          1HH2      ARG  51 -12.235 -13.788  13.842
  402   2HH2  ARG  51          2HH2      ARG  51 -13.787 -13.885  14.602
  403    H    THR  52           H        THR  52  -9.550  -7.128   7.722
  404    HA   THR  52           HA       THR  52 -10.383  -9.052   5.656
  405    HB   THR  52           HB       THR  52  -8.898  -6.510   5.061
  406    HG1  THR  52           HG1      THR  52 -11.733  -6.760   5.227
  407   1HG2  THR  52          1HG2      THR  52 -10.149  -6.717   2.926
  408   2HG2  THR  52          2HG2      THR  52 -10.835  -8.232   3.511
  409   3HG2  THR  52          3HG2      THR  52  -9.097  -8.094   3.247
  410    H    SER  53           H        SER  53  -8.996 -10.652   5.328
  411    HA   SER  53           HA       SER  53  -6.268 -10.509   6.200
  412   1HB   SER  53          1HB       SER  53  -6.206 -12.806   4.962
  413   2HB   SER  53          2HB       SER  53  -7.160 -12.652   6.437
  414    HG   SER  53           HG       SER  53  -8.060 -12.669   3.756
  415    H    LEU  54           H        LEU  54  -4.640 -11.587   4.492
  416    HA   LEU  54           HA       LEU  54  -3.977  -9.611   2.666
  417   1HB   LEU  54          1HB       LEU  54  -2.401 -11.284   3.481
  418   2HB   LEU  54          2HB       LEU  54  -3.261 -12.539   2.592
  419    HG   LEU  54           HG       LEU  54  -2.618 -11.436   0.477
  420   1HD1  LEU  54          1HD1      LEU  54  -2.345  -9.168   1.649
  421   2HD1  LEU  54          2HD1      LEU  54  -1.204  -9.590   0.372
  422   3HD1  LEU  54          3HD1      LEU  54  -0.728  -9.736   2.064
  423   1HD2  LEU  54          1HD2      LEU  54  -0.389 -12.192   2.359
  424   2HD2  LEU  54          2HD2      LEU  54  -0.197 -12.001   0.616
  425   3HD2  LEU  54          3HD2      LEU  54  -1.264 -13.253   1.255
  426    H    ALA  55           H        ALA  55  -6.109 -12.343   2.320
  427    HA   ALA  55           HA       ALA  55  -6.253 -12.602  -0.436
  428   1HB   ALA  55          1HB       ALA  55  -7.358 -14.081   1.235
  429   2HB   ALA  55          2HB       ALA  55  -8.588 -12.836   1.454
  430   3HB   ALA  55          3HB       ALA  55  -8.396 -13.620  -0.115
  431    H    GLY  56           H        GLY  56  -7.678 -10.182   1.667
  432   1HA   GLY  56          1HA       GLY  56  -9.440  -9.083  -0.293
  433   2HA   GLY  56          2HA       GLY  56  -8.966  -8.324   1.219
  434    H    MET  57           H        MET  57  -6.244  -8.107   0.921
  435    HA   MET  57           HA       MET  57  -6.057  -5.836  -0.788
  436   1HB   MET  57          1HB       MET  57  -4.010  -7.363   0.816
  437   2HB   MET  57          2HB       MET  57  -3.602  -5.946  -0.142
  438   1HG   MET  57          1HG       MET  57  -5.859  -5.603   1.704
  439   2HG   MET  57          2HG       MET  57  -4.294  -5.885   2.463
  440   1HE   MET  57          1HE       MET  57  -4.666  -2.583  -0.720
  441   2HE   MET  57          2HE       MET  57  -4.269  -4.271  -1.040
  442   3HE   MET  57          3HE       MET  57  -5.895  -3.832  -0.515
  443    H    LYS  58           H        LYS  58  -4.626  -9.089  -0.893
  444    HA   LYS  58           HA       LYS  58  -3.105  -8.834  -3.190
  445   1HB   LYS  58          1HB       LYS  58  -3.582 -10.858  -1.493
  446   2HB   LYS  58          2HB       LYS  58  -4.590 -11.383  -2.835
  447   1HG   LYS  58          1HG       LYS  58  -2.631 -11.223  -4.326
  448   2HG   LYS  58          2HG       LYS  58  -1.638 -10.796  -2.930
  449   1HD   LYS  58          1HD       LYS  58  -3.217 -13.352  -3.212
  450   2HD   LYS  58          2HD       LYS  58  -1.489 -13.193  -3.532
  451   1HE   LYS  58          1HE       LYS  58  -1.249 -12.359  -1.164
  452   2HE   LYS  58          2HE       LYS  58  -2.925 -12.843  -0.908
  453   1HZ   LYS  58          1HZ       LYS  58  -2.318 -14.949  -0.673
  454   2HZ   LYS  58          2HZ       LYS  58  -0.708 -14.431  -0.639
  455   3HZ   LYS  58          3HZ       LYS  58  -1.403 -14.935  -2.096
  456    H    LYS  59           H        LYS  59  -6.560  -9.312  -2.848
  457    HA   LYS  59           HA       LYS  59  -7.217 -10.080  -5.440
  458   1HB   LYS  59          1HB       LYS  59  -8.647  -8.705  -3.224
  459   2HB   LYS  59          2HB       LYS  59  -9.376  -8.628  -4.823
  460   1HG   LYS  59          1HG       LYS  59  -8.497 -11.266  -3.756
  461   2HG   LYS  59          2HG       LYS  59  -9.995 -10.545  -3.164
  462   1HD   LYS  59          1HD       LYS  59 -11.004 -10.621  -5.259
  463   2HD   LYS  59          2HD       LYS  59  -9.460 -10.753  -6.105
  464   1HE   LYS  59          1HE       LYS  59  -9.182 -13.014  -5.095
  465   2HE   LYS  59          2HE       LYS  59 -10.809 -12.870  -4.433
  466   1HZ   LYS  59          1HZ       LYS  59 -11.313 -13.912  -6.356
  467   2HZ   LYS  59          2HZ       LYS  59  -9.956 -13.329  -7.180
  468   3HZ   LYS  59          3HZ       LYS  59 -11.309 -12.334  -6.968
  469    H    LEU  60           H        LEU  60  -6.391  -6.940  -4.147
  470    HA   LEU  60           HA       LEU  60  -7.217  -5.512  -6.512
  471   1HB   LEU  60          1HB       LEU  60  -5.717  -4.731  -4.029
  472   2HB   LEU  60          2HB       LEU  60  -5.954  -3.617  -5.373
  473    HG   LEU  60           HG       LEU  60  -8.438  -3.962  -5.060
  474   1HD1  LEU  60          1HD1      LEU  60  -8.996  -5.680  -3.748
  475   2HD1  LEU  60          2HD1      LEU  60  -8.616  -4.604  -2.404
  476   3HD1  LEU  60          3HD1      LEU  60  -7.403  -5.740  -2.993
  477   1HD2  LEU  60          1HD2      LEU  60  -8.316  -2.008  -4.018
  478   2HD2  LEU  60          2HD2      LEU  60  -6.602  -2.300  -3.721
  479   3HD2  LEU  60          3HD2      LEU  60  -7.802  -2.796  -2.527
  480    H    ILE  61           H        ILE  61  -4.196  -6.681  -5.116
  481    HA   ILE  61           HA       ILE  61  -2.869  -6.061  -7.673
  482    HB   ILE  61           HB       ILE  61  -1.215  -6.229  -5.211
  483   1HG1  ILE  61          1HG1      ILE  61  -3.071  -4.778  -4.511
  484   2HG1  ILE  61          2HG1      ILE  61  -1.581  -3.859  -4.693
  485   1HG2  ILE  61          1HG2      ILE  61  -1.129  -4.583  -7.734
  486   2HG2  ILE  61          2HG2      ILE  61   0.043  -4.457  -6.423
  487   3HG2  ILE  61          3HG2      ILE  61  -0.113  -5.965  -7.325
  488   1HD1  ILE  61          1HD1      ILE  61  -4.033  -3.224  -5.759
  489   2HD1  ILE  61          2HD1      ILE  61  -2.478  -2.542  -6.237
  490   3HD1  ILE  61          3HD1      ILE  61  -3.154  -3.906  -7.127
  491    HA   PRO  62           HA       PRO  62  -2.671 -10.624  -6.839
  492   1HB   PRO  62          1HB       PRO  62  -3.313 -11.348  -9.376
  493   2HB   PRO  62          2HB       PRO  62  -4.527 -11.013  -8.136
  494   1HG   PRO  62          1HG       PRO  62  -3.525  -9.244 -10.333
  495   2HG   PRO  62          2HG       PRO  62  -5.188  -9.497  -9.771
  496   1HD   PRO  62          1HD       PRO  62  -3.719  -7.338  -9.053
  497   2HD   PRO  62          2HD       PRO  62  -4.933  -8.065  -7.982
  498    H    GLY  63           H        GLY  63  -0.467 -10.775  -6.622
  499   1HA   GLY  63          1HA       GLY  63   1.330 -11.927  -7.925
  500   2HA   GLY  63          2HA       GLY  63   1.103 -10.663  -9.124
  501    H    ALA  64           H        ALA  64   0.679  -8.774  -6.735
  502    HA   ALA  64           HA       ALA  64   3.409  -7.896  -6.611
  503   1HB   ALA  64          1HB       ALA  64   2.323  -6.195  -4.965
  504   2HB   ALA  64          2HB       ALA  64   1.952  -6.111  -6.688
  505   3HB   ALA  64          3HB       ALA  64   0.807  -6.860  -5.575
  506    H    HIS  65           H        HIS  65   4.401  -7.283  -4.480
  507    HA   HIS  65           HA       HIS  65   4.209  -9.570  -2.672
  508   1HB   HIS  65          1HB       HIS  65   6.412  -8.669  -3.680
  509   2HB   HIS  65          2HB       HIS  65   6.263  -7.379  -2.491
  510    HD1  HIS  65           HD1      HIS  65   8.082 -10.281  -2.851
  511    HD2  HIS  65           HD2      HIS  65   5.638  -8.889   0.207
  512    HE1  HIS  65           HE1      HIS  65   8.807 -11.527  -0.791
  513    H    PHE  66           H        PHE  66   2.933  -9.397  -0.962
  514    HA   PHE  66           HA       PHE  66   2.572  -6.747   0.268
  515   1HB   PHE  66          1HB       PHE  66   0.723  -8.979  -0.284
  516   2HB   PHE  66          2HB       PHE  66   0.544  -8.238   1.303
  517    HD1  PHE  66           HD1      PHE  66   0.480  -7.585  -2.327
  518    HD2  PHE  66           HD2      PHE  66  -0.444  -6.109   1.556
  519    HE1  PHE  66           HE1      PHE  66  -0.824  -5.759  -3.336
  520    HE2  PHE  66           HE2      PHE  66  -1.750  -4.281   0.554
  521    HZ   PHE  66           HZ       PHE  66  -1.942  -4.104  -1.895
  522    H    GLU  67           H        GLU  67   2.345  -6.677   2.602
  523    HA   GLU  67           HA       GLU  67   3.221  -8.957   4.141
  524   1HB   GLU  67          1HB       GLU  67   5.280  -7.659   3.167
  525   2HB   GLU  67          2HB       GLU  67   4.908  -6.502   4.437
  526   1HG   GLU  67          1HG       GLU  67   5.038  -8.389   6.074
  527   2HG   GLU  67          2HG       GLU  67   5.635  -9.400   4.760
  528    H    LYS  68           H        LYS  68   1.834  -8.941   5.773
  529    HA   LYS  68           HA       LYS  68   1.078  -6.352   6.958
  530   1HB   LYS  68          1HB       LYS  68  -0.794  -7.577   5.918
  531   2HB   LYS  68          2HB       LYS  68  -0.466  -8.953   6.962
  532   1HG   LYS  68          1HG       LYS  68  -0.864  -6.420   8.380
  533   2HG   LYS  68          2HG       LYS  68  -2.272  -7.000   7.487
  534   1HD   LYS  68          1HD       LYS  68  -1.119  -9.218   8.828
  535   2HD   LYS  68          2HD       LYS  68  -1.255  -7.897   9.990
  536   1HE   LYS  68          1HE       LYS  68  -3.625  -7.630   9.365
  537   2HE   LYS  68          2HE       LYS  68  -3.471  -8.999   8.264
  538   1HZ   LYS  68          1HZ       LYS  68  -4.238  -9.166  10.842
  539   2HZ   LYS  68          2HZ       LYS  68  -2.596  -9.554  10.951
  540   3HZ   LYS  68          3HZ       LYS  68  -3.610 -10.450   9.937
  541    H    ARG  69           H        ARG  69   2.905  -9.077   7.467
  542    HA   ARG  69           HA       ARG  69   2.500  -9.915  10.038
  543   1HB   ARG  69          1HB       ARG  69   5.036  -9.490   8.479
  544   2HB   ARG  69          2HB       ARG  69   5.072 -10.127  10.117
  545   1HG   ARG  69          1HG       ARG  69   3.432 -11.895   9.279
  546   2HG   ARG  69          2HG       ARG  69   3.879 -11.356   7.659
  547   1HD   ARG  69          1HD       ARG  69   5.738 -12.569   7.736
  548   2HD   ARG  69          2HD       ARG  69   6.250 -11.734   9.202
  549    HE   ARG  69           HE       ARG  69   4.312 -13.754   9.744
  550   1HH1  ARG  69          1HH1      ARG  69   7.689 -13.211   9.095
  551   2HH1  ARG  69          2HH1      ARG  69   8.212 -14.639   9.924
  552   1HH2  ARG  69          1HH2      ARG  69   4.988 -15.638  10.838
  553   2HH2  ARG  69          2HH2      ARG  69   6.675 -16.019  10.914
  554    H    ARG  70           H        ARG  70   4.859  -7.368   9.204
  555    HA   ARG  70           HA       ARG  70   3.991  -5.467  11.038
  556   1HB   ARG  70          1HB       ARG  70   5.075  -7.612  12.395
  557   2HB   ARG  70          2HB       ARG  70   6.424  -6.488  12.297
  558   1HG   ARG  70          1HG       ARG  70   5.482  -5.024  13.722
  559   2HG   ARG  70          2HG       ARG  70   3.851  -5.319  13.116
  560   1HD   ARG  70          1HD       ARG  70   3.559  -6.375  15.077
  561   2HD   ARG  70          2HD       ARG  70   4.411  -7.700  14.285
  562    HE   ARG  70           HE       ARG  70   6.363  -6.106  15.395
  563   1HH1  ARG  70          1HH1      ARG  70   3.619  -7.917  16.537
  564   2HH1  ARG  70          2HH1      ARG  70   4.316  -8.244  18.090
  565   1HH2  ARG  70          1HH2      ARG  70   7.292  -6.529  17.435
  566   2HH2  ARG  70          2HH2      ARG  70   6.405  -7.453  18.599
  567    H    GLY  71           H        GLY  71   4.811  -5.106   8.565
  568   1HA   GLY  71          1HA       GLY  71   7.438  -4.770   7.885
  569   2HA   GLY  71          2HA       GLY  71   6.160  -3.692   7.346
  570    H    THR  72           H        THR  72   5.449  -2.168   9.300
  571    HA   THR  72           HA       THR  72   7.626  -1.296  10.967
  572    HB   THR  72           HB       THR  72   6.678   0.788   9.034
  573    HG1  THR  72           HG1      THR  72   7.933   0.046   7.486
  574   1HG2  THR  72          1HG2      THR  72   8.177   0.994  11.240
  575   2HG2  THR  72          2HG2      THR  72   8.410   2.031   9.833
  576   3HG2  THR  72          3HG2      THR  72   9.449   0.627  10.076
  577    H    GLN  73           H        GLN  73   4.710  -2.066  11.012
  578    HA   GLN  73           HA       GLN  73   2.752  -1.427  11.997
  579   1HB   GLN  73          1HB       GLN  73   4.804  -1.143  13.782
  580   2HB   GLN  73          2HB       GLN  73   4.055   0.447  13.850
  581   1HG   GLN  73          1HG       GLN  73   2.361  -0.313  15.055
  582   2HG   GLN  73          2HG       GLN  73   2.068  -1.639  13.930
  583   1HE2  GLN  73          1HE2      GLN  73   2.656  -3.647  14.486
  584   2HE2  GLN  73          2HE2      GLN  73   3.491  -4.064  15.940
  585    H    GLY  74           H        GLY  74   1.956   0.919  13.272
  586   1HA   GLY  74          1HA       GLY  74   1.100   2.484  11.111
  587   2HA   GLY  74          2HA       GLY  74   1.015   2.957  12.801
  588    H    GLU  75           H        GLU  75   4.086   2.512  12.774
  589    HA   GLU  75           HA       GLU  75   4.822   5.197  12.617
  590   1HB   GLU  75          1HB       GLU  75   6.034   3.159  13.694
  591   2HB   GLU  75          2HB       GLU  75   6.801   2.998  12.120
  592   1HG   GLU  75          1HG       GLU  75   8.341   4.314  13.121
  593   2HG   GLU  75          2HG       GLU  75   7.275   5.576  12.506
  594    H    ALA  76           H        ALA  76   4.536   2.794  10.148
  595    HA   ALA  76           HA       ALA  76   6.237   3.877   8.195
  596   1HB   ALA  76          1HB       ALA  76   4.090   1.901   8.289
  597   2HB   ALA  76          2HB       ALA  76   4.214   2.740   6.742
  598   3HB   ALA  76          3HB       ALA  76   5.611   1.885   7.396
  599    H    ARG  77           H        ARG  77   3.300   5.035   9.469
  600    HA   ARG  77           HA       ARG  77   2.214   6.369   7.249
  601   1HB   ARG  77          1HB       ARG  77   1.058   5.988   9.435
  602   2HB   ARG  77          2HB       ARG  77   2.070   7.242  10.138
  603   1HG   ARG  77          1HG       ARG  77   0.972   8.930   9.061
  604   2HG   ARG  77          2HG       ARG  77   0.489   7.902   7.710
  605   1HD   ARG  77          1HD       ARG  77  -0.835   6.715   9.752
  606   2HD   ARG  77          2HD       ARG  77  -0.838   8.394  10.290
  607    HE   ARG  77           HE       ARG  77  -1.647   8.553   7.707
  608   1HH1  ARG  77          1HH1      ARG  77  -2.713   6.711  10.462
  609   2HH1  ARG  77          2HH1      ARG  77  -4.365   6.646   9.944
  610   1HH2  ARG  77          1HH2      ARG  77  -3.819   8.474   7.014
  611   2HH2  ARG  77          2HH2      ARG  77  -4.993   7.649   7.982
  612    H    ALA  78           H        ALA  78   4.946   7.067   9.234
  613    HA   ALA  78           HA       ALA  78   5.092   9.842   8.356
  614   1HB   ALA  78          1HB       ALA  78   7.438   9.147   9.742
  615   2HB   ALA  78          2HB       ALA  78   6.073  10.098  10.329
  616   3HB   ALA  78          3HB       ALA  78   6.105   8.353  10.580
  617    H    TYR  79           H        TYR  79   7.599   7.321   8.544
  618    HA   TYR  79           HA       TYR  79   9.216   8.384   6.543
  619   1HB   TYR  79          1HB       TYR  79  10.282   6.816   7.890
  620   2HB   TYR  79          2HB       TYR  79   8.958   5.662   7.771
  621    HD1  TYR  79           HD1      TYR  79  11.024   7.418   5.196
  622    HD2  TYR  79           HD2      TYR  79   9.726   3.706   6.819
  623    HE1  TYR  79           HE1      TYR  79  12.232   6.225   3.416
  624    HE2  TYR  79           HE2      TYR  79  10.931   2.502   5.045
  625    HH   TYR  79           HH       TYR  79  11.774   2.915   2.786
  626    H    SER  80           H        SER  80   6.941   5.648   6.305
  627    HA   SER  80           HA       SER  80   5.818   4.751   4.542
  628   1HB   SER  80          1HB       SER  80   6.236   7.551   3.490
  629   2HB   SER  80          2HB       SER  80   5.304   6.333   2.619
  630    HG   SER  80           HG       SER  80   4.513   7.899   4.618
  631    H    MET  81           H        MET  81   7.677   6.831   2.416
  632    HA   MET  81           HA       MET  81   9.227   4.483   1.541
  633   1HB   MET  81          1HB       MET  81   7.608   6.418  -0.022
  634   2HB   MET  81          2HB       MET  81   9.140   5.918  -0.726
  635   1HG   MET  81          1HG       MET  81   7.387   4.511  -1.556
  636   2HG   MET  81          2HG       MET  81   8.444   3.568  -0.507
  637   1HE   MET  81          1HE       MET  81   4.967   5.401  -0.802
  638   2HE   MET  81          2HE       MET  81   4.317   5.154   0.819
  639   3HE   MET  81          3HE       MET  81   5.733   6.180   0.583
  640    H    LYS  82           H        LYS  82  11.121   5.276   0.067
  641    HA   LYS  82           HA       LYS  82  12.615   7.200   1.663
  642   1HB   LYS  82          1HB       LYS  82  13.296   4.822   0.403
  643   2HB   LYS  82          2HB       LYS  82  14.017   6.056  -0.621
  644   1HG   LYS  82          1HG       LYS  82  15.361   6.872   1.114
  645   2HG   LYS  82          2HG       LYS  82  14.414   6.041   2.351
  646   1HD   LYS  82          1HD       LYS  82  15.217   3.895   1.575
  647   2HD   LYS  82          2HD       LYS  82  16.076   4.667   0.240
  648   1HE   LYS  82          1HE       LYS  82  17.462   5.884   1.878
  649   2HE   LYS  82          2HE       LYS  82  16.633   5.036   3.183
  650   1HZ   LYS  82          1HZ       LYS  82  18.470   3.732   2.908
  651   2HZ   LYS  82          2HZ       LYS  82  18.580   4.011   1.244
  652   3HZ   LYS  82          3HZ       LYS  82  17.409   2.951   1.847
  653    H    GLU  83           H        GLU  83  12.788   9.260   1.100
  654    HA   GLU  83           HA       GLU  83  11.695  10.313  -1.274
  655   1HB   GLU  83          1HB       GLU  83  13.022  11.333   1.104
  656   2HB   GLU  83          2HB       GLU  83  13.479  12.231  -0.336
  657   1HG   GLU  83          1HG       GLU  83  11.259  12.861  -0.778
  658   2HG   GLU  83          2HG       GLU  83  10.614  11.679   0.360
  659    H    ASP  84           H        ASP  84  14.952   9.369  -0.377
  660    HA   ASP  84           HA       ASP  84  16.397  10.584  -2.423
  661   1HB   ASP  84          1HB       ASP  84  17.435   9.440  -0.502
  662   2HB   ASP  84          2HB       ASP  84  16.910   7.888  -1.148
  663    H    THR  85           H        THR  85  14.515   7.615  -2.417
  664    HA   THR  85           HA       THR  85  15.142   7.238  -5.268
  665    HB   THR  85           HB       THR  85  13.927   4.950  -4.749
  666    HG1  THR  85           HG1      THR  85  14.086   4.326  -2.642
  667   1HG2  THR  85          1HG2      THR  85  16.220   5.110  -5.513
  668   2HG2  THR  85          2HG2      THR  85  16.128   3.968  -4.172
  669   3HG2  THR  85          3HG2      THR  85  16.753   5.595  -3.904
  670    H    ARG  86           H        ARG  86  12.970   8.832  -3.578
  671    HA   ARG  86           HA       ARG  86  10.499   7.798  -4.598
  672   1HB   ARG  86          1HB       ARG  86  10.671   9.094  -2.482
  673   2HB   ARG  86          2HB       ARG  86  11.081  10.522  -3.424
  674   1HG   ARG  86          1HG       ARG  86   8.930  10.586  -4.424
  675   2HG   ARG  86          2HG       ARG  86   8.517   8.995  -3.781
  676   1HD   ARG  86          1HD       ARG  86   7.767   9.897  -1.895
  677   2HD   ARG  86          2HD       ARG  86   9.296  10.737  -1.643
  678    HE   ARG  86           HE       ARG  86   7.541  11.994  -3.555
  679   1HH1  ARG  86          1HH1      ARG  86   8.471  11.751  -0.209
  680   2HH1  ARG  86          2HH1      ARG  86   7.860  13.318   0.209
  681   1HH2  ARG  86          1HH2      ARG  86   6.733  14.058  -3.017
  682   2HH2  ARG  86          2HH2      ARG  86   6.871  14.629  -1.388
  683    H    LEU  87           H        LEU  87   9.704   8.074  -6.568
  684    HA   LEU  87           HA       LEU  87  10.898  10.097  -8.311
  685   1HB   LEU  87          1HB       LEU  87   9.978   7.438  -8.676
  686   2HB   LEU  87          2HB       LEU  87   8.975   8.495  -9.667
  687    HG   LEU  87           HG       LEU  87  11.964   8.141  -9.808
  688   1HD1  LEU  87          1HD1      LEU  87   9.656   7.436 -11.588
  689   2HD1  LEU  87          2HD1      LEU  87  10.946   6.398 -10.980
  690   3HD1  LEU  87          3HD1      LEU  87  11.295   7.605 -12.217
  691   1HD2  LEU  87          1HD2      LEU  87  11.758   9.750 -11.747
  692   2HD2  LEU  87          2HD2      LEU  87  11.625  10.457 -10.136
  693   3HD2  LEU  87          3HD2      LEU  87  10.174  10.183 -11.103
  694    H    GLU  88           H        GLU  88   7.727   8.976  -7.187
  695    HA   GLU  88           HA       GLU  88   6.672  11.659  -7.686
  696   1HB   GLU  88          1HB       GLU  88   6.096   9.521  -9.375
  697   2HB   GLU  88          2HB       GLU  88   4.696   9.623  -8.316
  698   1HG   GLU  88          1HG       GLU  88   4.166  11.775  -9.016
  699   2HG   GLU  88          2HG       GLU  88   5.777  12.059  -9.674
  700    H    GLY  89           H        GLY  89   4.320  11.752  -6.763
  701   1HA   GLY  89          1HA       GLY  89   2.814  11.241  -5.042
  702   2HA   GLY  89          2HA       GLY  89   3.935  10.023  -4.452
  703    HA   PRO  90           HA       PRO  90   3.233   9.785  -2.517
  704   1HB   PRO  90          1HB       PRO  90   1.768  10.577  -0.374
  705   2HB   PRO  90          2HB       PRO  90   3.464  10.094  -0.252
  706   1HG   PRO  90          1HG       PRO  90   2.280  12.841  -0.373
  707   2HG   PRO  90          2HG       PRO  90   3.583  12.229   0.662
  708   1HD   PRO  90          1HD       PRO  90   4.058  13.687  -1.570
  709   2HD   PRO  90          2HD       PRO  90   5.166  12.420  -1.003
  710    H    TRP  91           H        TRP  91   0.844   9.237  -2.181
  711    HA   TRP  91           HA       TRP  91  -0.963  11.216  -3.345
  712   1HB   TRP  91          1HB       TRP  91  -0.319   8.532  -4.549
  713   2HB   TRP  91          2HB       TRP  91  -1.857   9.333  -4.859
  714    HD1  TRP  91           HD1      TRP  91  -0.797  12.309  -5.218
  715    HE1  TRP  91           HE1      TRP  91   0.559  12.925  -7.318
  716    HE3  TRP  91           HE3      TRP  91   0.792   7.638  -6.558
  717    HZ2  TRP  91           HZ2      TRP  91   2.098  11.606  -9.282
  718    HZ3  TRP  91           HZ3      TRP  91   2.202   7.401  -8.560
  719    HH2  TRP  91           HH2      TRP  91   2.840   9.345  -9.893
  720    H    GLU  92           H        GLU  92  -2.970  11.137  -2.506
  721    HA   GLU  92           HA       GLU  92  -3.628   8.831  -0.792
  722   1HB   GLU  92          1HB       GLU  92  -4.018  11.772  -0.389
  723   2HB   GLU  92          2HB       GLU  92  -5.137  10.642   0.360
  724   1HG   GLU  92          1HG       GLU  92  -3.470   9.691   1.692
  725   2HG   GLU  92          2HG       GLU  92  -2.175  10.379   0.714
  726    H    TYR  93           H        TYR  93  -5.588   7.882  -1.019
  727    HA   TYR  93           HA       TYR  93  -7.606   9.163  -2.705
  728   1HB   TYR  93          1HB       TYR  93  -6.430   6.425  -3.208
  729   2HB   TYR  93          2HB       TYR  93  -7.929   6.992  -3.936
  730    HD1  TYR  93           HD1      TYR  93  -7.868   8.940  -5.506
  731    HD2  TYR  93           HD2      TYR  93  -4.322   7.072  -4.079
  732    HE1  TYR  93           HE1      TYR  93  -6.593   9.977  -7.336
  733    HE2  TYR  93           HE2      TYR  93  -3.037   8.105  -5.904
  734    HH   TYR  93           HH       TYR  93  -4.169  10.630  -7.751
  735    H    GLY  94           H        GLY  94  -9.716   8.047  -2.599
  736   1HA   GLY  94          1HA       GLY  94 -11.288   6.664  -1.525
  737   2HA   GLY  94          2HA       GLY  94 -10.073   6.253  -0.323
  738    H    GLU  95           H        GLU  95 -11.470   6.649   1.404
  739    HA   GLU  95           HA       GLU  95 -13.019   8.938   1.775
  740   1HB   GLU  95          1HB       GLU  95 -13.390   7.038   3.176
  741   2HB   GLU  95          2HB       GLU  95 -11.733   7.067   3.761
  742   1HG   GLU  95          1HG       GLU  95 -13.274   7.900   5.440
  743   2HG   GLU  95          2HG       GLU  95 -12.159   9.162   4.918
  Start of MODEL   23
    1   1H    ALA   2          1H        ALA   2 -12.807   2.121  19.779
    2    HA   ALA   2           HA       ALA   2 -13.976   0.488  17.681
    3   1HB   ALA   2          1HB       ALA   2 -12.414   2.090  16.127
    4   2HB   ALA   2          2HB       ALA   2 -14.165   2.229  16.283
    5   3HB   ALA   2          3HB       ALA   2 -13.109   3.252  17.257
    6    H    ARG   3           H        ARG   3 -12.363  -0.626  16.393
    7    HA   ARG   3           HA       ARG   3  -9.875  -1.013  17.906
    8   1HB   ARG   3          1HB       ARG   3 -11.615  -2.789  16.282
    9   2HB   ARG   3          2HB       ARG   3  -9.886  -3.105  16.229
   10   1HG   ARG   3          1HG       ARG   3 -10.526  -4.453  17.962
   11   2HG   ARG   3          2HG       ARG   3 -10.084  -2.983  18.832
   12   1HD   ARG   3          1HD       ARG   3 -12.537  -2.325  18.631
   13   2HD   ARG   3          2HD       ARG   3 -12.828  -3.994  18.142
   14    HE   ARG   3           HE       ARG   3 -11.366  -3.760  20.602
   15   1HH1  ARG   3          1HH1      ARG   3 -14.533  -3.812  19.156
   16   2HH1  ARG   3          2HH1      ARG   3 -15.328  -4.339  20.603
   17   1HH2  ARG   3          1HH2      ARG   3 -12.401  -4.455  22.513
   18   2HH2  ARG   3          2HH2      ARG   3 -14.114  -4.704  22.511
   19    H    GLN   4           H        GLN   4  -7.960  -0.502  17.049
   20    HA   GLN   4           HA       GLN   4  -7.889   0.705  14.418
   21   1HB   GLN   4          1HB       GLN   4  -5.664   1.425  14.991
   22   2HB   GLN   4          2HB       GLN   4  -6.720   1.721  16.366
   23   1HG   GLN   4          1HG       GLN   4  -5.650  -0.856  16.715
   24   2HG   GLN   4          2HG       GLN   4  -4.316   0.190  16.232
   25   1HE2  GLN   4          1HE2      GLN   4  -4.888  -1.092  18.800
   26   2HE2  GLN   4          2HE2      GLN   4  -4.949   0.184  19.963
   27    H    VAL   5           H        VAL   5  -6.623   0.025  12.688
   28    HA   VAL   5           HA       VAL   5  -5.667  -2.760  12.857
   29    HB   VAL   5           HB       VAL   5  -6.246  -3.057  10.517
   30   1HG1  VAL   5          1HG1      VAL   5  -8.131  -3.799  11.455
   31   2HG1  VAL   5          2HG1      VAL   5  -8.196  -2.448  12.588
   32   3HG1  VAL   5          3HG1      VAL   5  -8.848  -2.266  10.960
   33   1HG2  VAL   5          1HG2      VAL   5  -6.256  -0.244  10.470
   34   2HG2  VAL   5          2HG2      VAL   5  -6.539  -1.350   9.126
   35   3HG2  VAL   5          3HG2      VAL   5  -7.898  -0.760  10.083
   36    H    ILE   6           H        ILE   6  -3.895  -3.321  11.428
   37    HA   ILE   6           HA       ILE   6  -1.938  -1.181  11.300
   38    HB   ILE   6           HB       ILE   6  -1.554  -4.073  10.534
   39   1HG1  ILE   6          1HG1      ILE   6  -0.383  -3.914  12.942
   40   2HG1  ILE   6          2HG1      ILE   6  -1.663  -2.730  13.184
   41   1HG2  ILE   6          1HG2      ILE   6   0.835  -3.355  11.338
   42   2HG2  ILE   6          2HG2      ILE   6   0.287  -2.985   9.704
   43   3HG2  ILE   6          3HG2      ILE   6   0.248  -1.738  10.951
   44   1HD1  ILE   6          1HD1      ILE   6  -2.974  -4.427  13.727
   45   2HD1  ILE   6          2HD1      ILE   6  -2.939  -4.902  12.029
   46   3HD1  ILE   6          3HD1      ILE   6  -1.790  -5.608  13.166
   47    H    CYS   7           H        CYS   7  -0.787  -0.597   9.427
   48    HA   CYS   7           HA       CYS   7  -2.373  -0.621   7.030
   49   1HB   CYS   7          1HB       CYS   7  -0.826   0.945   6.164
   50   2HB   CYS   7          2HB       CYS   7  -0.956   1.322   7.877
   51    HG   CYS   7           HG       CYS   7   1.471  -0.798   7.640
   52    H    TRP   8           H        TRP   8  -1.609  -1.319   4.945
   53    HA   TRP   8           HA       TRP   8   0.084  -3.715   5.149
   54   1HB   TRP   8          1HB       TRP   8  -2.061  -2.965   3.156
   55   2HB   TRP   8          2HB       TRP   8  -1.022  -4.378   2.991
   56    HD1  TRP   8           HD1      TRP   8  -3.425  -2.961   5.705
   57    HE1  TRP   8           HE1      TRP   8  -4.693  -4.946   6.742
   58    HE3  TRP   8           HE3      TRP   8  -1.232  -6.774   3.100
   59    HZ2  TRP   8           HZ2      TRP   8  -4.755  -7.757   6.490
   60    HZ3  TRP   8           HZ3      TRP   8  -1.951  -9.082   3.558
   61    HH2  TRP   8           HH2      TRP   8  -3.676  -9.561   5.219
   62    H    CYS   9           H        CYS   9   2.103  -3.422   4.489
   63    HA   CYS   9           HA       CYS   9   2.667  -1.401   2.445
   64   1HB   CYS   9          1HB       CYS   9   4.701  -2.914   4.079
   65   2HB   CYS   9          2HB       CYS   9   4.916  -1.396   3.216
   66    HG   CYS   9           HG       CYS   9   4.092   0.205   5.085
   67    H    PHE  10           H        PHE  10   2.882  -2.037   0.414
   68    HA   PHE  10           HA       PHE  10   4.125  -4.639  -0.136
   69   1HB   PHE  10          1HB       PHE  10   2.472  -5.309  -1.642
   70   2HB   PHE  10          2HB       PHE  10   1.538  -4.591  -0.334
   71    HD1  PHE  10           HD2      PHE  10   1.002  -2.040  -0.624
   72    HD2  PHE  10           HD1      PHE  10   2.026  -4.676  -3.805
   73    HE1  PHE  10           HE2      PHE  10  -0.076  -0.518  -2.228
   74    HE2  PHE  10           HE1      PHE  10   0.950  -3.158  -5.414
   75    HZ   PHE  10           HZ       PHE  10  -0.104  -1.076  -4.627
   76    H    THR  11           H        THR  11   4.840  -4.821  -2.440
   77    HA   THR  11           HA       THR  11   5.576  -2.199  -3.560
   78    HB   THR  11           HB       THR  11   7.457  -4.532  -3.730
   79    HG1  THR  11           HG1      THR  11   7.037  -4.122  -1.489
   80   1HG2  THR  11          1HG2      THR  11   8.848  -2.144  -3.488
   81   2HG2  THR  11          2HG2      THR  11   7.448  -1.727  -4.476
   82   3HG2  THR  11          3HG2      THR  11   8.530  -3.023  -4.982
   83    H    LEU  12           H        LEU  12   4.906  -1.973  -5.583
   84    HA   LEU  12           HA       LEU  12   4.379  -4.393  -7.171
   85   1HB   LEU  12          1HB       LEU  12   2.424  -2.999  -6.736
   86   2HB   LEU  12          2HB       LEU  12   3.247  -1.612  -7.447
   87    HG   LEU  12           HG       LEU  12   3.073  -2.494  -9.624
   88   1HD1  LEU  12          1HD1      LEU  12   1.833  -4.881  -9.681
   89   2HD1  LEU  12          2HD1      LEU  12   2.784  -5.060  -8.207
   90   3HD1  LEU  12          3HD1      LEU  12   3.585  -4.685  -9.732
   91   1HD2  LEU  12          1HD2      LEU  12   0.627  -2.732  -7.948
   92   2HD2  LEU  12          2HD2      LEU  12   0.555  -3.273  -9.625
   93   3HD2  LEU  12          3HD2      LEU  12   0.999  -1.606  -9.254
   94    H    ASN  13           H        ASN  13   5.698  -4.812  -8.806
   95    HA   ASN  13           HA       ASN  13   7.375  -2.636  -9.853
   96   1HB   ASN  13          1HB       ASN  13   8.834  -4.491 -10.704
   97   2HB   ASN  13          2HB       ASN  13   8.700  -4.427  -8.949
   98   1HD2  ASN  13          1HD2      ASN  13   7.864  -6.125  -7.869
   99   2HD2  ASN  13          2HD2      ASN  13   7.325  -7.584  -8.621
  100    H    ASN  14           H        ASN  14   7.309  -2.072 -11.958
  101    HA   ASN  14           HA       ASN  14   6.405  -1.812 -14.037
  102   1HB   ASN  14          1HB       ASN  14   7.844  -4.022 -14.091
  103   2HB   ASN  14          2HB       ASN  14   6.275  -4.787 -14.322
  104   1HD2  ASN  14          1HD2      ASN  14   8.703  -4.306 -16.064
  105   2HD2  ASN  14          2HD2      ASN  14   8.048  -3.644 -17.519
  106    HA   PRO  15           HA       PRO  15   2.134  -2.981 -12.481
  107   1HB   PRO  15          1HB       PRO  15   1.231  -0.436 -12.208
  108   2HB   PRO  15          2HB       PRO  15   2.069  -1.301 -10.915
  109   1HG   PRO  15          1HG       PRO  15   3.141   0.719 -12.846
  110   2HG   PRO  15          2HG       PRO  15   3.438   0.569 -11.104
  111   1HD   PRO  15          1HD       PRO  15   5.202  -0.306 -12.963
  112   2HD   PRO  15          2HD       PRO  15   5.003  -1.099 -11.387
  113    H    LEU  16           H        LEU  16   0.396  -3.140 -13.815
  114    HA   LEU  16           HA       LEU  16   0.704  -2.161 -16.523
  115   1HB   LEU  16          1HB       LEU  16  -1.313  -3.954 -15.195
  116   2HB   LEU  16          2HB       LEU  16  -1.440  -3.453 -16.880
  117    HG   LEU  16           HG       LEU  16   1.108  -4.488 -16.732
  118   1HD1  LEU  16          1HD1      LEU  16   0.392  -5.308 -14.417
  119   2HD1  LEU  16          2HD1      LEU  16   1.095  -6.487 -15.524
  120   3HD1  LEU  16          3HD1      LEU  16  -0.651  -6.437 -15.282
  121   1HD2  LEU  16          1HD2      LEU  16   0.318  -6.092 -18.215
  122   2HD2  LEU  16          2HD2      LEU  16  -0.838  -4.772 -18.400
  123   3HD2  LEU  16          3HD2      LEU  16  -1.260  -6.185 -17.431
  124    H    SER  17           H        SER  17  -0.549  -0.907 -13.741
  125    HA   SER  17           HA       SER  17  -1.715   1.319 -14.960
  126   1HB   SER  17          1HB       SER  17  -4.125   0.667 -13.973
  127   2HB   SER  17          2HB       SER  17  -3.659   0.322 -15.639
  128    HG   SER  17           HG       SER  17  -3.613  -1.746 -15.203
  129    HA   PRO  18           HA       PRO  18  -1.373   2.904 -10.885
  130   1HB   PRO  18          1HB       PRO  18  -3.347   4.767 -10.813
  131   2HB   PRO  18          2HB       PRO  18  -1.863   4.975 -11.751
  132   1HG   PRO  18          1HG       PRO  18  -4.575   4.096 -12.665
  133   2HG   PRO  18          2HG       PRO  18  -3.447   5.227 -13.435
  134   1HD   PRO  18          1HD       PRO  18  -3.710   2.656 -14.243
  135   2HD   PRO  18          2HD       PRO  18  -2.171   3.534 -14.340
  136    H    LEU  19           H        LEU  19  -2.252   2.855  -8.795
  137    HA   LEU  19           HA       LEU  19  -4.170   0.811  -8.326
  138   1HB   LEU  19          1HB       LEU  19  -3.194   2.847  -6.338
  139   2HB   LEU  19          2HB       LEU  19  -3.837   1.241  -6.006
  140    HG   LEU  19           HG       LEU  19  -1.180   1.894  -7.277
  141   1HD1  LEU  19          1HD1      LEU  19  -1.586   0.361  -4.748
  142   2HD1  LEU  19          2HD1      LEU  19  -1.624   2.123  -4.723
  143   3HD1  LEU  19          3HD1      LEU  19  -0.184   1.281  -5.293
  144   1HD2  LEU  19          1HD2      LEU  19  -2.787  -0.560  -7.228
  145   2HD2  LEU  19          2HD2      LEU  19  -1.119  -0.759  -6.692
  146   3HD2  LEU  19          3HD2      LEU  19  -1.458  -0.090  -8.289
  147    H    SER  20           H        SER  20  -6.088   1.149  -6.880
  148    HA   SER  20           HA       SER  20  -7.377   3.745  -7.114
  149   1HB   SER  20          1HB       SER  20  -9.408   2.805  -8.150
  150   2HB   SER  20          2HB       SER  20  -8.007   2.633  -9.207
  151    HG   SER  20           HG       SER  20  -8.691   0.628  -9.255
  152    H    LEU  21           H        LEU  21  -9.157   4.015  -5.705
  153    HA   LEU  21           HA       LEU  21  -8.940   2.875  -3.205
  154   1HB   LEU  21          1HB       LEU  21 -10.127   4.910  -3.453
  155   2HB   LEU  21          2HB       LEU  21 -11.275   4.182  -4.574
  156    HG   LEU  21           HG       LEU  21 -12.142   2.806  -2.679
  157   1HD1  LEU  21          1HD1      LEU  21 -10.982   2.693  -0.796
  158   2HD1  LEU  21          2HD1      LEU  21 -11.314   4.401  -0.514
  159   3HD1  LEU  21          3HD1      LEU  21  -9.854   3.918  -1.377
  160   1HD2  LEU  21          1HD2      LEU  21 -13.086   4.932  -1.459
  161   2HD2  LEU  21          2HD2      LEU  21 -13.539   4.567  -3.124
  162   3HD2  LEU  21          3HD2      LEU  21 -12.301   5.778  -2.792
  163    H    HIS  22           H        HIS  22 -10.229   1.372  -2.040
  164    HA   HIS  22           HA       HIS  22 -11.574  -0.625  -3.741
  165   1HB   HIS  22          1HB       HIS  22  -9.300  -1.249  -2.678
  166   2HB   HIS  22          2HB       HIS  22 -10.192  -1.324  -1.162
  167    HD1  HIS  22           HD1      HIS  22 -10.312  -3.773  -0.721
  168    HD2  HIS  22           HD2      HIS  22 -11.377  -2.825  -4.623
  169    HE1  HIS  22           HE1      HIS  22 -11.133  -5.922  -1.735
  170    H    ASP  23           H        ASP  23 -13.609  -1.107  -3.223
  171    HA   ASP  23           HA       ASP  23 -15.084   0.331  -1.361
  172   1HB   ASP  23          1HB       ASP  23 -15.543  -2.054  -3.040
  173   2HB   ASP  23          2HB       ASP  23 -16.592  -1.913  -1.631
  174    H    SER  24           H        SER  24 -13.121  -2.473  -0.937
  175    HA   SER  24           HA       SER  24 -14.320  -3.226   1.586
  176   1HB   SER  24          1HB       SER  24 -11.671  -4.232   0.574
  177   2HB   SER  24          2HB       SER  24 -12.852  -5.061   1.587
  178    HG   SER  24           HG       SER  24 -13.906  -5.668  -0.137
  179    H    MET  25           H        MET  25 -11.396  -1.602   0.456
  180    HA   MET  25           HA       MET  25 -10.303  -1.300   3.094
  181   1HB   MET  25          1HB       MET  25  -8.483  -0.267   2.077
  182   2HB   MET  25          2HB       MET  25  -9.048  -1.368   0.828
  183   1HG   MET  25          1HG       MET  25 -10.112   0.409  -0.356
  184   2HG   MET  25          2HG       MET  25  -9.804   1.538   0.961
  185   1HE   MET  25          1HE       MET  25  -8.089  -1.175  -0.859
  186   2HE   MET  25          2HE       MET  25  -7.585  -0.233  -2.262
  187   3HE   MET  25          3HE       MET  25  -6.414  -0.644  -1.008
  188    H    LYS  26           H        LYS  26  -9.491   1.178   3.453
  189    HA   LYS  26           HA       LYS  26 -11.916   2.849   3.343
  190   1HB   LYS  26          1HB       LYS  26 -10.539   1.861   5.635
  191   2HB   LYS  26          2HB       LYS  26 -10.307   3.603   5.571
  192   1HG   LYS  26          1HG       LYS  26 -13.044   2.992   5.018
  193   2HG   LYS  26          2HG       LYS  26 -12.544   2.183   6.505
  194   1HD   LYS  26          1HD       LYS  26 -11.523   4.461   7.143
  195   2HD   LYS  26          2HD       LYS  26 -12.541   5.113   5.857
  196   1HE   LYS  26          1HE       LYS  26 -14.498   4.604   6.970
  197   2HE   LYS  26          2HE       LYS  26 -13.746   3.327   7.924
  198   1HZ   LYS  26          1HZ       LYS  26 -12.532   5.806   8.514
  199   2HZ   LYS  26          2HZ       LYS  26 -13.369   4.762   9.548
  200   3HZ   LYS  26          3HZ       LYS  26 -14.209   5.950   8.686
  201    H    TYR  27           H        TYR  27  -8.391   2.767   3.458
  202    HA   TYR  27           HA       TYR  27  -8.359   5.358   2.076
  203   1HB   TYR  27          1HB       TYR  27  -7.739   5.316   4.659
  204   2HB   TYR  27          2HB       TYR  27  -6.184   4.780   4.034
  205    HD1  TYR  27           HD1      TYR  27  -8.730   7.442   3.383
  206    HD2  TYR  27           HD2      TYR  27  -4.609   6.397   3.561
  207    HE1  TYR  27           HE1      TYR  27  -8.123   9.778   2.909
  208    HE2  TYR  27           HE2      TYR  27  -3.991   8.730   3.088
  209    HH   TYR  27           HH       TYR  27  -6.313  11.289   3.118
  210    H    LEU  28           H        LEU  28  -6.589   5.692   0.682
  211    HA   LEU  28           HA       LEU  28  -4.932   3.321   0.148
  212   1HB   LEU  28          1HB       LEU  28  -6.505   3.196  -1.564
  213   2HB   LEU  28          2HB       LEU  28  -6.571   4.947  -1.758
  214    HG   LEU  28           HG       LEU  28  -4.477   4.969  -2.909
  215   1HD1  LEU  28          1HD1      LEU  28  -3.710   2.362  -3.337
  216   2HD1  LEU  28          2HD1      LEU  28  -4.147   2.379  -1.629
  217   3HD1  LEU  28          3HD1      LEU  28  -2.936   3.505  -2.240
  218   1HD2  LEU  28          1HD2      LEU  28  -4.983   3.512  -4.842
  219   2HD2  LEU  28          2HD2      LEU  28  -6.379   4.439  -4.292
  220   3HD2  LEU  28          3HD2      LEU  28  -6.242   2.728  -3.887
  221    H    VAL  29           H        VAL  29  -2.826   3.743   0.083
  222    HA   VAL  29           HA       VAL  29  -1.918   6.421  -0.697
  223    HB   VAL  29           HB       VAL  29  -0.981   4.968   1.781
  224   1HG1  VAL  29          1HG1      VAL  29   0.034   7.550   1.791
  225   2HG1  VAL  29          2HG1      VAL  29   0.934   6.066   1.476
  226   3HG1  VAL  29          3HG1      VAL  29   0.267   6.996   0.133
  227   1HG2  VAL  29          1HG2      VAL  29  -2.945   5.964   2.452
  228   2HG2  VAL  29          2HG2      VAL  29  -1.786   7.255   2.766
  229   3HG2  VAL  29          3HG2      VAL  29  -2.784   7.301   1.313
  230    H    TYR  30           H        TYR  30  -0.438   6.264  -2.236
  231    HA   TYR  30           HA       TYR  30   1.630   4.240  -2.113
  232   1HB   TYR  30          1HB       TYR  30   1.159   3.136  -4.124
  233   2HB   TYR  30          2HB       TYR  30  -0.419   3.281  -3.358
  234    HD1  TYR  30           HD2      TYR  30  -2.036   4.980  -4.181
  235    HD2  TYR  30           HD1      TYR  30   1.633   4.215  -6.196
  236    HE1  TYR  30           HE2      TYR  30  -2.911   6.100  -6.189
  237    HE2  TYR  30           HE1      TYR  30   0.769   5.333  -8.208
  238    HH   TYR  30           HH       TYR  30  -0.984   6.307  -9.165
  239    H    GLN  31           H        GLN  31   3.385   4.648  -3.567
  240    HA   GLN  31           HA       GLN  31   3.336   7.259  -4.903
  241   1HB   GLN  31          1HB       GLN  31   5.691   6.389  -3.241
  242   2HB   GLN  31          2HB       GLN  31   5.361   7.980  -3.914
  243   1HG   GLN  31          1HG       GLN  31   3.317   8.004  -2.384
  244   2HG   GLN  31          2HG       GLN  31   4.073   6.636  -1.568
  245   1HE2  GLN  31          1HE2      GLN  31   5.421   9.598  -2.966
  246   2HE2  GLN  31          2HE2      GLN  31   6.180  10.145  -1.514
  247    H    THR  32           H        THR  32   5.063   7.542  -6.477
  248    HA   THR  32           HA       THR  32   5.773   4.979  -7.719
  249    HB   THR  32           HB       THR  32   5.670   7.765  -8.890
  250    HG1  THR  32           HG1      THR  32   4.020   6.514 -10.205
  251   1HG2  THR  32          1HG2      THR  32   7.325   6.822 -10.180
  252   2HG2  THR  32          2HG2      THR  32   5.892   6.283 -11.055
  253   3HG2  THR  32          3HG2      THR  32   6.719   5.183  -9.953
  254    H    GLU  33           H        GLU  33   7.819   4.307  -7.817
  255    HA   GLU  33           HA       GLU  33   9.949   6.249  -7.204
  256   1HB   GLU  33          1HB       GLU  33   9.424   3.520  -6.162
  257   2HB   GLU  33          2HB       GLU  33  11.103   3.938  -6.474
  258   1HG   GLU  33          1HG       GLU  33  11.222   5.134  -4.618
  259   2HG   GLU  33          2HG       GLU  33   9.791   6.064  -5.058
  260    H    GLN  34           H        GLN  34  12.086   5.680  -8.089
  261    HA   GLN  34           HA       GLN  34  11.791   4.520 -10.769
  262   1HB   GLN  34          1HB       GLN  34  13.006   6.883  -9.851
  263   2HB   GLN  34          2HB       GLN  34  14.325   5.822 -10.326
  264   1HG   GLN  34          1HG       GLN  34  12.268   5.739 -12.310
  265   2HG   GLN  34          2HG       GLN  34  12.704   7.413 -11.971
  266   1HE2  GLN  34          1HE2      GLN  34  15.339   7.284 -11.447
  267   2HE2  GLN  34          2HE2      GLN  34  16.209   6.719 -12.828
  268    H    GLY  35           H        GLY  35  12.765   2.668 -11.298
  269   1HA   GLY  35          1HA       GLY  35  15.173   1.653 -10.828
  270   2HA   GLY  35          2HA       GLY  35  14.404   1.349  -9.277
  271    H    GLU  36           H        GLU  36  15.377  -0.734 -10.779
  272    HA   GLU  36           HA       GLU  36  14.795  -2.799 -11.535
  273   1HB   GLU  36          1HB       GLU  36  13.271  -3.307  -9.922
  274   2HB   GLU  36          2HB       GLU  36  12.343  -1.837 -10.185
  275   1HG   GLU  36          1HG       GLU  36  11.071  -3.843 -10.749
  276   2HG   GLU  36          2HG       GLU  36  11.310  -2.796 -12.147
  277    H    ALA  37           H        ALA  37  14.878  -3.238 -13.626
  278    HA   ALA  37           HA       ALA  37  14.532  -3.129 -15.879
  279   1HB   ALA  37          1HB       ALA  37  12.510  -4.341 -15.119
  280   2HB   ALA  37          2HB       ALA  37  11.646  -2.804 -15.071
  281   3HB   ALA  37          3HB       ALA  37  12.258  -3.424 -16.604
  282    H    GLY  38           H        GLY  38  12.827  -1.787 -17.522
  283   1HA   GLY  38          1HA       GLY  38  13.779   0.951 -17.195
  284   2HA   GLY  38          2HA       GLY  38  13.076   0.259 -18.649
  285    H    ASN  39           H        ASN  39  11.351  -0.373 -15.773
  286    HA   ASN  39           HA       ASN  39   9.422   1.748 -16.460
  287   1HB   ASN  39          1HB       ASN  39   8.984  -1.090 -15.546
  288   2HB   ASN  39          2HB       ASN  39   7.728   0.134 -15.391
  289   1HD2  ASN  39          1HD2      ASN  39   9.857  -1.444 -17.713
  290   2HD2  ASN  39          2HD2      ASN  39   8.797  -1.280 -19.068
  291    H    ILE  40           H        ILE  40   7.762   1.761 -14.384
  292    HA   ILE  40           HA       ILE  40   9.502   2.453 -12.113
  293    HB   ILE  40           HB       ILE  40   7.403   3.799 -11.399
  294   1HG1  ILE  40          1HG1      ILE  40   6.913   3.606 -14.378
  295   2HG1  ILE  40          2HG1      ILE  40   5.948   2.782 -13.157
  296   1HG2  ILE  40          1HG2      ILE  40   8.817   5.437 -11.886
  297   2HG2  ILE  40          2HG2      ILE  40   9.666   4.394 -13.026
  298   3HG2  ILE  40          3HG2      ILE  40   8.300   5.368 -13.570
  299   1HD1  ILE  40          1HD1      ILE  40   5.209   5.085 -14.181
  300   2HD1  ILE  40          2HD1      ILE  40   4.919   4.698 -12.484
  301   3HD1  ILE  40          3HD1      ILE  40   6.282   5.722 -12.935
  302    H    HIS  41           H        HIS  41   8.400   2.297  -9.945
  303    HA   HIS  41           HA       HIS  41   6.553   0.013  -9.816
  304   1HB   HIS  41          1HB       HIS  41   7.934  -0.542  -7.639
  305   2HB   HIS  41          2HB       HIS  41   8.470  -1.118  -9.215
  306    HD1  HIS  41           HD1      HIS  41  10.952  -1.130  -8.842
  307    HD2  HIS  41           HD2      HIS  41   9.202   2.500  -7.832
  308    HE1  HIS  41           HE1      HIS  41  12.867   0.437  -8.388
  309    H    PHE  42           H        PHE  42   5.083   0.035  -8.130
  310    HA   PHE  42           HA       PHE  42   4.772   2.631  -6.821
  311   1HB   PHE  42          1HB       PHE  42   2.847   0.312  -7.085
  312   2HB   PHE  42          2HB       PHE  42   2.476   1.853  -6.319
  313    HD1  PHE  42           HD1      PHE  42   4.039   3.539  -8.370
  314    HD2  PHE  42           HD2      PHE  42   1.148   0.438  -8.751
  315    HE1  PHE  42           HE1      PHE  42   3.348   4.456 -10.546
  316    HE2  PHE  42           HE2      PHE  42   0.454   1.349 -10.928
  317    HZ   PHE  42           HZ       PHE  42   1.554   3.359 -11.829
  318    H    GLN  43           H        GLN  43   4.778   2.915  -4.643
  319    HA   GLN  43           HA       GLN  43   4.923   0.588  -2.891
  320   1HB   GLN  43          1HB       GLN  43   7.201   2.232  -3.605
  321   2HB   GLN  43          2HB       GLN  43   6.896   2.285  -1.874
  322   1HG   GLN  43          1HG       GLN  43   7.490   0.136  -1.562
  323   2HG   GLN  43          2HG       GLN  43   6.826  -0.386  -3.110
  324   1HE2  GLN  43          1HE2      GLN  43   8.075   0.575  -5.035
  325   2HE2  GLN  43          2HE2      GLN  43   9.796   0.465  -4.932
  326    H    GLY  44           H        GLY  44   4.000   0.919  -0.934
  327   1HA   GLY  44          1HA       GLY  44   3.841   3.287   0.500
  328   2HA   GLY  44          2HA       GLY  44   2.430   3.258  -0.548
  329    H    TYR  45           H        TYR  45   1.310   3.278   1.567
  330    HA   TYR  45           HA       TYR  45   1.043   0.536   2.615
  331   1HB   TYR  45          1HB       TYR  45   0.325   1.675   4.779
  332   2HB   TYR  45          2HB       TYR  45   2.036   1.771   4.374
  333    HD1  TYR  45           HD2      TYR  45   2.972   3.902   3.487
  334    HD2  TYR  45           HD1      TYR  45  -1.016   3.634   4.948
  335    HE1  TYR  45           HE2      TYR  45   2.883   6.352   3.677
  336    HE2  TYR  45           HE1      TYR  45  -1.116   6.084   5.140
  337    HH   TYR  45           HH       TYR  45   1.338   8.019   5.286
  338    H    ILE  46           H        ILE  46  -1.013  -0.228   3.000
  339    HA   ILE  46           HA       ILE  46  -3.260   1.543   2.337
  340    HB   ILE  46           HB       ILE  46  -2.942  -1.263   1.267
  341   1HG1  ILE  46          1HG1      ILE  46  -2.943   1.352  -0.250
  342   2HG1  ILE  46          2HG1      ILE  46  -1.482   0.474   0.189
  343   1HG2  ILE  46          1HG2      ILE  46  -5.118  -1.248   0.829
  344   2HG2  ILE  46          2HG2      ILE  46  -5.252   0.243   1.760
  345   3HG2  ILE  46          3HG2      ILE  46  -4.989   0.312   0.018
  346   1HD1  ILE  46          1HD1      ILE  46  -2.089  -1.363  -1.199
  347   2HD1  ILE  46          2HD1      ILE  46  -3.686  -0.678  -1.498
  348   3HD1  ILE  46          3HD1      ILE  46  -2.250   0.116  -2.146
  349    H    GLU  47           H        GLU  47  -4.861   1.436   3.771
  350    HA   GLU  47           HA       GLU  47  -4.836  -0.769   5.712
  351   1HB   GLU  47          1HB       GLU  47  -6.350   1.821   5.988
  352   2HB   GLU  47          2HB       GLU  47  -5.919   0.676   7.250
  353   1HG   GLU  47          1HG       GLU  47  -3.495   1.458   6.123
  354   2HG   GLU  47          2HG       GLU  47  -4.452   2.934   6.238
  355    H    MET  48           H        MET  48  -6.286  -2.321   5.447
  356    HA   MET  48           HA       MET  48  -8.540  -1.973   3.686
  357   1HB   MET  48          1HB       MET  48  -7.652  -4.318   5.372
  358   2HB   MET  48          2HB       MET  48  -9.008  -4.359   4.253
  359   1HG   MET  48          1HG       MET  48  -6.114  -3.911   3.563
  360   2HG   MET  48          2HG       MET  48  -7.075  -5.350   3.229
  361   1HE   MET  48          1HE       MET  48  -8.638  -5.711   1.635
  362   2HE   MET  48          2HE       MET  48  -9.829  -4.410   1.616
  363   3HE   MET  48          3HE       MET  48  -8.906  -4.783   0.160
  364    H    LYS  49           H        LYS  49 -10.641  -3.196   4.604
  365    HA   LYS  49           HA       LYS  49 -11.935  -1.444   6.288
  366   1HB   LYS  49          1HB       LYS  49 -12.606  -3.772   4.923
  367   2HB   LYS  49          2HB       LYS  49 -12.939  -4.158   6.606
  368   1HG   LYS  49          1HG       LYS  49 -14.562  -2.519   6.798
  369   2HG   LYS  49          2HG       LYS  49 -13.945  -1.607   5.418
  370   1HD   LYS  49          1HD       LYS  49 -16.029  -2.714   4.837
  371   2HD   LYS  49          2HD       LYS  49 -14.691  -3.405   3.916
  372   1HE   LYS  49          1HE       LYS  49 -15.256  -5.416   4.668
  373   2HE   LYS  49          2HE       LYS  49 -14.882  -4.884   6.306
  374   1HZ   LYS  49          1HZ       LYS  49 -17.022  -5.221   6.732
  375   2HZ   LYS  49          2HZ       LYS  49 -17.423  -5.377   5.097
  376   3HZ   LYS  49          3HZ       LYS  49 -17.354  -3.843   5.808
  377    H    LYS  50           H        LYS  50 -10.876  -4.718   7.239
  378    HA   LYS  50           HA       LYS  50  -9.589  -3.978   9.596
  379   1HB   LYS  50          1HB       LYS  50 -12.461  -3.935   9.798
  380   2HB   LYS  50          2HB       LYS  50 -11.810  -5.195  10.838
  381   1HG   LYS  50          1HG       LYS  50 -10.456  -3.629  12.017
  382   2HG   LYS  50          2HG       LYS  50 -10.837  -2.349  10.863
  383   1HD   LYS  50          1HD       LYS  50 -13.206  -3.560  12.057
  384   2HD   LYS  50          2HD       LYS  50 -12.135  -2.814  13.245
  385   1HE   LYS  50          1HE       LYS  50 -13.409  -1.005  12.676
  386   2HE   LYS  50          2HE       LYS  50 -12.118  -0.850  11.485
  387   1HZ   LYS  50          1HZ       LYS  50 -14.913  -1.512  11.107
  388   2HZ   LYS  50          2HZ       LYS  50 -13.831  -2.430  10.187
  389   3HZ   LYS  50          3HZ       LYS  50 -13.830  -0.743  10.059
  390    H    ARG  51           H        ARG  51 -12.058  -6.501   9.137
  391    HA   ARG  51           HA       ARG  51 -10.091  -8.536   9.771
  392   1HB   ARG  51          1HB       ARG  51 -12.585  -8.415  10.543
  393   2HB   ARG  51          2HB       ARG  51 -12.918  -9.125   8.969
  394   1HG   ARG  51          1HG       ARG  51 -12.384 -11.139   9.710
  395   2HG   ARG  51          2HG       ARG  51 -10.804 -10.568  10.250
  396   1HD   ARG  51          1HD       ARG  51 -11.839  -9.755  12.333
  397   2HD   ARG  51          2HD       ARG  51 -13.390 -10.396  11.793
  398    HE   ARG  51           HE       ARG  51 -11.694 -12.533  11.696
  399   1HH1  ARG  51          1HH1      ARG  51 -12.658 -10.259  14.150
  400   2HH1  ARG  51          2HH1      ARG  51 -12.451 -11.380  15.455
  401   1HH2  ARG  51          1HH2      ARG  51 -11.417 -14.018  13.406
  402   2HH2  ARG  51          2HH2      ARG  51 -11.744 -13.517  15.030
  403    H    THR  52           H        THR  52  -9.288  -7.398   7.487
  404    HA   THR  52           HA       THR  52 -10.105  -9.279   5.369
  405    HB   THR  52           HB       THR  52  -8.672  -6.705   4.794
  406    HG1  THR  52           HG1      THR  52 -11.404  -7.079   5.420
  407   1HG2  THR  52          1HG2      THR  52  -9.725  -8.854   3.266
  408   2HG2  THR  52          2HG2      THR  52  -8.943  -7.382   2.690
  409   3HG2  THR  52          3HG2      THR  52 -10.691  -7.421   2.918
  410    H    SER  53           H        SER  53  -8.672 -10.839   5.049
  411    HA   SER  53           HA       SER  53  -5.953 -10.613   5.948
  412   1HB   SER  53          1HB       SER  53  -5.836 -12.922   4.708
  413   2HB   SER  53          2HB       SER  53  -6.752 -12.780   6.208
  414    HG   SER  53           HG       SER  53  -7.618 -13.371   3.704
  415    H    LEU  54           H        LEU  54  -4.280 -11.652   4.268
  416    HA   LEU  54           HA       LEU  54  -3.652  -9.688   2.428
  417   1HB   LEU  54          1HB       LEU  54  -2.014 -11.271   3.202
  418   2HB   LEU  54          2HB       LEU  54  -2.891 -12.603   2.451
  419    HG   LEU  54           HG       LEU  54  -2.365 -11.659   0.232
  420   1HD1  LEU  54          1HD1      LEU  54  -2.131  -9.305   1.046
  421   2HD1  LEU  54          2HD1      LEU  54  -0.846  -9.846  -0.034
  422   3HD1  LEU  54          3HD1      LEU  54  -0.557  -9.754   1.703
  423   1HD2  LEU  54          1HD2      LEU  54   0.263 -11.913   0.636
  424   2HD2  LEU  54          2HD2      LEU  54  -0.843 -13.288   0.643
  425   3HD2  LEU  54          3HD2      LEU  54  -0.319 -12.569   2.167
  426    H    ALA  55           H        ALA  55  -5.738 -12.458   2.082
  427    HA   ALA  55           HA       ALA  55  -5.875 -12.712  -0.676
  428   1HB   ALA  55          1HB       ALA  55  -7.998 -13.777  -0.357
  429   2HB   ALA  55          2HB       ALA  55  -6.945 -14.225   0.985
  430   3HB   ALA  55          3HB       ALA  55  -8.200 -13.009   1.218
  431    H    GLY  56           H        GLY  56  -7.366 -10.341   1.441
  432   1HA   GLY  56          1HA       GLY  56  -9.145  -9.272  -0.522
  433   2HA   GLY  56          2HA       GLY  56  -8.701  -8.515   1.001
  434    H    MET  57           H        MET  57  -5.950  -8.292   0.673
  435    HA   MET  57           HA       MET  57  -5.813  -5.965  -0.969
  436   1HB   MET  57          1HB       MET  57  -3.713  -7.513   0.547
  437   2HB   MET  57          2HB       MET  57  -3.360  -6.043  -0.351
  438   1HG   MET  57          1HG       MET  57  -5.590  -5.850   1.551
  439   2HG   MET  57          2HG       MET  57  -4.001  -6.116   2.264
  440   1HE   MET  57          1HE       MET  57  -4.517  -2.697  -0.769
  441   2HE   MET  57          2HE       MET  57  -4.071  -4.358  -1.162
  442   3HE   MET  57          3HE       MET  57  -5.705  -3.991  -0.606
  443    H    LYS  58           H        LYS  58  -4.337  -9.194  -1.175
  444    HA   LYS  58           HA       LYS  58  -2.861  -8.857  -3.492
  445   1HB   LYS  58          1HB       LYS  58  -2.761 -11.203  -3.645
  446   2HB   LYS  58          2HB       LYS  58  -2.953 -10.876  -1.928
  447   1HG   LYS  58          1HG       LYS  58  -5.300 -11.425  -2.044
  448   2HG   LYS  58          2HG       LYS  58  -5.190 -11.642  -3.792
  449   1HD   LYS  58          1HD       LYS  58  -5.165 -13.787  -2.595
  450   2HD   LYS  58          2HD       LYS  58  -3.666 -13.512  -3.486
  451   1HE   LYS  58          1HE       LYS  58  -2.437 -13.152  -1.564
  452   2HE   LYS  58          2HE       LYS  58  -3.853 -12.691  -0.621
  453   1HZ   LYS  58          1HZ       LYS  58  -4.479 -15.193  -1.149
  454   2HZ   LYS  58          2HZ       LYS  58  -3.545 -14.762   0.194
  455   3HZ   LYS  58          3HZ       LYS  58  -2.795 -15.344  -1.207
  456    H    LYS  59           H        LYS  59  -6.298  -9.388  -3.096
  457    HA   LYS  59           HA       LYS  59  -6.997 -10.132  -5.684
  458   1HB   LYS  59          1HB       LYS  59  -8.343  -9.271  -3.320
  459   2HB   LYS  59          2HB       LYS  59  -9.004  -8.379  -4.684
  460   1HG   LYS  59          1HG       LYS  59  -9.538 -10.432  -5.827
  461   2HG   LYS  59          2HG       LYS  59  -8.761 -11.377  -4.555
  462   1HD   LYS  59          1HD       LYS  59 -10.483 -10.005  -3.049
  463   2HD   LYS  59          2HD       LYS  59 -11.383  -9.989  -4.568
  464   1HE   LYS  59          1HE       LYS  59 -11.498 -12.334  -4.646
  465   2HE   LYS  59          2HE       LYS  59 -10.233 -12.521  -3.432
  466   1HZ   LYS  59          1HZ       LYS  59 -13.014 -11.585  -3.011
  467   2HZ   LYS  59          2HZ       LYS  59 -11.807 -11.452  -1.833
  468   3HZ   LYS  59          3HZ       LYS  59 -12.287 -12.978  -2.384
  469    H    LEU  60           H        LEU  60  -6.249  -6.978  -4.350
  470    HA   LEU  60           HA       LEU  60  -7.079  -5.569  -6.730
  471   1HB   LEU  60          1HB       LEU  60  -5.677  -4.728  -4.208
  472   2HB   LEU  60          2HB       LEU  60  -5.956  -3.622  -5.551
  473    HG   LEU  60           HG       LEU  60  -8.433  -4.170  -5.269
  474   1HD1  LEU  60          1HD1      LEU  60  -8.473  -4.687  -2.544
  475   2HD1  LEU  60          2HD1      LEU  60  -7.284  -5.817  -3.189
  476   3HD1  LEU  60          3HD1      LEU  60  -8.924  -5.797  -3.838
  477   1HD2  LEU  60          1HD2      LEU  60  -8.519  -2.187  -4.273
  478   2HD2  LEU  60          2HD2      LEU  60  -6.767  -2.272  -4.088
  479   3HD2  LEU  60          3HD2      LEU  60  -7.820  -2.835  -2.789
  480    H    ILE  61           H        ILE  61  -4.062  -6.636  -5.255
  481    HA   ILE  61           HA       ILE  61  -2.635  -5.763  -7.682
  482    HB   ILE  61           HB       ILE  61  -1.171  -6.415  -5.162
  483   1HG1  ILE  61          1HG1      ILE  61  -2.910  -4.894  -4.399
  484   2HG1  ILE  61          2HG1      ILE  61  -1.367  -4.050  -4.451
  485   1HG2  ILE  61          1HG2      ILE  61  -0.630  -4.265  -7.189
  486   2HG2  ILE  61          2HG2      ILE  61   0.488  -4.992  -6.037
  487   3HG2  ILE  61          3HG2      ILE  61  -0.097  -5.931  -7.410
  488   1HD1  ILE  61          1HD1      ILE  61  -2.264  -2.493  -5.730
  489   2HD1  ILE  61          2HD1      ILE  61  -2.649  -3.702  -6.955
  490   3HD1  ILE  61          3HD1      ILE  61  -3.809  -3.341  -5.678
  491    HA   PRO  62           HA       PRO  62  -2.627 -10.373  -7.800
  492   1HB   PRO  62          1HB       PRO  62  -2.872 -10.516 -10.500
  493   2HB   PRO  62          2HB       PRO  62  -4.259 -10.356  -9.416
  494   1HG   PRO  62          1HG       PRO  62  -2.846  -8.251 -11.007
  495   2HG   PRO  62          2HG       PRO  62  -4.586  -8.494 -10.771
  496   1HD   PRO  62          1HD       PRO  62  -3.176  -6.638  -9.394
  497   2HD   PRO  62          2HD       PRO  62  -4.575  -7.481  -8.701
  498    H    GLY  63           H        GLY  63  -0.453 -10.546  -7.219
  499   1HA   GLY  63          1HA       GLY  63   1.593 -11.490  -8.041
  500   2HA   GLY  63          2HA       GLY  63   1.405 -10.530  -9.501
  501    H    ALA  64           H        ALA  64   1.486  -9.841  -6.001
  502    HA   ALA  64           HA       ALA  64   3.774  -8.075  -6.444
  503   1HB   ALA  64          1HB       ALA  64   2.283  -6.362  -6.553
  504   2HB   ALA  64          2HB       ALA  64   1.068  -7.208  -5.596
  505   3HB   ALA  64          3HB       ALA  64   2.453  -6.462  -4.800
  506    H    HIS  65           H        HIS  65   4.736  -7.335  -4.363
  507    HA   HIS  65           HA       HIS  65   4.680  -9.538  -2.446
  508   1HB   HIS  65          1HB       HIS  65   6.823  -8.543  -3.499
  509   2HB   HIS  65          2HB       HIS  65   6.591  -7.216  -2.365
  510    HD1  HIS  65           HD1      HIS  65   8.477 -10.143  -2.632
  511    HD2  HIS  65           HD2      HIS  65   6.176  -8.515   0.420
  512    HE1  HIS  65           HE1      HIS  65   9.307 -11.220  -0.517
  513    H    PHE  66           H        PHE  66   3.300  -9.350  -0.814
  514    HA   PHE  66           HA       PHE  66   2.839  -6.682   0.342
  515   1HB   PHE  66          1HB       PHE  66   1.071  -8.984  -0.193
  516   2HB   PHE  66          2HB       PHE  66   0.830  -8.204   1.367
  517    HD1  PHE  66           HD1      PHE  66   0.824  -7.667  -2.280
  518    HD2  PHE  66           HD2      PHE  66  -0.211  -6.088   1.535
  519    HE1  PHE  66           HE1      PHE  66  -0.507  -5.909  -3.372
  520    HE2  PHE  66           HE2      PHE  66  -1.544  -4.329   0.449
  521    HZ   PHE  66           HZ       PHE  66  -1.694  -4.238  -2.008
  522    H    GLU  67           H        GLU  67   2.542  -6.563   2.668
  523    HA   GLU  67           HA       GLU  67   3.527  -8.779   4.259
  524   1HB   GLU  67          1HB       GLU  67   5.482  -7.271   3.376
  525   2HB   GLU  67          2HB       GLU  67   4.936  -6.163   4.627
  526   1HG   GLU  67          1HG       GLU  67   5.118  -8.707   5.818
  527   2HG   GLU  67          2HG       GLU  67   6.582  -8.478   4.863
  528    H    LYS  68           H        LYS  68   2.083  -8.913   5.834
  529    HA   LYS  68           HA       LYS  68   1.008  -6.421   6.980
  530   1HB   LYS  68          1HB       LYS  68  -0.787  -7.621   5.992
  531   2HB   LYS  68          2HB       LYS  68  -0.225  -9.152   6.652
  532   1HG   LYS  68          1HG       LYS  68  -2.189  -8.369   7.836
  533   2HG   LYS  68          2HG       LYS  68  -0.784  -8.389   8.905
  534   1HD   LYS  68          1HD       LYS  68  -0.518  -6.002   8.669
  535   2HD   LYS  68          2HD       LYS  68  -1.813  -5.941   7.471
  536   1HE   LYS  68          1HE       LYS  68  -3.021  -7.176   9.601
  537   2HE   LYS  68          2HE       LYS  68  -1.948  -6.020  10.389
  538   1HZ   LYS  68          1HZ       LYS  68  -3.608  -4.590  10.027
  539   2HZ   LYS  68          2HZ       LYS  68  -4.336  -5.553   8.843
  540   3HZ   LYS  68          3HZ       LYS  68  -3.047  -4.538   8.432
  541    H    ARG  69           H        ARG  69   2.861  -9.208   7.585
  542    HA   ARG  69           HA       ARG  69   2.448  -9.911  10.176
  543   1HB   ARG  69          1HB       ARG  69   4.629 -10.050   8.334
  544   2HB   ARG  69          2HB       ARG  69   5.259  -9.604   9.914
  545   1HG   ARG  69          1HG       ARG  69   3.990 -11.559  10.854
  546   2HG   ARG  69          2HG       ARG  69   3.669 -12.047   9.189
  547   1HD   ARG  69          1HD       ARG  69   6.199 -11.919   8.853
  548   2HD   ARG  69          2HD       ARG  69   6.307 -11.860  10.612
  549    HE   ARG  69           HE       ARG  69   4.704 -14.043   9.801
  550   1HH1  ARG  69          1HH1      ARG  69   8.018 -12.981   9.929
  551   2HH1  ARG  69          2HH1      ARG  69   8.664 -14.586  10.029
  552   1HH2  ARG  69          1HH2      ARG  69   5.543 -16.160   9.932
  553   2HH2  ARG  69          2HH2      ARG  69   7.256 -16.393  10.030
  554    H    ARG  70           H        ARG  70   4.278  -7.083   9.059
  555    HA   ARG  70           HA       ARG  70   3.524  -5.406  11.136
  556   1HB   ARG  70          1HB       ARG  70   5.392  -7.316  12.019
  557   2HB   ARG  70          2HB       ARG  70   6.289  -5.813  11.844
  558   1HG   ARG  70          1HG       ARG  70   5.468  -5.082  13.760
  559   2HG   ARG  70          2HG       ARG  70   3.825  -5.234  13.134
  560   1HD   ARG  70          1HD       ARG  70   3.561  -6.748  14.767
  561   2HD   ARG  70          2HD       ARG  70   4.446  -7.827  13.689
  562    HE   ARG  70           HE       ARG  70   6.386  -6.538  15.113
  563   1HH1  ARG  70          1HH1      ARG  70   3.590  -8.447  15.923
  564   2HH1  ARG  70          2HH1      ARG  70   4.275  -9.065  17.390
  565   1HH2  ARG  70          1HH2      ARG  70   7.299  -7.345  17.041
  566   2HH2  ARG  70          2HH2      ARG  70   6.384  -8.436  18.025
  567    H    GLY  71           H        GLY  71   3.471  -4.374   8.963
  568   1HA   GLY  71          1HA       GLY  71   5.911  -3.650   7.670
  569   2HA   GLY  71          2HA       GLY  71   4.324  -2.964   7.353
  570    H    THR  72           H        THR  72   7.014  -2.868   9.663
  571    HA   THR  72           HA       THR  72   7.756  -1.220  11.062
  572    HB   THR  72           HB       THR  72   7.666   1.128   9.917
  573    HG1  THR  72           HG1      THR  72   7.247  -0.454   7.608
  574   1HG2  THR  72          1HG2      THR  72   9.160  -1.113   8.554
  575   2HG2  THR  72          2HG2      THR  72   9.644  -0.386  10.087
  576   3HG2  THR  72          3HG2      THR  72   9.616   0.589   8.618
  577    H    GLN  73           H        GLN  73   4.881  -1.916  11.230
  578    HA   GLN  73           HA       GLN  73   2.942  -1.186  12.187
  579   1HB   GLN  73          1HB       GLN  73   5.030  -0.681  13.882
  580   2HB   GLN  73          2HB       GLN  73   4.260   0.897  13.788
  581   1HG   GLN  73          1HG       GLN  73   2.912   0.169  15.393
  582   2HG   GLN  73          2HG       GLN  73   2.132  -0.798  14.142
  583   1HE2  GLN  73          1HE2      GLN  73   3.928  -0.828  17.017
  584   2HE2  GLN  73          2HE2      GLN  73   4.156  -2.536  17.141
  585    H    GLY  74           H        GLY  74   2.114   1.260  13.187
  586   1HA   GLY  74          1HA       GLY  74   1.308   2.587  10.826
  587   2HA   GLY  74          2HA       GLY  74   1.066   3.171  12.466
  588    H    GLU  75           H        GLU  75   4.193   2.806  12.585
  589    HA   GLU  75           HA       GLU  75   4.837   5.513  12.397
  590   1HB   GLU  75          1HB       GLU  75   6.123   3.202  13.244
  591   2HB   GLU  75          2HB       GLU  75   7.119   3.769  11.910
  592   1HG   GLU  75          1HG       GLU  75   7.878   5.536  13.056
  593   2HG   GLU  75          2HG       GLU  75   6.313   5.855  13.802
  594    H    ALA  76           H        ALA  76   4.728   3.045   9.971
  595    HA   ALA  76           HA       ALA  76   6.434   4.179   8.046
  596   1HB   ALA  76          1HB       ALA  76   4.666   1.968   8.209
  597   2HB   ALA  76          2HB       ALA  76   4.289   2.860   6.734
  598   3HB   ALA  76          3HB       ALA  76   5.930   2.281   7.019
  599    H    ARG  77           H        ARG  77   3.408   5.203   9.211
  600    HA   ARG  77           HA       ARG  77   2.324   6.421   6.916
  601   1HB   ARG  77          1HB       ARG  77   2.006   7.079   9.848
  602   2HB   ARG  77          2HB       ARG  77   1.063   7.833   8.569
  603   1HG   ARG  77          1HG       ARG  77   0.003   5.793   8.018
  604   2HG   ARG  77          2HG       ARG  77   1.134   4.861   9.001
  605   1HD   ARG  77          1HD       ARG  77  -0.822   4.980  10.289
  606   2HD   ARG  77          2HD       ARG  77   0.249   6.196  10.984
  607    HE   ARG  77           HE       ARG  77  -1.480   7.285   8.989
  608   1HH1  ARG  77          1HH1      ARG  77  -1.294   6.312  12.326
  609   2HH1  ARG  77          2HH1      ARG  77  -2.553   7.384  12.845
  610   1HH2  ARG  77          1HH2      ARG  77  -3.139   8.701   9.659
  611   2HH2  ARG  77          2HH2      ARG  77  -3.602   8.742  11.326
  612    H    ALA  78           H        ALA  78   4.935   7.302   8.980
  613    HA   ALA  78           HA       ALA  78   4.954  10.059   7.999
  614   1HB   ALA  78          1HB       ALA  78   5.577  10.396  10.115
  615   2HB   ALA  78          2HB       ALA  78   5.985   8.697  10.358
  616   3HB   ALA  78          3HB       ALA  78   7.157   9.789   9.620
  617    H    TYR  79           H        TYR  79   7.595   7.751   8.606
  618    HA   TYR  79           HA       TYR  79   9.357   8.791   6.740
  619   1HB   TYR  79          1HB       TYR  79  10.333   7.310   8.242
  620   2HB   TYR  79          2HB       TYR  79   9.073   6.100   8.027
  621    HD1  TYR  79           HD1      TYR  79  11.351   7.856   5.635
  622    HD2  TYR  79           HD2      TYR  79   9.994   4.147   7.218
  623    HE1  TYR  79           HE1      TYR  79  12.784   6.656   4.037
  624    HE2  TYR  79           HE2      TYR  79  11.424   2.937   5.625
  625    HH   TYR  79           HH       TYR  79  13.354   3.267   4.265
  626    H    SER  80           H        SER  80   7.234   5.953   6.346
  627    HA   SER  80           HA       SER  80   6.345   4.959   4.503
  628   1HB   SER  80          1HB       SER  80   6.782   7.734   3.387
  629   2HB   SER  80          2HB       SER  80   5.968   6.452   2.490
  630    HG   SER  80           HG       SER  80   4.677   8.006   3.865
  631    H    MET  81           H        MET  81   8.361   7.055   2.536
  632    HA   MET  81           HA       MET  81  10.173   4.803   2.003
  633   1HB   MET  81          1HB       MET  81   9.091   6.619  -0.152
  634   2HB   MET  81          2HB       MET  81  10.083   5.182  -0.364
  635   1HG   MET  81          1HG       MET  81   8.301   3.874  -0.427
  636   2HG   MET  81          2HG       MET  81   7.681   4.546   1.079
  637   1HE   MET  81          1HE       MET  81   4.501   4.983  -0.347
  638   2HE   MET  81          2HE       MET  81   5.593   4.580   0.978
  639   3HE   MET  81          3HE       MET  81   5.064   6.247   0.747
  640    H    LYS  82           H        LYS  82  11.810   5.971   0.151
  641    HA   LYS  82           HA       LYS  82  13.025   8.144   1.716
  642   1HB   LYS  82          1HB       LYS  82  14.104   5.872   0.162
  643   2HB   LYS  82          2HB       LYS  82  14.988   7.385   0.009
  644   1HG   LYS  82          1HG       LYS  82  15.174   7.483   2.470
  645   2HG   LYS  82          2HG       LYS  82  14.383   5.907   2.561
  646   1HD   LYS  82          1HD       LYS  82  16.751   6.154   0.788
  647   2HD   LYS  82          2HD       LYS  82  17.032   6.175   2.530
  648   1HE   LYS  82          1HE       LYS  82  17.079   3.936   2.293
  649   2HE   LYS  82          2HE       LYS  82  15.324   4.093   2.333
  650   1HZ   LYS  82          1HZ       LYS  82  16.253   4.511  -0.295
  651   2HZ   LYS  82          2HZ       LYS  82  15.213   3.308   0.281
  652   3HZ   LYS  82          3HZ       LYS  82  16.886   3.055   0.288
  653    H    GLU  83           H        GLU  83  13.047  10.130   0.901
  654    HA   GLU  83           HA       GLU  83  11.855  10.787  -1.555
  655   1HB   GLU  83          1HB       GLU  83  13.516  12.304   0.426
  656   2HB   GLU  83          2HB       GLU  83  13.087  13.045  -1.109
  657   1HG   GLU  83          1HG       GLU  83  10.701  12.625  -0.586
  658   2HG   GLU  83          2HG       GLU  83  11.195  12.035   0.999
  659    H    ASP  84           H        ASP  84  15.195  10.232  -0.641
  660    HA   ASP  84           HA       ASP  84  16.454  11.287  -2.912
  661   1HB   ASP  84          1HB       ASP  84  17.182   9.315  -0.806
  662   2HB   ASP  84          2HB       ASP  84  18.158   9.326  -2.273
  663    H    THR  85           H        THR  85  14.588   8.430  -2.479
  664    HA   THR  85           HA       THR  85  15.358   7.519  -5.176
  665    HB   THR  85           HB       THR  85  14.203   5.307  -4.086
  666    HG1  THR  85           HG1      THR  85  15.688   6.591  -2.016
  667   1HG2  THR  85          1HG2      THR  85  16.824   4.895  -3.459
  668   2HG2  THR  85          2HG2      THR  85  16.940   6.239  -4.595
  669   3HG2  THR  85          3HG2      THR  85  16.143   4.742  -5.078
  670    H    ARG  86           H        ARG  86  13.065   9.190  -3.717
  671    HA   ARG  86           HA       ARG  86  10.727   7.785  -4.705
  672   1HB   ARG  86          1HB       ARG  86  10.988   9.322  -2.566
  673   2HB   ARG  86          2HB       ARG  86  10.611  10.599  -3.714
  674   1HG   ARG  86          1HG       ARG  86   8.454  10.065  -3.749
  675   2HG   ARG  86          2HG       ARG  86   8.800   8.345  -3.942
  676   1HD   ARG  86          1HD       ARG  86   7.777   8.346  -1.889
  677   2HD   ARG  86          2HD       ARG  86   9.466   8.516  -1.412
  678    HE   ARG  86           HE       ARG  86   8.077  11.015  -1.774
  679   1HH1  ARG  86          1HH1      ARG  86   8.889   8.462   0.450
  680   2HH1  ARG  86          2HH1      ARG  86   8.671   9.444   1.860
  681   1HH2  ARG  86          1HH2      ARG  86   7.787  12.318   0.075
  682   2HH2  ARG  86          2HH2      ARG  86   8.044  11.637   1.646
  683    H    LEU  87           H        LEU  87   9.667   8.195  -6.555
  684    HA   LEU  87           HA       LEU  87  10.835  10.170  -8.367
  685   1HB   LEU  87          1HB       LEU  87   9.874   7.563  -8.697
  686   2HB   LEU  87          2HB       LEU  87   8.703   8.602  -9.506
  687    HG   LEU  87           HG       LEU  87  11.635   8.291 -10.112
  688   1HD1  LEU  87          1HD1      LEU  87  10.508   7.949 -12.434
  689   2HD1  LEU  87          2HD1      LEU  87   9.069   7.607 -11.475
  690   3HD1  LEU  87          3HD1      LEU  87  10.523   6.633 -11.260
  691   1HD2  LEU  87          1HD2      LEU  87   9.696  10.399 -11.037
  692   2HD2  LEU  87          2HD2      LEU  87  11.177  10.000 -11.908
  693   3HD2  LEU  87          3HD2      LEU  87  11.264  10.626 -10.261
  694    H    GLU  88           H        GLU  88   7.581   9.080  -7.388
  695    HA   GLU  88           HA       GLU  88   6.674  11.865  -7.624
  696   1HB   GLU  88          1HB       GLU  88   6.008   9.960  -9.475
  697   2HB   GLU  88          2HB       GLU  88   4.663   9.848  -8.349
  698   1HG   GLU  88          1HG       GLU  88   4.057  11.382 -10.053
  699   2HG   GLU  88          2HG       GLU  88   4.351  12.306  -8.581
  700    H    GLY  89           H        GLY  89   4.342  12.013  -6.656
  701   1HA   GLY  89          1HA       GLY  89   2.824  11.377  -4.959
  702   2HA   GLY  89          2HA       GLY  89   4.001  10.210  -4.376
  703    HA   PRO  90           HA       PRO  90   3.313   9.952  -2.436
  704   1HB   PRO  90          1HB       PRO  90   1.827  10.692  -0.288
  705   2HB   PRO  90          2HB       PRO  90   3.541  10.277  -0.173
  706   1HG   PRO  90          1HG       PRO  90   2.250  12.975  -0.297
  707   2HG   PRO  90          2HG       PRO  90   3.581  12.418   0.734
  708   1HD   PRO  90          1HD       PRO  90   3.988  13.886  -1.505
  709   2HD   PRO  90          2HD       PRO  90   5.147  12.666  -0.939
  710    H    TRP  91           H        TRP  91   1.005   9.247  -2.232
  711    HA   TRP  91           HA       TRP  91  -0.904  11.169  -3.351
  712   1HB   TRP  91          1HB       TRP  91  -0.142   8.509  -4.537
  713   2HB   TRP  91          2HB       TRP  91  -1.714   9.238  -4.854
  714    HD1  TRP  91           HD1      TRP  91  -0.703  12.271  -5.172
  715    HE1  TRP  91           HE1      TRP  91   0.593  12.928  -7.296
  716    HE3  TRP  91           HE3      TRP  91   0.892   7.634  -6.618
  717    HZ2  TRP  91           HZ2      TRP  91   2.093  11.651  -9.317
  718    HZ3  TRP  91           HZ3      TRP  91   2.253   7.438  -8.659
  719    HH2  TRP  91           HH2      TRP  91   2.839   9.406  -9.979
  720    H    GLU  92           H        GLU  92  -2.836  11.082  -2.390
  721    HA   GLU  92           HA       GLU  92  -3.465   8.700  -0.773
  722   1HB   GLU  92          1HB       GLU  92  -3.890  11.622  -0.218
  723   2HB   GLU  92          2HB       GLU  92  -4.880  10.403   0.571
  724   1HG   GLU  92          1HG       GLU  92  -2.904   9.385   1.537
  725   2HG   GLU  92          2HG       GLU  92  -1.876  10.548   0.701
  726    H    TYR  93           H        TYR  93  -5.438   7.781  -0.992
  727    HA   TYR  93           HA       TYR  93  -7.498   9.172  -2.532
  728   1HB   TYR  93          1HB       TYR  93  -6.382   6.452  -3.231
  729   2HB   TYR  93          2HB       TYR  93  -7.883   7.095  -3.887
  730    HD1  TYR  93           HD1      TYR  93  -7.800   9.174  -5.303
  731    HD2  TYR  93           HD2      TYR  93  -4.291   7.066  -4.144
  732    HE1  TYR  93           HE1      TYR  93  -6.542  10.293  -7.096
  733    HE2  TYR  93           HE2      TYR  93  -3.023   8.180  -5.933
  734    HH   TYR  93           HH       TYR  93  -3.258  10.404  -7.245
  735    H    GLY  94           H        GLY  94  -9.615   8.082  -2.411
  736   1HA   GLY  94          1HA       GLY  94 -11.125   6.573  -1.374
  737   2HA   GLY  94          2HA       GLY  94  -9.893   6.204  -0.177
  738    H    GLU  95           H        GLU  95 -11.317   6.538   1.547
  739    HA   GLU  95           HA       GLU  95 -12.952   8.754   1.938
  740   1HB   GLU  95          1HB       GLU  95 -13.212   6.844   3.350
  741   2HB   GLU  95          2HB       GLU  95 -11.551   6.957   3.915
  742   1HG   GLU  95          1HG       GLU  95 -12.025   8.565   5.423
  743   2HG   GLU  95          2HG       GLU  95 -13.257   9.310   4.408
  Start of MODEL   24
    1   1H    ALA   2          1H        ALA   2 -13.853   1.615  19.997
    2    HA   ALA   2           HA       ALA   2 -13.441   1.928  17.153
    3   1HB   ALA   2          1HB       ALA   2 -13.631   3.853  18.737
    4   2HB   ALA   2          2HB       ALA   2 -12.056   3.396  19.389
    5   3HB   ALA   2          3HB       ALA   2 -12.202   3.891  17.703
    6    H    ARG   3           H        ARG   3 -12.549  -0.357  17.087
    7    HA   ARG   3           HA       ARG   3  -9.912  -0.792  18.124
    8   1HB   ARG   3          1HB       ARG   3 -11.706  -2.318  16.254
    9   2HB   ARG   3          2HB       ARG   3 -10.043  -2.817  16.532
   10   1HG   ARG   3          1HG       ARG   3 -11.089  -2.439  19.076
   11   2HG   ARG   3          2HG       ARG   3 -12.386  -3.215  18.165
   12   1HD   ARG   3          1HD       ARG   3  -9.567  -4.243  18.083
   13   2HD   ARG   3          2HD       ARG   3 -10.684  -4.716  19.362
   14    HE   ARG   3           HE       ARG   3 -10.726  -5.572  16.612
   15   1HH1  ARG   3          1HH1      ARG   3 -12.577  -5.176  19.534
   16   2HH1  ARG   3          2HH1      ARG   3 -13.752  -6.376  19.107
   17   1HH2  ARG   3          1HH2      ARG   3 -12.266  -7.154  16.039
   18   2HH2  ARG   3          2HH2      ARG   3 -13.573  -7.502  17.120
   19    H    GLN   4           H        GLN   4  -7.971  -0.639  17.103
   20    HA   GLN   4           HA       GLN   4  -7.978   0.744  14.517
   21   1HB   GLN   4          1HB       GLN   4  -6.218   0.775  16.888
   22   2HB   GLN   4          2HB       GLN   4  -5.395   0.860  15.336
   23   1HG   GLN   4          1HG       GLN   4  -7.500   2.670  15.135
   24   2HG   GLN   4          2HG       GLN   4  -6.852   2.892  16.759
   25   1HE2  GLN   4          1HE2      GLN   4  -4.520   3.230  16.931
   26   2HE2  GLN   4          2HE2      GLN   4  -3.711   4.093  15.673
   27    H    VAL   5           H        VAL   5  -6.415   0.145  12.895
   28    HA   VAL   5           HA       VAL   5  -5.506  -2.650  13.084
   29    HB   VAL   5           HB       VAL   5  -6.093  -3.027  10.754
   30   1HG1  VAL   5          1HG1      VAL   5  -7.930  -3.822  11.745
   31   2HG1  VAL   5          2HG1      VAL   5  -8.047  -2.437  12.832
   32   3HG1  VAL   5          3HG1      VAL   5  -8.719  -2.341  11.204
   33   1HG2  VAL   5          1HG2      VAL   5  -7.839  -0.796  10.305
   34   2HG2  VAL   5          2HG2      VAL   5  -6.203  -0.223  10.632
   35   3HG2  VAL   5          3HG2      VAL   5  -6.490  -1.372   9.325
   36    H    ILE   6           H        ILE   6  -3.732  -3.193  11.648
   37    HA   ILE   6           HA       ILE   6  -1.846  -0.996  11.445
   38    HB   ILE   6           HB       ILE   6  -1.411  -3.910  10.786
   39   1HG1  ILE   6          1HG1      ILE   6  -0.137  -3.635  13.107
   40   2HG1  ILE   6          2HG1      ILE   6  -1.363  -2.397  13.356
   41   1HG2  ILE   6          1HG2      ILE   6   0.998  -3.170  11.356
   42   2HG2  ILE   6          2HG2      ILE   6   0.328  -2.754   9.779
   43   3HG2  ILE   6          3HG2      ILE   6   0.395  -1.540  11.057
   44   1HD1  ILE   6          1HD1      ILE   6  -2.762  -3.977  14.005
   45   2HD1  ILE   6          2HD1      ILE   6  -2.701  -4.669  12.383
   46   3HD1  ILE   6          3HD1      ILE   6  -1.576  -5.225  13.623
   47    H    CYS   7           H        CYS   7  -0.737  -0.419   9.546
   48    HA   CYS   7           HA       CYS   7  -2.347  -0.538   7.172
   49   1HB   CYS   7          1HB       CYS   7  -0.808   1.016   6.234
   50   2HB   CYS   7          2HB       CYS   7  -0.986   1.461   7.926
   51    HG   CYS   7           HG       CYS   7   1.653  -0.285   6.619
   52    H    TRP   8           H        TRP   8  -1.583  -1.257   5.087
   53    HA   TRP   8           HA       TRP   8   0.129  -3.635   5.326
   54   1HB   TRP   8          1HB       TRP   8  -2.017  -2.913   3.325
   55   2HB   TRP   8          2HB       TRP   8  -0.960  -4.312   3.155
   56    HD1  TRP   8           HD1      TRP   8  -3.378  -2.931   5.874
   57    HE1  TRP   8           HE1      TRP   8  -4.617  -4.935   6.910
   58    HE3  TRP   8           HE3      TRP   8  -1.137  -6.711   3.261
   59    HZ2  TRP   8           HZ2      TRP   8  -4.641  -7.746   6.654
   60    HZ3  TRP   8           HZ3      TRP   8  -1.825  -9.029   3.717
   61    HH2  TRP   8           HH2      TRP   8  -3.540  -9.534   5.379
   62    H    CYS   9           H        CYS   9   2.148  -3.359   4.662
   63    HA   CYS   9           HA       CYS   9   2.730  -1.339   2.625
   64   1HB   CYS   9          1HB       CYS   9   5.109  -1.696   3.320
   65   2HB   CYS   9          2HB       CYS   9   4.063  -1.123   4.614
   66    HG   CYS   9           HG       CYS   9   6.047  -3.108   5.398
   67    H    PHE  10           H        PHE  10   2.924  -1.963   0.589
   68    HA   PHE  10           HA       PHE  10   4.126  -4.581   0.016
   69   1HB   PHE  10          1HB       PHE  10   2.457  -5.224  -1.464
   70   2HB   PHE  10          2HB       PHE  10   1.526  -4.432  -0.196
   71    HD1  PHE  10           HD2      PHE  10   1.080  -1.880  -0.568
   72    HD2  PHE  10           HD1      PHE  10   2.100  -4.627  -3.655
   73    HE1  PHE  10           HE2      PHE  10   0.097  -0.364  -2.237
   74    HE2  PHE  10           HE1      PHE  10   1.119  -3.115  -5.330
   75    HZ   PHE  10           HZ       PHE  10   0.115  -0.980  -4.622
   76    H    THR  11           H        THR  11   4.926  -4.759  -2.229
   77    HA   THR  11           HA       THR  11   5.654  -2.146  -3.374
   78    HB   THR  11           HB       THR  11   7.613  -4.384  -3.569
   79    HG1  THR  11           HG1      THR  11   7.943  -4.408  -1.488
   80   1HG2  THR  11          1HG2      THR  11   8.934  -2.753  -4.328
   81   2HG2  THR  11          2HG2      THR  11   8.625  -1.765  -2.899
   82   3HG2  THR  11          3HG2      THR  11   7.533  -1.683  -4.281
   83    H    LEU  12           H        LEU  12   5.020  -1.975  -5.413
   84    HA   LEU  12           HA       LEU  12   4.610  -4.435  -6.975
   85   1HB   LEU  12          1HB       LEU  12   2.578  -3.195  -6.681
   86   2HB   LEU  12          2HB       LEU  12   3.359  -1.705  -7.208
   87    HG   LEU  12           HG       LEU  12   3.453  -2.465  -9.467
   88   1HD1  LEU  12          1HD1      LEU  12   2.385  -4.734 -10.000
   89   2HD1  LEU  12          2HD1      LEU  12   2.666  -5.112  -8.301
   90   3HD1  LEU  12          3HD1      LEU  12   4.026  -4.721  -9.353
   91   1HD2  LEU  12          1HD2      LEU  12   1.364  -1.513  -9.066
   92   2HD2  LEU  12          2HD2      LEU  12   0.821  -2.880  -8.092
   93   3HD2  LEU  12          3HD2      LEU  12   0.980  -3.051  -9.840
   94    H    ASN  13           H        ASN  13   5.995  -4.834  -8.559
   95    HA   ASN  13           HA       ASN  13   7.641  -2.628  -9.584
   96   1HB   ASN  13          1HB       ASN  13   8.148  -5.587  -9.918
   97   2HB   ASN  13          2HB       ASN  13   9.277  -4.266 -10.204
   98   1HD2  ASN  13          1HD2      ASN  13   9.886  -2.969  -8.320
   99   2HD2  ASN  13          2HD2      ASN  13  10.022  -3.756  -6.787
  100    H    ASN  14           H        ASN  14   7.590  -2.043 -11.680
  101    HA   ASN  14           HA       ASN  14   6.749  -1.796 -13.784
  102   1HB   ASN  14          1HB       ASN  14   6.647  -4.787 -14.017
  103   2HB   ASN  14          2HB       ASN  14   7.131  -3.595 -15.221
  104   1HD2  ASN  14          1HD2      ASN  14   9.220  -3.246 -15.506
  105   2HD2  ASN  14          2HD2      ASN  14  10.481  -3.773 -14.449
  106    HA   PRO  15           HA       PRO  15   2.436  -2.877 -12.329
  107   1HB   PRO  15          1HB       PRO  15   1.539  -0.316 -12.244
  108   2HB   PRO  15          2HB       PRO  15   2.338  -1.101 -10.875
  109   1HG   PRO  15          1HG       PRO  15   3.472   0.788 -12.902
  110   2HG   PRO  15          2HG       PRO  15   3.721   0.748 -11.146
  111   1HD   PRO  15          1HD       PRO  15   5.529  -0.250 -12.898
  112   2HD   PRO  15          2HD       PRO  15   5.285  -0.940 -11.280
  113    H    LEU  16           H        LEU  16   0.727  -3.107 -13.693
  114    HA   LEU  16           HA       LEU  16   1.105  -2.232 -16.441
  115   1HB   LEU  16          1HB       LEU  16   0.009  -4.499 -15.218
  116   2HB   LEU  16          2HB       LEU  16  -1.348  -3.664 -15.970
  117    HG   LEU  16           HG       LEU  16  -0.435  -5.368 -17.447
  118   1HD1  LEU  16          1HD1      LEU  16  -1.238  -2.989 -18.202
  119   2HD1  LEU  16          2HD1      LEU  16  -0.533  -4.115 -19.362
  120   3HD1  LEU  16          3HD1      LEU  16   0.447  -2.811 -18.692
  121   1HD2  LEU  16          1HD2      LEU  16   2.076  -3.899 -17.928
  122   2HD2  LEU  16          2HD2      LEU  16   1.750  -5.633 -17.944
  123   3HD2  LEU  16          3HD2      LEU  16   1.980  -4.792 -16.410
  124    H    SER  17           H        SER  17  -0.377  -1.047 -13.712
  125    HA   SER  17           HA       SER  17  -1.588   1.115 -15.002
  126   1HB   SER  17          1HB       SER  17  -4.017   0.355 -14.212
  127   2HB   SER  17          2HB       SER  17  -3.403  -0.036 -15.818
  128    HG   SER  17           HG       SER  17  -4.332  -1.828 -14.594
  129    HA   PRO  18           HA       PRO  18  -1.610   2.698 -10.911
  130   1HB   PRO  18          1HB       PRO  18  -3.697   4.433 -10.963
  131   2HB   PRO  18          2HB       PRO  18  -2.172   4.739 -11.804
  132   1HG   PRO  18          1HG       PRO  18  -4.760   3.697 -12.891
  133   2HG   PRO  18          2HG       PRO  18  -3.658   4.901 -13.585
  134   1HD   PRO  18          1HD       PRO  18  -3.709   2.322 -14.412
  135   2HD   PRO  18          2HD       PRO  18  -2.224   3.295 -14.410
  136    H    LEU  19           H        LEU  19  -2.652   2.637  -8.882
  137    HA   LEU  19           HA       LEU  19  -4.603   0.523  -8.634
  138   1HB   LEU  19          1HB       LEU  19  -3.642   2.217  -6.363
  139   2HB   LEU  19          2HB       LEU  19  -4.135   0.525  -6.356
  140    HG   LEU  19           HG       LEU  19  -1.604   1.524  -7.653
  141   1HD1  LEU  19          1HD1      LEU  19  -1.832   1.838  -5.105
  142   2HD1  LEU  19          2HD1      LEU  19  -0.402   1.020  -5.734
  143   3HD1  LEU  19          3HD1      LEU  19  -1.718   0.079  -5.034
  144   1HD2  LEU  19          1HD2      LEU  19  -1.159  -1.044  -7.089
  145   2HD2  LEU  19          2HD2      LEU  19  -1.889  -0.515  -8.605
  146   3HD2  LEU  19          3HD2      LEU  19  -2.910  -1.109  -7.294
  147    H    SER  20           H        SER  20  -6.417   0.881  -6.975
  148    HA   SER  20           HA       SER  20  -7.570   3.553  -7.062
  149   1HB   SER  20          1HB       SER  20  -9.052   1.151  -8.160
  150   2HB   SER  20          2HB       SER  20  -9.695   2.785  -7.999
  151    HG   SER  20           HG       SER  20  -8.729   2.012 -10.121
  152    H    LEU  21           H        LEU  21  -9.350   3.831  -5.596
  153    HA   LEU  21           HA       LEU  21  -8.992   2.677  -3.104
  154   1HB   LEU  21          1HB       LEU  21 -10.131   4.736  -3.233
  155   2HB   LEU  21          2HB       LEU  21 -11.340   4.085  -4.338
  156    HG   LEU  21           HG       LEU  21 -12.162   2.659  -2.436
  157   1HD1  LEU  21          1HD1      LEU  21  -9.843   3.763  -1.186
  158   2HD1  LEU  21          2HD1      LEU  21 -10.959   2.540  -0.580
  159   3HD1  LEU  21          3HD1      LEU  21 -11.281   4.249  -0.287
  160   1HD2  LEU  21          1HD2      LEU  21 -12.340   5.617  -2.598
  161   2HD2  LEU  21          2HD2      LEU  21 -13.028   4.829  -1.178
  162   3HD2  LEU  21          3HD2      LEU  21 -13.594   4.392  -2.791
  163    H    HIS  22           H        HIS  22 -10.213   1.177  -1.887
  164    HA   HIS  22           HA       HIS  22 -11.646  -0.802  -3.535
  165   1HB   HIS  22          1HB       HIS  22  -9.410  -1.450  -2.433
  166   2HB   HIS  22          2HB       HIS  22 -10.303  -1.429  -0.915
  167    HD1  HIS  22           HD1      HIS  22 -10.460  -3.858  -0.369
  168    HD2  HIS  22           HD2      HIS  22 -11.562  -3.050  -4.292
  169    HE1  HIS  22           HE1      HIS  22 -11.350  -6.027  -1.278
  170    H    ASP  23           H        ASP  23 -13.624  -1.505  -2.892
  171    HA   ASP  23           HA       ASP  23 -15.151   0.106  -1.162
  172   1HB   ASP  23          1HB       ASP  23 -15.625  -2.538  -2.506
  173   2HB   ASP  23          2HB       ASP  23 -16.799  -1.897  -1.359
  174    H    SER  24           H        SER  24 -13.172  -2.658  -0.594
  175    HA   SER  24           HA       SER  24 -14.390  -3.280   1.962
  176   1HB   SER  24          1HB       SER  24 -11.776  -4.389   0.956
  177   2HB   SER  24          2HB       SER  24 -12.934  -5.133   2.059
  178    HG   SER  24           HG       SER  24 -13.718  -6.043   0.345
  179    H    MET  25           H        MET  25 -11.437  -1.781   0.736
  180    HA   MET  25           HA       MET  25 -10.239  -1.416   3.294
  181   1HB   MET  25          1HB       MET  25  -8.525  -0.305   2.180
  182   2HB   MET  25          2HB       MET  25  -9.136  -1.402   0.949
  183   1HG   MET  25          1HG       MET  25 -10.290   0.341  -0.160
  184   2HG   MET  25          2HG       MET  25 -10.029   1.455   1.180
  185   1HE   MET  25          1HE       MET  25  -8.150  -1.091  -0.735
  186   2HE   MET  25          2HE       MET  25  -7.838  -0.078  -2.145
  187   3HE   MET  25          3HE       MET  25  -6.545  -0.404  -0.990
  188    H    LYS  26           H        LYS  26  -9.488   1.080   3.651
  189    HA   LYS  26           HA       LYS  26 -11.928   2.724   3.634
  190   1HB   LYS  26          1HB       LYS  26 -10.629   1.601   5.914
  191   2HB   LYS  26          2HB       LYS  26 -10.403   3.345   5.958
  192   1HG   LYS  26          1HG       LYS  26 -13.119   2.236   5.428
  193   2HG   LYS  26          2HG       LYS  26 -12.486   2.249   7.076
  194   1HD   LYS  26          1HD       LYS  26 -12.015   4.700   6.763
  195   2HD   LYS  26          2HD       LYS  26 -12.911   4.606   5.245
  196   1HE   LYS  26          1HE       LYS  26 -14.219   3.533   7.682
  197   2HE   LYS  26          2HE       LYS  26 -14.061   5.284   7.549
  198   1HZ   LYS  26          1HZ       LYS  26 -15.989   3.696   6.384
  199   2HZ   LYS  26          2HZ       LYS  26 -14.984   4.172   5.110
  200   3HZ   LYS  26          3HZ       LYS  26 -15.713   5.340   6.093
  201    H    TYR  27           H        TYR  27  -8.415   2.592   3.793
  202    HA   TYR  27           HA       TYR  27  -8.336   5.317   2.691
  203   1HB   TYR  27          1HB       TYR  27  -7.599   4.888   5.222
  204   2HB   TYR  27          2HB       TYR  27  -6.090   4.440   4.436
  205    HD1  TYR  27           HD1      TYR  27  -8.602   7.137   3.793
  206    HD2  TYR  27           HD2      TYR  27  -4.553   6.145   4.645
  207    HE1  TYR  27           HE1      TYR  27  -7.991   9.513   3.626
  208    HE2  TYR  27           HE2      TYR  27  -3.931   8.519   4.482
  209    HH   TYR  27           HH       TYR  27  -6.375  11.024   3.912
  210    H    LEU  28           H        LEU  28  -6.798   5.704   1.129
  211    HA   LEU  28           HA       LEU  28  -5.147   3.408   0.309
  212   1HB   LEU  28          1HB       LEU  28  -6.885   3.426  -1.263
  213   2HB   LEU  28          2HB       LEU  28  -6.897   5.186  -1.356
  214    HG   LEU  28           HG       LEU  28  -4.901   5.206  -2.662
  215   1HD1  LEU  28          1HD1      LEU  28  -3.355   3.674  -2.192
  216   2HD1  LEU  28          2HD1      LEU  28  -4.250   2.596  -3.263
  217   3HD1  LEU  28          3HD1      LEU  28  -4.546   2.557  -1.525
  218   1HD2  LEU  28          1HD2      LEU  28  -5.685   4.262  -4.643
  219   2HD2  LEU  28          2HD2      LEU  28  -7.152   4.532  -3.701
  220   3HD2  LEU  28          3HD2      LEU  28  -6.457   2.914  -3.808
  221    H    VAL  29           H        VAL  29  -3.055   3.862   0.174
  222    HA   VAL  29           HA       VAL  29  -2.200   6.563  -0.562
  223    HB   VAL  29           HB       VAL  29  -1.185   5.109   1.885
  224   1HG1  VAL  29          1HG1      VAL  29   0.049   7.077   0.203
  225   2HG1  VAL  29          2HG1      VAL  29  -0.239   7.752   1.808
  226   3HG1  VAL  29          3HG1      VAL  29   0.694   6.265   1.629
  227   1HG2  VAL  29          1HG2      VAL  29  -2.993   7.457   1.482
  228   2HG2  VAL  29          2HG2      VAL  29  -3.175   6.079   2.567
  229   3HG2  VAL  29          3HG2      VAL  29  -1.998   7.341   2.934
  230    H    TYR  30           H        TYR  30  -0.746   6.439  -2.130
  231    HA   TYR  30           HA       TYR  30   1.336   4.425  -2.073
  232   1HB   TYR  30          1HB       TYR  30   0.822   3.322  -4.059
  233   2HB   TYR  30          2HB       TYR  30  -0.759   3.508  -3.308
  234    HD1  TYR  30           HD2      TYR  30  -2.252   5.395  -4.094
  235    HD2  TYR  30           HD1      TYR  30   1.269   4.237  -6.182
  236    HE1  TYR  30           HE2      TYR  30  -3.081   6.534  -6.110
  237    HE2  TYR  30           HE1      TYR  30   0.451   5.374  -8.204
  238    HH   TYR  30           HH       TYR  30  -2.611   6.212  -8.730
  239    H    GLN  31           H        GLN  31   2.955   4.783  -3.802
  240    HA   GLN  31           HA       GLN  31   2.895   7.357  -5.130
  241   1HB   GLN  31          1HB       GLN  31   3.967   8.410  -3.461
  242   2HB   GLN  31          2HB       GLN  31   4.366   6.901  -2.651
  243   1HG   GLN  31          1HG       GLN  31   6.292   6.598  -4.060
  244   2HG   GLN  31          2HG       GLN  31   5.860   8.018  -5.012
  245   1HE2  GLN  31          1HE2      GLN  31   8.294   7.443  -3.515
  246   2HE2  GLN  31          2HE2      GLN  31   8.473   8.732  -2.378
  247    H    THR  32           H        THR  32   4.561   7.606  -6.709
  248    HA   THR  32           HA       THR  32   5.522   5.036  -7.705
  249    HB   THR  32           HB       THR  32   5.322   7.759  -8.989
  250    HG1  THR  32           HG1      THR  32   3.591   5.861  -8.744
  251   1HG2  THR  32          1HG2      THR  32   6.514   5.223 -10.117
  252   2HG2  THR  32          2HG2      THR  32   7.363   6.736  -9.800
  253   3HG2  THR  32          3HG2      THR  32   6.130   6.664 -11.058
  254    H    GLU  33           H        GLU  33   7.645   4.517  -7.983
  255    HA   GLU  33           HA       GLU  33   9.664   6.527  -7.278
  256   1HB   GLU  33          1HB       GLU  33   9.359   3.777  -6.085
  257   2HB   GLU  33          2HB       GLU  33  10.885   4.648  -6.048
  258   1HG   GLU  33          1HG       GLU  33  10.217   5.609  -4.175
  259   2HG   GLU  33          2HG       GLU  33   8.988   6.461  -5.108
  260    H    GLN  34           H        GLN  34  11.888   5.822  -7.894
  261    HA   GLN  34           HA       GLN  34  11.790   4.215 -10.361
  262   1HB   GLN  34          1HB       GLN  34  12.583   6.856 -10.042
  263   2HB   GLN  34          2HB       GLN  34  14.100   5.970 -10.107
  264   1HG   GLN  34          1HG       GLN  34  12.245   5.091 -12.148
  265   2HG   GLN  34          2HG       GLN  34  12.585   6.818 -12.254
  266   1HE2  GLN  34          1HE2      GLN  34  14.983   7.342 -12.002
  267   2HE2  GLN  34          2HE2      GLN  34  16.072   6.343 -12.897
  268    H    GLY  35           H        GLY  35  13.023   2.446 -10.477
  269   1HA   GLY  35          1HA       GLY  35  15.518   2.207  -9.080
  270   2HA   GLY  35          2HA       GLY  35  14.245   1.245  -8.345
  271    H    GLU  36           H        GLU  36  14.785  -0.796  -8.846
  272    HA   GLU  36           HA       GLU  36  16.168  -1.793 -10.956
  273   1HB   GLU  36          1HB       GLU  36  14.927  -3.916 -10.644
  274   2HB   GLU  36          2HB       GLU  36  15.471  -3.210  -9.129
  275   1HG   GLU  36          1HG       GLU  36  13.233  -2.336  -8.722
  276   2HG   GLU  36          2HG       GLU  36  12.683  -3.025 -10.249
  277    H    ALA  37           H        ALA  37  15.754  -2.506 -13.031
  278    HA   ALA  37           HA       ALA  37  14.773  -2.584 -15.085
  279   1HB   ALA  37          1HB       ALA  37  12.021  -2.114 -14.426
  280   2HB   ALA  37          2HB       ALA  37  12.794  -3.586 -15.017
  281   3HB   ALA  37          3HB       ALA  37  12.730  -3.257 -13.285
  282    H    GLY  38           H        GLY  38  14.364  -1.130 -16.698
  283   1HA   GLY  38          1HA       GLY  38  14.710   1.581 -16.251
  284   2HA   GLY  38          2HA       GLY  38  14.011   0.900 -17.712
  285    H    ASN  39           H        ASN  39  11.801  -0.292 -16.041
  286    HA   ASN  39           HA       ASN  39   9.995   1.914 -16.305
  287   1HB   ASN  39          1HB       ASN  39   9.324  -0.669 -14.918
  288   2HB   ASN  39          2HB       ASN  39   8.275   0.374 -15.873
  289   1HD2  ASN  39          1HD2      ASN  39   9.366   0.715 -18.189
  290   2HD2  ASN  39          2HD2      ASN  39   9.721  -0.773 -18.994
  291    H    ILE  40           H        ILE  40   8.243   1.661 -14.220
  292    HA   ILE  40           HA       ILE  40   9.856   2.483 -11.893
  293    HB   ILE  40           HB       ILE  40   7.844   3.913 -11.288
  294   1HG1  ILE  40          1HG1      ILE  40   7.192   3.370 -14.192
  295   2HG1  ILE  40          2HG1      ILE  40   6.218   2.911 -12.800
  296   1HG2  ILE  40          1HG2      ILE  40   8.606   5.771 -12.603
  297   2HG2  ILE  40          2HG2      ILE  40   9.995   4.769 -12.186
  298   3HG2  ILE  40          3HG2      ILE  40   9.305   4.688 -13.806
  299   1HD1  ILE  40          1HD1      ILE  40   5.383   4.898 -14.023
  300   2HD1  ILE  40          2HD1      ILE  40   5.723   5.198 -12.318
  301   3HD1  ILE  40          3HD1      ILE  40   6.853   5.751 -13.553
  302    H    HIS  41           H        HIS  41   8.635   2.325  -9.799
  303    HA   HIS  41           HA       HIS  41   6.776   0.045  -9.793
  304   1HB   HIS  41          1HB       HIS  41   7.933  -0.570  -7.563
  305   2HB   HIS  41          2HB       HIS  41   8.747  -0.987  -9.068
  306    HD1  HIS  41           HD1      HIS  41  11.061  -0.969  -7.928
  307    HD2  HIS  41           HD2      HIS  41   9.052   2.663  -7.737
  308    HE1  HIS  41           HE1      HIS  41  12.775   0.709  -7.173
  309    H    PHE  42           H        PHE  42   5.312  -0.035  -8.020
  310    HA   PHE  42           HA       PHE  42   4.780   2.617  -6.887
  311   1HB   PHE  42          1HB       PHE  42   3.055   0.234  -7.480
  312   2HB   PHE  42          2HB       PHE  42   2.524   1.444  -6.317
  313    HD1  PHE  42           HD1      PHE  42   4.565   2.500  -9.124
  314    HD2  PHE  42           HD2      PHE  42   0.583   1.927  -7.735
  315    HE1  PHE  42           HE1      PHE  42   3.724   3.896 -10.968
  316    HE2  PHE  42           HE2      PHE  42  -0.264   3.321  -9.577
  317    HZ   PHE  42           HZ       PHE  42   1.307   4.308 -11.196
  318    H    GLN  43           H        GLN  43   4.635   2.976  -4.719
  319    HA   GLN  43           HA       GLN  43   4.833   0.720  -2.880
  320   1HB   GLN  43          1HB       GLN  43   6.959   2.727  -3.371
  321   2HB   GLN  43          2HB       GLN  43   6.631   2.330  -1.690
  322   1HG   GLN  43          1HG       GLN  43   6.868   0.001  -3.438
  323   2HG   GLN  43          2HG       GLN  43   8.331   0.978  -3.330
  324   1HE2  GLN  43          1HE2      GLN  43   6.277  -1.248  -1.754
  325   2HE2  GLN  43          2HE2      GLN  43   7.166  -1.377  -0.279
  326    H    GLY  44           H        GLY  44   3.979   1.109  -0.856
  327   1HA   GLY  44          1HA       GLY  44   3.506   3.507   0.400
  328   2HA   GLY  44          2HA       GLY  44   2.133   3.288  -0.675
  329    H    TYR  45           H        TYR  45   1.103   3.380   1.557
  330    HA   TYR  45           HA       TYR  45   0.940   0.641   2.634
  331   1HB   TYR  45          1HB       TYR  45   0.459   1.605   4.838
  332   2HB   TYR  45          2HB       TYR  45   2.028   2.136   4.244
  333    HD1  TYR  45           HD1      TYR  45  -1.471   3.180   4.804
  334    HD2  TYR  45           HD2      TYR  45   2.481   4.440   3.857
  335    HE1  TYR  45           HE1      TYR  45  -2.141   5.521   5.151
  336    HE2  TYR  45           HE2      TYR  45   1.822   6.785   4.203
  337    HH   TYR  45           HH       TYR  45  -0.134   8.160   4.240
  338    H    ILE  46           H        ILE  46  -1.066  -0.203   2.985
  339    HA   ILE  46           HA       ILE  46  -3.381   1.520   2.410
  340    HB   ILE  46           HB       ILE  46  -3.024  -1.309   1.413
  341   1HG1  ILE  46          1HG1      ILE  46  -3.217   1.223  -0.221
  342   2HG1  ILE  46          2HG1      ILE  46  -1.679   0.513   0.258
  343   1HG2  ILE  46          1HG2      ILE  46  -5.139  -0.991   0.281
  344   2HG2  ILE  46          2HG2      ILE  46  -5.341  -0.727   2.012
  345   3HG2  ILE  46          3HG2      ILE  46  -5.261   0.650   0.914
  346   1HD1  ILE  46          1HD1      ILE  46  -2.507  -0.040  -2.057
  347   2HD1  ILE  46          2HD1      ILE  46  -2.054  -1.411  -1.043
  348   3HD1  ILE  46          3HD1      ILE  46  -3.756  -1.012  -1.279
  349    H    GLU  47           H        GLU  47  -4.956   1.407   3.877
  350    HA   GLU  47           HA       GLU  47  -4.810  -0.724   5.894
  351   1HB   GLU  47          1HB       GLU  47  -6.389   1.831   6.124
  352   2HB   GLU  47          2HB       GLU  47  -5.892   0.743   7.412
  353   1HG   GLU  47          1HG       GLU  47  -3.503   1.498   6.284
  354   2HG   GLU  47          2HG       GLU  47  -4.475   2.966   6.193
  355    H    MET  48           H        MET  48  -6.231  -2.317   5.748
  356    HA   MET  48           HA       MET  48  -8.535  -2.102   4.029
  357   1HB   MET  48          1HB       MET  48  -7.487  -4.340   5.763
  358   2HB   MET  48          2HB       MET  48  -8.931  -4.478   4.769
  359   1HG   MET  48          1HG       MET  48  -6.699  -3.493   3.233
  360   2HG   MET  48          2HG       MET  48  -6.315  -5.022   4.020
  361   1HE   MET  48          1HE       MET  48  -8.293  -2.976   1.821
  362   2HE   MET  48          2HE       MET  48  -8.473  -4.033   0.421
  363   3HE   MET  48          3HE       MET  48  -9.792  -3.875   1.582
  364    H    LYS  49           H        LYS  49 -10.583  -3.331   5.046
  365    HA   LYS  49           HA       LYS  49 -11.862  -1.538   6.707
  366   1HB   LYS  49          1HB       LYS  49 -12.695  -3.656   5.317
  367   2HB   LYS  49          2HB       LYS  49 -12.653  -4.402   6.909
  368   1HG   LYS  49          1HG       LYS  49 -14.863  -3.574   6.470
  369   2HG   LYS  49          2HG       LYS  49 -14.125  -2.612   7.752
  370   1HD   LYS  49          1HD       LYS  49 -14.755  -0.836   6.542
  371   2HD   LYS  49          2HD       LYS  49 -13.401  -1.244   5.486
  372   1HE   LYS  49          1HE       LYS  49 -14.992  -2.722   4.210
  373   2HE   LYS  49          2HE       LYS  49 -16.295  -2.012   5.161
  374   1HZ   LYS  49          1HZ       LYS  49 -16.005  -0.911   3.014
  375   2HZ   LYS  49          2HZ       LYS  49 -14.422  -0.487   3.433
  376   3HZ   LYS  49          3HZ       LYS  49 -15.727   0.153   4.299
  377    H    LYS  50           H        LYS  50 -10.648  -4.749   7.687
  378    HA   LYS  50           HA       LYS  50  -9.393  -3.902  10.029
  379   1HB   LYS  50          1HB       LYS  50 -12.261  -4.072  10.249
  380   2HB   LYS  50          2HB       LYS  50 -11.507  -5.268  11.296
  381   1HG   LYS  50          1HG       LYS  50 -10.300  -3.607  12.477
  382   2HG   LYS  50          2HG       LYS  50 -10.715  -2.368  11.289
  383   1HD   LYS  50          1HD       LYS  50 -13.182  -3.123  12.011
  384   2HD   LYS  50          2HD       LYS  50 -12.320  -3.496  13.506
  385   1HE   LYS  50          1HE       LYS  50 -12.261  -1.344  14.053
  386   2HE   LYS  50          2HE       LYS  50 -11.475  -0.943  12.527
  387   1HZ   LYS  50          1HZ       LYS  50 -14.328  -1.457  12.379
  388   2HZ   LYS  50          2HZ       LYS  50 -13.400  -0.269  11.613
  389   3HZ   LYS  50          3HZ       LYS  50 -13.885  -0.058  13.220
  390    H    ARG  51           H        ARG  51 -11.675  -6.599   9.589
  391    HA   ARG  51           HA       ARG  51  -9.524  -8.474  10.169
  392   1HB   ARG  51          1HB       ARG  51 -12.043  -8.475  11.031
  393   2HB   ARG  51          2HB       ARG  51 -12.290  -9.390   9.550
  394   1HG   ARG  51          1HG       ARG  51 -10.551 -10.983  10.288
  395   2HG   ARG  51          2HG       ARG  51 -10.427 -10.092  11.806
  396   1HD   ARG  51          1HD       ARG  51 -11.899 -11.750  12.400
  397   2HD   ARG  51          2HD       ARG  51 -13.015 -10.483  11.892
  398    HE   ARG  51           HE       ARG  51 -13.638 -11.785  10.105
  399   1HH1  ARG  51          1HH1      ARG  51 -10.760 -13.099  11.558
  400   2HH1  ARG  51          2HH1      ARG  51 -10.807 -14.565  10.636
  401   1HH2  ARG  51          1HH2      ARG  51 -13.710 -13.711   8.885
  402   2HH2  ARG  51          2HH2      ARG  51 -12.485 -14.911   9.115
  403    H    THR  52           H        THR  52  -9.086  -7.241   7.774
  404    HA   THR  52           HA       THR  52  -9.924  -9.187   5.736
  405    HB   THR  52           HB       THR  52  -8.455  -6.819   4.810
  406    HG1  THR  52           HG1      THR  52  -9.576  -5.645   6.270
  407   1HG2  THR  52          1HG2      THR  52  -9.428  -7.871   3.046
  408   2HG2  THR  52          2HG2      THR  52 -10.779  -6.819   3.472
  409   3HG2  THR  52          3HG2      THR  52 -10.761  -8.497   4.015
  410    H    SER  53           H        SER  53  -8.512 -10.743   5.317
  411    HA   SER  53           HA       SER  53  -5.754 -10.543   6.079
  412   1HB   SER  53          1HB       SER  53  -5.723 -12.814   4.736
  413   2HB   SER  53          2HB       SER  53  -6.508 -12.718   6.312
  414    HG   SER  53           HG       SER  53  -7.588 -13.420   4.010
  415    H    LEU  54           H        LEU  54  -4.156 -11.523   4.303
  416    HA   LEU  54           HA       LEU  54  -3.617  -9.511   2.487
  417   1HB   LEU  54          1HB       LEU  54  -1.994 -11.198   3.214
  418   2HB   LEU  54          2HB       LEU  54  -2.853 -12.420   2.278
  419    HG   LEU  54           HG       LEU  54  -2.228 -11.339   0.212
  420   1HD1  LEU  54          1HD1      LEU  54  -0.778  -9.301   1.893
  421   2HD1  LEU  54          2HD1      LEU  54  -2.307  -9.019   1.062
  422   3HD1  LEU  54          3HD1      LEU  54  -0.850  -9.368   0.132
  423   1HD2  LEU  54          1HD2      LEU  54   0.226 -11.603   0.344
  424   2HD2  LEU  54          2HD2      LEU  54  -0.651 -12.934   1.100
  425   3HD2  LEU  54          3HD2      LEU  54   0.097 -11.688   2.101
  426    H    ALA  55           H        ALA  55  -5.705 -12.282   2.164
  427    HA   ALA  55           HA       ALA  55  -5.962 -12.487  -0.585
  428   1HB   ALA  55          1HB       ALA  55  -8.082 -13.536  -0.197
  429   2HB   ALA  55          2HB       ALA  55  -6.980 -14.015   1.094
  430   3HB   ALA  55          3HB       ALA  55  -8.212 -12.791   1.397
  431    H    GLY  56           H        GLY  56  -7.296 -10.105   1.610
  432   1HA   GLY  56          1HA       GLY  56  -9.189  -9.006  -0.217
  433   2HA   GLY  56          2HA       GLY  56  -8.600  -8.242   1.252
  434    H    MET  57           H        MET  57  -5.902  -8.041   0.731
  435    HA   MET  57           HA       MET  57  -5.853  -5.771  -0.994
  436   1HB   MET  57          1HB       MET  57  -3.595  -7.281   0.333
  437   2HB   MET  57          2HB       MET  57  -3.426  -5.733  -0.485
  438   1HG   MET  57          1HG       MET  57  -5.456  -5.900   1.656
  439   2HG   MET  57          2HG       MET  57  -3.765  -5.962   2.145
  440   1HE   MET  57          1HE       MET  57  -5.509  -3.306  -0.782
  441   2HE   MET  57          2HE       MET  57  -6.461  -4.352   0.271
  442   3HE   MET  57          3HE       MET  57  -6.304  -2.635   0.642
  443    H    LYS  58           H        LYS  58  -4.417  -9.019  -1.182
  444    HA   LYS  58           HA       LYS  58  -3.106  -8.745  -3.618
  445   1HB   LYS  58          1HB       LYS  58  -3.369 -10.752  -1.824
  446   2HB   LYS  58          2HB       LYS  58  -4.407 -11.354  -3.110
  447   1HG   LYS  58          1HG       LYS  58  -2.653 -12.005  -4.289
  448   2HG   LYS  58          2HG       LYS  58  -1.950 -10.387  -4.222
  449   1HD   LYS  58          1HD       LYS  58  -0.432 -12.034  -3.260
  450   2HD   LYS  58          2HD       LYS  58  -0.989 -10.900  -2.027
  451   1HE   LYS  58          1HE       LYS  58  -1.020 -13.148  -1.141
  452   2HE   LYS  58          2HE       LYS  58  -2.671 -12.553  -1.308
  453   1HZ   LYS  58          1HZ       LYS  58  -1.546 -14.059  -3.545
  454   2HZ   LYS  58          2HZ       LYS  58  -3.132 -14.016  -2.960
  455   3HZ   LYS  58          3HZ       LYS  58  -1.958 -14.928  -2.153
  456    H    LYS  59           H        LYS  59  -6.485  -9.246  -2.920
  457    HA   LYS  59           HA       LYS  59  -7.376 -10.166  -5.402
  458   1HB   LYS  59          1HB       LYS  59  -8.598  -8.795  -3.079
  459   2HB   LYS  59          2HB       LYS  59  -9.482  -8.681  -4.595
  460   1HG   LYS  59          1HG       LYS  59  -8.519 -11.344  -3.662
  461   2HG   LYS  59          2HG       LYS  59  -9.956 -10.627  -2.928
  462   1HD   LYS  59          1HD       LYS  59  -9.765 -10.674  -5.897
  463   2HD   LYS  59          2HD       LYS  59 -10.115 -12.187  -5.059
  464   1HE   LYS  59          1HE       LYS  59 -11.903 -10.774  -3.810
  465   2HE   LYS  59          2HE       LYS  59 -11.718  -9.663  -5.166
  466   1HZ   LYS  59          1HZ       LYS  59 -12.554 -12.507  -5.284
  467   2HZ   LYS  59          2HZ       LYS  59 -12.189 -11.579  -6.651
  468   3HZ   LYS  59          3HZ       LYS  59 -13.490 -11.148  -5.659
  469    H    LEU  60           H        LEU  60  -6.507  -6.959  -4.321
  470    HA   LEU  60           HA       LEU  60  -7.611  -5.640  -6.633
  471   1HB   LEU  60          1HB       LEU  60  -5.889  -4.754  -4.341
  472   2HB   LEU  60          2HB       LEU  60  -6.230  -3.692  -5.706
  473    HG   LEU  60           HG       LEU  60  -8.703  -4.102  -5.155
  474   1HD1  LEU  60          1HD1      LEU  60  -8.596  -4.407  -2.447
  475   2HD1  LEU  60          2HD1      LEU  60  -7.371  -5.551  -2.993
  476   3HD1  LEU  60          3HD1      LEU  60  -9.024  -5.674  -3.596
  477   1HD2  LEU  60          1HD2      LEU  60  -8.557  -2.030  -4.379
  478   2HD2  LEU  60          2HD2      LEU  60  -6.809  -2.229  -4.252
  479   3HD2  LEU  60          3HD2      LEU  60  -7.842  -2.606  -2.872
  480    H    ILE  61           H        ILE  61  -4.432  -6.709  -5.544
  481    HA   ILE  61           HA       ILE  61  -3.458  -6.400  -8.291
  482    HB   ILE  61           HB       ILE  61  -1.882  -5.520  -5.869
  483   1HG1  ILE  61          1HG1      ILE  61  -2.065  -3.304  -7.365
  484   2HG1  ILE  61          2HG1      ILE  61  -3.583  -4.066  -7.828
  485   1HG2  ILE  61          1HG2      ILE  61  -1.149  -6.172  -8.601
  486   2HG2  ILE  61          2HG2      ILE  61  -0.667  -4.539  -8.145
  487   3HG2  ILE  61          3HG2      ILE  61  -0.128  -5.918  -7.187
  488   1HD1  ILE  61          1HD1      ILE  61  -3.739  -4.319  -5.164
  489   2HD1  ILE  61          2HD1      ILE  61  -2.773  -2.848  -5.278
  490   3HD1  ILE  61          3HD1      ILE  61  -4.354  -2.927  -6.054
  491    HA   PRO  62           HA       PRO  62  -2.499 -10.568  -6.499
  492   1HB   PRO  62          1HB       PRO  62  -3.262 -11.944  -8.711
  493   2HB   PRO  62          2HB       PRO  62  -4.392 -11.473  -7.436
  494   1HG   PRO  62          1HG       PRO  62  -3.867 -10.168 -10.078
  495   2HG   PRO  62          2HG       PRO  62  -5.415 -10.478  -9.272
  496   1HD   PRO  62          1HD       PRO  62  -4.216  -8.051  -9.240
  497   2HD   PRO  62          2HD       PRO  62  -5.207  -8.644  -7.892
  498    H    GLY  63           H        GLY  63  -0.288 -10.417  -6.527
  499   1HA   GLY  63          1HA       GLY  63   1.484 -11.658  -7.840
  500   2HA   GLY  63          2HA       GLY  63   1.024 -10.602  -9.167
  501    H    ALA  64           H        ALA  64   1.349  -9.709  -5.766
  502    HA   ALA  64           HA       ALA  64   3.770  -8.182  -6.421
  503   1HB   ALA  64          1HB       ALA  64   2.500  -6.500  -4.685
  504   2HB   ALA  64          2HB       ALA  64   2.531  -6.318  -6.440
  505   3HB   ALA  64          3HB       ALA  64   1.160  -7.106  -5.659
  506    H    HIS  65           H        HIS  65   4.740  -7.242  -4.333
  507    HA   HIS  65           HA       HIS  65   4.842  -9.418  -2.386
  508   1HB   HIS  65          1HB       HIS  65   6.908  -8.340  -3.500
  509   2HB   HIS  65          2HB       HIS  65   6.633  -6.999  -2.391
  510    HD1  HIS  65           HD1      HIS  65   8.968  -9.369  -2.534
  511    HD2  HIS  65           HD2      HIS  65   6.032  -8.716   0.332
  512    HE1  HIS  65           HE1      HIS  65   9.818 -10.470  -0.438
  513    H    PHE  66           H        PHE  66   3.490  -9.275  -0.726
  514    HA   PHE  66           HA       PHE  66   2.955  -6.617   0.426
  515   1HB   PHE  66          1HB       PHE  66   1.233  -8.962  -0.094
  516   2HB   PHE  66          2HB       PHE  66   0.979  -8.166   1.455
  517    HD1  PHE  66           HD1      PHE  66   1.052  -7.603  -2.200
  518    HD2  PHE  66           HD2      PHE  66  -0.198  -6.144   1.598
  519    HE1  PHE  66           HE1      PHE  66  -0.314  -5.886  -3.313
  520    HE2  PHE  66           HE2      PHE  66  -1.567  -4.425   0.491
  521    HZ   PHE  66           HZ       PHE  66  -1.627  -4.295  -1.967
  522    H    GLU  67           H        GLU  67   2.667  -6.517   2.755
  523    HA   GLU  67           HA       GLU  67   3.648  -8.717   4.352
  524   1HB   GLU  67          1HB       GLU  67   5.644  -7.313   3.415
  525   2HB   GLU  67          2HB       GLU  67   5.155  -6.142   4.631
  526   1HG   GLU  67          1HG       GLU  67   5.319  -8.037   6.308
  527   2HG   GLU  67          2HG       GLU  67   6.141  -8.944   5.040
  528    H    LYS  68           H        LYS  68   2.242  -8.776   5.964
  529    HA   LYS  68           HA       LYS  68   1.255  -6.231   7.073
  530   1HB   LYS  68          1HB       LYS  68  -0.501  -7.609   6.052
  531   2HB   LYS  68          2HB       LYS  68  -0.058  -8.956   7.093
  532   1HG   LYS  68          1HG       LYS  68  -0.613  -6.573   8.629
  533   2HG   LYS  68          2HG       LYS  68  -1.973  -7.017   7.595
  534   1HD   LYS  68          1HD       LYS  68  -0.782  -9.314   8.924
  535   2HD   LYS  68          2HD       LYS  68  -1.372  -8.103  10.064
  536   1HE   LYS  68          1HE       LYS  68  -3.555  -8.131   8.963
  537   2HE   LYS  68          2HE       LYS  68  -2.965  -9.330   7.814
  538   1HZ   LYS  68          1HZ       LYS  68  -3.025  -9.775  10.745
  539   2HZ   LYS  68          2HZ       LYS  68  -2.739 -10.922   9.536
  540   3HZ   LYS  68          3HZ       LYS  68  -4.278 -10.242   9.708
  541    H    ARG  69           H        ARG  69   3.237  -8.855   7.687
  542    HA   ARG  69           HA       ARG  69   2.848  -9.575  10.303
  543   1HB   ARG  69          1HB       ARG  69   5.202  -9.384   8.524
  544   2HB   ARG  69          2HB       ARG  69   5.552  -9.459  10.245
  545   1HG   ARG  69          1HG       ARG  69   4.574 -11.569  10.473
  546   2HG   ARG  69          2HG       ARG  69   3.722 -11.435   8.933
  547   1HD   ARG  69          1HD       ARG  69   5.881 -11.504   7.756
  548   2HD   ARG  69          2HD       ARG  69   6.705 -11.685   9.305
  549    HE   ARG  69           HE       ARG  69   5.273 -13.716   7.847
  550   1HH1  ARG  69          1HH1      ARG  69   6.474 -12.708  10.956
  551   2HH1  ARG  69          2HH1      ARG  69   6.520 -14.314  11.604
  552   1HH2  ARG  69          1HH2      ARG  69   5.330 -15.835   8.689
  553   2HH2  ARG  69          2HH2      ARG  69   5.870 -16.092  10.314
  554    H    ARG  70           H        ARG  70   5.221  -7.079   9.370
  555    HA   ARG  70           HA       ARG  70   4.299  -5.067  11.065
  556   1HB   ARG  70          1HB       ARG  70   5.804  -7.163  12.406
  557   2HB   ARG  70          2HB       ARG  70   6.568  -5.590  12.589
  558   1HG   ARG  70          1HG       ARG  70   5.072  -4.967  14.097
  559   2HG   ARG  70          2HG       ARG  70   3.735  -5.383  13.023
  560   1HD   ARG  70          1HD       ARG  70   3.354  -7.327  14.068
  561   2HD   ARG  70          2HD       ARG  70   5.072  -7.707  14.175
  562    HE   ARG  70           HE       ARG  70   4.266  -5.659  16.007
  563   1HH1  ARG  70          1HH1      ARG  70   4.431  -9.098  15.490
  564   2HH1  ARG  70          2HH1      ARG  70   4.453  -9.482  17.180
  565   1HH2  ARG  70          1HH2      ARG  70   4.293  -6.152  18.234
  566   2HH2  ARG  70          2HH2      ARG  70   4.373  -7.806  18.739
  567    H    GLY  71           H        GLY  71   5.045  -4.558   8.718
  568   1HA   GLY  71          1HA       GLY  71   7.676  -4.362   7.928
  569   2HA   GLY  71          2HA       GLY  71   6.425  -3.222   7.455
  570    H    THR  72           H        THR  72   5.834  -1.922   9.754
  571    HA   THR  72           HA       THR  72   8.153  -1.097  11.201
  572    HB   THR  72           HB       THR  72   7.259   1.324   9.921
  573    HG1  THR  72           HG1      THR  72   8.258   0.748   7.837
  574   1HG2  THR  72          1HG2      THR  72   9.513   0.437  11.115
  575   2HG2  THR  72          2HG2      THR  72   9.456   1.848  10.058
  576   3HG2  THR  72          3HG2      THR  72   9.976   0.288   9.421
  577    H    GLN  73           H        GLN  73   5.283  -1.896  11.506
  578    HA   GLN  73           HA       GLN  73   3.424  -1.333  12.706
  579   1HB   GLN  73          1HB       GLN  73   5.641  -1.078  14.287
  580   2HB   GLN  73          2HB       GLN  73   4.877   0.492  14.495
  581   1HG   GLN  73          1HG       GLN  73   3.134  -0.351  15.644
  582   2HG   GLN  73          2HG       GLN  73   3.102  -1.848  14.713
  583   1HE2  GLN  73          1HE2      GLN  73   3.259  -3.441  16.127
  584   2HE2  GLN  73          2HE2      GLN  73   4.442  -3.567  17.380
  585    H    GLY  74           H        GLY  74   2.726   0.947  14.148
  586   1HA   GLY  74          1HA       GLY  74   1.595   2.568  12.182
  587   2HA   GLY  74          2HA       GLY  74   1.754   3.007  13.876
  588    H    GLU  75           H        GLU  75   4.779   2.619  13.465
  589    HA   GLU  75           HA       GLU  75   5.387   5.352  13.081
  590   1HB   GLU  75          1HB       GLU  75   6.703   3.210  14.159
  591   2HB   GLU  75          2HB       GLU  75   7.593   3.453  12.663
  592   1HG   GLU  75          1HG       GLU  75   8.113   5.709  13.260
  593   2HG   GLU  75          2HG       GLU  75   7.062   5.625  14.673
  594    H    ALA  76           H        ALA  76   5.109   2.677  10.913
  595    HA   ALA  76           HA       ALA  76   6.726   3.560   8.798
  596   1HB   ALA  76          1HB       ALA  76   6.008   1.703   7.799
  597   2HB   ALA  76          2HB       ALA  76   5.085   1.388   9.268
  598   3HB   ALA  76          3HB       ALA  76   4.321   2.205   7.905
  599    H    ARG  77           H        ARG  77   3.793   4.798  10.015
  600    HA   ARG  77           HA       ARG  77   2.661   5.876   7.671
  601   1HB   ARG  77          1HB       ARG  77   1.771   5.678  10.164
  602   2HB   ARG  77          2HB       ARG  77   2.390   7.321  10.265
  603   1HG   ARG  77          1HG       ARG  77   0.784   6.878   7.885
  604   2HG   ARG  77          2HG       ARG  77  -0.102   6.571   9.380
  605   1HD   ARG  77          1HD       ARG  77   0.005   8.742  10.051
  606   2HD   ARG  77          2HD       ARG  77   1.562   9.018   9.272
  607    HE   ARG  77           HE       ARG  77   0.464   9.676   7.366
  608   1HH1  ARG  77          1HH1      ARG  77  -1.784   8.141   9.536
  609   2HH1  ARG  77          2HH1      ARG  77  -3.181   8.593   8.616
  610   1HH2  ARG  77          1HH2      ARG  77  -1.367  10.276   6.146
  611   2HH2  ARG  77          2HH2      ARG  77  -2.943   9.806   6.688
  612    H    ALA  78           H        ALA  78   5.427   6.756   9.478
  613    HA   ALA  78           HA       ALA  78   5.466   9.508   8.560
  614   1HB   ALA  78          1HB       ALA  78   7.131   9.868  10.062
  615   2HB   ALA  78          2HB       ALA  78   6.421   8.430  10.796
  616   3HB   ALA  78          3HB       ALA  78   7.866   8.287   9.796
  617    H    TYR  79           H        TYR  79   7.441   6.582   8.084
  618    HA   TYR  79           HA       TYR  79   9.268   7.593   6.269
  619   1HB   TYR  79          1HB       TYR  79   8.662   5.089   7.317
  620   2HB   TYR  79          2HB       TYR  79   8.450   4.886   5.581
  621    HD1  TYR  79           HD2      TYR  79  10.544   6.758   4.581
  622    HD2  TYR  79           HD1      TYR  79  10.642   3.913   7.743
  623    HE1  TYR  79           HE2      TYR  79  12.978   6.545   4.306
  624    HE2  TYR  79           HE1      TYR  79  13.077   3.693   7.478
  625    HH   TYR  79           HH       TYR  79  14.825   5.518   4.979
  626    H    SER  80           H        SER  80   6.225   5.890   5.520
  627    HA   SER  80           HA       SER  80   4.785   6.081   3.762
  628   1HB   SER  80          1HB       SER  80   6.366   8.419   2.713
  629   2HB   SER  80          2HB       SER  80   4.640   8.095   2.553
  630    HG   SER  80           HG       SER  80   4.542   9.431   4.188
  631    H    MET  81           H        MET  81   7.788   7.296   2.284
  632    HA   MET  81           HA       MET  81   8.092   4.796   0.816
  633   1HB   MET  81          1HB       MET  81   7.902   7.468  -0.585
  634   2HB   MET  81          2HB       MET  81   8.239   5.920  -1.348
  635   1HG   MET  81          1HG       MET  81   6.027   6.067  -1.799
  636   2HG   MET  81          2HG       MET  81   5.935   5.277  -0.226
  637   1HE   MET  81          1HE       MET  81   3.685   6.148   1.043
  638   2HE   MET  81          2HE       MET  81   2.866   7.466   0.207
  639   3HE   MET  81          3HE       MET  81   3.448   6.071  -0.703
  640    H    LYS  82           H        LYS  82  10.061   5.454  -0.918
  641    HA   LYS  82           HA       LYS  82  12.226   6.292   0.885
  642   1HB   LYS  82          1HB       LYS  82  12.058   4.362  -1.387
  643   2HB   LYS  82          2HB       LYS  82  13.598   5.152  -1.073
  644   1HG   LYS  82          1HG       LYS  82  13.075   4.352   1.399
  645   2HG   LYS  82          2HG       LYS  82  12.131   3.139   0.531
  646   1HD   LYS  82          1HD       LYS  82  14.204   2.709  -0.855
  647   2HD   LYS  82          2HD       LYS  82  15.081   3.706   0.309
  648   1HE   LYS  82          1HE       LYS  82  13.387   1.520   1.380
  649   2HE   LYS  82          2HE       LYS  82  14.871   1.059   0.548
  650   1HZ   LYS  82          1HZ       LYS  82  15.320   1.314   2.869
  651   2HZ   LYS  82          2HZ       LYS  82  14.642   2.863   2.894
  652   3HZ   LYS  82          3HZ       LYS  82  16.078   2.582   2.045
  653    H    GLU  83           H        GLU  83  13.065   8.237   0.571
  654    HA   GLU  83           HA       GLU  83  12.392   9.893  -1.609
  655   1HB   GLU  83          1HB       GLU  83  13.787  10.151   0.862
  656   2HB   GLU  83          2HB       GLU  83  14.807  10.815  -0.408
  657   1HG   GLU  83          1HG       GLU  83  12.912  12.225  -1.136
  658   2HG   GLU  83          2HG       GLU  83  11.977  11.616   0.229
  659    H    ASP  84           H        ASP  84  15.112   7.777  -0.983
  660    HA   ASP  84           HA       ASP  84  16.922   8.679  -2.885
  661   1HB   ASP  84          1HB       ASP  84  17.011   6.712  -1.101
  662   2HB   ASP  84          2HB       ASP  84  16.604   5.737  -2.510
  663    H    THR  85           H        THR  85  13.928   7.006  -3.298
  664    HA   THR  85           HA       THR  85  14.472   6.770  -6.187
  665    HB   THR  85           HB       THR  85  12.837   4.932  -6.267
  666    HG1  THR  85           HG1      THR  85  12.726   5.425  -3.474
  667   1HG2  THR  85          1HG2      THR  85  14.918   4.350  -4.164
  668   2HG2  THR  85          2HG2      THR  85  15.297   4.536  -5.876
  669   3HG2  THR  85          3HG2      THR  85  14.231   3.235  -5.345
  670    H    ARG  86           H        ARG  86  13.080   8.782  -4.195
  671    HA   ARG  86           HA       ARG  86  10.395   9.009  -4.705
  672   1HB   ARG  86          1HB       ARG  86  12.206  10.547  -3.416
  673   2HB   ARG  86          2HB       ARG  86  11.910  11.547  -4.832
  674   1HG   ARG  86          1HG       ARG  86  10.287  12.376  -3.499
  675   2HG   ARG  86          2HG       ARG  86   9.384  11.020  -4.177
  676   1HD   ARG  86          1HD       ARG  86  10.175   9.665  -2.199
  677   2HD   ARG  86          2HD       ARG  86  10.764  11.176  -1.506
  678    HE   ARG  86           HE       ARG  86   8.044  11.415  -2.257
  679   1HH1  ARG  86          1HH1      ARG  86  10.114  10.002   0.159
  680   2HH1  ARG  86          2HH1      ARG  86   8.903  10.024   1.398
  681   1HH2  ARG  86          1HH2      ARG  86   6.440  11.449  -0.635
  682   2HH2  ARG  86          2HH2      ARG  86   6.813  10.846   0.945
  683    H    LEU  87           H        LEU  87   9.190   9.318  -6.456
  684    HA   LEU  87           HA       LEU  87  10.400  10.613  -8.802
  685   1HB   LEU  87          1HB       LEU  87   9.566   7.898  -8.569
  686   2HB   LEU  87          2HB       LEU  87   8.482   8.724  -9.687
  687    HG   LEU  87           HG       LEU  87  11.475   8.446  -9.927
  688   1HD1  LEU  87          1HD1      LEU  87  10.539   6.444 -10.641
  689   2HD1  LEU  87          2HD1      LEU  87  10.688   7.376 -12.130
  690   3HD1  LEU  87          3HD1      LEU  87   9.122   7.237 -11.331
  691   1HD2  LEU  87          1HD2      LEU  87   9.507  10.046 -11.548
  692   2HD2  LEU  87          2HD2      LEU  87  11.102   9.582 -12.142
  693   3HD2  LEU  87          3HD2      LEU  87  10.956  10.620 -10.723
  694    H    GLU  88           H        GLU  88   7.264   9.334  -7.669
  695    HA   GLU  88           HA       GLU  88   6.072  11.946  -8.293
  696   1HB   GLU  88          1HB       GLU  88   5.655   9.736  -9.856
  697   2HB   GLU  88          2HB       GLU  88   4.303   9.643  -8.735
  698   1HG   GLU  88          1HG       GLU  88   3.756  10.851 -10.801
  699   2HG   GLU  88          2HG       GLU  88   3.566  11.843  -9.357
  700    H    GLY  89           H        GLY  89   3.692  11.935  -7.387
  701   1HA   GLY  89          1HA       GLY  89   2.223  11.407  -5.622
  702   2HA   GLY  89          2HA       GLY  89   3.498  10.454  -4.876
  703    HA   PRO  90           HA       PRO  90   2.842  10.376  -2.922
  704   1HB   PRO  90          1HB       PRO  90   1.263  11.218  -0.881
  705   2HB   PRO  90          2HB       PRO  90   3.012  11.017  -0.722
  706   1HG   PRO  90          1HG       PRO  90   1.428  13.513  -1.191
  707   2HG   PRO  90          2HG       PRO  90   2.803  13.248  -0.103
  708   1HD   PRO  90          1HD       PRO  90   3.065  14.448  -2.516
  709   2HD   PRO  90          2HD       PRO  90   4.348  13.450  -1.802
  710    H    TRP  91           H        TRP  91   0.577   9.506  -2.511
  711    HA   TRP  91           HA       TRP  91  -1.513  11.023  -3.880
  712   1HB   TRP  91          1HB       TRP  91  -0.385   8.393  -4.784
  713   2HB   TRP  91          2HB       TRP  91  -2.074   8.783  -5.094
  714    HD1  TRP  91           HD1      TRP  91  -1.829  11.807  -5.915
  715    HE1  TRP  91           HE1      TRP  91  -0.681  12.460  -8.124
  716    HE3  TRP  91           HE3      TRP  91   0.964   7.589  -6.657
  717    HZ2  TRP  91           HZ2      TRP  91   1.163  11.335  -9.941
  718    HZ3  TRP  91           HZ3      TRP  91   2.393   7.457  -8.656
  719    HH2  TRP  91           HH2      TRP  91   2.489   9.292 -10.263
  720    H    GLU  92           H        GLU  92  -3.217  11.023  -2.583
  721    HA   GLU  92           HA       GLU  92  -3.731   8.634  -0.936
  722   1HB   GLU  92          1HB       GLU  92  -3.106  10.572   0.423
  723   2HB   GLU  92          2HB       GLU  92  -4.383  11.521  -0.323
  724   1HG   GLU  92          1HG       GLU  92  -5.482   9.113   0.764
  725   2HG   GLU  92          2HG       GLU  92  -4.529   9.946   1.990
  726    H    TYR  93           H        TYR  93  -5.718   7.724  -0.995
  727    HA   TYR  93           HA       TYR  93  -7.901   9.139  -2.328
  728   1HB   TYR  93          1HB       TYR  93  -6.830   6.445  -3.177
  729   2HB   TYR  93          2HB       TYR  93  -8.407   7.060  -3.661
  730    HD1  TYR  93           HD1      TYR  93  -8.565   9.027  -5.151
  731    HD2  TYR  93           HD2      TYR  93  -4.818   7.252  -4.191
  732    HE1  TYR  93           HE1      TYR  93  -7.530  10.200  -7.049
  733    HE2  TYR  93           HE2      TYR  93  -3.773   8.421  -6.085
  734    HH   TYR  93           HH       TYR  93  -5.603  10.714  -8.066
  735    H    GLY  94           H        GLY  94 -10.000   8.040  -2.041
  736   1HA   GLY  94          1HA       GLY  94 -11.411   6.512  -0.900
  737   2HA   GLY  94          2HA       GLY  94 -10.079   6.132   0.182
  738    H    GLU  95           H        GLU  95 -11.309   6.446   2.041
  739    HA   GLU  95           HA       GLU  95 -12.848   8.757   2.552
  740   1HB   GLU  95          1HB       GLU  95 -13.278   6.788   3.836
  741   2HB   GLU  95          2HB       GLU  95 -11.610   6.707   4.385
  742   1HG   GLU  95          1HG       GLU  95 -12.893   9.216   5.084
  743   2HG   GLU  95          2HG       GLU  95 -13.727   7.812   5.749
  Start of MODEL   25
    1   1H    ALA   2          1H        ALA   2 -13.070  -1.881  20.525
    2    HA   ALA   2           HA       ALA   2 -12.983  -0.008  18.939
    3   1HB   ALA   2          1HB       ALA   2 -12.563   1.397  21.518
    4   2HB   ALA   2          2HB       ALA   2 -11.760   2.048  20.088
    5   3HB   ALA   2          3HB       ALA   2 -13.515   1.869  20.109
    6    H    ARG   3           H        ARG   3 -11.468  -1.327  17.973
    7    HA   ARG   3           HA       ARG   3  -8.692  -0.978  18.903
    8   1HB   ARG   3          1HB       ARG   3 -10.187  -3.388  18.093
    9   2HB   ARG   3          2HB       ARG   3  -8.577  -3.245  17.400
   10   1HG   ARG   3          1HG       ARG   3  -7.605  -3.074  19.610
   11   2HG   ARG   3          2HG       ARG   3  -9.211  -3.115  20.340
   12   1HD   ARG   3          1HD       ARG   3  -9.107  -5.332  20.391
   13   2HD   ARG   3          2HD       ARG   3  -9.021  -5.351  18.630
   14    HE   ARG   3           HE       ARG   3  -6.462  -4.831  19.491
   15   1HH1  ARG   3          1HH1      ARG   3  -8.803  -7.371  19.929
   16   2HH1  ARG   3          2HH1      ARG   3  -7.612  -8.613  20.126
   17   1HH2  ARG   3          1HH2      ARG   3  -4.884  -6.458  19.750
   18   2HH2  ARG   3          2HH2      ARG   3  -5.383  -8.092  20.025
   19    H    GLN   4           H        GLN   4  -7.052  -0.972  17.240
   20    HA   GLN   4           HA       GLN   4  -8.074   0.123  14.708
   21   1HB   GLN   4          1HB       GLN   4  -6.002   1.335  14.506
   22   2HB   GLN   4          2HB       GLN   4  -6.672   1.632  16.105
   23   1HG   GLN   4          1HG       GLN   4  -5.135  -0.178  16.952
   24   2HG   GLN   4          2HG       GLN   4  -4.359  -0.135  15.370
   25   1HE2  GLN   4          1HE2      GLN   4  -5.222   1.877  18.137
   26   2HE2  GLN   4          2HE2      GLN   4  -3.892   2.969  17.986
   27    H    VAL   5           H        VAL   5  -6.928  -0.392  12.745
   28    HA   VAL   5           HA       VAL   5  -5.832  -3.118  12.812
   29    HB   VAL   5           HB       VAL   5  -6.408  -3.280  10.455
   30   1HG1  VAL   5          1HG1      VAL   5  -8.359  -2.735  12.550
   31   2HG1  VAL   5          2HG1      VAL   5  -8.998  -2.495  10.923
   32   3HG1  VAL   5          3HG1      VAL   5  -8.294  -4.048  11.375
   33   1HG2  VAL   5          1HG2      VAL   5  -6.372  -0.470  10.560
   34   2HG2  VAL   5          2HG2      VAL   5  -6.679  -1.496   9.158
   35   3HG2  VAL   5          3HG2      VAL   5  -8.024  -0.935  10.152
   36    H    ILE   6           H        ILE   6  -4.066  -3.642  11.364
   37    HA   ILE   6           HA       ILE   6  -2.069  -1.535  11.343
   38    HB   ILE   6           HB       ILE   6  -1.775  -4.417  10.493
   39   1HG1  ILE   6          1HG1      ILE   6  -0.476  -4.243  12.863
   40   2HG1  ILE   6          2HG1      ILE   6  -1.789  -3.105  13.146
   41   1HG2  ILE   6          1HG2      ILE   6   0.653  -3.914  11.021
   42   2HG2  ILE   6          2HG2      ILE   6  -0.004  -3.173   9.564
   43   3HG2  ILE   6          3HG2      ILE   6   0.194  -2.212  11.029
   44   1HD1  ILE   6          1HD1      ILE   6  -1.833  -6.027  12.924
   45   2HD1  ILE   6          2HD1      ILE   6  -2.884  -4.934  13.826
   46   3HD1  ILE   6          3HD1      ILE   6  -3.149  -5.190  12.101
   47    H    CYS   7           H        CYS   7  -0.907  -0.878   9.505
   48    HA   CYS   7           HA       CYS   7  -2.481  -0.753   7.108
   49   1HB   CYS   7          1HB       CYS   7   0.367   0.187   7.353
   50   2HB   CYS   7          2HB       CYS   7  -0.914   0.825   6.329
   51    HG   CYS   7           HG       CYS   7  -2.063   1.207   9.289
   52    H    TRP   8           H        TRP   8  -1.697  -1.343   4.983
   53    HA   TRP   8           HA       TRP   8  -0.094  -3.807   5.075
   54   1HB   TRP   8          1HB       TRP   8  -2.193  -2.877   3.109
   55   2HB   TRP   8          2HB       TRP   8  -1.195  -4.308   2.867
   56    HD1  TRP   8           HD1      TRP   8  -3.720  -2.963   5.493
   57    HE1  TRP   8           HE1      TRP   8  -5.002  -4.975   6.458
   58    HE3  TRP   8           HE3      TRP   8  -1.283  -6.728   3.040
   59    HZ2  TRP   8           HZ2      TRP   8  -4.982  -7.787   6.212
   60    HZ3  TRP   8           HZ3      TRP   8  -1.975  -9.052   3.462
   61    HH2  TRP   8           HH2      TRP   8  -3.786  -9.568   5.016
   62    H    CYS   9           H        CYS   9   1.946  -3.522   4.478
   63    HA   CYS   9           HA       CYS   9   2.582  -1.452   2.499
   64   1HB   CYS   9          1HB       CYS   9   4.936  -1.774   3.276
   65   2HB   CYS   9          2HB       CYS   9   3.838  -1.235   4.541
   66    HG   CYS   9           HG       CYS   9   5.695  -3.977   4.386
   67    H    PHE  10           H        PHE  10   2.829  -2.077   0.468
   68    HA   PHE  10           HA       PHE  10   4.099  -4.670  -0.072
   69   1HB   PHE  10          1HB       PHE  10   2.486  -5.337  -1.609
   70   2HB   PHE  10          2HB       PHE  10   1.509  -4.589  -0.351
   71    HD1  PHE  10           HD2      PHE  10   1.172  -1.958  -0.720
   72    HD2  PHE  10           HD1      PHE  10   1.986  -4.807  -3.776
   73    HE1  PHE  10           HE2      PHE  10   0.182  -0.445  -2.388
   74    HE2  PHE  10           HE1      PHE  10   0.998  -3.298  -5.450
   75    HZ   PHE  10           HZ       PHE  10   0.094  -1.114  -4.757
   76    H    THR  11           H        THR  11   4.900  -4.829  -2.342
   77    HA   THR  11           HA       THR  11   5.636  -2.200  -3.442
   78    HB   THR  11           HB       THR  11   7.570  -4.507  -3.424
   79    HG1  THR  11           HG1      THR  11   8.152  -4.014  -1.441
   80   1HG2  THR  11          1HG2      THR  11   7.555  -1.742  -4.358
   81   2HG2  THR  11          2HG2      THR  11   8.621  -3.078  -4.796
   82   3HG2  THR  11          3HG2      THR  11   8.950  -2.124  -3.350
   83    H    LEU  12           H        LEU  12   5.045  -2.017  -5.494
   84    HA   LEU  12           HA       LEU  12   4.668  -4.469  -7.077
   85   1HB   LEU  12          1HB       LEU  12   2.649  -3.151  -6.765
   86   2HB   LEU  12          2HB       LEU  12   3.460  -1.727  -7.413
   87    HG   LEU  12           HG       LEU  12   3.465  -2.610  -9.607
   88   1HD1  LEU  12          1HD1      LEU  12   2.464  -4.934  -9.991
   89   2HD1  LEU  12          2HD1      LEU  12   2.777  -5.209  -8.278
   90   3HD1  LEU  12          3HD1      LEU  12   4.112  -4.840  -9.370
   91   1HD2  LEU  12          1HD2      LEU  12   0.911  -2.894  -8.099
   92   2HD2  LEU  12          2HD2      LEU  12   0.965  -3.391  -9.790
   93   3HD2  LEU  12          3HD2      LEU  12   1.363  -1.731  -9.344
   94    H    ASN  13           H        ASN  13   6.157  -4.874  -8.559
   95    HA   ASN  13           HA       ASN  13   7.790  -2.658  -9.578
   96   1HB   ASN  13          1HB       ASN  13   8.304  -5.638  -9.709
   97   2HB   ASN  13          2HB       ASN  13   9.412  -4.373 -10.234
   98   1HD2  ASN  13          1HD2      ASN  13   8.173  -6.159  -7.590
   99   2HD2  ASN  13          2HD2      ASN  13   9.166  -5.459  -6.362
  100    H    ASN  14           H        ASN  14   7.755  -2.076 -11.669
  101    HA   ASN  14           HA       ASN  14   6.962  -1.867 -13.796
  102   1HB   ASN  14          1HB       ASN  14   8.535  -3.883 -13.909
  103   2HB   ASN  14          2HB       ASN  14   7.082  -4.878 -13.918
  104   1HD2  ASN  14          1HD2      ASN  14   8.586  -5.234 -16.002
  105   2HD2  ASN  14          2HD2      ASN  14   7.981  -4.433 -17.408
  106    HA   PRO  15           HA       PRO  15   2.660  -3.142 -12.460
  107   1HB   PRO  15          1HB       PRO  15   1.653  -0.622 -12.372
  108   2HB   PRO  15          2HB       PRO  15   2.447  -1.388 -10.990
  109   1HG   PRO  15          1HG       PRO  15   3.554   0.571 -12.964
  110   2HG   PRO  15          2HG       PRO  15   3.757   0.521 -11.203
  111   1HD   PRO  15          1HD       PRO  15   5.653  -0.379 -12.915
  112   2HD   PRO  15          2HD       PRO  15   5.394  -1.098 -11.312
  113    H    LEU  16           H        LEU  16   0.577  -2.485 -13.588
  114    HA   LEU  16           HA       LEU  16   1.128  -1.901 -16.424
  115   1HB   LEU  16          1HB       LEU  16  -0.848  -3.794 -15.175
  116   2HB   LEU  16          2HB       LEU  16  -0.940  -3.289 -16.861
  117    HG   LEU  16           HG       LEU  16   1.560  -4.557 -15.815
  118   1HD1  LEU  16          1HD1      LEU  16  -0.488  -6.293 -17.063
  119   2HD1  LEU  16          2HD1      LEU  16  -0.717  -5.858 -15.370
  120   3HD1  LEU  16          3HD1      LEU  16   0.760  -6.677 -15.877
  121   1HD2  LEU  16          1HD2      LEU  16   2.010  -5.008 -18.038
  122   2HD2  LEU  16          2HD2      LEU  16   1.203  -3.442 -18.131
  123   3HD2  LEU  16          3HD2      LEU  16   0.313  -4.918 -18.509
  124    H    SER  17           H        SER  17  -0.285  -0.730 -13.680
  125    HA   SER  17           HA       SER  17  -1.506   1.451 -14.925
  126   1HB   SER  17          1HB       SER  17  -3.679   0.917 -15.240
  127   2HB   SER  17          2HB       SER  17  -3.115  -0.754 -15.213
  128    HG   SER  17           HG       SER  17  -4.821  -0.448 -13.746
  129    HA   PRO  18           HA       PRO  18  -1.399   3.010 -10.827
  130   1HB   PRO  18          1HB       PRO  18  -3.463   4.774 -10.815
  131   2HB   PRO  18          2HB       PRO  18  -1.957   5.063 -11.693
  132   1HG   PRO  18          1HG       PRO  18  -4.585   4.063 -12.718
  133   2HG   PRO  18          2HG       PRO  18  -3.486   5.255 -13.435
  134   1HD   PRO  18          1HD       PRO  18  -3.592   2.683 -14.273
  135   2HD   PRO  18          2HD       PRO  18  -2.095   3.636 -14.304
  136    H    LEU  19           H        LEU  19  -2.372   2.927  -8.771
  137    HA   LEU  19           HA       LEU  19  -4.253   0.799  -8.429
  138   1HB   LEU  19          1HB       LEU  19  -3.223   2.747  -6.374
  139   2HB   LEU  19          2HB       LEU  19  -3.992   1.192  -6.061
  140    HG   LEU  19           HG       LEU  19  -1.270   1.668  -7.268
  141   1HD1  LEU  19          1HD1      LEU  19  -0.384   1.075  -5.274
  142   2HD1  LEU  19          2HD1      LEU  19  -1.711  -0.017  -4.880
  143   3HD1  LEU  19          3HD1      LEU  19  -1.911   1.722  -4.674
  144   1HD2  LEU  19          1HD2      LEU  19  -1.348  -0.977  -6.864
  145   2HD2  LEU  19          2HD2      LEU  19  -1.768  -0.226  -8.403
  146   3HD2  LEU  19          3HD2      LEU  19  -3.040  -0.699  -7.277
  147    H    SER  20           H        SER  20  -6.148   1.115  -6.885
  148    HA   SER  20           HA       SER  20  -7.458   3.702  -7.106
  149   1HB   SER  20          1HB       SER  20  -9.545   2.618  -8.019
  150   2HB   SER  20          2HB       SER  20  -8.201   2.702  -9.158
  151    HG   SER  20           HG       SER  20  -8.694   0.425  -7.553
  152    H    LEU  21           H        LEU  21  -9.421   3.834  -5.801
  153    HA   LEU  21           HA       LEU  21  -9.080   2.715  -3.250
  154   1HB   LEU  21          1HB       LEU  21 -10.220   4.772  -3.410
  155   2HB   LEU  21          2HB       LEU  21 -11.380   4.125  -4.570
  156    HG   LEU  21           HG       LEU  21 -12.283   2.687  -2.721
  157   1HD1  LEU  21          1HD1      LEU  21 -11.495   4.221  -0.508
  158   2HD1  LEU  21          2HD1      LEU  21 -10.015   3.783  -1.359
  159   3HD1  LEU  21          3HD1      LEU  21 -11.134   2.525  -0.834
  160   1HD2  LEU  21          1HD2      LEU  21 -13.144   4.883  -1.458
  161   2HD2  LEU  21          2HD2      LEU  21 -13.717   4.405  -3.056
  162   3HD2  LEU  21          3HD2      LEU  21 -12.459   5.632  -2.901
  163    H    HIS  22           H        HIS  22 -10.358   1.208  -2.095
  164    HA   HIS  22           HA       HIS  22 -11.755  -0.738  -3.813
  165   1HB   HIS  22          1HB       HIS  22  -9.513  -1.417  -2.728
  166   2HB   HIS  22          2HB       HIS  22 -10.416  -1.462  -1.217
  167    HD1  HIS  22           HD1      HIS  22 -10.591  -3.906  -0.765
  168    HD2  HIS  22           HD2      HIS  22 -11.622  -2.951  -4.675
  169    HE1  HIS  22           HE1      HIS  22 -11.459  -6.041  -1.772
  170    H    ASP  23           H        ASP  23 -13.787  -1.273  -3.284
  171    HA   ASP  23           HA       ASP  23 -15.275   0.222  -1.462
  172   1HB   ASP  23          1HB       ASP  23 -15.740  -2.180  -3.120
  173   2HB   ASP  23          2HB       ASP  23 -16.811  -1.996  -1.734
  174    H    SER  24           H        SER  24 -13.335  -2.586  -0.992
  175    HA   SER  24           HA       SER  24 -14.574  -3.318   1.518
  176   1HB   SER  24          1HB       SER  24 -13.050  -4.688  -0.345
  177   2HB   SER  24          2HB       SER  24 -11.936  -4.464   1.003
  178    HG   SER  24           HG       SER  24 -13.786  -5.269   2.320
  179    H    MET  25           H        MET  25 -11.583  -1.778   0.424
  180    HA   MET  25           HA       MET  25 -10.490  -1.476   3.040
  181   1HB   MET  25          1HB       MET  25  -8.718  -0.352   2.021
  182   2HB   MET  25          2HB       MET  25  -9.269  -1.451   0.764
  183   1HG   MET  25          1HG       MET  25 -10.378   0.297  -0.395
  184   2HG   MET  25          2HG       MET  25 -10.151   1.414   0.949
  185   1HE   MET  25          1HE       MET  25  -6.634  -0.412  -1.279
  186   2HE   MET  25          2HE       MET  25  -8.178  -1.166  -0.882
  187   3HE   MET  25          3HE       MET  25  -8.037  -0.148  -2.316
  188    H    LYS  26           H        LYS  26  -9.716   1.017   3.443
  189    HA   LYS  26           HA       LYS  26 -12.185   2.626   3.459
  190   1HB   LYS  26          1HB       LYS  26 -10.694   1.621   5.673
  191   2HB   LYS  26          2HB       LYS  26 -10.519   3.371   5.646
  192   1HG   LYS  26          1HG       LYS  26 -13.259   2.436   5.225
  193   2HG   LYS  26          2HG       LYS  26 -12.576   2.017   6.798
  194   1HD   LYS  26          1HD       LYS  26 -11.867   4.463   6.951
  195   2HD   LYS  26          2HD       LYS  26 -12.944   4.743   5.581
  196   1HE   LYS  26          1HE       LYS  26 -14.191   3.182   7.696
  197   2HE   LYS  26          2HE       LYS  26 -13.650   4.766   8.251
  198   1HZ   LYS  26          1HZ       LYS  26 -15.398   5.668   7.269
  199   2HZ   LYS  26          2HZ       LYS  26 -15.920   4.148   6.742
  200   3HZ   LYS  26          3HZ       LYS  26 -14.899   5.077   5.764
  201    H    TYR  27           H        TYR  27  -8.658   2.634   3.437
  202    HA   TYR  27           HA       TYR  27  -8.741   5.240   2.094
  203   1HB   TYR  27          1HB       TYR  27  -8.097   5.239   4.660
  204   2HB   TYR  27          2HB       TYR  27  -6.532   4.725   4.039
  205    HD1  TYR  27           HD1      TYR  27  -9.127   7.339   3.388
  206    HD2  TYR  27           HD2      TYR  27  -4.988   6.362   3.529
  207    HE1  TYR  27           HE1      TYR  27  -8.564   9.681   2.892
  208    HE2  TYR  27           HE2      TYR  27  -4.414   8.702   3.035
  209    HH   TYR  27           HH       TYR  27  -6.370  11.195   3.406
  210    H    LEU  28           H        LEU  28  -7.040   5.630   0.647
  211    HA   LEU  28           HA       LEU  28  -5.314   3.314   0.074
  212   1HB   LEU  28          1HB       LEU  28  -6.893   3.216  -1.635
  213   2HB   LEU  28          2HB       LEU  28  -6.980   4.970  -1.781
  214    HG   LEU  28           HG       LEU  28  -4.880   5.044  -2.928
  215   1HD1  LEU  28          1HD1      LEU  28  -3.319   3.558  -2.389
  216   2HD1  LEU  28          2HD1      LEU  28  -4.162   2.407  -3.425
  217   3HD1  LEU  28          3HD1      LEU  28  -4.511   2.457  -1.697
  218   1HD2  LEU  28          1HD2      LEU  28  -6.931   4.437  -4.209
  219   2HD2  LEU  28          2HD2      LEU  28  -6.461   2.743  -4.064
  220   3HD2  LEU  28          3HD2      LEU  28  -5.429   3.873  -4.942
  221    H    VAL  29           H        VAL  29  -3.214   3.764   0.001
  222    HA   VAL  29           HA       VAL  29  -2.343   6.471  -0.711
  223    HB   VAL  29           HB       VAL  29  -1.402   4.983   1.744
  224   1HG1  VAL  29          1HG1      VAL  29  -0.314   7.453   1.929
  225   2HG1  VAL  29          2HG1      VAL  29   0.529   6.045   1.281
  226   3HG1  VAL  29          3HG1      VAL  29  -0.243   7.192   0.186
  227   1HG2  VAL  29          1HG2      VAL  29  -2.973   7.535   1.412
  228   2HG2  VAL  29          2HG2      VAL  29  -3.534   6.026   2.133
  229   3HG2  VAL  29          3HG2      VAL  29  -2.285   6.977   2.938
  230    H    TYR  30           H        TYR  30  -0.841   6.376  -2.236
  231    HA   TYR  30           HA       TYR  30   1.227   4.346  -2.160
  232   1HB   TYR  30          1HB       TYR  30   0.796   3.363  -4.254
  233   2HB   TYR  30          2HB       TYR  30  -0.779   3.427  -3.471
  234    HD1  TYR  30           HD2      TYR  30  -2.467   5.064  -4.211
  235    HD2  TYR  30           HD1      TYR  30   1.257   4.649  -6.227
  236    HE1  TYR  30           HE2      TYR  30  -3.382   6.283  -6.141
  237    HE2  TYR  30           HE1      TYR  30   0.352   5.868  -8.162
  238    HH   TYR  30           HH       TYR  30  -2.584   7.589  -8.040
  239    H    GLN  31           H        GLN  31   3.020   4.822  -3.528
  240    HA   GLN  31           HA       GLN  31   3.000   7.449  -4.820
  241   1HB   GLN  31          1HB       GLN  31   4.234   8.381  -3.212
  242   2HB   GLN  31          2HB       GLN  31   4.290   6.859  -2.333
  243   1HG   GLN  31          1HG       GLN  31   6.231   6.171  -3.654
  244   2HG   GLN  31          2HG       GLN  31   6.180   7.708  -4.515
  245   1HE2  GLN  31          1HE2      GLN  31   5.624   9.427  -2.428
  246   2HE2  GLN  31          2HE2      GLN  31   6.972   9.464  -1.348
  247    H    THR  32           H        THR  32   4.728   7.767  -6.340
  248    HA   THR  32           HA       THR  32   5.559   5.250  -7.565
  249    HB   THR  32           HB       THR  32   6.246   7.796  -8.902
  250    HG1  THR  32           HG1      THR  32   3.889   7.757  -9.627
  251   1HG2  THR  32          1HG2      THR  32   4.870   5.261  -9.802
  252   2HG2  THR  32          2HG2      THR  32   6.583   5.636  -9.986
  253   3HG2  THR  32          3HG2      THR  32   5.375   6.582 -10.855
  254    H    GLU  33           H        GLU  33   7.644   4.617  -7.813
  255    HA   GLU  33           HA       GLU  33   9.771   6.450  -6.963
  256   1HB   GLU  33          1HB       GLU  33   9.128   3.758  -5.826
  257   2HB   GLU  33          2HB       GLU  33  10.806   4.277  -5.904
  258   1HG   GLU  33          1HG       GLU  33  10.467   6.030  -4.421
  259   2HG   GLU  33          2HG       GLU  33   8.721   6.028  -4.669
  260    H    GLN  34           H        GLN  34  11.960   5.621  -7.568
  261    HA   GLN  34           HA       GLN  34  11.805   4.175 -10.130
  262   1HB   GLN  34          1HB       GLN  34  12.807   6.716  -9.611
  263   2HB   GLN  34          2HB       GLN  34  14.244   5.707  -9.719
  264   1HG   GLN  34          1HG       GLN  34  12.400   5.098 -11.844
  265   2HG   GLN  34          2HG       GLN  34  12.794   6.816 -11.818
  266   1HE2  GLN  34          1HE2      GLN  34  13.992   6.746 -13.691
  267   2HE2  GLN  34          2HE2      GLN  34  15.534   5.973 -13.789
  268    H    GLY  35           H        GLY  35  13.033   2.400 -10.436
  269   1HA   GLY  35          1HA       GLY  35  15.397   1.851  -8.923
  270   2HA   GLY  35          2HA       GLY  35  14.029   0.909  -8.349
  271    H    GLU  36           H        GLU  36  14.665  -1.095  -8.989
  272    HA   GLU  36           HA       GLU  36  16.008  -1.875 -11.234
  273   1HB   GLU  36          1HB       GLU  36  14.820  -4.062 -11.021
  274   2HB   GLU  36          2HB       GLU  36  15.502  -3.468  -9.513
  275   1HG   GLU  36          1HG       GLU  36  13.167  -2.512  -9.064
  276   2HG   GLU  36          2HG       GLU  36  12.633  -3.581 -10.359
  277    H    ALA  37           H        ALA  37  15.364  -2.765 -13.268
  278    HA   ALA  37           HA       ALA  37  14.228  -2.797 -15.242
  279   1HB   ALA  37          1HB       ALA  37  11.922  -3.084 -15.234
  280   2HB   ALA  37          2HB       ALA  37  12.405  -3.663 -13.639
  281   3HB   ALA  37          3HB       ALA  37  11.700  -2.057 -13.817
  282    H    GLY  38           H        GLY  38  13.922  -1.343 -16.864
  283   1HA   GLY  38          1HA       GLY  38  14.551   1.326 -16.524
  284   2HA   GLY  38          2HA       GLY  38  13.700   0.684 -17.921
  285    H    ASN  39           H        ASN  39  11.477  -0.230 -16.111
  286    HA   ASN  39           HA       ASN  39   9.959   2.219 -16.251
  287   1HB   ASN  39          1HB       ASN  39   9.082  -0.476 -15.197
  288   2HB   ASN  39          2HB       ASN  39   8.042   0.853 -15.699
  289   1HD2  ASN  39          1HD2      ASN  39   9.775  -1.901 -16.670
  290   2HD2  ASN  39          2HD2      ASN  39   9.443  -1.805 -18.363
  291    H    ILE  40           H        ILE  40   8.207   2.046 -14.164
  292    HA   ILE  40           HA       ILE  40   9.943   2.510 -11.828
  293    HB   ILE  40           HB       ILE  40   8.000   3.997 -11.053
  294   1HG1  ILE  40          1HG1      ILE  40   7.385   3.822 -14.010
  295   2HG1  ILE  40          2HG1      ILE  40   6.350   3.268 -12.699
  296   1HG2  ILE  40          1HG2      ILE  40   8.888   5.924 -12.257
  297   2HG2  ILE  40          2HG2      ILE  40  10.184   4.845 -11.743
  298   3HG2  ILE  40          3HG2      ILE  40   9.655   4.848 -13.425
  299   1HD1  ILE  40          1HD1      ILE  40   5.383   5.252 -12.705
  300   2HD1  ILE  40          2HD1      ILE  40   6.906   5.960 -12.165
  301   3HD1  ILE  40          3HD1      ILE  40   6.543   5.858 -13.887
  302    H    HIS  41           H        HIS  41   8.768   2.286  -9.706
  303    HA   HIS  41           HA       HIS  41   6.860   0.043  -9.814
  304   1HB   HIS  41          1HB       HIS  41   7.915  -0.582  -7.542
  305   2HB   HIS  41          2HB       HIS  41   8.817  -0.959  -9.007
  306    HD1  HIS  41           HD1      HIS  41  11.076  -0.905  -7.777
  307    HD2  HIS  41           HD2      HIS  41   8.964   2.667  -7.576
  308    HE1  HIS  41           HE1      HIS  41  12.710   0.793  -6.899
  309    H    PHE  42           H        PHE  42   5.391  -0.119  -8.002
  310    HA   PHE  42           HA       PHE  42   4.770   2.526  -6.872
  311   1HB   PHE  42          1HB       PHE  42   3.064   0.209  -7.710
  312   2HB   PHE  42          2HB       PHE  42   2.470   1.328  -6.487
  313    HD1  PHE  42           HD1      PHE  42   4.499   1.993  -9.530
  314    HD2  PHE  42           HD2      PHE  42   0.784   2.527  -7.524
  315    HE1  PHE  42           HE1      PHE  42   3.767   3.534 -11.303
  316    HE2  PHE  42           HE2      PHE  42   0.045   4.068  -9.294
  317    HZ   PHE  42           HZ       PHE  42   1.537   4.573 -11.187
  318    H    GLN  43           H        GLN  43   4.597   2.811  -4.712
  319    HA   GLN  43           HA       GLN  43   4.549   0.493  -2.945
  320   1HB   GLN  43          1HB       GLN  43   6.892   2.161  -3.411
  321   2HB   GLN  43          2HB       GLN  43   6.424   2.127  -1.716
  322   1HG   GLN  43          1HG       GLN  43   6.888  -0.091  -1.483
  323   2HG   GLN  43          2HG       GLN  43   6.565  -0.451  -3.178
  324   1HE2  GLN  43          1HE2      GLN  43   8.151   0.489  -4.736
  325   2HE2  GLN  43          2HE2      GLN  43   9.818   0.464  -4.282
  326    H    GLY  44           H        GLY  44   3.809   0.941  -0.841
  327   1HA   GLY  44          1HA       GLY  44   3.405   3.353   0.387
  328   2HA   GLY  44          2HA       GLY  44   2.027   3.185  -0.691
  329    H    TYR  45           H        TYR  45   0.926   3.306   1.470
  330    HA   TYR  45           HA       TYR  45   0.710   0.600   2.618
  331   1HB   TYR  45          1HB       TYR  45   0.055   1.724   4.759
  332   2HB   TYR  45          2HB       TYR  45   1.723   2.013   4.277
  333    HD1  TYR  45           HD2      TYR  45   2.393   4.223   3.402
  334    HD2  TYR  45           HD1      TYR  45  -1.532   3.514   4.882
  335    HE1  TYR  45           HE2      TYR  45   2.022   6.649   3.563
  336    HE2  TYR  45           HE1      TYR  45  -1.915   5.938   5.046
  337    HH   TYR  45           HH       TYR  45   0.325   8.150   5.142
  338    H    ILE  46           H        ILE  46  -1.305  -0.234   2.895
  339    HA   ILE  46           HA       ILE  46  -3.597   1.485   2.224
  340    HB   ILE  46           HB       ILE  46  -3.164  -1.336   1.236
  341   1HG1  ILE  46          1HG1      ILE  46  -3.643   0.887  -0.650
  342   2HG1  ILE  46          2HG1      ILE  46  -2.097   0.933   0.189
  343   1HG2  ILE  46          1HG2      ILE  46  -5.498  -0.927   1.784
  344   2HG2  ILE  46          2HG2      ILE  46  -5.482   0.546   0.816
  345   3HG2  ILE  46          3HG2      ILE  46  -5.280  -1.024   0.037
  346   1HD1  ILE  46          1HD1      ILE  46  -1.702  -1.405  -0.580
  347   2HD1  ILE  46          2HD1      ILE  46  -3.160  -1.263  -1.563
  348   3HD1  ILE  46          3HD1      ILE  46  -1.784  -0.204  -1.870
  349    H    GLU  47           H        GLU  47  -5.199   1.399   3.659
  350    HA   GLU  47           HA       GLU  47  -5.121  -0.709   5.698
  351   1HB   GLU  47          1HB       GLU  47  -6.747   1.824   5.817
  352   2HB   GLU  47          2HB       GLU  47  -6.289   0.766   7.144
  353   1HG   GLU  47          1HG       GLU  47  -3.883   1.591   6.006
  354   2HG   GLU  47          2HG       GLU  47  -4.902   3.029   6.038
  355    H    MET  48           H        MET  48  -6.478  -2.347   5.454
  356    HA   MET  48           HA       MET  48  -8.745  -2.162   3.683
  357   1HB   MET  48          1HB       MET  48  -7.654  -4.400   5.388
  358   2HB   MET  48          2HB       MET  48  -9.093  -4.566   4.391
  359   1HG   MET  48          1HG       MET  48  -6.906  -3.488   2.862
  360   2HG   MET  48          2HG       MET  48  -6.450  -5.002   3.639
  361   1HE   MET  48          1HE       MET  48  -8.740  -4.251  -0.018
  362   2HE   MET  48          2HE       MET  48  -9.839  -3.790   1.282
  363   3HE   MET  48          3HE       MET  48  -8.222  -3.089   1.204
  364    H    LYS  49           H        LYS  49 -10.776  -3.478   4.635
  365    HA   LYS  49           HA       LYS  49 -12.152  -1.755   6.291
  366   1HB   LYS  49          1HB       LYS  49 -12.914  -3.835   4.847
  367   2HB   LYS  49          2HB       LYS  49 -12.815  -4.665   6.395
  368   1HG   LYS  49          1HG       LYS  49 -15.066  -3.937   6.053
  369   2HG   LYS  49          2HG       LYS  49 -14.353  -2.972   7.348
  370   1HD   LYS  49          1HD       LYS  49 -15.153  -1.218   6.195
  371   2HD   LYS  49          2HD       LYS  49 -13.753  -1.475   5.150
  372   1HE   LYS  49          1HE       LYS  49 -15.311  -1.567   3.525
  373   2HE   LYS  49          2HE       LYS  49 -15.493  -3.233   4.072
  374   1HZ   LYS  49          1HZ       LYS  49 -17.504  -2.817   4.935
  375   2HZ   LYS  49          2HZ       LYS  49 -17.506  -1.485   3.892
  376   3HZ   LYS  49          3HZ       LYS  49 -17.076  -1.287   5.516
  377    H    LYS  50           H        LYS  50 -10.910  -4.956   7.270
  378    HA   LYS  50           HA       LYS  50  -9.684  -4.124   9.627
  379   1HB   LYS  50          1HB       LYS  50 -12.555  -4.264   9.817
  380   2HB   LYS  50          2HB       LYS  50 -11.825  -5.465  10.874
  381   1HG   LYS  50          1HG       LYS  50 -10.622  -3.819  12.071
  382   2HG   LYS  50          2HG       LYS  50 -10.992  -2.578  10.871
  383   1HD   LYS  50          1HD       LYS  50 -13.431  -2.926  11.463
  384   2HD   LYS  50          2HD       LYS  50 -12.865  -3.881  12.835
  385   1HE   LYS  50          1HE       LYS  50 -11.974  -2.055  13.911
  386   2HE   LYS  50          2HE       LYS  50 -11.736  -1.156  12.414
  387   1HZ   LYS  50          1HZ       LYS  50 -13.622  -0.104  12.830
  388   2HZ   LYS  50          2HZ       LYS  50 -13.906  -1.046  14.205
  389   3HZ   LYS  50          3HZ       LYS  50 -14.470  -1.562  12.696
  390    H    ARG  51           H        ARG  51 -11.982  -6.793   9.081
  391    HA   ARG  51           HA       ARG  51  -9.873  -8.697   9.729
  392   1HB   ARG  51          1HB       ARG  51 -12.375  -8.698  10.561
  393   2HB   ARG  51          2HB       ARG  51 -12.660  -9.523   9.034
  394   1HG   ARG  51          1HG       ARG  51 -12.244 -11.371  10.225
  395   2HG   ARG  51          2HG       ARG  51 -10.552 -10.930   9.986
  396   1HD   ARG  51          1HD       ARG  51 -11.538  -9.471  12.213
  397   2HD   ARG  51          2HD       ARG  51 -12.007 -11.158  12.418
  398    HE   ARG  51           HE       ARG  51  -9.344 -10.069  12.524
  399   1HH1  ARG  51          1HH1      ARG  51 -11.265 -12.925  11.998
  400   2HH1  ARG  51          2HH1      ARG  51  -9.988 -14.019  12.415
  401   1HH2  ARG  51          1HH2      ARG  51  -7.655 -11.499  13.074
  402   2HH2  ARG  51          2HH2      ARG  51  -7.935 -13.207  13.028
  403    H    THR  52           H        THR  52  -9.442  -7.395   7.323
  404    HA   THR  52           HA       THR  52 -10.193  -9.358   5.269
  405    HB   THR  52           HB       THR  52  -8.752  -6.930   4.419
  406    HG1  THR  52           HG1      THR  52  -9.999  -5.771   5.748
  407   1HG2  THR  52          1HG2      THR  52 -11.139  -8.516   3.517
  408   2HG2  THR  52          2HG2      THR  52  -9.599  -8.271   2.693
  409   3HG2  THR  52          3HG2      THR  52 -10.757  -6.947   2.811
  410    H    SER  53           H        SER  53  -8.747 -10.887   4.869
  411    HA   SER  53           HA       SER  53  -6.010 -10.654   5.686
  412   1HB   SER  53          1HB       SER  53  -5.912 -12.903   4.312
  413   2HB   SER  53          2HB       SER  53  -6.737 -12.843   5.870
  414    HG   SER  53           HG       SER  53  -7.876 -13.823   3.977
  415    H    LEU  54           H        LEU  54  -4.357 -11.582   3.933
  416    HA   LEU  54           HA       LEU  54  -3.810  -9.534   2.159
  417   1HB   LEU  54          1HB       LEU  54  -2.180 -11.212   2.900
  418   2HB   LEU  54          2HB       LEU  54  -2.996 -12.427   1.919
  419    HG   LEU  54           HG       LEU  54  -2.309 -11.348  -0.106
  420   1HD1  LEU  54          1HD1      LEU  54  -2.557  -9.031   0.639
  421   2HD1  LEU  54          2HD1      LEU  54  -0.992  -9.305  -0.125
  422   3HD1  LEU  54          3HD1      LEU  54  -1.108  -9.196   1.631
  423   1HD2  LEU  54          1HD2      LEU  54   0.026 -11.703  -0.011
  424   2HD2  LEU  54          2HD2      LEU  54  -0.686 -12.807   1.165
  425   3HD2  LEU  54          3HD2      LEU  54   0.090 -11.319   1.709
  426    H    ALA  55           H        ALA  55  -5.854 -12.323   1.752
  427    HA   ALA  55           HA       ALA  55  -6.046 -12.509  -1.000
  428   1HB   ALA  55          1HB       ALA  55  -8.170 -13.567  -0.673
  429   2HB   ALA  55          2HB       ALA  55  -7.103 -14.047   0.646
  430   3HB   ALA  55          3HB       ALA  55  -8.347 -12.828   0.918
  431    H    GLY  56           H        GLY  56  -7.466 -10.155   1.176
  432   1HA   GLY  56          1HA       GLY  56  -9.309  -9.048  -0.690
  433   2HA   GLY  56          2HA       GLY  56  -8.752  -8.286   0.792
  434    H    MET  57           H        MET  57  -6.032  -8.107   0.306
  435    HA   MET  57           HA       MET  57  -5.952  -5.818  -1.395
  436   1HB   MET  57          1HB       MET  57  -3.719  -7.351  -0.052
  437   2HB   MET  57          2HB       MET  57  -3.531  -5.798  -0.855
  438   1HG   MET  57          1HG       MET  57  -5.593  -5.960   1.251
  439   2HG   MET  57          2HG       MET  57  -3.912  -6.055   1.771
  440   1HE   MET  57          1HE       MET  57  -6.375  -2.679   0.258
  441   2HE   MET  57          2HE       MET  57  -5.552  -3.330  -1.159
  442   3HE   MET  57          3HE       MET  57  -6.540  -4.387  -0.149
  443    H    LYS  58           H        LYS  58  -4.544  -9.076  -1.596
  444    HA   LYS  58           HA       LYS  58  -3.181  -8.802  -3.998
  445   1HB   LYS  58          1HB       LYS  58  -3.537 -10.829  -2.246
  446   2HB   LYS  58          2HB       LYS  58  -4.564 -11.383  -3.562
  447   1HG   LYS  58          1HG       LYS  58  -2.799 -12.087  -4.690
  448   2HG   LYS  58          2HG       LYS  58  -2.081 -10.475  -4.638
  449   1HD   LYS  58          1HD       LYS  58  -0.587 -12.124  -3.642
  450   2HD   LYS  58          2HD       LYS  58  -1.142 -10.969  -2.429
  451   1HE   LYS  58          1HE       LYS  58  -1.165 -13.279  -1.592
  452   2HE   LYS  58          2HE       LYS  58  -2.777 -12.565  -1.617
  453   1HZ   LYS  58          1HZ       LYS  58  -1.865 -14.151  -3.918
  454   2HZ   LYS  58          2HZ       LYS  58  -3.437 -13.893  -3.350
  455   3HZ   LYS  58          3HZ       LYS  58  -2.403 -14.948  -2.525
  456    H    LYS  59           H        LYS  59  -6.590  -9.299  -3.391
  457    HA   LYS  59           HA       LYS  59  -7.426 -10.118  -5.923
  458   1HB   LYS  59          1HB       LYS  59  -8.646  -9.270  -3.502
  459   2HB   LYS  59          2HB       LYS  59  -9.372  -8.342  -4.808
  460   1HG   LYS  59          1HG       LYS  59 -10.376 -10.152  -5.725
  461   2HG   LYS  59          2HG       LYS  59  -9.086 -11.253  -5.238
  462   1HD   LYS  59          1HD       LYS  59 -10.057 -10.577  -2.821
  463   2HD   LYS  59          2HD       LYS  59 -11.523 -10.418  -3.792
  464   1HE   LYS  59          1HE       LYS  59 -10.859 -12.740  -4.726
  465   2HE   LYS  59          2HE       LYS  59  -9.831 -12.840  -3.298
  466   1HZ   LYS  59          1HZ       LYS  59 -12.538 -11.999  -2.759
  467   2HZ   LYS  59          2HZ       LYS  59 -11.583 -13.148  -1.966
  468   3HZ   LYS  59          3HZ       LYS  59 -12.416 -13.569  -3.377
  469    H    LEU  60           H        LEU  60  -6.595  -6.945  -4.703
  470    HA   LEU  60           HA       LEU  60  -7.604  -5.563  -7.025
  471   1HB   LEU  60          1HB       LEU  60  -6.038  -4.740  -4.604
  472   2HB   LEU  60          2HB       LEU  60  -6.274  -3.637  -5.958
  473    HG   LEU  60           HG       LEU  60  -8.792  -4.089  -5.594
  474   1HD1  LEU  60          1HD1      LEU  60  -8.734  -4.375  -2.837
  475   2HD1  LEU  60          2HD1      LEU  60  -7.610  -5.599  -3.429
  476   3HD1  LEU  60          3HD1      LEU  60  -9.274  -5.574  -4.013
  477   1HD2  LEU  60          1HD2      LEU  60  -8.789  -2.039  -4.729
  478   2HD2  LEU  60          2HD2      LEU  60  -7.029  -2.151  -4.687
  479   3HD2  LEU  60          3HD2      LEU  60  -7.975  -2.581  -3.261
  480    H    ILE  61           H        ILE  61  -4.479  -6.647  -5.809
  481    HA   ILE  61           HA       ILE  61  -3.358  -6.190  -8.482
  482    HB   ILE  61           HB       ILE  61  -1.943  -5.475  -5.911
  483   1HG1  ILE  61          1HG1      ILE  61  -1.983  -3.223  -7.464
  484   2HG1  ILE  61          2HG1      ILE  61  -3.550  -3.934  -7.836
  485   1HG2  ILE  61          1HG2      ILE  61  -0.922  -6.215  -8.444
  486   2HG2  ILE  61          2HG2      ILE  61  -0.653  -4.485  -8.245
  487   3HG2  ILE  61          3HG2      ILE  61  -0.039  -5.616  -7.040
  488   1HD1  ILE  61          1HD1      ILE  61  -3.214  -4.063  -5.038
  489   2HD1  ILE  61          2HD1      ILE  61  -2.764  -2.438  -5.557
  490   3HD1  ILE  61          3HD1      ILE  61  -4.353  -3.086  -5.965
  491    HA   PRO  62           HA       PRO  62  -2.542 -10.485  -6.946
  492   1HB   PRO  62          1HB       PRO  62  -3.159 -11.685  -9.302
  493   2HB   PRO  62          2HB       PRO  62  -4.372 -11.295  -8.076
  494   1HG   PRO  62          1HG       PRO  62  -3.654  -9.805 -10.572
  495   2HG   PRO  62          2HG       PRO  62  -5.257 -10.155  -9.899
  496   1HD   PRO  62          1HD       PRO  62  -4.047  -7.751  -9.604
  497   2HD   PRO  62          2HD       PRO  62  -5.133  -8.430  -8.375
  498    H    GLY  63           H        GLY  63  -0.333 -10.358  -6.811
  499   1HA   GLY  63          1HA       GLY  63   1.544 -11.496  -8.024
  500   2HA   GLY  63          2HA       GLY  63   1.147 -10.435  -9.368
  501    H    ALA  64           H        ALA  64   1.590  -9.919  -5.869
  502    HA   ALA  64           HA       ALA  64   3.886  -8.212  -6.407
  503   1HB   ALA  64          1HB       ALA  64   1.246  -7.182  -5.778
  504   2HB   ALA  64          2HB       ALA  64   2.470  -6.650  -4.624
  505   3HB   ALA  64          3HB       ALA  64   2.686  -6.336  -6.346
  506    H    HIS  65           H        HIS  65   4.695  -7.285  -4.204
  507    HA   HIS  65           HA       HIS  65   4.733  -9.540  -2.328
  508   1HB   HIS  65          1HB       HIS  65   6.864  -8.517  -3.379
  509   2HB   HIS  65          2HB       HIS  65   6.613  -7.193  -2.245
  510    HD1  HIS  65           HD1      HIS  65   8.103 -10.494  -2.517
  511    HD2  HIS  65           HD2      HIS  65   6.647  -8.096   0.547
  512    HE1  HIS  65           HE1      HIS  65   9.055 -11.459  -0.399
  513    H    PHE  66           H        PHE  66   3.340  -9.366  -0.704
  514    HA   PHE  66           HA       PHE  66   2.847  -6.703   0.451
  515   1HB   PHE  66          1HB       PHE  66   1.115  -9.074  -0.002
  516   2HB   PHE  66          2HB       PHE  66   0.831  -8.152   1.471
  517    HD1  PHE  66           HD1      PHE  66   1.041  -7.861  -2.215
  518    HD2  PHE  66           HD2      PHE  66  -0.357  -6.140   1.418
  519    HE1  PHE  66           HE1      PHE  66  -0.273  -6.225  -3.500
  520    HE2  PHE  66           HE2      PHE  66  -1.675  -4.503   0.139
  521    HZ   PHE  66           HZ       PHE  66  -1.635  -4.544  -2.323
  522    H    GLU  67           H        GLU  67   2.535  -6.591   2.778
  523    HA   GLU  67           HA       GLU  67   3.462  -8.788   4.403
  524   1HB   GLU  67          1HB       GLU  67   5.291  -6.734   3.530
  525   2HB   GLU  67          2HB       GLU  67   5.109  -6.683   5.277
  526   1HG   GLU  67          1HG       GLU  67   5.500  -9.354   4.101
  527   2HG   GLU  67          2HG       GLU  67   6.871  -8.251   4.001
  528    H    LYS  68           H        LYS  68   2.068  -8.782   6.026
  529    HA   LYS  68           HA       LYS  68   1.279  -6.194   7.195
  530   1HB   LYS  68          1HB       LYS  68  -0.452  -7.715   5.869
  531   2HB   LYS  68          2HB       LYS  68  -0.531  -8.553   7.413
  532   1HG   LYS  68          1HG       LYS  68  -0.746  -5.884   8.099
  533   2HG   LYS  68          2HG       LYS  68  -1.687  -6.023   6.612
  534   1HD   LYS  68          1HD       LYS  68  -2.820  -8.021   7.659
  535   2HD   LYS  68          2HD       LYS  68  -2.030  -7.573   9.172
  536   1HE   LYS  68          1HE       LYS  68  -3.179  -5.214   8.245
  537   2HE   LYS  68          2HE       LYS  68  -4.383  -6.457   7.910
  538   1HZ   LYS  68          1HZ       LYS  68  -3.952  -5.227  10.311
  539   2HZ   LYS  68          2HZ       LYS  68  -3.237  -6.747  10.509
  540   3HZ   LYS  68          3HZ       LYS  68  -4.863  -6.630  10.058
  541    H    ARG  69           H        ARG  69  -0.087  -7.099   9.393
  542    HA   ARG  69           HA       ARG  69   0.126  -7.969  11.495
  543   1HB   ARG  69          1HB       ARG  69   1.255  -9.930   9.923
  544   2HB   ARG  69          2HB       ARG  69   2.550  -9.551  11.051
  545   1HG   ARG  69          1HG       ARG  69   0.921  -9.892  12.913
  546   2HG   ARG  69          2HG       ARG  69  -0.237 -10.467  11.712
  547   1HD   ARG  69          1HD       ARG  69   0.859 -12.425  11.394
  548   2HD   ARG  69          2HD       ARG  69   2.446 -11.701  11.650
  549    HE   ARG  69           HE       ARG  69   1.093 -11.713  14.093
  550   1HH1  ARG  69          1HH1      ARG  69   2.437 -13.969  11.807
  551   2HH1  ARG  69          2HH1      ARG  69   2.781 -15.175  13.002
  552   1HH2  ARG  69          1HH2      ARG  69   1.541 -13.293  15.675
  553   2HH2  ARG  69          2HH2      ARG  69   2.270 -14.790  15.202
  554    H    ARG  70           H        ARG  70   3.418  -7.683  10.139
  555    HA   ARG  70           HA       ARG  70   3.998  -5.492  11.947
  556   1HB   ARG  70          1HB       ARG  70   5.214  -8.215  12.219
  557   2HB   ARG  70          2HB       ARG  70   6.179  -6.795  12.599
  558   1HG   ARG  70          1HG       ARG  70   3.521  -7.450  13.851
  559   2HG   ARG  70          2HG       ARG  70   5.094  -7.792  14.573
  560   1HD   ARG  70          1HD       ARG  70   5.096  -5.075  13.792
  561   2HD   ARG  70          2HD       ARG  70   3.576  -5.377  14.633
  562    HE   ARG  70           HE       ARG  70   5.902  -6.409  15.984
  563   1HH1  ARG  70          1HH1      ARG  70   3.808  -3.663  15.539
  564   2HH1  ARG  70          2HH1      ARG  70   4.204  -2.949  17.068
  565   1HH2  ARG  70          1HH2      ARG  70   6.431  -5.479  17.998
  566   2HH2  ARG  70          2HH2      ARG  70   5.696  -3.983  18.465
  567    H    GLY  71           H        GLY  71   3.793  -5.552   9.163
  568   1HA   GLY  71          1HA       GLY  71   6.203  -5.957   7.788
  569   2HA   GLY  71          2HA       GLY  71   4.916  -4.874   7.280
  570    H    THR  72           H        THR  72   4.851  -2.873   8.966
  571    HA   THR  72           HA       THR  72   7.486  -1.932   9.674
  572    HB   THR  72           HB       THR  72   6.396   0.153   8.043
  573    HG1  THR  72           HG1      THR  72   6.583  -0.940   6.009
  574   1HG2  THR  72          1HG2      THR  72   8.567   0.410   7.454
  575   2HG2  THR  72          2HG2      THR  72   8.795  -1.311   7.141
  576   3HG2  THR  72          3HG2      THR  72   8.845  -0.701   8.795
  577    H    GLN  73           H        GLN  73   4.691  -2.366  10.762
  578    HA   GLN  73           HA       GLN  73   3.195  -1.351  12.154
  579   1HB   GLN  73          1HB       GLN  73   5.473   0.495  12.853
  580   2HB   GLN  73          2HB       GLN  73   4.149  -0.027  13.886
  581   1HG   GLN  73          1HG       GLN  73   5.086  -2.379  13.615
  582   2HG   GLN  73          2HG       GLN  73   6.526  -1.600  12.960
  583   1HE2  GLN  73          1HE2      GLN  73   7.818  -2.302  14.646
  584   2HE2  GLN  73          2HE2      GLN  73   7.706  -1.639  16.238
  585    H    GLY  74           H        GLY  74   2.859   1.234  13.051
  586   1HA   GLY  74          1HA       GLY  74   1.662   2.448  10.739
  587   2HA   GLY  74          2HA       GLY  74   1.621   3.068  12.383
  588    H    GLU  75           H        GLU  75   4.777   2.494  11.828
  589    HA   GLU  75           HA       GLU  75   5.532   5.176  11.757
  590   1HB   GLU  75          1HB       GLU  75   6.829   2.696  11.955
  591   2HB   GLU  75          2HB       GLU  75   7.550   3.487  10.560
  592   1HG   GLU  75          1HG       GLU  75   8.173   5.385  11.877
  593   2HG   GLU  75          2HG       GLU  75   7.292   4.762  13.271
  594    H    ALA  76           H        ALA  76   4.702   2.998   9.194
  595    HA   ALA  76           HA       ALA  76   5.963   4.294   7.040
  596   1HB   ALA  76          1HB       ALA  76   4.878   2.002   7.058
  597   2HB   ALA  76          2HB       ALA  76   3.340   2.840   6.845
  598   3HB   ALA  76          3HB       ALA  76   4.604   2.992   5.625
  599    H    ARG  77           H        ARG  77   3.361   5.260   8.998
  600    HA   ARG  77           HA       ARG  77   1.856   6.771   7.139
  601   1HB   ARG  77          1HB       ARG  77   1.056   6.080   9.399
  602   2HB   ARG  77          2HB       ARG  77   2.158   7.254  10.107
  603   1HG   ARG  77          1HG       ARG  77   0.724   8.915   9.782
  604   2HG   ARG  77          2HG       ARG  77   0.487   8.469   8.091
  605   1HD   ARG  77          1HD       ARG  77  -1.011   6.600   8.985
  606   2HD   ARG  77          2HD       ARG  77  -0.973   7.469  10.518
  607    HE   ARG  77           HE       ARG  77  -1.727   9.096   8.266
  608   1HH1  ARG  77          1HH1      ARG  77  -2.849   6.937  10.757
  609   2HH1  ARG  77          2HH1      ARG  77  -4.469   7.551  10.741
  610   1HH2  ARG  77          1HH2      ARG  77  -3.857   9.913   8.236
  611   2HH2  ARG  77          2HH2      ARG  77  -5.041   9.243   9.307
  612    H    ALA  78           H        ALA  78   4.897   7.290   8.618
  613    HA   ALA  78           HA       ALA  78   4.849  10.126   7.817
  614   1HB   ALA  78          1HB       ALA  78   7.008  10.049   9.378
  615   2HB   ALA  78          2HB       ALA  78   5.385  10.326  10.012
  616   3HB   ALA  78          3HB       ALA  78   6.103   8.717  10.099
  617    H    TYR  79           H        TYR  79   7.334   7.610   8.305
  618    HA   TYR  79           HA       TYR  79   9.162   8.633   6.471
  619   1HB   TYR  79          1HB       TYR  79   9.951   7.022   8.016
  620   2HB   TYR  79          2HB       TYR  79   8.726   5.851   7.543
  621    HD1  TYR  79           HD1      TYR  79  10.961   7.863   5.353
  622    HD2  TYR  79           HD2      TYR  79   9.979   4.002   6.849
  623    HE1  TYR  79           HE1      TYR  79  12.547   6.852   3.768
  624    HE2  TYR  79           HE2      TYR  79  11.563   2.981   5.269
  625    HH   TYR  79           HH       TYR  79  13.495   3.559   3.965
  626    H    SER  80           H        SER  80   6.581   6.253   6.026
  627    HA   SER  80           HA       SER  80   5.554   5.441   4.166
  628   1HB   SER  80          1HB       SER  80   6.730   7.971   3.007
  629   2HB   SER  80          2HB       SER  80   5.683   6.893   2.085
  630    HG   SER  80           HG       SER  80   4.253   8.236   2.951
  631    H    MET  81           H        MET  81   8.139   6.872   2.266
  632    HA   MET  81           HA       MET  81   9.426   4.258   1.977
  633   1HB   MET  81          1HB       MET  81   8.505   5.966  -0.342
  634   2HB   MET  81          2HB       MET  81   9.495   4.518  -0.479
  635   1HG   MET  81          1HG       MET  81   7.734   3.168  -0.330
  636   2HG   MET  81          2HG       MET  81   7.045   4.071   1.017
  637   1HE   MET  81          1HE       MET  81   4.002   5.142  -0.267
  638   2HE   MET  81          2HE       MET  81   5.151   4.893   1.047
  639   3HE   MET  81          3HE       MET  81   5.065   6.458   0.236
  640    H    LYS  82           H        LYS  82  11.415   4.603   0.394
  641    HA   LYS  82           HA       LYS  82  13.117   6.475   1.711
  642   1HB   LYS  82          1HB       LYS  82  13.456   4.169   0.152
  643   2HB   LYS  82          2HB       LYS  82  14.215   5.462  -0.767
  644   1HG   LYS  82          1HG       LYS  82  15.783   5.891   0.879
  645   2HG   LYS  82          2HG       LYS  82  14.812   5.131   2.142
  646   1HD   LYS  82          1HD       LYS  82  16.179   3.375   1.861
  647   2HD   LYS  82          2HD       LYS  82  15.220   3.054   0.414
  648   1HE   LYS  82          1HE       LYS  82  17.107   3.231  -0.752
  649   2HE   LYS  82          2HE       LYS  82  17.079   4.956  -0.389
  650   1HZ   LYS  82          1HZ       LYS  82  19.069   3.276   0.285
  651   2HZ   LYS  82          2HZ       LYS  82  18.173   3.320   1.719
  652   3HZ   LYS  82          3HZ       LYS  82  18.762   4.756   1.046
  653    H    GLU  83           H        GLU  83  13.287   8.566   1.283
  654    HA   GLU  83           HA       GLU  83  12.029   9.826  -0.899
  655   1HB   GLU  83          1HB       GLU  83  13.459  10.618   1.450
  656   2HB   GLU  83          2HB       GLU  83  14.088  11.517   0.077
  657   1HG   GLU  83          1HG       GLU  83  11.730  12.137  -0.484
  658   2HG   GLU  83          2HG       GLU  83  11.245  11.410   1.047
  659    H    ASP  84           H        ASP  84  15.304   8.684  -0.391
  660    HA   ASP  84           HA       ASP  84  16.643   9.985  -2.438
  661   1HB   ASP  84          1HB       ASP  84  17.030   7.153  -1.445
  662   2HB   ASP  84          2HB       ASP  84  18.183   8.039  -2.440
  663    H    THR  85           H        THR  85  14.535   7.175  -2.568
  664    HA   THR  85           HA       THR  85  14.906   7.043  -5.482
  665    HB   THR  85           HB       THR  85  13.653   4.839  -5.256
  666    HG1  THR  85           HG1      THR  85  13.876   3.967  -3.044
  667   1HG2  THR  85          1HG2      THR  85  15.679   3.657  -4.308
  668   2HG2  THR  85          2HG2      THR  85  16.356   5.254  -3.990
  669   3HG2  THR  85          3HG2      THR  85  15.995   4.763  -5.645
  670    H    ARG  86           H        ARG  86  13.034   8.672  -3.484
  671    HA   ARG  86           HA       ARG  86  10.395   8.021  -4.308
  672   1HB   ARG  86          1HB       ARG  86  10.699   9.211  -2.249
  673   2HB   ARG  86          2HB       ARG  86  11.573  10.504  -3.060
  674   1HG   ARG  86          1HG       ARG  86   9.579  11.234  -4.174
  675   2HG   ARG  86          2HG       ARG  86   8.678   9.848  -3.554
  676   1HD   ARG  86          1HD       ARG  86   8.372  10.794  -1.537
  677   2HD   ARG  86          2HD       ARG  86   9.999  11.472  -1.499
  678    HE   ARG  86           HE       ARG  86   7.595  12.773  -2.395
  679   1HH1  ARG  86          1HH1      ARG  86  11.070  12.706  -2.602
  680   2HH1  ARG  86          2HH1      ARG  86  11.204  14.369  -3.070
  681   1HH2  ARG  86          1HH2      ARG  86   7.759  14.964  -3.011
  682   2HH2  ARG  86          2HH2      ARG  86   9.321  15.652  -3.301
  683    H    LEU  87           H        LEU  87   9.485   8.371  -6.215
  684    HA   LEU  87           HA       LEU  87  10.679  10.359  -8.013
  685   1HB   LEU  87          1HB       LEU  87   9.567   7.728  -8.363
  686   2HB   LEU  87          2HB       LEU  87   8.732   8.889  -9.392
  687    HG   LEU  87           HG       LEU  87  11.695   8.316  -9.377
  688   1HD1  LEU  87          1HD1      LEU  87  11.014   7.706 -11.820
  689   2HD1  LEU  87          2HD1      LEU  87   9.415   7.483 -11.111
  690   3HD1  LEU  87          3HD1      LEU  87  10.782   6.540 -10.516
  691   1HD2  LEU  87          1HD2      LEU  87  11.392  10.633  -9.861
  692   2HD2  LEU  87          2HD2      LEU  87  10.050  10.288 -10.953
  693   3HD2  LEU  87          3HD2      LEU  87  11.689   9.802 -11.389
  694    H    GLU  88           H        GLU  88   7.422   9.103  -7.258
  695    HA   GLU  88           HA       GLU  88   6.414  11.860  -7.518
  696   1HB   GLU  88          1HB       GLU  88   5.776   9.722  -9.174
  697   2HB   GLU  88          2HB       GLU  88   4.420   9.809  -8.058
  698   1HG   GLU  88          1HG       GLU  88   3.934  11.122 -10.002
  699   2HG   GLU  88          2HG       GLU  88   4.148  12.193  -8.619
  700    H    GLY  89           H        GLY  89   4.084  11.951  -6.521
  701   1HA   GLY  89          1HA       GLY  89   2.646  11.479  -4.737
  702   2HA   GLY  89          2HA       GLY  89   3.773  10.250  -4.183
  703    HA   PRO  90           HA       PRO  90   3.124  10.035  -2.223
  704   1HB   PRO  90          1HB       PRO  90   1.741  10.863  -0.038
  705   2HB   PRO  90          2HB       PRO  90   3.432  10.352   0.031
  706   1HG   PRO  90          1HG       PRO  90   2.291  13.118  -0.068
  707   2HG   PRO  90          2HG       PRO  90   3.617  12.490   0.928
  708   1HD   PRO  90          1HD       PRO  90   4.044  13.927  -1.327
  709   2HD   PRO  90          2HD       PRO  90   5.148  12.645  -0.788
  710    H    TRP  91           H        TRP  91   0.798   9.448  -1.987
  711    HA   TRP  91           HA       TRP  91  -1.046  11.477  -3.020
  712   1HB   TRP  91          1HB       TRP  91  -0.442   8.811  -4.286
  713   2HB   TRP  91          2HB       TRP  91  -1.976   9.633  -4.555
  714    HD1  TRP  91           HD1      TRP  91  -0.849  12.610  -4.849
  715    HE1  TRP  91           HE1      TRP  91   0.462  13.249  -6.970
  716    HE3  TRP  91           HE3      TRP  91   0.567   7.938  -6.368
  717    HZ2  TRP  91           HZ2      TRP  91   1.904  11.946  -9.016
  718    HZ3  TRP  91           HZ3      TRP  91   1.910   7.721  -8.418
  719    HH2  TRP  91           HH2      TRP  91   2.564   9.685  -9.714
  720    H    GLU  92           H        GLU  92  -3.241  11.099  -2.551
  721    HA   GLU  92           HA       GLU  92  -3.797   8.861  -0.729
  722   1HB   GLU  92          1HB       GLU  92  -4.316  11.786  -0.271
  723   2HB   GLU  92          2HB       GLU  92  -5.293  10.559   0.523
  724   1HG   GLU  92          1HG       GLU  92  -3.363   9.653   1.622
  725   2HG   GLU  92          2HG       GLU  92  -2.297  10.732   0.724
  726    H    TYR  93           H        TYR  93  -5.750   7.901  -0.979
  727    HA   TYR  93           HA       TYR  93  -7.771   9.199  -2.649
  728   1HB   TYR  93          1HB       TYR  93  -6.533   6.501  -3.202
  729   2HB   TYR  93          2HB       TYR  93  -8.074   7.005  -3.886
  730    HD1  TYR  93           HD2      TYR  93  -4.445   7.571  -3.907
  731    HD2  TYR  93           HD1      TYR  93  -8.174   8.647  -5.652
  732    HE1  TYR  93           HE2      TYR  93  -3.256   8.677  -5.754
  733    HE2  TYR  93           HE1      TYR  93  -6.994   9.755  -7.504
  734    HH   TYR  93           HH       TYR  93  -3.901  10.654  -7.437
  735    H    GLY  94           H        GLY  94  -9.873   8.058  -2.576
  736   1HA   GLY  94          1HA       GLY  94 -11.462   6.691  -1.527
  737   2HA   GLY  94          2HA       GLY  94 -10.240   6.200  -0.363
  738    H    GLU  95           H        GLU  95 -11.640   6.533   1.385
  739    HA   GLU  95           HA       GLU  95 -13.177   8.761   1.921
  740   1HB   GLU  95          1HB       GLU  95 -13.374   6.831   3.316
  741   2HB   GLU  95          2HB       GLU  95 -11.685   6.927   3.795
  742   1HG   GLU  95          1HG       GLU  95 -13.110   9.356   4.437
  743   2HG   GLU  95          2HG       GLU  95 -13.867   7.941   5.165
  Start of MODEL   26
    1   1H    ALA   2          1H        ALA   2  -9.404   2.932  20.555
    2    HA   ALA   2           HA       ALA   2  -9.938   0.686  21.236
    3   1HB   ALA   2          1HB       ALA   2 -11.829   2.337  21.183
    4   2HB   ALA   2          2HB       ALA   2 -12.291   1.651  19.625
    5   3HB   ALA   2          3HB       ALA   2 -12.309   0.643  21.072
    6    H    ARG   3           H        ARG   3 -11.002   1.193  17.864
    7    HA   ARG   3           HA       ARG   3 -10.270  -1.610  17.324
    8   1HB   ARG   3          1HB       ARG   3 -12.601   0.024  16.365
    9   2HB   ARG   3          2HB       ARG   3 -12.026  -1.352  15.434
   10   1HG   ARG   3          1HG       ARG   3 -12.254  -2.624  17.697
   11   2HG   ARG   3          2HG       ARG   3 -13.332  -1.289  18.112
   12   1HD   ARG   3          1HD       ARG   3 -14.318  -1.863  15.709
   13   2HD   ARG   3          2HD       ARG   3 -13.655  -3.449  16.103
   14    HE   ARG   3           HE       ARG   3 -15.138  -2.550  18.295
   15   1HH1  ARG   3          1HH1      ARG   3 -15.631  -3.549  14.997
   16   2HH1  ARG   3          2HH1      ARG   3 -17.235  -4.142  15.279
   17   1HH2  ARG   3          1HH2      ARG   3 -17.248  -3.327  18.679
   18   2HH2  ARG   3          2HH2      ARG   3 -18.154  -4.014  17.373
   19    H    GLN   4           H        GLN   4  -8.142  -0.471  16.926
   20    HA   GLN   4           HA       GLN   4  -8.034   0.880  14.333
   21   1HB   GLN   4          1HB       GLN   4  -6.342   0.835  16.745
   22   2HB   GLN   4          2HB       GLN   4  -5.461   0.858  15.224
   23   1HG   GLN   4          1HG       GLN   4  -6.566   2.882  14.553
   24   2HG   GLN   4          2HG       GLN   4  -7.606   2.828  15.976
   25   1HE2  GLN   4          1HE2      GLN   4  -4.377   3.403  14.802
   26   2HE2  GLN   4          2HE2      GLN   4  -3.796   4.219  16.210
   27    H    VAL   5           H        VAL   5  -6.477   0.226  12.732
   28    HA   VAL   5           HA       VAL   5  -5.711  -2.613  12.907
   29    HB   VAL   5           HB       VAL   5  -6.237  -2.922  10.558
   30   1HG1  VAL   5          1HG1      VAL   5  -8.221  -2.243  12.569
   31   2HG1  VAL   5          2HG1      VAL   5  -8.828  -2.046  10.924
   32   3HG1  VAL   5          3HG1      VAL   5  -8.170  -3.598  11.442
   33   1HG2  VAL   5          1HG2      VAL   5  -6.172  -0.108  10.482
   34   2HG2  VAL   5          2HG2      VAL   5  -6.436  -1.222   9.141
   35   3HG2  VAL   5          3HG2      VAL   5  -7.811  -0.589  10.045
   36    H    ILE   6           H        ILE   6  -3.924  -3.229  11.510
   37    HA   ILE   6           HA       ILE   6  -1.900  -1.152  11.441
   38    HB   ILE   6           HB       ILE   6  -1.607  -4.053  10.664
   39   1HG1  ILE   6          1HG1      ILE   6  -0.416  -3.802  13.112
   40   2HG1  ILE   6          2HG1      ILE   6  -1.810  -2.742  13.293
   41   1HG2  ILE   6          1HG2      ILE   6   0.211  -1.759  10.854
   42   2HG2  ILE   6          2HG2      ILE   6   0.793  -3.231  11.630
   43   3HG2  ILE   6          3HG2      ILE   6   0.354  -3.249   9.922
   44   1HD1  ILE   6          1HD1      ILE   6  -2.003  -5.585  12.344
   45   2HD1  ILE   6          2HD1      ILE   6  -2.158  -5.099  14.032
   46   3HD1  ILE   6          3HD1      ILE   6  -3.316  -4.517  12.837
   47    H    CYS   7           H        CYS   7  -0.686  -0.589   9.601
   48    HA   CYS   7           HA       CYS   7  -2.219  -0.506   7.176
   49   1HB   CYS   7          1HB       CYS   7  -0.547   0.964   6.346
   50   2HB   CYS   7          2HB       CYS   7  -0.734   1.355   8.051
   51    HG   CYS   7           HG       CYS   7   1.554  -0.332   8.701
   52    H    TRP   8           H        TRP   8  -1.480  -1.232   5.099
   53    HA   TRP   8           HA       TRP   8   0.105  -3.703   5.294
   54   1HB   TRP   8          1HB       TRP   8  -2.043  -2.858   3.346
   55   2HB   TRP   8          2HB       TRP   8  -1.034  -4.282   3.109
   56    HD1  TRP   8           HD1      TRP   8  -3.425  -2.907   5.849
   57    HE1  TRP   8           HE1      TRP   8  -4.675  -4.908   6.877
   58    HE3  TRP   8           HE3      TRP   8  -1.177  -6.691   3.248
   59    HZ2  TRP   8           HZ2      TRP   8  -4.703  -7.719   6.621
   60    HZ3  TRP   8           HZ3      TRP   8  -1.872  -9.008   3.700
   61    HH2  TRP   8           HH2      TRP   8  -3.598  -9.509   5.352
   62    H    CYS   9           H        CYS   9   2.125  -3.518   4.604
   63    HA   CYS   9           HA       CYS   9   2.786  -1.481   2.610
   64   1HB   CYS   9          1HB       CYS   9   5.144  -1.966   3.251
   65   2HB   CYS   9          2HB       CYS   9   4.152  -1.431   4.602
   66    HG   CYS   9           HG       CYS   9   3.811  -4.025   5.637
   67    H    PHE  10           H        PHE  10   3.104  -1.999   0.556
   68    HA   PHE  10           HA       PHE  10   4.112  -4.657  -0.129
   69   1HB   PHE  10          1HB       PHE  10   2.366  -5.252  -1.515
   70   2HB   PHE  10          2HB       PHE  10   1.493  -4.394  -0.251
   71    HD1  PHE  10           HD2      PHE  10   1.082  -1.866  -0.662
   72    HD2  PHE  10           HD1      PHE  10   2.066  -4.656  -3.722
   73    HE1  PHE  10           HE2      PHE  10   0.136  -0.345  -2.349
   74    HE2  PHE  10           HE1      PHE  10   1.123  -3.139  -5.414
   75    HZ   PHE  10           HZ       PHE  10   0.155  -0.980  -4.728
   76    H    THR  11           H        THR  11   4.781  -4.787  -2.437
   77    HA   THR  11           HA       THR  11   5.514  -2.164  -3.548
   78    HB   THR  11           HB       THR  11   7.435  -4.477  -3.635
   79    HG1  THR  11           HG1      THR  11   8.295  -3.846  -1.734
   80   1HG2  THR  11          1HG2      THR  11   8.497  -3.035  -4.972
   81   2HG2  THR  11          2HG2      THR  11   8.781  -2.045  -3.540
   82   3HG2  THR  11          3HG2      THR  11   7.381  -1.732  -4.565
   83    H    LEU  12           H        LEU  12   4.990  -1.964  -5.624
   84    HA   LEU  12           HA       LEU  12   4.397  -4.406  -7.153
   85   1HB   LEU  12          1HB       LEU  12   2.642  -2.553  -6.686
   86   2HB   LEU  12          2HB       LEU  12   3.497  -1.664  -7.944
   87    HG   LEU  12           HG       LEU  12   2.984  -3.409  -9.557
   88   1HD1  LEU  12          1HD1      LEU  12   2.998  -5.369  -8.206
   89   2HD1  LEU  12          2HD1      LEU  12   1.382  -5.213  -8.895
   90   3HD1  LEU  12          3HD1      LEU  12   1.670  -4.767  -7.213
   91   1HD2  LEU  12          1HD2      LEU  12   0.626  -3.021  -9.762
   92   2HD2  LEU  12          2HD2      LEU  12   1.381  -1.553  -9.142
   93   3HD2  LEU  12          3HD2      LEU  12   0.495  -2.619  -8.050
   94    H    ASN  13           H        ASN  13   5.845  -4.964  -8.626
   95    HA   ASN  13           HA       ASN  13   7.637  -2.909  -9.713
   96   1HB   ASN  13          1HB       ASN  13   9.153  -4.700 -10.273
   97   2HB   ASN  13          2HB       ASN  13   8.644  -4.909  -8.600
   98   1HD2  ASN  13          1HD2      ASN  13   9.313  -6.552 -11.280
   99   2HD2  ASN  13          2HD2      ASN  13   8.268  -7.915 -11.092
  100    H    ASN  14           H        ASN  14   7.603  -2.355 -11.808
  101    HA   ASN  14           HA       ASN  14   6.783  -2.118 -13.924
  102   1HB   ASN  14          1HB       ASN  14   6.772  -5.135 -14.003
  103   2HB   ASN  14          2HB       ASN  14   7.046  -4.016 -15.335
  104   1HD2  ASN  14          1HD2      ASN  14   8.690  -6.217 -14.321
  105   2HD2  ASN  14          2HD2      ASN  14  10.226  -5.521 -13.944
  106    HA   PRO  15           HA       PRO  15   2.446  -3.233 -12.512
  107   1HB   PRO  15          1HB       PRO  15   1.556  -0.677 -12.303
  108   2HB   PRO  15          2HB       PRO  15   2.338  -1.533 -10.969
  109   1HG   PRO  15          1HG       PRO  15   3.499   0.454 -12.883
  110   2HG   PRO  15          2HG       PRO  15   3.729   0.323 -11.129
  111   1HD   PRO  15          1HD       PRO  15   5.553  -0.589 -12.911
  112   2HD   PRO  15          2HD       PRO  15   5.289  -1.361 -11.334
  113    H    LEU  16           H        LEU  16   0.491  -2.914 -13.706
  114    HA   LEU  16           HA       LEU  16   0.985  -2.094 -16.482
  115   1HB   LEU  16          1HB       LEU  16  -1.057  -3.925 -15.246
  116   2HB   LEU  16          2HB       LEU  16  -1.138  -3.391 -16.924
  117    HG   LEU  16           HG       LEU  16   1.436  -4.439 -16.605
  118   1HD1  LEU  16          1HD1      LEU  16   0.711  -5.476 -14.512
  119   2HD1  LEU  16          2HD1      LEU  16   1.040  -6.684 -15.754
  120   3HD1  LEU  16          3HD1      LEU  16  -0.625  -6.255 -15.360
  121   1HD2  LEU  16          1HD2      LEU  16   0.108  -4.570 -18.620
  122   2HD2  LEU  16          2HD2      LEU  16  -1.060  -5.621 -17.819
  123   3HD2  LEU  16          3HD2      LEU  16   0.582  -6.192 -18.116
  124    H    SER  17           H        SER  17  -0.342  -0.907 -13.705
  125    HA   SER  17           HA       SER  17  -1.491   1.339 -14.899
  126   1HB   SER  17          1HB       SER  17  -3.688   0.898 -15.195
  127   2HB   SER  17          2HB       SER  17  -3.191  -0.795 -15.203
  128    HG   SER  17           HG       SER  17  -4.694  -0.752 -13.656
  129    HA   PRO  18           HA       PRO  18  -1.279   2.826 -10.778
  130   1HB   PRO  18          1HB       PRO  18  -3.279   4.661 -10.708
  131   2HB   PRO  18          2HB       PRO  18  -1.775   4.912 -11.603
  132   1HG   PRO  18          1HG       PRO  18  -4.451   4.022 -12.607
  133   2HG   PRO  18          2HG       PRO  18  -3.320   5.186 -13.320
  134   1HD   PRO  18          1HD       PRO  18  -3.529   2.634 -14.198
  135   2HD   PRO  18          2HD       PRO  18  -1.999   3.534 -14.235
  136    H    LEU  19           H        LEU  19  -2.188   2.678  -8.715
  137    HA   LEU  19           HA       LEU  19  -4.134   0.627  -8.372
  138   1HB   LEU  19          1HB       LEU  19  -3.191   2.520  -6.239
  139   2HB   LEU  19          2HB       LEU  19  -3.771   0.866  -6.052
  140    HG   LEU  19           HG       LEU  19  -1.183   1.603  -7.412
  141   1HD1  LEU  19          1HD1      LEU  19  -1.377   0.379  -4.692
  142   2HD1  LEU  19          2HD1      LEU  19  -1.444   2.130  -4.890
  143   3HD1  LEU  19          3HD1      LEU  19  -0.030   1.234  -5.443
  144   1HD2  LEU  19          1HD2      LEU  19  -2.711  -0.803  -7.252
  145   2HD2  LEU  19          2HD2      LEU  19  -1.203  -1.015  -6.362
  146   3HD2  LEU  19          3HD2      LEU  19  -1.167  -0.519  -8.055
  147    H    SER  20           H        SER  20  -5.990   0.997  -6.761
  148    HA   SER  20           HA       SER  20  -7.259   3.603  -7.004
  149   1HB   SER  20          1HB       SER  20  -9.364   2.610  -7.889
  150   2HB   SER  20          2HB       SER  20  -8.024   2.498  -9.029
  151    HG   SER  20           HG       SER  20  -7.766   0.337  -8.452
  152    H    LEU  21           H        LEU  21  -9.273   3.728  -5.710
  153    HA   LEU  21           HA       LEU  21  -8.863   2.672  -3.124
  154   1HB   LEU  21          1HB       LEU  21  -9.963   4.753  -3.304
  155   2HB   LEU  21          2HB       LEU  21 -11.167   4.104  -4.414
  156    HG   LEU  21           HG       LEU  21 -12.031   2.717  -2.500
  157   1HD1  LEU  21          1HD1      LEU  21  -9.697   3.584  -1.260
  158   2HD1  LEU  21          2HD1      LEU  21 -11.035   2.710  -0.515
  159   3HD1  LEU  21          3HD1      LEU  21 -10.994   4.472  -0.458
  160   1HD2  LEU  21          1HD2      LEU  21 -13.513   4.379  -2.711
  161   2HD2  LEU  21          2HD2      LEU  21 -12.256   5.601  -2.909
  162   3HD2  LEU  21          3HD2      LEU  21 -12.727   5.073  -1.292
  163    H    HIS  22           H        HIS  22 -10.143   1.206  -1.922
  164    HA   HIS  22           HA       HIS  22 -11.567  -0.763  -3.588
  165   1HB   HIS  22          1HB       HIS  22  -9.375  -1.437  -2.414
  166   2HB   HIS  22          2HB       HIS  22 -10.312  -1.387  -0.924
  167    HD1  HIS  22           HD1      HIS  22 -10.523  -3.809  -0.362
  168    HD2  HIS  22           HD2      HIS  22 -11.499  -3.017  -4.322
  169    HE1  HIS  22           HE1      HIS  22 -11.421  -5.971  -1.278
  170    H    ASP  23           H        ASP  23 -13.567  -1.449  -2.978
  171    HA   ASP  23           HA       ASP  23 -15.114   0.216  -1.309
  172   1HB   ASP  23          1HB       ASP  23 -15.551  -2.078  -3.028
  173   2HB   ASP  23          2HB       ASP  23 -16.516  -2.190  -1.558
  174    H    SER  24           H        SER  24 -13.199  -2.576  -0.668
  175    HA   SER  24           HA       SER  24 -14.500  -3.159   1.857
  176   1HB   SER  24          1HB       SER  24 -11.885  -4.329   0.927
  177   2HB   SER  24          2HB       SER  24 -13.087  -5.041   2.004
  178    HG   SER  24           HG       SER  24 -13.499  -6.020   0.125
  179    H    MET  25           H        MET  25 -11.479  -1.740   0.702
  180    HA   MET  25           HA       MET  25 -10.325  -1.389   3.274
  181   1HB   MET  25          1HB       MET  25  -8.588  -0.277   2.193
  182   2HB   MET  25          2HB       MET  25  -9.187  -1.366   0.949
  183   1HG   MET  25          1HG       MET  25 -10.300   0.382  -0.181
  184   2HG   MET  25          2HG       MET  25 -10.086   1.488   1.174
  185   1HE   MET  25          1HE       MET  25  -7.960  -0.066  -2.076
  186   2HE   MET  25          2HE       MET  25  -6.519  -0.230  -1.072
  187   3HE   MET  25          3HE       MET  25  -8.012  -1.052  -0.614
  188    H    LYS  26           H        LYS  26  -9.546   1.113   3.630
  189    HA   LYS  26           HA       LYS  26 -12.009   2.728   3.690
  190   1HB   LYS  26          1HB       LYS  26 -10.532   1.691   5.897
  191   2HB   LYS  26          2HB       LYS  26 -10.332   3.439   5.882
  192   1HG   LYS  26          1HG       LYS  26 -12.513   3.835   6.358
  193   2HG   LYS  26          2HG       LYS  26 -13.076   2.391   5.513
  194   1HD   LYS  26          1HD       LYS  26 -12.080   1.031   7.372
  195   2HD   LYS  26          2HD       LYS  26 -11.789   2.543   8.235
  196   1HE   LYS  26          1HE       LYS  26 -14.517   2.287   7.234
  197   2HE   LYS  26          2HE       LYS  26 -14.073   1.018   8.374
  198   1HZ   LYS  26          1HZ       LYS  26 -14.096   2.445  10.066
  199   2HZ   LYS  26          2HZ       LYS  26 -14.922   3.504   9.037
  200   3HZ   LYS  26          3HZ       LYS  26 -13.244   3.634   9.215
  201    H    TYR  27           H        TYR  27  -8.483   2.703   3.663
  202    HA   TYR  27           HA       TYR  27  -8.544   5.332   2.360
  203   1HB   TYR  27          1HB       TYR  27  -7.891   5.337   4.891
  204   2HB   TYR  27          2HB       TYR  27  -6.358   4.695   4.312
  205    HD1  TYR  27           HD1      TYR  27  -8.652   7.328   2.976
  206    HD2  TYR  27           HD2      TYR  27  -4.760   6.360   4.398
  207    HE1  TYR  27           HE1      TYR  27  -7.900   9.611   2.455
  208    HE2  TYR  27           HE2      TYR  27  -3.998   8.641   3.882
  209    HH   TYR  27           HH       TYR  27  -5.473  11.066   3.650
  210    H    LEU  28           H        LEU  28  -6.879   5.715   0.880
  211    HA   LEU  28           HA       LEU  28  -5.172   3.400   0.253
  212   1HB   LEU  28          1HB       LEU  28  -6.771   3.280  -1.425
  213   2HB   LEU  28          2HB       LEU  28  -6.916   5.032  -1.545
  214    HG   LEU  28           HG       LEU  28  -4.861   5.188  -2.759
  215   1HD1  LEU  28          1HD1      LEU  28  -4.046   2.596  -3.301
  216   2HD1  LEU  28          2HD1      LEU  28  -4.364   2.600  -1.566
  217   3HD1  LEU  28          3HD1      LEU  28  -3.232   3.762  -2.258
  218   1HD2  LEU  28          1HD2      LEU  28  -6.967   4.453  -3.941
  219   2HD2  LEU  28          2HD2      LEU  28  -6.316   2.814  -3.900
  220   3HD2  LEU  28          3HD2      LEU  28  -5.452   4.085  -4.767
  221    H    VAL  29           H        VAL  29  -3.077   3.862   0.146
  222    HA   VAL  29           HA       VAL  29  -2.228   6.558  -0.623
  223    HB   VAL  29           HB       VAL  29  -1.248   5.133   1.855
  224   1HG1  VAL  29          1HG1      VAL  29  -0.161   7.364   0.257
  225   2HG1  VAL  29          2HG1      VAL  29  -0.166   7.587   2.008
  226   3HG1  VAL  29          3HG1      VAL  29   0.664   6.203   1.296
  227   1HG2  VAL  29          1HG2      VAL  29  -3.184   7.316   1.370
  228   2HG2  VAL  29          2HG2      VAL  29  -3.131   6.112   2.657
  229   3HG2  VAL  29          3HG2      VAL  29  -2.077   7.524   2.727
  230    H    TYR  30           H        TYR  30  -0.756   6.424  -2.172
  231    HA   TYR  30           HA       TYR  30   1.345   4.433  -2.060
  232   1HB   TYR  30          1HB       TYR  30   0.900   3.381  -4.133
  233   2HB   TYR  30          2HB       TYR  30  -0.636   3.388  -3.275
  234    HD1  TYR  30           HD1      TYR  30   1.259   4.859  -6.059
  235    HD2  TYR  30           HD2      TYR  30  -2.500   4.690  -4.072
  236    HE1  TYR  30           HE1      TYR  30   0.201   5.978  -7.977
  237    HE2  TYR  30           HE2      TYR  30  -3.568   5.807  -5.985
  238    HH   TYR  30           HH       TYR  30  -1.800   7.328  -8.446
  239    H    GLN  31           H        GLN  31   3.128   4.921  -3.394
  240    HA   GLN  31           HA       GLN  31   3.022   7.501  -4.792
  241   1HB   GLN  31          1HB       GLN  31   5.417   6.758  -3.144
  242   2HB   GLN  31          2HB       GLN  31   4.931   8.341  -3.736
  243   1HG   GLN  31          1HG       GLN  31   2.999   8.258  -2.169
  244   2HG   GLN  31          2HG       GLN  31   3.670   6.769  -1.505
  245   1HE2  GLN  31          1HE2      GLN  31   3.807   7.830   0.522
  246   2HE2  GLN  31          2HE2      GLN  31   5.096   8.930   0.858
  247    H    THR  32           H        THR  32   4.753   7.813  -6.346
  248    HA   THR  32           HA       THR  32   5.472   5.288  -7.621
  249    HB   THR  32           HB       THR  32   6.220   7.829  -8.935
  250    HG1  THR  32           HG1      THR  32   3.853   7.890  -9.611
  251   1HG2  THR  32          1HG2      THR  32   5.237   5.130  -9.650
  252   2HG2  THR  32          2HG2      THR  32   6.470   6.128 -10.420
  253   3HG2  THR  32          3HG2      THR  32   4.762   6.449 -10.718
  254    H    GLU  33           H        GLU  33   7.509   4.545  -7.828
  255    HA   GLU  33           HA       GLU  33   9.721   6.297  -7.001
  256   1HB   GLU  33          1HB       GLU  33   9.065   3.538  -6.014
  257   2HB   GLU  33          2HB       GLU  33  10.726   4.114  -6.014
  258   1HG   GLU  33          1HG       GLU  33   9.764   4.472  -3.851
  259   2HG   GLU  33          2HG       GLU  33  10.029   6.031  -4.630
  260    H    GLN  34           H        GLN  34  11.884   5.317  -7.626
  261    HA   GLN  34           HA       GLN  34  11.773   4.642 -10.422
  262   1HB   GLN  34          1HB       GLN  34  13.731   5.703  -8.575
  263   2HB   GLN  34          2HB       GLN  34  14.427   4.421  -9.557
  264   1HG   GLN  34          1HG       GLN  34  12.933   6.054 -11.296
  265   2HG   GLN  34          2HG       GLN  34  13.868   7.128 -10.256
  266   1HE2  GLN  34          1HE2      GLN  34  13.924   5.583 -13.107
  267   2HE2  GLN  34          2HE2      GLN  34  15.627   5.397 -13.326
  268    H    GLY  35           H        GLY  35  11.434   2.623 -11.070
  269   1HA   GLY  35          1HA       GLY  35  11.728   0.341  -9.445
  270   2HA   GLY  35          2HA       GLY  35  11.522   0.332 -11.190
  271    H    GLU  36           H        GLU  36  12.987  -1.596 -10.805
  272    HA   GLU  36           HA       GLU  36  15.790  -0.862 -10.445
  273   1HB   GLU  36          1HB       GLU  36  15.194  -3.658 -11.090
  274   2HB   GLU  36          2HB       GLU  36  16.138  -2.983  -9.770
  275   1HG   GLU  36          1HG       GLU  36  13.974  -2.407  -8.644
  276   2HG   GLU  36          2HG       GLU  36  13.158  -3.341  -9.897
  277    H    ALA  37           H        ALA  37  14.029  -0.286 -12.871
  278    HA   ALA  37           HA       ALA  37  16.053  -0.697 -14.830
  279   1HB   ALA  37          1HB       ALA  37  15.092  -2.276 -16.245
  280   2HB   ALA  37          2HB       ALA  37  14.843  -2.959 -14.638
  281   3HB   ALA  37          3HB       ALA  37  13.513  -2.153 -15.469
  282    H    GLY  38           H        GLY  38  14.589  -0.458 -17.155
  283   1HA   GLY  38          1HA       GLY  38  14.087   2.244 -17.351
  284   2HA   GLY  38          2HA       GLY  38  13.418   1.042 -18.444
  285    H    ASN  39           H        ASN  39  11.929  -0.272 -16.251
  286    HA   ASN  39           HA       ASN  39   9.604   1.454 -16.353
  287   1HB   ASN  39          1HB       ASN  39   9.669  -1.174 -14.908
  288   2HB   ASN  39          2HB       ASN  39   8.340  -0.420 -15.784
  289   1HD2  ASN  39          1HD2      ASN  39  10.926  -2.598 -15.928
  290   2HD2  ASN  39          2HD2      ASN  39  10.830  -2.975 -17.611
  291    H    ILE  40           H        ILE  40   8.204   1.414 -14.257
  292    HA   ILE  40           HA       ILE  40   9.950   2.114 -11.987
  293    HB   ILE  40           HB       ILE  40   7.982   3.641 -11.325
  294   1HG1  ILE  40          1HG1      ILE  40   7.437   3.300 -14.282
  295   2HG1  ILE  40          2HG1      ILE  40   6.376   2.799 -12.969
  296   1HG2  ILE  40          1HG2      ILE  40  10.182   4.446 -12.016
  297   2HG2  ILE  40          2HG2      ILE  40   9.694   4.341 -13.706
  298   3HG2  ILE  40          3HG2      ILE  40   8.899   5.489 -12.629
  299   1HD1  ILE  40          1HD1      ILE  40   5.599   4.858 -13.973
  300   2HD1  ILE  40          2HD1      ILE  40   6.111   5.139 -12.308
  301   3HD1  ILE  40          3HD1      ILE  40   7.152   5.626 -13.646
  302    H    HIS  41           H        HIS  41   8.801   2.026  -9.851
  303    HA   HIS  41           HA       HIS  41   6.827  -0.158  -9.791
  304   1HB   HIS  41          1HB       HIS  41   7.925  -0.896  -7.647
  305   2HB   HIS  41          2HB       HIS  41   8.896  -1.138  -9.096
  306    HD1  HIS  41           HD1      HIS  41  10.866  -1.199  -7.223
  307    HD2  HIS  41           HD2      HIS  41   9.095   2.485  -7.966
  308    HE1  HIS  41           HE1      HIS  41  12.463   0.512  -6.304
  309    H    PHE  42           H        PHE  42   5.527  -0.225  -7.803
  310    HA   PHE  42           HA       PHE  42   5.061   2.492  -6.769
  311   1HB   PHE  42          1HB       PHE  42   3.198   0.215  -7.373
  312   2HB   PHE  42          2HB       PHE  42   2.736   1.463  -6.220
  313    HD1  PHE  42           HD1      PHE  42   4.578   1.676  -9.449
  314    HD2  PHE  42           HD2      PHE  42   1.115   2.755  -7.223
  315    HE1  PHE  42           HE1      PHE  42   3.837   3.110 -11.305
  316    HE2  PHE  42           HE2      PHE  42   0.367   4.191  -9.077
  317    HZ   PHE  42           HZ       PHE  42   1.728   4.369 -11.121
  318    H    GLN  43           H        GLN  43   4.830   2.831  -4.588
  319    HA   GLN  43           HA       GLN  43   4.920   0.560  -2.769
  320   1HB   GLN  43          1HB       GLN  43   7.211   2.255  -3.361
  321   2HB   GLN  43          2HB       GLN  43   6.799   2.275  -1.651
  322   1HG   GLN  43          1HG       GLN  43   7.459   0.156  -1.330
  323   2HG   GLN  43          2HG       GLN  43   6.843  -0.385  -2.891
  324   1HE2  GLN  43          1HE2      GLN  43   8.119   0.470  -4.798
  325   2HE2  GLN  43          2HE2      GLN  43   9.840   0.437  -4.648
  326    H    GLY  44           H        GLY  44   3.720   0.909  -1.001
  327   1HA   GLY  44          1HA       GLY  44   3.468   3.391   0.323
  328   2HA   GLY  44          2HA       GLY  44   2.088   3.161  -0.741
  329    H    TYR  45           H        TYR  45   1.067   3.326   1.491
  330    HA   TYR  45           HA       TYR  45   0.874   0.620   2.642
  331   1HB   TYR  45          1HB       TYR  45   0.243   1.817   4.796
  332   2HB   TYR  45          2HB       TYR  45   1.930   1.935   4.309
  333    HD1  TYR  45           HD1      TYR  45  -1.269   3.767   4.497
  334    HD2  TYR  45           HD2      TYR  45   2.916   4.040   3.780
  335    HE1  TYR  45           HE1      TYR  45  -1.416   6.219   4.615
  336    HE2  TYR  45           HE2      TYR  45   2.781   6.493   3.897
  337    HH   TYR  45           HH       TYR  45   1.471   8.253   4.206
  338    H    ILE  46           H        ILE  46  -1.130  -0.211   2.945
  339    HA   ILE  46           HA       ILE  46  -3.433   1.533   2.379
  340    HB   ILE  46           HB       ILE  46  -3.084  -1.298   1.387
  341   1HG1  ILE  46          1HG1      ILE  46  -3.343   1.206  -0.272
  342   2HG1  ILE  46          2HG1      ILE  46  -1.778   0.575   0.230
  343   1HG2  ILE  46          1HG2      ILE  46  -5.345   0.651   0.958
  344   2HG2  ILE  46          2HG2      ILE  46  -5.212  -0.958   0.250
  345   3HG2  ILE  46          3HG2      ILE  46  -5.396  -0.775   1.994
  346   1HD1  ILE  46          1HD1      ILE  46  -3.809  -0.938  -1.394
  347   2HD1  ILE  46          2HD1      ILE  46  -2.398  -0.103  -2.043
  348   3HD1  ILE  46          3HD1      ILE  46  -2.187  -1.480  -0.963
  349    H    GLU  47           H        GLU  47  -5.031   1.423   3.825
  350    HA   GLU  47           HA       GLU  47  -4.891  -0.686   5.865
  351   1HB   GLU  47          1HB       GLU  47  -6.320   1.975   5.984
  352   2HB   GLU  47          2HB       GLU  47  -6.160   0.822   7.301
  353   1HG   GLU  47          1HG       GLU  47  -3.978   1.356   7.694
  354   2HG   GLU  47          2HG       GLU  47  -3.683   1.848   6.027
  355    H    MET  48           H        MET  48  -6.319  -2.275   5.741
  356    HA   MET  48           HA       MET  48  -8.613  -2.075   4.006
  357   1HB   MET  48          1HB       MET  48  -7.589  -4.297   5.776
  358   2HB   MET  48          2HB       MET  48  -9.018  -4.441   4.762
  359   1HG   MET  48          1HG       MET  48  -6.750  -3.479   3.257
  360   2HG   MET  48          2HG       MET  48  -6.398  -5.009   4.058
  361   1HE   MET  48          1HE       MET  48  -9.890  -3.918   1.565
  362   2HE   MET  48          2HE       MET  48  -8.467  -2.943   1.929
  363   3HE   MET  48          3HE       MET  48  -8.507  -3.934   0.470
  364    H    LYS  49           H        LYS  49 -10.669  -3.287   5.029
  365    HA   LYS  49           HA       LYS  49 -11.926  -1.462   6.691
  366   1HB   LYS  49          1HB       LYS  49 -12.798  -3.536   5.256
  367   2HB   LYS  49          2HB       LYS  49 -12.797  -4.305   6.838
  368   1HG   LYS  49          1HG       LYS  49 -14.978  -3.403   6.369
  369   2HG   LYS  49          2HG       LYS  49 -14.236  -2.501   7.692
  370   1HD   LYS  49          1HD       LYS  49 -14.738  -0.658   6.534
  371   2HD   LYS  49          2HD       LYS  49 -13.434  -1.120   5.438
  372   1HE   LYS  49          1HE       LYS  49 -14.993  -1.143   3.839
  373   2HE   LYS  49          2HE       LYS  49 -15.550  -2.648   4.567
  374   1HZ   LYS  49          1HZ       LYS  49 -17.449  -1.671   5.088
  375   2HZ   LYS  49          2HZ       LYS  49 -16.937  -0.245   4.336
  376   3HZ   LYS  49          3HZ       LYS  49 -16.645  -0.483   5.985
  377    H    LYS  50           H        LYS  50 -10.865  -4.737   7.638
  378    HA   LYS  50           HA       LYS  50  -9.607  -3.947  10.015
  379   1HB   LYS  50          1HB       LYS  50 -12.499  -4.186  10.170
  380   2HB   LYS  50          2HB       LYS  50 -11.695  -5.297  11.273
  381   1HG   LYS  50          1HG       LYS  50 -10.740  -2.493  11.227
  382   2HG   LYS  50          2HG       LYS  50 -12.316  -2.812  11.954
  383   1HD   LYS  50          1HD       LYS  50 -10.046  -4.571  12.719
  384   2HD   LYS  50          2HD       LYS  50 -10.071  -2.927  13.362
  385   1HE   LYS  50          1HE       LYS  50 -12.069  -3.277  14.506
  386   2HE   LYS  50          2HE       LYS  50 -12.500  -4.674  13.521
  387   1HZ   LYS  50          1HZ       LYS  50 -10.503  -5.787  14.561
  388   2HZ   LYS  50          2HZ       LYS  50 -11.829  -5.531  15.579
  389   3HZ   LYS  50          3HZ       LYS  50 -10.479  -4.516  15.677
  390    H    ARG  51           H        ARG  51 -11.909  -6.616   9.561
  391    HA   ARG  51           HA       ARG  51  -9.782  -8.520  10.099
  392   1HB   ARG  51          1HB       ARG  51 -12.201  -8.583  11.038
  393   2HB   ARG  51          2HB       ARG  51 -12.626  -9.252   9.468
  394   1HG   ARG  51          1HG       ARG  51 -11.284 -11.162   9.807
  395   2HG   ARG  51          2HG       ARG  51 -10.485 -10.440  11.205
  396   1HD   ARG  51          1HD       ARG  51 -13.153 -10.355  11.886
  397   2HD   ARG  51          2HD       ARG  51 -13.005 -11.889  11.030
  398    HE   ARG  51           HE       ARG  51 -11.754 -12.709  12.769
  399   1HH1  ARG  51          1HH1      ARG  51 -12.044  -9.253  13.076
  400   2HH1  ARG  51          2HH1      ARG  51 -11.355  -9.206  14.665
  401   1HH2  ARG  51          1HH2      ARG  51 -10.846 -12.659  14.861
  402   2HH2  ARG  51          2HH2      ARG  51 -10.673 -11.143  15.679
  403    H    THR  52           H        THR  52  -9.191  -7.325   7.775
  404    HA   THR  52           HA       THR  52 -10.041  -9.213   5.681
  405    HB   THR  52           HB       THR  52  -8.589  -6.758   4.890
  406    HG1  THR  52           HG1      THR  52 -10.861  -5.754   4.990
  407   1HG2  THR  52          1HG2      THR  52 -10.428  -6.787   3.156
  408   2HG2  THR  52          2HG2      THR  52 -10.967  -8.305   3.873
  409   3HG2  THR  52          3HG2      THR  52  -9.360  -8.189   3.156
  410    H    SER  53           H        SER  53  -8.609 -10.752   5.266
  411    HA   SER  53           HA       SER  53  -5.859 -10.524   6.061
  412   1HB   SER  53          1HB       SER  53  -5.791 -12.798   4.730
  413   2HB   SER  53          2HB       SER  53  -6.596 -12.706   6.297
  414    HG   SER  53           HG       SER  53  -8.510 -12.864   5.347
  415    H    LEU  54           H        LEU  54  -4.246 -11.508   4.292
  416    HA   LEU  54           HA       LEU  54  -3.693  -9.496   2.484
  417   1HB   LEU  54          1HB       LEU  54  -2.080 -11.193   3.199
  418   2HB   LEU  54          2HB       LEU  54  -2.950 -12.410   2.268
  419    HG   LEU  54           HG       LEU  54  -2.294 -11.398   0.203
  420   1HD1  LEU  54          1HD1      LEU  54  -1.016  -9.218   1.846
  421   2HD1  LEU  54          2HD1      LEU  54  -2.492  -9.058   0.894
  422   3HD1  LEU  54          3HD1      LEU  54  -0.955  -9.375   0.090
  423   1HD2  LEU  54          1HD2      LEU  54   0.258 -11.357   0.545
  424   2HD2  LEU  54          2HD2      LEU  54  -0.615 -12.846   0.906
  425   3HD2  LEU  54          3HD2      LEU  54  -0.109 -11.780   2.217
  426    H    ALA  55           H        ALA  55  -5.804 -12.245   2.142
  427    HA   ALA  55           HA       ALA  55  -6.057 -12.432  -0.609
  428   1HB   ALA  55          1HB       ALA  55  -8.313 -12.732   1.365
  429   2HB   ALA  55          2HB       ALA  55  -8.182 -13.472  -0.231
  430   3HB   ALA  55          3HB       ALA  55  -7.087 -13.963   1.061
  431    H    GLY  56           H        GLY  56  -7.395 -10.066   1.603
  432   1HA   GLY  56          1HA       GLY  56  -9.279  -8.940  -0.207
  433   2HA   GLY  56          2HA       GLY  56  -8.667  -8.181   1.256
  434    H    MET  57           H        MET  57  -5.977  -7.994   0.713
  435    HA   MET  57           HA       MET  57  -5.929  -5.733  -1.024
  436   1HB   MET  57          1HB       MET  57  -3.677  -7.247   0.308
  437   2HB   MET  57          2HB       MET  57  -3.493  -5.713  -0.533
  438   1HG   MET  57          1HG       MET  57  -5.509  -5.845   1.630
  439   2HG   MET  57          2HG       MET  57  -3.810  -5.881   2.094
  440   1HE   MET  57          1HE       MET  57  -6.439  -2.627   0.653
  441   2HE   MET  57          2HE       MET  57  -5.682  -3.256  -0.810
  442   3HE   MET  57          3HE       MET  57  -6.563  -4.343   0.264
  443    H    LYS  58           H        LYS  58  -4.542  -8.999  -1.208
  444    HA   LYS  58           HA       LYS  58  -3.209  -8.765  -3.630
  445   1HB   LYS  58          1HB       LYS  58  -3.592 -10.776  -1.848
  446   2HB   LYS  58          2HB       LYS  58  -4.601 -11.331  -3.177
  447   1HG   LYS  58          1HG       LYS  58  -2.815 -12.064  -4.253
  448   2HG   LYS  58          2HG       LYS  58  -2.114 -10.444  -4.240
  449   1HD   LYS  58          1HD       LYS  58  -0.570 -11.946  -3.185
  450   2HD   LYS  58          2HD       LYS  58  -1.265 -10.903  -1.942
  451   1HE   LYS  58          1HE       LYS  58  -1.405 -12.963  -0.929
  452   2HE   LYS  58          2HE       LYS  58  -2.992 -12.847  -1.690
  453   1HZ   LYS  58          1HZ       LYS  58  -1.692 -15.001  -1.976
  454   2HZ   LYS  58          2HZ       LYS  58  -0.724 -14.145  -3.067
  455   3HZ   LYS  58          3HZ       LYS  58  -2.380 -14.320  -3.363
  456    H    LYS  59           H        LYS  59  -6.614  -9.208  -2.974
  457    HA   LYS  59           HA       LYS  59  -7.498 -10.054  -5.480
  458   1HB   LYS  59          1HB       LYS  59  -8.670  -9.121  -3.060
  459   2HB   LYS  59          2HB       LYS  59  -9.406  -8.233  -4.387
  460   1HG   LYS  59          1HG       LYS  59 -10.014 -10.320  -5.473
  461   2HG   LYS  59          2HG       LYS  59  -9.234 -11.233  -4.179
  462   1HD   LYS  59          1HD       LYS  59 -10.845  -9.830  -2.651
  463   2HD   LYS  59          2HD       LYS  59 -11.777  -9.673  -4.142
  464   1HE   LYS  59          1HE       LYS  59 -10.813 -12.364  -3.275
  465   2HE   LYS  59          2HE       LYS  59 -12.230 -11.656  -2.501
  466   1HZ   LYS  59          1HZ       LYS  59 -13.108 -11.330  -4.832
  467   2HZ   LYS  59          2HZ       LYS  59 -13.046 -12.925  -4.273
  468   3HZ   LYS  59          3HZ       LYS  59 -11.871 -12.361  -5.352
  469    H    LEU  60           H        LEU  60  -6.569  -6.883  -4.338
  470    HA   LEU  60           HA       LEU  60  -7.622  -5.489  -6.621
  471   1HB   LEU  60          1HB       LEU  60  -5.835  -4.712  -4.338
  472   2HB   LEU  60          2HB       LEU  60  -6.157  -3.613  -5.678
  473    HG   LEU  60           HG       LEU  60  -8.632  -3.925  -5.099
  474   1HD1  LEU  60          1HD1      LEU  60  -9.014  -5.524  -3.585
  475   2HD1  LEU  60          2HD1      LEU  60  -8.504  -4.322  -2.400
  476   3HD1  LEU  60          3HD1      LEU  60  -7.348  -5.508  -3.006
  477   1HD2  LEU  60          1HD2      LEU  60  -7.676  -2.546  -2.778
  478   2HD2  LEU  60          2HD2      LEU  60  -8.388  -1.888  -4.252
  479   3HD2  LEU  60          3HD2      LEU  60  -6.648  -2.168  -4.160
  480    H    ILE  61           H        ILE  61  -4.472  -6.696  -5.588
  481    HA   ILE  61           HA       ILE  61  -3.527  -6.415  -8.344
  482    HB   ILE  61           HB       ILE  61  -1.901  -5.533  -5.957
  483   1HG1  ILE  61          1HG1      ILE  61  -2.046  -3.331  -7.450
  484   2HG1  ILE  61          2HG1      ILE  61  -3.564  -4.068  -7.951
  485   1HG2  ILE  61          1HG2      ILE  61  -1.250  -6.129  -8.758
  486   2HG2  ILE  61          2HG2      ILE  61  -0.607  -4.606  -8.147
  487   3HG2  ILE  61          3HG2      ILE  61  -0.218  -6.118  -7.328
  488   1HD1  ILE  61          1HD1      ILE  61  -4.358  -2.909  -6.198
  489   2HD1  ILE  61          2HD1      ILE  61  -3.796  -4.316  -5.293
  490   3HD1  ILE  61          3HD1      ILE  61  -2.796  -2.865  -5.379
  491    HA   PRO  62           HA       PRO  62  -2.624 -10.583  -6.537
  492   1HB   PRO  62          1HB       PRO  62  -3.407 -11.957  -8.744
  493   2HB   PRO  62          2HB       PRO  62  -4.530 -11.461  -7.473
  494   1HG   PRO  62          1HG       PRO  62  -3.979 -10.177 -10.120
  495   2HG   PRO  62          2HG       PRO  62  -5.533 -10.457  -9.315
  496   1HD   PRO  62          1HD       PRO  62  -4.294  -8.050  -9.292
  497   2HD   PRO  62          2HD       PRO  62  -5.297  -8.620  -7.942
  498    H    GLY  63           H        GLY  63  -0.422 -10.564  -6.556
  499   1HA   GLY  63          1HA       GLY  63   1.331 -11.809  -7.861
  500   2HA   GLY  63          2HA       GLY  63   0.895 -10.751  -9.195
  501    H    ALA  64           H        ALA  64   1.121  -9.711  -5.850
  502    HA   ALA  64           HA       ALA  64   3.607  -8.273  -6.497
  503   1HB   ALA  64          1HB       ALA  64   1.952  -6.786  -4.658
  504   2HB   ALA  64          2HB       ALA  64   2.688  -6.274  -6.177
  505   3HB   ALA  64          3HB       ALA  64   1.116  -7.073  -6.184
  506    H    HIS  65           H        HIS  65   4.607  -7.344  -4.425
  507    HA   HIS  65           HA       HIS  65   4.679  -9.504  -2.461
  508   1HB   HIS  65          1HB       HIS  65   6.758  -8.473  -3.599
  509   2HB   HIS  65          2HB       HIS  65   6.518  -7.123  -2.493
  510    HD1  HIS  65           HD1      HIS  65   8.643  -9.795  -2.709
  511    HD2  HIS  65           HD2      HIS  65   6.065  -8.560   0.306
  512    HE1  HIS  65           HE1      HIS  65   9.527 -10.840  -0.600
  513    H    PHE  66           H        PHE  66   3.347  -9.321  -0.788
  514    HA   PHE  66           HA       PHE  66   2.864  -6.643   0.337
  515   1HB   PHE  66          1HB       PHE  66   1.104  -8.968  -0.137
  516   2HB   PHE  66          2HB       PHE  66   0.877  -8.150   1.406
  517    HD1  PHE  66           HD1      PHE  66   0.906  -7.645  -2.257
  518    HD2  PHE  66           HD2      PHE  66  -0.254  -6.098   1.535
  519    HE1  PHE  66           HE1      PHE  66  -0.447  -5.923  -3.377
  520    HE2  PHE  66           HE2      PHE  66  -1.610  -4.374   0.421
  521    HZ   PHE  66           HZ       PHE  66  -1.709  -4.285  -2.038
  522    H    GLU  67           H        GLU  67   2.590  -6.516   2.671
  523    HA   GLU  67           HA       GLU  67   3.659  -8.713   4.244
  524   1HB   GLU  67          1HB       GLU  67   5.215  -6.360   3.520
  525   2HB   GLU  67          2HB       GLU  67   5.082  -6.557   5.262
  526   1HG   GLU  67          1HG       GLU  67   6.111  -8.665   5.212
  527   2HG   GLU  67          2HG       GLU  67   5.916  -8.808   3.466
  528    H    LYS  68           H        LYS  68   2.188  -8.925   5.787
  529    HA   LYS  68           HA       LYS  68   1.024  -6.494   6.974
  530   1HB   LYS  68          1HB       LYS  68  -0.691  -8.366   7.794
  531   2HB   LYS  68          2HB       LYS  68  -0.853  -7.561   6.239
  532   1HG   LYS  68          1HG       LYS  68  -1.171  -9.943   5.994
  533   2HG   LYS  68          2HG       LYS  68   0.298  -9.434   5.157
  534   1HD   LYS  68          1HD       LYS  68   1.621 -10.668   6.487
  535   2HD   LYS  68          2HD       LYS  68   0.727 -10.226   7.943
  536   1HE   LYS  68          1HE       LYS  68  -0.940 -11.884   7.501
  537   2HE   LYS  68          2HE       LYS  68  -0.261 -12.218   5.909
  538   1HZ   LYS  68          1HZ       LYS  68   0.857 -13.835   6.919
  539   2HZ   LYS  68          2HZ       LYS  68   0.505 -13.251   8.467
  540   3HZ   LYS  68          3HZ       LYS  68   1.824 -12.629   7.609
  541    H    ARG  69           H        ARG  69   3.545  -8.066   7.634
  542    HA   ARG  69           HA       ARG  69   3.057  -9.251  10.197
  543   1HB   ARG  69          1HB       ARG  69   5.045  -9.536   8.418
  544   2HB   ARG  69          2HB       ARG  69   5.788  -8.340   9.472
  545   1HG   ARG  69          1HG       ARG  69   5.287  -9.869  11.397
  546   2HG   ARG  69          2HG       ARG  69   4.812 -11.085  10.210
  547   1HD   ARG  69          1HD       ARG  69   7.483  -9.730  10.070
  548   2HD   ARG  69          2HD       ARG  69   7.222 -11.125  11.116
  549    HE   ARG  69           HE       ARG  69   6.331 -11.643   8.469
  550   1HH1  ARG  69          1HH1      ARG  69   9.195 -11.398  10.432
  551   2HH1  ARG  69          2HH1      ARG  69  10.123 -12.477   9.444
  552   1HH2  ARG  69          1HH2      ARG  69   7.542 -13.065   7.160
  553   2HH2  ARG  69          2HH2      ARG  69   9.182 -13.424   7.582
  554    H    ARG  70           H        ARG  70   2.994  -6.121   9.218
  555    HA   ARG  70           HA       ARG  70   2.939  -4.139  10.338
  556   1HB   ARG  70          1HB       ARG  70   3.473  -5.628  12.899
  557   2HB   ARG  70          2HB       ARG  70   2.615  -4.109  12.679
  558   1HG   ARG  70          1HG       ARG  70   0.749  -5.225  11.692
  559   2HG   ARG  70          2HG       ARG  70   1.626  -6.756  11.646
  560   1HD   ARG  70          1HD       ARG  70   1.714  -5.873  14.312
  561   2HD   ARG  70          2HD       ARG  70   0.058  -5.619  13.764
  562    HE   ARG  70           HE       ARG  70  -0.227  -7.897  13.647
  563   1HH1  ARG  70          1HH1      ARG  70   3.150  -7.157  14.058
  564   2HH1  ARG  70          2HH1      ARG  70   3.608  -8.801  14.356
  565   1HH2  ARG  70          1HH2      ARG  70   0.363 -10.065  14.039
  566   2HH2  ARG  70          2HH2      ARG  70   2.022 -10.455  14.344
  567    H    GLY  71           H        GLY  71   5.318  -4.912   9.154
  568   1HA   GLY  71          1HA       GLY  71   7.529  -4.600  10.957
  569   2HA   GLY  71          2HA       GLY  71   7.608  -4.613   9.201
  570    H    THR  72           H        THR  72   5.320  -2.406   9.831
  571    HA   THR  72           HA       THR  72   7.103  -0.188  10.465
  572    HB   THR  72           HB       THR  72   6.182   1.097   8.465
  573    HG1  THR  72           HG1      THR  72   5.840  -1.421   7.249
  574   1HG2  THR  72          1HG2      THR  72   7.917   0.313   6.991
  575   2HG2  THR  72          2HG2      THR  72   7.977  -1.243   7.820
  576   3HG2  THR  72          3HG2      THR  72   8.508   0.220   8.649
  577    H    GLN  73           H        GLN  73   4.761  -1.503  11.693
  578    HA   GLN  73           HA       GLN  73   2.396  -0.090  11.399
  579   1HB   GLN  73          1HB       GLN  73   2.342  -2.036  12.735
  580   2HB   GLN  73          2HB       GLN  73   3.635  -1.457  13.777
  581   1HG   GLN  73          1HG       GLN  73   1.245  -1.437  14.684
  582   2HG   GLN  73          2HG       GLN  73   2.238   0.001  14.917
  583   1HE2  GLN  73          1HE2      GLN  73   0.532   1.402  15.098
  584   2HE2  GLN  73          2HE2      GLN  73  -0.500   1.811  13.774
  585    H    GLY  74           H        GLY  74   2.423   2.088  11.249
  586   1HA   GLY  74          1HA       GLY  74   2.188   4.175  12.313
  587   2HA   GLY  74          2HA       GLY  74   3.123   3.563  13.670
  588    H    GLU  75           H        GLU  75   5.107   2.514  11.578
  589    HA   GLU  75           HA       GLU  75   6.801   4.836  11.647
  590   1HB   GLU  75          1HB       GLU  75   7.197   2.067  11.512
  591   2HB   GLU  75          2HB       GLU  75   7.801   2.690   9.983
  592   1HG   GLU  75          1HG       GLU  75   8.911   4.455  11.683
  593   2HG   GLU  75          2HG       GLU  75   8.844   3.025  12.712
  594    H    ALA  76           H        ALA  76   4.775   3.252   9.311
  595    HA   ALA  76           HA       ALA  76   5.919   4.503   7.004
  596   1HB   ALA  76          1HB       ALA  76   3.117   3.499   6.998
  597   2HB   ALA  76          2HB       ALA  76   4.378   3.342   5.774
  598   3HB   ALA  76          3HB       ALA  76   4.431   2.345   7.228
  599    H    ARG  77           H        ARG  77   4.112   5.701   9.519
  600    HA   ARG  77           HA       ARG  77   2.452   7.521   8.026
  601   1HB   ARG  77          1HB       ARG  77   2.618   6.615  10.716
  602   2HB   ARG  77          2HB       ARG  77   2.786   8.365  10.734
  603   1HG   ARG  77          1HG       ARG  77   0.540   8.289  10.815
  604   2HG   ARG  77          2HG       ARG  77   0.702   8.136   9.064
  605   1HD   ARG  77          1HD       ARG  77  -0.392   6.206   9.185
  606   2HD   ARG  77          2HD       ARG  77   0.966   5.542  10.093
  607    HE   ARG  77           HE       ARG  77  -0.638   6.933  11.889
  608   1HH1  ARG  77          1HH1      ARG  77  -0.853   4.142   9.820
  609   2HH1  ARG  77          2HH1      ARG  77  -1.991   3.317  10.832
  610   1HH2  ARG  77          1HH2      ARG  77  -2.136   5.857  13.231
  611   2HH2  ARG  77          2HH2      ARG  77  -2.721   4.293  12.772
  612    H    ALA  78           H        ALA  78   5.690   7.454   9.062
  613    HA   ALA  78           HA       ALA  78   5.933  10.358   8.614
  614   1HB   ALA  78          1HB       ALA  78   8.024  10.194  10.001
  615   2HB   ALA  78          2HB       ALA  78   6.514   9.938  10.875
  616   3HB   ALA  78          3HB       ALA  78   7.520   8.559  10.431
  617    H    TYR  79           H        TYR  79   7.752   7.302   8.364
  618    HA   TYR  79           HA       TYR  79   9.612   8.381   6.476
  619   1HB   TYR  79          1HB       TYR  79  10.396   6.619   7.880
  620   2HB   TYR  79          2HB       TYR  79   9.051   5.574   7.434
  621    HD1  TYR  79           HD1      TYR  79  11.242   7.595   5.207
  622    HD2  TYR  79           HD2      TYR  79  10.100   3.705   6.500
  623    HE1  TYR  79           HE1      TYR  79  12.611   6.605   3.419
  624    HE2  TYR  79           HE2      TYR  79  11.467   2.705   4.716
  625    HH   TYR  79           HH       TYR  79  12.313   3.618   2.316
  626    H    SER  80           H        SER  80   7.001   5.968   6.233
  627    HA   SER  80           HA       SER  80   5.714   5.286   4.485
  628   1HB   SER  80          1HB       SER  80   6.508   8.018   3.469
  629   2HB   SER  80          2HB       SER  80   5.384   6.967   2.609
  630    HG   SER  80           HG       SER  80   5.063   7.848   5.289
  631    H    MET  81           H        MET  81   7.810   7.126   2.356
  632    HA   MET  81           HA       MET  81   9.017   4.608   1.421
  633   1HB   MET  81          1HB       MET  81   7.495   6.642  -0.071
  634   2HB   MET  81          2HB       MET  81   9.000   6.143  -0.832
  635   1HG   MET  81          1HG       MET  81   7.170   4.811  -1.655
  636   2HG   MET  81          2HG       MET  81   8.275   3.808  -0.718
  637   1HE   MET  81          1HE       MET  81   4.716   5.773   1.163
  638   2HE   MET  81          2HE       MET  81   5.556   6.261  -0.309
  639   3HE   MET  81          3HE       MET  81   4.196   5.140  -0.399
  640    H    LYS  82           H        LYS  82  10.912   5.221  -0.177
  641    HA   LYS  82           HA       LYS  82  12.722   6.867   1.388
  642   1HB   LYS  82          1HB       LYS  82  13.111   4.522   0.135
  643   2HB   LYS  82          2HB       LYS  82  13.621   5.612  -1.148
  644   1HG   LYS  82          1HG       LYS  82  14.978   6.681   0.896
  645   2HG   LYS  82          2HG       LYS  82  14.889   5.006   1.445
  646   1HD   LYS  82          1HD       LYS  82  15.656   5.476  -1.382
  647   2HD   LYS  82          2HD       LYS  82  16.839   5.895  -0.141
  648   1HE   LYS  82          1HE       LYS  82  15.987   3.448   0.705
  649   2HE   LYS  82          2HE       LYS  82  15.893   3.270  -1.046
  650   1HZ   LYS  82          1HZ       LYS  82  18.168   3.751  -1.272
  651   2HZ   LYS  82          2HZ       LYS  82  18.073   2.660   0.016
  652   3HZ   LYS  82          3HZ       LYS  82  18.307   4.307   0.320
  653    H    GLU  83           H        GLU  83  12.983   8.953   0.983
  654    HA   GLU  83           HA       GLU  83  11.896  10.268  -1.259
  655   1HB   GLU  83          1HB       GLU  83  13.495  11.006   1.093
  656   2HB   GLU  83          2HB       GLU  83  13.765  12.029  -0.311
  657   1HG   GLU  83          1HG       GLU  83  11.581  12.789  -0.344
  658   2HG   GLU  83          2HG       GLU  83  10.986  11.422   0.597
  659    H    ASP  84           H        ASP  84  15.095   9.009  -0.567
  660    HA   ASP  84           HA       ASP  84  16.553  10.268  -2.581
  661   1HB   ASP  84          1HB       ASP  84  16.946   8.102  -0.749
  662   2HB   ASP  84          2HB       ASP  84  17.525   7.614  -2.340
  663    H    THR  85           H        THR  85  14.468   7.441  -2.691
  664    HA   THR  85           HA       THR  85  14.949   7.235  -5.589
  665    HB   THR  85           HB       THR  85  13.977   4.959  -5.427
  666    HG1  THR  85           HG1      THR  85  12.881   4.567  -3.663
  667   1HG2  THR  85          1HG2      THR  85  16.284   4.854  -5.405
  668   2HG2  THR  85          2HG2      THR  85  15.889   4.048  -3.887
  669   3HG2  THR  85          3HG2      THR  85  16.415   5.731  -3.881
  670    H    ARG  86           H        ARG  86  12.950   8.803  -3.682
  671    HA   ARG  86           HA       ARG  86  10.367   7.967  -4.524
  672   1HB   ARG  86          1HB       ARG  86  10.685   9.265  -2.481
  673   2HB   ARG  86          2HB       ARG  86  11.304  10.619  -3.417
  674   1HG   ARG  86          1HG       ARG  86   9.207  11.119  -4.308
  675   2HG   ARG  86          2HG       ARG  86   8.551   9.536  -3.884
  676   1HD   ARG  86          1HD       ARG  86   8.002  10.196  -1.816
  677   2HD   ARG  86          2HD       ARG  86   9.532  11.040  -1.585
  678    HE   ARG  86           HE       ARG  86   7.682  12.393  -3.331
  679   1HH1  ARG  86          1HH1      ARG  86   8.744  11.941  -0.047
  680   2HH1  ARG  86          2HH1      ARG  86   8.130  13.466   0.500
  681   1HH2  ARG  86          1HH2      ARG  86   6.869  14.404  -2.624
  682   2HH2  ARG  86          2HH2      ARG  86   7.063  14.866  -0.967
  683    H    LEU  87           H        LEU  87   9.471   8.205  -6.455
  684    HA   LEU  87           HA       LEU  87  10.626  10.112  -8.344
  685   1HB   LEU  87          1HB       LEU  87   9.389   7.520  -8.531
  686   2HB   LEU  87          2HB       LEU  87   8.579   8.668  -9.594
  687    HG   LEU  87           HG       LEU  87  11.505   7.935  -9.630
  688   1HD1  LEU  87          1HD1      LEU  87  10.741   7.279 -12.027
  689   2HD1  LEU  87          2HD1      LEU  87   9.138   7.204 -11.297
  690   3HD1  LEU  87          3HD1      LEU  87  10.436   6.183 -10.679
  691   1HD2  LEU  87          1HD2      LEU  87   9.940   9.975 -11.197
  692   2HD2  LEU  87          2HD2      LEU  87  11.505   9.347 -11.715
  693   3HD2  LEU  87          3HD2      LEU  87  11.369  10.236 -10.196
  694    H    GLU  88           H        GLU  88   7.376   9.077  -7.296
  695    HA   GLU  88           HA       GLU  88   6.479  11.854  -7.645
  696   1HB   GLU  88          1HB       GLU  88   5.718   9.726  -9.286
  697   2HB   GLU  88          2HB       GLU  88   4.366   9.944  -8.184
  698   1HG   GLU  88          1HG       GLU  88   3.943  12.099  -8.920
  699   2HG   GLU  88          2HG       GLU  88   5.559  12.290  -9.598
  700    H    GLY  89           H        GLY  89   4.180  12.077  -6.625
  701   1HA   GLY  89          1HA       GLY  89   2.706  11.589  -4.853
  702   2HA   GLY  89          2HA       GLY  89   3.847  10.389  -4.265
  703    HA   PRO  90           HA       PRO  90   3.224  10.215  -2.299
  704   1HB   PRO  90          1HB       PRO  90   1.842  11.076  -0.126
  705   2HB   PRO  90          2HB       PRO  90   3.542  10.596  -0.055
  706   1HG   PRO  90          1HG       PRO  90   2.353  13.339  -0.220
  707   2HG   PRO  90          2HG       PRO  90   3.696  12.759   0.783
  708   1HD   PRO  90          1HD       PRO  90   4.083  14.144  -1.511
  709   2HD   PRO  90          2HD       PRO  90   5.213  12.896  -0.947
  710    H    TRP  91           H        TRP  91   0.902   9.604  -2.007
  711    HA   TRP  91           HA       TRP  91  -0.982  11.571  -3.083
  712   1HB   TRP  91          1HB       TRP  91  -0.339   8.889  -4.295
  713   2HB   TRP  91          2HB       TRP  91  -1.890   9.678  -4.570
  714    HD1  TRP  91           HD1      TRP  91  -0.736  12.675  -4.887
  715    HE1  TRP  91           HE1      TRP  91   0.514  13.288  -7.052
  716    HE3  TRP  91           HE3      TRP  91   0.555   7.977  -6.436
  717    HZ2  TRP  91           HZ2      TRP  91   1.868  11.956  -9.140
  718    HZ3  TRP  91           HZ3      TRP  91   1.827   7.733  -8.528
  719    HH2  TRP  91           HH2      TRP  91   2.469   9.682  -9.851
  720    H    GLU  92           H        GLU  92  -3.133  11.233  -2.509
  721    HA   GLU  92           HA       GLU  92  -3.647   9.002  -0.662
  722   1HB   GLU  92          1HB       GLU  92  -4.212  11.929  -0.265
  723   2HB   GLU  92          2HB       GLU  92  -5.147  10.700   0.577
  724   1HG   GLU  92          1HG       GLU  92  -3.406  10.083   1.910
  725   2HG   GLU  92          2HG       GLU  92  -2.188  10.540   0.721
  726    H    TYR  93           H        TYR  93  -5.587   8.007  -0.868
  727    HA   TYR  93           HA       TYR  93  -7.649   9.239  -2.537
  728   1HB   TYR  93          1HB       TYR  93  -6.475   6.496  -3.030
  729   2HB   TYR  93          2HB       TYR  93  -7.935   7.109  -3.798
  730    HD1  TYR  93           HD1      TYR  93  -7.800   8.913  -5.460
  731    HD2  TYR  93           HD2      TYR  93  -4.295   7.238  -3.725
  732    HE1  TYR  93           HE1      TYR  93  -6.442   9.924  -7.244
  733    HE2  TYR  93           HE2      TYR  93  -2.926   8.246  -5.503
  734    HH   TYR  93           HH       TYR  93  -3.085   9.144  -7.662
  735    H    GLY  94           H        GLY  94  -9.741   8.147  -2.371
  736   1HA   GLY  94          1HA       GLY  94 -11.308   6.777  -1.285
  737   2HA   GLY  94          2HA       GLY  94 -10.057   6.281  -0.155
  738    H    GLU  95           H        GLU  95 -11.411   6.621   1.629
  739    HA   GLU  95           HA       GLU  95 -12.873   8.925   2.176
  740   1HB   GLU  95          1HB       GLU  95 -13.232   6.968   3.500
  741   2HB   GLU  95          2HB       GLU  95 -11.553   6.936   4.020
  742   1HG   GLU  95          1HG       GLU  95 -11.836   8.727   5.473
  743   2HG   GLU  95          2HG       GLU  95 -13.321   9.255   4.684
  Start of MODEL   27
    1   1H    ALA   2          1H        ALA   2 -15.695   0.941  18.799
    2    HA   ALA   2           HA       ALA   2 -15.227  -0.690  16.400
    3   1HB   ALA   2          1HB       ALA   2 -14.658   2.228  16.906
    4   2HB   ALA   2          2HB       ALA   2 -14.306   1.366  15.408
    5   3HB   ALA   2          3HB       ALA   2 -15.976   1.565  15.939
    6    H    ARG   3           H        ARG   3 -13.179  -1.309  15.789
    7    HA   ARG   3           HA       ARG   3 -11.050  -0.850  17.775
    8   1HB   ARG   3          1HB       ARG   3 -11.776  -3.315  16.211
    9   2HB   ARG   3          2HB       ARG   3 -10.162  -3.099  16.875
   10   1HG   ARG   3          1HG       ARG   3 -11.747  -2.552  19.032
   11   2HG   ARG   3          2HG       ARG   3 -12.660  -3.813  18.201
   12   1HD   ARG   3          1HD       ARG   3 -11.308  -5.158  19.424
   13   2HD   ARG   3          2HD       ARG   3 -10.222  -4.895  18.060
   14    HE   ARG   3           HE       ARG   3  -9.745  -2.866  19.898
   15   1HH1  ARG   3          1HH1      ARG   3  -9.472  -6.332  19.720
   16   2HH1  ARG   3          2HH1      ARG   3  -8.143  -6.414  20.828
   17   1HH2  ARG   3          1HH2      ARG   3  -7.995  -2.961  21.358
   18   2HH2  ARG   3          2HH2      ARG   3  -7.304  -4.497  21.760
   19    H    GLN   4           H        GLN   4  -8.864  -0.830  16.954
   20    HA   GLN   4           HA       GLN   4  -8.725   0.460  14.350
   21   1HB   GLN   4          1HB       GLN   4  -7.203   0.556  16.816
   22   2HB   GLN   4          2HB       GLN   4  -6.149   0.341  15.424
   23   1HG   GLN   4          1HG       GLN   4  -6.390   2.682  15.903
   24   2HG   GLN   4          2HG       GLN   4  -7.175   2.309  14.369
   25   1HE2  GLN   4          1HE2      GLN   4  -8.594   3.988  14.368
   26   2HE2  GLN   4          2HE2      GLN   4  -9.884   4.154  15.506
   27    H    VAL   5           H        VAL   5  -7.096  -0.127  12.781
   28    HA   VAL   5           HA       VAL   5  -6.275  -2.952  12.923
   29    HB   VAL   5           HB       VAL   5  -6.760  -3.239  10.557
   30   1HG1  VAL   5          1HG1      VAL   5  -9.383  -2.480  10.903
   31   2HG1  VAL   5          2HG1      VAL   5  -8.668  -4.005  11.433
   32   3HG1  VAL   5          3HG1      VAL   5  -8.794  -2.650  12.556
   33   1HG2  VAL   5          1HG2      VAL   5  -6.783  -0.430  10.523
   34   2HG2  VAL   5          2HG2      VAL   5  -7.028  -1.528   9.165
   35   3HG2  VAL   5          3HG2      VAL   5  -8.413  -0.945  10.088
   36    H    ILE   6           H        ILE   6  -4.452  -3.502  11.549
   37    HA   ILE   6           HA       ILE   6  -2.493  -1.361  11.514
   38    HB   ILE   6           HB       ILE   6  -2.102  -4.255  10.749
   39   1HG1  ILE   6          1HG1      ILE   6  -0.969  -4.119  13.162
   40   2HG1  ILE   6          2HG1      ILE   6  -2.200  -2.882  13.392
   41   1HG2  ILE   6          1HG2      ILE   6  -0.334  -1.907  11.023
   42   2HG2  ILE   6          2HG2      ILE   6   0.273  -3.426  11.681
   43   3HG2  ILE   6          3HG2      ILE   6  -0.190  -3.324   9.983
   44   1HD1  ILE   6          1HD1      ILE   6  -2.702  -5.330  14.047
   45   2HD1  ILE   6          2HD1      ILE   6  -3.932  -4.390  13.202
   46   3HD1  ILE   6          3HD1      ILE   6  -2.955  -5.561  12.318
   47    H    CYS   7           H        CYS   7  -1.269  -0.764   9.689
   48    HA   CYS   7           HA       CYS   7  -2.770  -0.738   7.242
   49   1HB   CYS   7          1HB       CYS   7   0.061   0.239   7.537
   50   2HB   CYS   7          2HB       CYS   7  -1.197   0.831   6.458
   51    HG   CYS   7           HG       CYS   7  -1.016   2.893   8.147
   52    H    TRP   8           H        TRP   8  -1.906  -1.388   5.163
   53    HA   TRP   8           HA       TRP   8  -0.279  -3.829   5.393
   54   1HB   TRP   8          1HB       TRP   8  -2.348  -3.005   3.350
   55   2HB   TRP   8          2HB       TRP   8  -1.313  -4.419   3.168
   56    HD1  TRP   8           HD1      TRP   8  -3.832  -3.068   5.805
   57    HE1  TRP   8           HE1      TRP   8  -5.121  -5.080   6.761
   58    HE3  TRP   8           HE3      TRP   8  -1.472  -6.825   3.266
   59    HZ2  TRP   8           HZ2      TRP   8  -5.135  -7.888   6.477
   60    HZ3  TRP   8           HZ3      TRP   8  -2.182  -9.146   3.666
   61    HH2  TRP   8           HH2      TRP   8  -3.976  -9.665   5.239
   62    H    CYS   9           H        CYS   9   1.760  -3.607   4.775
   63    HA   CYS   9           HA       CYS   9   2.453  -1.531   2.828
   64   1HB   CYS   9          1HB       CYS   9   4.800  -1.969   3.579
   65   2HB   CYS   9          2HB       CYS   9   3.731  -1.414   4.862
   66    HG   CYS   9           HG       CYS   9   3.468  -4.582   5.052
   67    H    PHE  10           H        PHE  10   2.690  -2.097   0.780
   68    HA   PHE  10           HA       PHE  10   3.893  -4.696   0.149
   69   1HB   PHE  10          1HB       PHE  10   2.214  -5.372  -1.280
   70   2HB   PHE  10          2HB       PHE  10   1.268  -4.533  -0.055
   71    HD1  PHE  10           HD2      PHE  10   0.936  -1.949  -0.531
   72    HD2  PHE  10           HD1      PHE  10   1.804  -4.890  -3.483
   73    HE1  PHE  10           HE2      PHE  10  -0.010  -0.483  -2.265
   74    HE2  PHE  10           HE1      PHE  10   0.861  -3.428  -5.222
   75    HZ   PHE  10           HZ       PHE  10  -0.049  -1.222  -4.614
   76    H    THR  11           H        THR  11   4.632  -4.813  -2.140
   77    HA   THR  11           HA       THR  11   5.310  -2.168  -3.234
   78    HB   THR  11           HB       THR  11   7.243  -4.485  -3.028
   79    HG1  THR  11           HG1      THR  11   8.326  -2.835  -1.624
   80   1HG2  THR  11          1HG2      THR  11   7.372  -1.774  -4.291
   81   2HG2  THR  11          2HG2      THR  11   7.914  -3.330  -4.922
   82   3HG2  THR  11          3HG2      THR  11   8.837  -2.520  -3.656
   83    H    LEU  12           H        LEU  12   5.025  -1.970  -5.373
   84    HA   LEU  12           HA       LEU  12   4.467  -4.423  -6.906
   85   1HB   LEU  12          1HB       LEU  12   2.678  -2.551  -6.478
   86   2HB   LEU  12          2HB       LEU  12   3.527  -1.733  -7.789
   87    HG   LEU  12           HG       LEU  12   3.039  -3.608  -9.280
   88   1HD1  LEU  12          1HD1      LEU  12   1.398  -5.326  -8.508
   89   2HD1  LEU  12          2HD1      LEU  12   1.654  -4.748  -6.862
   90   3HD1  LEU  12          3HD1      LEU  12   2.994  -5.450  -7.768
   91   1HD2  LEU  12          1HD2      LEU  12   0.752  -3.132  -9.627
   92   2HD2  LEU  12          2HD2      LEU  12   1.454  -1.667  -8.940
   93   3HD2  LEU  12          3HD2      LEU  12   0.495  -2.746  -7.925
   94    H    ASN  13           H        ASN  13   5.982  -4.937  -8.327
   95    HA   ASN  13           HA       ASN  13   7.736  -2.823  -9.364
   96   1HB   ASN  13          1HB       ASN  13   8.129  -5.824  -9.390
   97   2HB   ASN  13          2HB       ASN  13   9.301  -4.623  -9.923
   98   1HD2  ASN  13          1HD2      ASN  13   9.720  -6.590  -7.930
   99   2HD2  ASN  13          2HD2      ASN  13  10.012  -5.769  -6.438
  100    H    ASN  14           H        ASN  14   7.686  -2.250 -11.445
  101    HA   ASN  14           HA       ASN  14   6.930  -2.072 -13.589
  102   1HB   ASN  14          1HB       ASN  14   8.546  -4.033 -13.680
  103   2HB   ASN  14          2HB       ASN  14   7.133  -5.084 -13.647
  104   1HD2  ASN  14          1HD2      ASN  14   7.493  -5.925 -15.669
  105   2HD2  ASN  14          2HD2      ASN  14   7.288  -5.005 -17.118
  106    HA   PRO  15           HA       PRO  15   2.623  -3.405 -12.332
  107   1HB   PRO  15          1HB       PRO  15   1.571  -0.903 -12.299
  108   2HB   PRO  15          2HB       PRO  15   2.348  -1.637 -10.891
  109   1HG   PRO  15          1HG       PRO  15   3.464   0.316 -12.867
  110   2HG   PRO  15          2HG       PRO  15   3.629   0.292 -11.101
  111   1HD   PRO  15          1HD       PRO  15   5.577  -0.597 -12.759
  112   2HD   PRO  15          2HD       PRO  15   5.296  -1.299 -11.153
  113    H    LEU  16           H        LEU  16   0.552  -2.789 -13.513
  114    HA   LEU  16           HA       LEU  16   1.158  -2.250 -16.346
  115   1HB   LEU  16          1HB       LEU  16   0.281  -4.593 -15.416
  116   2HB   LEU  16          2HB       LEU  16  -1.270  -3.781 -15.609
  117    HG   LEU  16           HG       LEU  16   0.631  -3.795 -17.905
  118   1HD1  LEU  16          1HD1      LEU  16   0.742  -6.019 -17.929
  119   2HD1  LEU  16          2HD1      LEU  16  -0.974  -5.996 -18.333
  120   3HD1  LEU  16          3HD1      LEU  16  -0.466  -6.175 -16.653
  121   1HD2  LEU  16          1HD2      LEU  16  -1.265  -2.567 -18.386
  122   2HD2  LEU  16          2HD2      LEU  16  -2.321  -3.634 -17.461
  123   3HD2  LEU  16          3HD2      LEU  16  -1.687  -4.157 -19.022
  124    H    SER  17           H        SER  17  -0.299  -1.016 -13.661
  125    HA   SER  17           HA       SER  17  -1.519   1.120 -14.986
  126   1HB   SER  17          1HB       SER  17  -3.227  -1.245 -14.590
  127   2HB   SER  17          2HB       SER  17  -3.921   0.262 -13.993
  128    HG   SER  17           HG       SER  17  -4.437   0.542 -16.012
  129    HA   PRO  18           HA       PRO  18  -1.447   2.817 -10.943
  130   1HB   PRO  18          1HB       PRO  18  -3.527   4.562 -10.998
  131   2HB   PRO  18          2HB       PRO  18  -2.020   4.836 -11.880
  132   1HG   PRO  18          1HG       PRO  18  -4.635   3.777 -12.881
  133   2HG   PRO  18          2HG       PRO  18  -3.543   4.955 -13.633
  134   1HD   PRO  18          1HD       PRO  18  -3.623   2.355 -14.385
  135   2HD   PRO  18          2HD       PRO  18  -2.134   3.320 -14.442
  136    H    LEU  19           H        LEU  19  -2.451   2.828  -8.890
  137    HA   LEU  19           HA       LEU  19  -4.376   0.714  -8.525
  138   1HB   LEU  19          1HB       LEU  19  -3.407   2.542  -6.359
  139   2HB   LEU  19          2HB       LEU  19  -3.908   0.856  -6.243
  140    HG   LEU  19           HG       LEU  19  -1.379   1.778  -7.603
  141   1HD1  LEU  19          1HD1      LEU  19  -1.547   0.458  -4.915
  142   2HD1  LEU  19          2HD1      LEU  19  -1.552   2.212  -5.093
  143   3HD1  LEU  19          3HD1      LEU  19  -0.174   1.272  -5.665
  144   1HD2  LEU  19          1HD2      LEU  19  -0.815  -0.675  -7.200
  145   2HD2  LEU  19          2HD2      LEU  19  -1.979  -0.316  -8.476
  146   3HD2  LEU  19          3HD2      LEU  19  -2.539  -0.905  -6.910
  147    H    SER  20           H        SER  20  -6.227   1.075  -6.965
  148    HA   SER  20           HA       SER  20  -7.404   3.733  -7.067
  149   1HB   SER  20          1HB       SER  20  -9.374   3.128  -8.228
  150   2HB   SER  20          2HB       SER  20  -8.063   2.432  -9.180
  151    HG   SER  20           HG       SER  20 -10.098   1.195  -7.863
  152    H    LEU  21           H        LEU  21  -9.236   3.976  -5.658
  153    HA   LEU  21           HA       LEU  21  -8.950   2.777  -3.174
  154   1HB   LEU  21          1HB       LEU  21 -10.163   4.919  -3.762
  155   2HB   LEU  21          2HB       LEU  21 -11.534   3.909  -4.217
  156    HG   LEU  21           HG       LEU  21 -11.621   3.058  -1.890
  157   1HD1  LEU  21          1HD1      LEU  21  -9.263   3.460  -1.323
  158   2HD1  LEU  21          2HD1      LEU  21 -10.366   4.178  -0.149
  159   3HD1  LEU  21          3HD1      LEU  21  -9.566   5.197  -1.346
  160   1HD2  LEU  21          1HD2      LEU  21 -13.066   4.884  -2.580
  161   2HD2  LEU  21          2HD2      LEU  21 -11.800   6.054  -2.204
  162   3HD2  LEU  21          3HD2      LEU  21 -12.543   5.112  -0.911
  163    H    HIS  22           H        HIS  22 -10.477   1.408  -1.994
  164    HA   HIS  22           HA       HIS  22 -11.822  -0.554  -3.729
  165   1HB   HIS  22          1HB       HIS  22  -9.589  -1.287  -2.660
  166   2HB   HIS  22          2HB       HIS  22 -10.486  -1.325  -1.145
  167    HD1  HIS  22           HD1      HIS  22 -10.679  -3.777  -0.722
  168    HD2  HIS  22           HD2      HIS  22 -11.769  -2.754  -4.599
  169    HE1  HIS  22           HE1      HIS  22 -11.603  -5.883  -1.739
  170    H    ASP  23           H        ASP  23 -13.866  -1.029  -3.203
  171    HA   ASP  23           HA       ASP  23 -15.319   0.477  -1.371
  172   1HB   ASP  23          1HB       ASP  23 -15.827  -1.915  -3.026
  173   2HB   ASP  23          2HB       ASP  23 -16.881  -1.731  -1.627
  174    H    SER  24           H        SER  24 -13.430  -2.372  -0.904
  175    HA   SER  24           HA       SER  24 -14.664  -3.070   1.617
  176   1HB   SER  24          1HB       SER  24 -13.136  -4.452  -0.253
  177   2HB   SER  24          2HB       SER  24 -12.055  -4.269   1.128
  178    HG   SER  24           HG       SER  24 -13.625  -5.236   2.428
  179    H    MET  25           H        MET  25 -11.658  -1.574   0.503
  180    HA   MET  25           HA       MET  25 -10.580  -1.261   3.135
  181   1HB   MET  25          1HB       MET  25  -8.748  -0.243   2.117
  182   2HB   MET  25          2HB       MET  25  -9.322  -1.350   0.877
  183   1HG   MET  25          1HG       MET  25 -10.373   0.426  -0.322
  184   2HG   MET  25          2HG       MET  25 -10.049   1.564   0.984
  185   1HE   MET  25          1HE       MET  25  -8.399  -1.176  -0.838
  186   2HE   MET  25          2HE       MET  25  -7.777  -0.264  -2.214
  187   3HE   MET  25          3HE       MET  25  -6.698  -0.709  -0.891
  188    H    LYS  26           H        LYS  26  -9.737   1.191   3.523
  189    HA   LYS  26           HA       LYS  26 -12.077   2.960   3.307
  190   1HB   LYS  26          1HB       LYS  26 -10.993   1.810   5.691
  191   2HB   LYS  26          2HB       LYS  26 -10.717   3.547   5.730
  192   1HG   LYS  26          1HG       LYS  26 -12.871   3.991   6.095
  193   2HG   LYS  26          2HG       LYS  26 -13.409   2.834   4.876
  194   1HD   LYS  26          1HD       LYS  26 -12.893   1.012   6.536
  195   2HD   LYS  26          2HD       LYS  26 -12.654   2.281   7.740
  196   1HE   LYS  26          1HE       LYS  26 -15.164   2.381   6.177
  197   2HE   LYS  26          2HE       LYS  26 -15.006   1.060   7.334
  198   1HZ   LYS  26          1HZ       LYS  26 -14.655   2.620   9.090
  199   2HZ   LYS  26          2HZ       LYS  26 -16.055   3.080   8.260
  200   3HZ   LYS  26          3HZ       LYS  26 -14.610   3.923   8.011
  201    H    TYR  27           H        TYR  27  -8.601   2.627   3.675
  202    HA   TYR  27           HA       TYR  27  -8.300   5.361   2.628
  203   1HB   TYR  27          1HB       TYR  27  -7.733   5.036   5.126
  204   2HB   TYR  27          2HB       TYR  27  -6.320   4.159   4.549
  205    HD1  TYR  27           HD1      TYR  27  -7.933   7.236   3.197
  206    HD2  TYR  27           HD2      TYR  27  -4.500   5.522   5.036
  207    HE1  TYR  27           HE1      TYR  27  -6.731   9.364   2.922
  208    HE2  TYR  27           HE2      TYR  27  -3.289   7.646   4.767
  209    HH   TYR  27           HH       TYR  27  -3.889  10.089   4.520
  210    H    LEU  28           H        LEU  28  -6.695   5.677   1.121
  211    HA   LEU  28           HA       LEU  28  -5.100   3.335   0.343
  212   1HB   LEU  28          1HB       LEU  28  -7.069   3.540  -1.129
  213   2HB   LEU  28          2HB       LEU  28  -6.552   5.168  -1.560
  214    HG   LEU  28           HG       LEU  28  -4.614   4.312  -2.695
  215   1HD1  LEU  28          1HD1      LEU  28  -4.920   1.562  -2.806
  216   2HD1  LEU  28          2HD1      LEU  28  -5.165   1.957  -1.105
  217   3HD1  LEU  28          3HD1      LEU  28  -3.680   2.450  -1.919
  218   1HD2  LEU  28          1HD2      LEU  28  -5.659   3.193  -4.520
  219   2HD2  LEU  28          2HD2      LEU  28  -6.834   4.327  -3.854
  220   3HD2  LEU  28          3HD2      LEU  28  -6.965   2.606  -3.490
  221    H    VAL  29           H        VAL  29  -3.006   3.774   0.128
  222    HA   VAL  29           HA       VAL  29  -2.167   6.481  -0.614
  223    HB   VAL  29           HB       VAL  29  -1.082   4.980   1.773
  224   1HG1  VAL  29          1HG1      VAL  29   0.032   7.108   0.119
  225   2HG1  VAL  29          2HG1      VAL  29  -0.023   7.509   1.837
  226   3HG1  VAL  29          3HG1      VAL  29   0.819   6.056   1.295
  227   1HG2  VAL  29          1HG2      VAL  29  -2.993   7.215   1.440
  228   2HG2  VAL  29          2HG2      VAL  29  -2.913   5.967   2.683
  229   3HG2  VAL  29          3HG2      VAL  29  -1.823   7.352   2.752
  230    H    TYR  30           H        TYR  30  -0.751   6.391  -2.220
  231    HA   TYR  30           HA       TYR  30   1.281   4.317  -2.287
  232   1HB   TYR  30          1HB       TYR  30   0.714   3.376  -4.350
  233   2HB   TYR  30          2HB       TYR  30  -0.841   3.531  -3.541
  234    HD1  TYR  30           HD2      TYR  30  -2.394   5.361  -4.200
  235    HD2  TYR  30           HD1      TYR  30   1.186   4.566  -6.357
  236    HE1  TYR  30           HE2      TYR  30  -3.261   6.655  -6.103
  237    HE2  TYR  30           HE1      TYR  30   0.329   5.860  -8.266
  238    HH   TYR  30           HH       TYR  30  -1.827   6.583  -9.181
  239    H    GLN  31           H        GLN  31   3.028   4.795  -3.705
  240    HA   GLN  31           HA       GLN  31   3.015   7.428  -4.974
  241   1HB   GLN  31          1HB       GLN  31   4.917   8.233  -3.852
  242   2HB   GLN  31          2HB       GLN  31   3.909   7.555  -2.580
  243   1HG   GLN  31          1HG       GLN  31   5.956   6.729  -1.999
  244   2HG   GLN  31          2HG       GLN  31   5.337   5.411  -2.992
  245   1HE2  GLN  31          1HE2      GLN  31   7.188   8.421  -3.288
  246   2HE2  GLN  31          2HE2      GLN  31   8.307   7.820  -4.458
  247    H    THR  32           H        THR  32   4.737   7.735  -6.505
  248    HA   THR  32           HA       THR  32   5.573   5.205  -7.706
  249    HB   THR  32           HB       THR  32   6.213   7.724  -9.107
  250    HG1  THR  32           HG1      THR  32   3.526   6.942  -9.246
  251   1HG2  THR  32          1HG2      THR  32   4.852   5.147  -9.900
  252   2HG2  THR  32          2HG2      THR  32   6.541   5.575 -10.179
  253   3HG2  THR  32          3HG2      THR  32   5.259   6.457 -11.007
  254    H    GLU  33           H        GLU  33   7.674   4.626  -8.035
  255    HA   GLU  33           HA       GLU  33   9.770   6.491  -7.168
  256   1HB   GLU  33          1HB       GLU  33   9.044   3.923  -5.951
  257   2HB   GLU  33          2HB       GLU  33  10.751   4.059  -6.349
  258   1HG   GLU  33          1HG       GLU  33  11.098   5.794  -4.878
  259   2HG   GLU  33          2HG       GLU  33   9.402   6.274  -4.880
  260    H    GLN  34           H        GLN  34  11.867   6.055  -8.034
  261    HA   GLN  34           HA       GLN  34  11.728   4.670 -10.611
  262   1HB   GLN  34          1HB       GLN  34  12.847   7.125  -9.793
  263   2HB   GLN  34          2HB       GLN  34  14.203   6.076 -10.184
  264   1HG   GLN  34          1HG       GLN  34  12.164   5.855 -12.192
  265   2HG   GLN  34          2HG       GLN  34  12.612   7.543 -11.948
  266   1HE2  GLN  34          1HE2      GLN  34  13.498   7.514 -14.066
  267   2HE2  GLN  34          2HE2      GLN  34  15.054   6.824 -14.360
  268    H    GLY  35           H        GLY  35  12.989   2.953 -11.122
  269   1HA   GLY  35          1HA       GLY  35  15.399   2.162 -10.121
  270   2HA   GLY  35          2HA       GLY  35  14.242   1.536  -8.955
  271    H    GLU  36           H        GLU  36  15.663  -0.348 -10.050
  272    HA   GLU  36           HA       GLU  36  15.768  -2.114 -11.528
  273   1HB   GLU  36          1HB       GLU  36  13.517  -3.313 -11.615
  274   2HB   GLU  36          2HB       GLU  36  14.196  -3.011 -10.022
  275   1HG   GLU  36          1HG       GLU  36  12.723  -1.114  -9.720
  276   2HG   GLU  36          2HG       GLU  36  12.081  -1.329 -11.348
  277    H    ALA  37           H        ALA  37  16.335  -0.976 -13.439
  278    HA   ALA  37           HA       ALA  37  16.135  -0.497 -15.655
  279   1HB   ALA  37          1HB       ALA  37  15.072  -2.150 -16.679
  280   2HB   ALA  37          2HB       ALA  37  14.254  -2.563 -15.171
  281   3HB   ALA  37          3HB       ALA  37  13.521  -1.409 -16.285
  282    H    GLY  38           H        GLY  38  14.659   0.689 -17.278
  283   1HA   GLY  38          1HA       GLY  38  14.055   3.209 -16.321
  284   2HA   GLY  38          2HA       GLY  38  13.413   2.543 -17.815
  285    H    ASN  39           H        ASN  39  12.060   0.355 -16.308
  286    HA   ASN  39           HA       ASN  39   9.535   1.524 -16.057
  287   1HB   ASN  39          1HB       ASN  39  10.335  -0.998 -14.616
  288   2HB   ASN  39          2HB       ASN  39   8.771  -0.585 -15.312
  289   1HD2  ASN  39          1HD2      ASN  39  10.775  -2.822 -15.705
  290   2HD2  ASN  39          2HD2      ASN  39  10.961  -2.917 -17.420
  291    H    ILE  40           H        ILE  40   8.178   1.452 -14.038
  292    HA   ILE  40           HA       ILE  40   9.746   2.385 -11.722
  293    HB   ILE  40           HB       ILE  40   7.635   3.735 -11.172
  294   1HG1  ILE  40          1HG1      ILE  40   7.179   3.226 -14.120
  295   2HG1  ILE  40          2HG1      ILE  40   6.145   2.686 -12.802
  296   1HG2  ILE  40          1HG2      ILE  40   9.315   4.516 -13.552
  297   2HG2  ILE  40          2HG2      ILE  40   8.383   5.617 -12.538
  298   3HG2  ILE  40          3HG2      ILE  40   9.751   4.737 -11.857
  299   1HD1  ILE  40          1HD1      ILE  40   6.140   5.174 -14.214
  300   2HD1  ILE  40          2HD1      ILE  40   4.982   4.548 -13.040
  301   3HD1  ILE  40          3HD1      ILE  40   6.393   5.454 -12.491
  302    H    HIS  41           H        HIS  41   8.491   2.246  -9.637
  303    HA   HIS  41           HA       HIS  41   6.730  -0.111  -9.601
  304   1HB   HIS  41          1HB       HIS  41   7.918  -0.428  -7.237
  305   2HB   HIS  41          2HB       HIS  41   8.576  -1.131  -8.712
  306    HD1  HIS  41           HD1      HIS  41  11.034  -1.008  -8.325
  307    HD2  HIS  41           HD2      HIS  41   9.126   2.582  -7.470
  308    HE1  HIS  41           HE1      HIS  41  12.876   0.636  -7.850
  309    H    PHE  42           H        PHE  42   5.121  -0.134  -8.024
  310    HA   PHE  42           HA       PHE  42   4.551   2.496  -6.857
  311   1HB   PHE  42          1HB       PHE  42   2.835   0.182  -7.688
  312   2HB   PHE  42          2HB       PHE  42   2.232   1.342  -6.509
  313    HD1  PHE  42           HD1      PHE  42   4.293   1.812  -9.574
  314    HD2  PHE  42           HD2      PHE  42   0.630   2.620  -7.563
  315    HE1  PHE  42           HE1      PHE  42   3.624   3.315 -11.404
  316    HE2  PHE  42           HE2      PHE  42  -0.045   4.123  -9.389
  317    HZ   PHE  42           HZ       PHE  42   1.452   4.472 -11.314
  318    H    GLN  43           H        GLN  43   4.544   2.815  -4.720
  319    HA   GLN  43           HA       GLN  43   4.277   0.552  -2.903
  320   1HB   GLN  43          1HB       GLN  43   6.792   1.431  -3.569
  321   2HB   GLN  43          2HB       GLN  43   6.452   2.352  -2.110
  322   1HG   GLN  43          1HG       GLN  43   6.190   0.410  -0.816
  323   2HG   GLN  43          2HG       GLN  43   6.081  -0.621  -2.242
  324   1HE2  GLN  43          1HE2      GLN  43   8.176   0.090  -3.736
  325   2HE2  GLN  43          2HE2      GLN  43   9.661  -0.195  -2.902
  326    H    GLY  44           H        GLY  44   3.543   1.100  -0.844
  327   1HA   GLY  44          1HA       GLY  44   3.443   3.626   0.298
  328   2HA   GLY  44          2HA       GLY  44   1.997   3.479  -0.691
  329    H    TYR  45           H        TYR  45   0.732   3.642   1.224
  330    HA   TYR  45           HA       TYR  45   0.695   1.151   2.800
  331   1HB   TYR  45          1HB       TYR  45   0.615   3.979   3.647
  332   2HB   TYR  45          2HB       TYR  45  -0.542   2.921   4.446
  333    HD1  TYR  45           HD1      TYR  45   2.953   2.282   3.302
  334    HD2  TYR  45           HD2      TYR  45   0.263   2.544   6.588
  335    HE1  TYR  45           HE1      TYR  45   4.728   1.491   4.810
  336    HE2  TYR  45           HE2      TYR  45   2.031   1.755   8.106
  337    HH   TYR  45           HH       TYR  45   4.367   0.192   7.552
  338    H    ILE  46           H        ILE  46  -1.284   0.224   3.238
  339    HA   ILE  46           HA       ILE  46  -3.678   1.522   2.154
  340    HB   ILE  46           HB       ILE  46  -2.969  -1.351   1.554
  341   1HG1  ILE  46          1HG1      ILE  46  -3.029   1.008  -0.337
  342   2HG1  ILE  46          2HG1      ILE  46  -1.557   0.313   0.333
  343   1HG2  ILE  46          1HG2      ILE  46  -5.346  -1.022   1.733
  344   2HG2  ILE  46          2HG2      ILE  46  -5.267   0.393   0.685
  345   3HG2  ILE  46          3HG2      ILE  46  -4.919  -1.208   0.032
  346   1HD1  ILE  46          1HD1      ILE  46  -1.995  -0.461  -1.940
  347   2HD1  ILE  46          2HD1      ILE  46  -2.022  -1.789  -0.779
  348   3HD1  ILE  46          3HD1      ILE  46  -3.535  -1.138  -1.409
  349    H    GLU  47           H        GLU  47  -5.328   1.417   3.527
  350    HA   GLU  47           HA       GLU  47  -5.210  -0.578   5.690
  351   1HB   GLU  47          1HB       GLU  47  -6.597   2.109   5.651
  352   2HB   GLU  47          2HB       GLU  47  -6.587   0.984   7.002
  353   1HG   GLU  47          1HG       GLU  47  -4.103   1.200   7.064
  354   2HG   GLU  47          2HG       GLU  47  -4.241   2.473   5.853
  355    H    MET  48           H        MET  48  -6.602  -2.193   5.497
  356    HA   MET  48           HA       MET  48  -8.847  -2.031   3.702
  357   1HB   MET  48          1HB       MET  48  -7.819  -4.213   5.515
  358   2HB   MET  48          2HB       MET  48  -9.262  -4.393   4.527
  359   1HG   MET  48          1HG       MET  48  -7.031  -3.440   2.964
  360   2HG   MET  48          2HG       MET  48  -6.647  -4.947   3.793
  361   1HE   MET  48          1HE       MET  48  -9.998  -3.653   1.460
  362   2HE   MET  48          2HE       MET  48  -8.355  -3.037   1.286
  363   3HE   MET  48          3HE       MET  48  -8.985  -4.209   0.128
  364    H    LYS  49           H        LYS  49 -10.924  -3.248   4.679
  365    HA   LYS  49           HA       LYS  49 -12.223  -1.402   6.303
  366   1HB   LYS  49          1HB       LYS  49 -12.943  -3.678   4.891
  367   2HB   LYS  49          2HB       LYS  49 -13.308  -4.097   6.560
  368   1HG   LYS  49          1HG       LYS  49 -14.859  -2.371   6.781
  369   2HG   LYS  49          2HG       LYS  49 -14.242  -1.512   5.368
  370   1HD   LYS  49          1HD       LYS  49 -15.084  -3.286   3.915
  371   2HD   LYS  49          2HD       LYS  49 -15.680  -4.166   5.324
  372   1HE   LYS  49          1HE       LYS  49 -16.926  -1.888   5.787
  373   2HE   LYS  49          2HE       LYS  49 -16.714  -1.681   4.049
  374   1HZ   LYS  49          1HZ       LYS  49 -18.240  -3.759   5.485
  375   2HZ   LYS  49          2HZ       LYS  49 -17.705  -4.020   3.902
  376   3HZ   LYS  49          3HZ       LYS  49 -18.753  -2.735   4.239
  377    H    LYS  50           H        LYS  50 -11.275  -4.713   7.245
  378    HA   LYS  50           HA       LYS  50 -10.064  -3.995   9.664
  379   1HB   LYS  50          1HB       LYS  50 -12.946  -4.028   9.744
  380   2HB   LYS  50          2HB       LYS  50 -12.300  -5.284  10.791
  381   1HG   LYS  50          1HG       LYS  50 -11.069  -3.711  12.067
  382   2HG   LYS  50          2HG       LYS  50 -11.379  -2.425  10.899
  383   1HD   LYS  50          1HD       LYS  50 -13.894  -3.420  11.681
  384   2HD   LYS  50          2HD       LYS  50 -12.945  -3.238  13.159
  385   1HE   LYS  50          1HE       LYS  50 -12.794  -0.972  12.944
  386   2HE   LYS  50          2HE       LYS  50 -12.857  -1.025  11.183
  387   1HZ   LYS  50          1HZ       LYS  50 -14.866  -0.115  12.484
  388   2HZ   LYS  50          2HZ       LYS  50 -15.232  -1.741  12.772
  389   3HZ   LYS  50          3HZ       LYS  50 -15.146  -1.162  11.184
  390    H    ARG  51           H        ARG  51 -12.463  -6.558   9.097
  391    HA   ARG  51           HA       ARG  51 -10.439  -8.557   9.693
  392   1HB   ARG  51          1HB       ARG  51 -12.961  -8.469  10.475
  393   2HB   ARG  51          2HB       ARG  51 -13.239  -9.266   8.932
  394   1HG   ARG  51          1HG       ARG  51 -12.932 -11.132  10.136
  395   2HG   ARG  51          2HG       ARG  51 -11.222 -10.772   9.893
  396   1HD   ARG  51          1HD       ARG  51 -11.077  -9.706  12.033
  397   2HD   ARG  51          2HD       ARG  51 -12.823  -9.810  12.257
  398    HE   ARG  51           HE       ARG  51 -11.682 -12.384  11.894
  399   1HH1  ARG  51          1HH1      ARG  51 -12.067  -9.831  14.229
  400   2HH1  ARG  51          2HH1      ARG  51 -11.953 -10.887  15.597
  401   1HH2  ARG  51          1HH2      ARG  51 -11.531 -13.786  13.688
  402   2HH2  ARG  51          2HH2      ARG  51 -11.647 -13.136  15.288
  403    H    THR  52           H        THR  52  -9.546  -7.544   7.487
  404    HA   THR  52           HA       THR  52 -10.433  -9.354   5.335
  405    HB   THR  52           HB       THR  52  -8.969  -6.872   4.611
  406    HG1  THR  52           HG1      THR  52 -11.707  -6.913   5.410
  407   1HG2  THR  52          1HG2      THR  52  -9.595  -8.413   2.867
  408   2HG2  THR  52          2HG2      THR  52 -10.584  -6.961   2.715
  409   3HG2  THR  52          3HG2      THR  52 -11.268  -8.425   3.421
  410    H    SER  53           H        SER  53  -8.989 -10.896   4.979
  411    HA   SER  53           HA       SER  53  -6.270 -10.672   5.865
  412   1HB   SER  53          1HB       SER  53  -6.160 -12.940   4.517
  413   2HB   SER  53          2HB       SER  53  -7.009 -12.856   6.060
  414    HG   SER  53           HG       SER  53  -8.055 -13.777   3.984
  415    H    LEU  54           H        LEU  54  -4.591 -11.647   4.154
  416    HA   LEU  54           HA       LEU  54  -3.970  -9.625   2.379
  417   1HB   LEU  54          1HB       LEU  54  -2.391 -11.337   3.154
  418   2HB   LEU  54          2HB       LEU  54  -3.218 -12.538   2.164
  419    HG   LEU  54           HG       LEU  54  -2.467 -11.494   0.148
  420   1HD1  LEU  54          1HD1      LEU  54  -1.130  -9.468   0.126
  421   2HD1  LEU  54          2HD1      LEU  54  -1.264  -9.339   1.880
  422   3HD1  LEU  54          3HD1      LEU  54  -2.700  -9.164   0.871
  423   1HD2  LEU  54          1HD2      LEU  54   0.070 -11.447   0.621
  424   2HD2  LEU  54          2HD2      LEU  54  -0.817 -12.948   0.890
  425   3HD2  LEU  54          3HD2      LEU  54  -0.386 -11.920   2.258
  426    H    ALA  55           H        ALA  55  -6.060 -12.379   1.941
  427    HA   ALA  55           HA       ALA  55  -6.207 -12.543  -0.821
  428   1HB   ALA  55          1HB       ALA  55  -8.336 -13.602  -0.533
  429   2HB   ALA  55          2HB       ALA  55  -7.288 -14.096   0.797
  430   3HB   ALA  55          3HB       ALA  55  -8.535 -12.877   1.063
  431    H    GLY  56           H        GLY  56  -7.651 -10.211   1.364
  432   1HA   GLY  56          1HA       GLY  56  -9.471  -9.079  -0.505
  433   2HA   GLY  56          2HA       GLY  56  -8.920  -8.330   0.986
  434    H    MET  57           H        MET  57  -6.212  -8.123   0.544
  435    HA   MET  57           HA       MET  57  -6.114  -5.841  -1.163
  436   1HB   MET  57          1HB       MET  57  -3.884  -7.359   0.203
  437   2HB   MET  57          2HB       MET  57  -3.710  -5.794  -0.578
  438   1HG   MET  57          1HG       MET  57  -5.801  -6.002   1.492
  439   2HG   MET  57          2HG       MET  57  -4.130  -6.102   2.042
  440   1HE   MET  57          1HE       MET  57  -6.507  -2.676   0.417
  441   2HE   MET  57          2HE       MET  57  -5.637  -3.402  -0.934
  442   3HE   MET  57          3HE       MET  57  -6.706  -4.392   0.060
  443    H    LYS  58           H        LYS  58  -4.757  -9.115  -1.352
  444    HA   LYS  58           HA       LYS  58  -3.347  -8.819  -3.743
  445   1HB   LYS  58          1HB       LYS  58  -3.728 -10.852  -1.965
  446   2HB   LYS  58          2HB       LYS  58  -4.647 -11.432  -3.347
  447   1HG   LYS  58          1HG       LYS  58  -2.786 -12.071  -4.353
  448   2HG   LYS  58          2HG       LYS  58  -2.141 -10.431  -4.264
  449   1HD   LYS  58          1HD       LYS  58  -0.608 -11.912  -3.161
  450   2HD   LYS  58          2HD       LYS  58  -1.400 -10.918  -1.936
  451   1HE   LYS  58          1HE       LYS  58  -1.520 -13.011  -0.982
  452   2HE   LYS  58          2HE       LYS  58  -3.075 -12.910  -1.805
  453   1HZ   LYS  58          1HZ       LYS  58  -2.524 -14.542  -3.210
  454   2HZ   LYS  58          2HZ       LYS  58  -1.336 -14.938  -2.073
  455   3HZ   LYS  58          3HZ       LYS  58  -0.938 -13.991  -3.417
  456    H    LYS  59           H        LYS  59  -6.745  -9.294  -3.138
  457    HA   LYS  59           HA       LYS  59  -7.571 -10.192  -5.654
  458   1HB   LYS  59          1HB       LYS  59  -8.821  -9.016  -3.290
  459   2HB   LYS  59          2HB       LYS  59  -9.641  -8.577  -4.783
  460   1HG   LYS  59          1HG       LYS  59  -8.948 -11.429  -4.207
  461   2HG   LYS  59          2HG       LYS  59 -10.393 -10.688  -3.517
  462   1HD   LYS  59          1HD       LYS  59 -11.431 -10.498  -5.547
  463   2HD   LYS  59          2HD       LYS  59  -9.910 -10.359  -6.432
  464   1HE   LYS  59          1HE       LYS  59  -9.516 -12.692  -6.294
  465   2HE   LYS  59          2HE       LYS  59 -10.801 -12.909  -5.107
  466   1HZ   LYS  59          1HZ       LYS  59 -12.401 -12.850  -6.689
  467   2HZ   LYS  59          2HZ       LYS  59 -11.143 -13.434  -7.657
  468   3HZ   LYS  59          3HZ       LYS  59 -11.549 -11.793  -7.698
  469    H    LEU  60           H        LEU  60  -6.751  -6.993  -4.503
  470    HA   LEU  60           HA       LEU  60  -7.769  -5.662  -6.852
  471   1HB   LEU  60          1HB       LEU  60  -6.195  -4.781  -4.456
  472   2HB   LEU  60          2HB       LEU  60  -6.453  -3.708  -5.830
  473    HG   LEU  60           HG       LEU  60  -8.961  -4.164  -5.437
  474   1HD1  LEU  60          1HD1      LEU  60  -9.468  -5.586  -3.814
  475   2HD1  LEU  60          2HD1      LEU  60  -8.821  -4.424  -2.656
  476   3HD1  LEU  60          3HD1      LEU  60  -7.782  -5.692  -3.307
  477   1HD2  LEU  60          1HD2      LEU  60  -8.086  -2.632  -3.123
  478   2HD2  LEU  60          2HD2      LEU  60  -8.989  -2.117  -4.548
  479   3HD2  LEU  60          3HD2      LEU  60  -7.227  -2.194  -4.599
  480    H    ILE  61           H        ILE  61  -4.638  -6.707  -5.616
  481    HA   ILE  61           HA       ILE  61  -3.525  -6.319  -8.302
  482    HB   ILE  61           HB       ILE  61  -2.092  -5.518  -5.766
  483   1HG1  ILE  61          1HG1      ILE  61  -2.209  -3.299  -7.375
  484   2HG1  ILE  61          2HG1      ILE  61  -3.776  -4.043  -7.672
  485   1HG2  ILE  61          1HG2      ILE  61  -1.222  -5.988  -8.531
  486   2HG2  ILE  61          2HG2      ILE  61  -0.660  -4.476  -7.818
  487   3HG2  ILE  61          3HG2      ILE  61  -0.299  -6.011  -7.028
  488   1HD1  ILE  61          1HD1      ILE  61  -3.549  -4.162  -4.941
  489   2HD1  ILE  61          2HD1      ILE  61  -2.798  -2.617  -5.342
  490   3HD1  ILE  61          3HD1      ILE  61  -4.450  -2.955  -5.859
  491    HA   PRO  62           HA       PRO  62  -2.659 -10.547  -6.604
  492   1HB   PRO  62          1HB       PRO  62  -3.308 -11.848  -8.896
  493   2HB   PRO  62          2HB       PRO  62  -4.501 -11.419  -7.664
  494   1HG   PRO  62          1HG       PRO  62  -3.844 -10.027 -10.232
  495   2HG   PRO  62          2HG       PRO  62  -5.431 -10.362  -9.516
  496   1HD   PRO  62          1HD       PRO  62  -4.236  -7.938  -9.342
  497   2HD   PRO  62          2HD       PRO  62  -5.293  -8.575  -8.066
  498    H    GLY  63           H        GLY  63  -0.448 -10.389  -6.516
  499   1HA   GLY  63          1HA       GLY  63   1.406 -11.574  -7.739
  500   2HA   GLY  63          2HA       GLY  63   0.989 -10.536  -9.094
  501    H    ALA  64           H        ALA  64   1.599 -10.062  -5.610
  502    HA   ALA  64           HA       ALA  64   3.878  -8.382  -6.184
  503   1HB   ALA  64          1HB       ALA  64   2.973  -6.368  -5.924
  504   2HB   ALA  64          2HB       ALA  64   1.395  -7.148  -6.051
  505   3HB   ALA  64          3HB       ALA  64   2.115  -6.867  -4.465
  506    H    HIS  65           H        HIS  65   4.724  -7.411  -4.044
  507    HA   HIS  65           HA       HIS  65   4.695  -9.569  -2.076
  508   1HB   HIS  65          1HB       HIS  65   6.830  -8.502  -3.066
  509   2HB   HIS  65          2HB       HIS  65   6.489  -7.154  -1.985
  510    HD1  HIS  65           HD1      HIS  65   9.042  -8.407  -1.373
  511    HD2  HIS  65           HD2      HIS  65   5.494  -9.983   0.107
  512    HE1  HIS  65           HE1      HIS  65   9.699  -9.783   0.627
  513    H    PHE  66           H        PHE  66   3.293  -9.418  -0.462
  514    HA   PHE  66           HA       PHE  66   2.647  -6.746   0.596
  515   1HB   PHE  66          1HB       PHE  66   1.005  -9.141   0.056
  516   2HB   PHE  66          2HB       PHE  66   0.664  -8.322   1.576
  517    HD1  PHE  66           HD1      PHE  66   0.799  -7.899  -2.084
  518    HD2  PHE  66           HD2      PHE  66  -0.480  -6.256   1.628
  519    HE1  PHE  66           HE1      PHE  66  -0.558  -6.238  -3.291
  520    HE2  PHE  66           HE2      PHE  66  -1.839  -4.594   0.428
  521    HZ   PHE  66           HZ       PHE  66  -1.880  -4.583  -2.034
  522    H    GLU  67           H        GLU  67   2.237  -6.604   2.910
  523    HA   GLU  67           HA       GLU  67   3.326  -8.738   4.562
  524   1HB   GLU  67          1HB       GLU  67   4.771  -6.287   3.924
  525   2HB   GLU  67          2HB       GLU  67   4.557  -6.508   5.654
  526   1HG   GLU  67          1HG       GLU  67   5.756  -8.501   5.674
  527   2HG   GLU  67          2HG       GLU  67   5.592  -8.726   3.934
  528    H    LYS  68           H        LYS  68   1.798  -9.032   6.035
  529    HA   LYS  68           HA       LYS  68   0.414  -6.672   7.127
  530   1HB   LYS  68          1HB       LYS  68  -1.195  -8.702   7.866
  531   2HB   LYS  68          2HB       LYS  68  -1.374  -7.829   6.349
  532   1HG   LYS  68          1HG       LYS  68  -0.490  -9.551   5.097
  533   2HG   LYS  68          2HG       LYS  68   0.376 -10.243   6.470
  534   1HD   LYS  68          1HD       LYS  68  -2.336 -10.322   7.167
  535   2HD   LYS  68          2HD       LYS  68  -2.262 -10.840   5.481
  536   1HE   LYS  68          1HE       LYS  68  -0.421 -11.963   7.573
  537   2HE   LYS  68          2HE       LYS  68  -2.026 -12.634   7.290
  538   1HZ   LYS  68          1HZ       LYS  68  -0.218 -12.262   5.008
  539   2HZ   LYS  68          2HZ       LYS  68  -1.442 -13.407   5.232
  540   3HZ   LYS  68          3HZ       LYS  68   0.034 -13.578   6.041
  541    H    ARG  69           H        ARG  69   2.863  -8.635   7.857
  542    HA   ARG  69           HA       ARG  69   2.457  -9.783  10.310
  543   1HB   ARG  69          1HB       ARG  69   4.637  -9.341   8.746
  544   2HB   ARG  69          2HB       ARG  69   4.977  -8.265  10.095
  545   1HG   ARG  69          1HG       ARG  69   4.506 -10.281  11.591
  546   2HG   ARG  69          2HG       ARG  69   4.638 -11.241  10.116
  547   1HD   ARG  69          1HD       ARG  69   6.837 -11.280  10.463
  548   2HD   ARG  69          2HD       ARG  69   6.849  -9.566  10.049
  549    HE   ARG  69           HE       ARG  69   7.172  -9.062  12.263
  550   1HH1  ARG  69          1HH1      ARG  69   6.222 -12.397  11.960
  551   2HH1  ARG  69          2HH1      ARG  69   6.548 -12.776  13.619
  552   1HH2  ARG  69          1HH2      ARG  69   7.604  -9.548  14.450
  553   2HH2  ARG  69          2HH2      ARG  69   7.332 -11.155  15.035
  554    H    ARG  70           H        ARG  70   3.627  -6.450   9.796
  555    HA   ARG  70           HA       ARG  70   2.153  -5.591  12.157
  556   1HB   ARG  70          1HB       ARG  70   4.981  -6.055  12.174
  557   2HB   ARG  70          2HB       ARG  70   4.682  -4.331  12.353
  558   1HG   ARG  70          1HG       ARG  70   3.001  -6.068  14.022
  559   2HG   ARG  70          2HG       ARG  70   4.726  -6.095  14.394
  560   1HD   ARG  70          1HD       ARG  70   4.539  -3.515  14.300
  561   2HD   ARG  70          2HD       ARG  70   2.808  -3.797  14.478
  562    HE   ARG  70           HE       ARG  70   3.157  -4.383  16.669
  563   1HH1  ARG  70          1HH1      ARG  70   6.206  -4.303  14.990
  564   2HH1  ARG  70          2HH1      ARG  70   7.152  -4.478  16.430
  565   1HH2  ARG  70          1HH2      ARG  70   4.392  -4.614  18.573
  566   2HH2  ARG  70          2HH2      ARG  70   6.120  -4.656  18.468
  567    H    GLY  71           H        GLY  71   2.616  -5.173   9.063
  568   1HA   GLY  71          1HA       GLY  71   2.491  -3.424   7.573
  569   2HA   GLY  71          2HA       GLY  71   1.500  -2.674   8.815
  570    H    THR  72           H        THR  72   4.799  -3.443   9.522
  571    HA   THR  72           HA       THR  72   6.526  -2.101  10.186
  572    HB   THR  72           HB       THR  72   6.270  -0.085   8.118
  573    HG1  THR  72           HG1      THR  72   6.415  -1.628   6.369
  574   1HG2  THR  72          1HG2      THR  72   8.375  -1.547   7.379
  575   2HG2  THR  72          2HG2      THR  72   8.209  -2.136   9.034
  576   3HG2  THR  72          3HG2      THR  72   8.441  -0.415   8.729
  577    H    GLN  73           H        GLN  73   3.876  -1.400  11.227
  578    HA   GLN  73           HA       GLN  73   3.300   1.298  11.248
  579   1HB   GLN  73          1HB       GLN  73   2.283   0.908  13.470
  580   2HB   GLN  73          2HB       GLN  73   1.835  -0.320  12.294
  581   1HG   GLN  73          1HG       GLN  73   2.651  -1.938  13.563
  582   2HG   GLN  73          2HG       GLN  73   4.198  -1.108  13.731
  583   1HE2  GLN  73          1HE2      GLN  73   4.420   0.449  15.424
  584   2HE2  GLN  73          2HE2      GLN  73   3.461   0.321  16.855
  585    H    GLY  74           H        GLY  74   4.066   3.081  12.276
  586   1HA   GLY  74          1HA       GLY  74   5.312   3.823  14.354
  587   2HA   GLY  74          2HA       GLY  74   6.563   2.716  13.808
  588    H    GLU  75           H        GLU  75   8.233   3.835  13.065
  589    HA   GLU  75           HA       GLU  75   8.180   6.492  12.222
  590   1HB   GLU  75          1HB       GLU  75  10.152   4.762  12.808
  591   2HB   GLU  75          2HB       GLU  75  10.261   4.730  11.054
  592   1HG   GLU  75          1HG       GLU  75  10.702   7.051  10.946
  593   2HG   GLU  75          2HG       GLU  75  10.283   7.278  12.643
  594    H    ALA  76           H        ALA  76   7.485   3.568  10.504
  595    HA   ALA  76           HA       ALA  76   7.894   4.444   7.865
  596   1HB   ALA  76          1HB       ALA  76   7.488   2.078   8.652
  597   2HB   ALA  76          2HB       ALA  76   5.773   2.488   8.715
  598   3HB   ALA  76          3HB       ALA  76   6.641   2.560   7.181
  599    H    ARG  77           H        ARG  77   5.559   5.344  10.173
  600    HA   ARG  77           HA       ARG  77   3.390   5.965   8.461
  601   1HB   ARG  77          1HB       ARG  77   3.644   5.843  11.124
  602   2HB   ARG  77          2HB       ARG  77   3.819   7.580  10.917
  603   1HG   ARG  77          1HG       ARG  77   1.596   7.641  11.021
  604   2HG   ARG  77          2HG       ARG  77   1.633   7.024   9.368
  605   1HD   ARG  77          1HD       ARG  77   1.214   4.838  10.043
  606   2HD   ARG  77          2HD       ARG  77   1.736   5.148  11.698
  607    HE   ARG  77           HE       ARG  77  -0.375   5.901  12.196
  608   1HH1  ARG  77          1HH1      ARG  77  -0.021   5.624   8.744
  609   2HH1  ARG  77          2HH1      ARG  77  -1.703   5.883   8.419
  610   1HH2  ARG  77          1HH2      ARG  77  -2.592   6.243  11.781
  611   2HH2  ARG  77          2HH2      ARG  77  -3.164   6.236  10.148
  612    H    ALA  78           H        ALA  78   6.417   7.439   8.956
  613    HA   ALA  78           HA       ALA  78   5.480   9.898   7.625
  614   1HB   ALA  78          1HB       ALA  78   7.274   9.486   9.905
  615   2HB   ALA  78          2HB       ALA  78   7.881  10.609   8.687
  616   3HB   ALA  78          3HB       ALA  78   6.317  10.896   9.451
  617    H    TYR  79           H        TYR  79   8.273   7.717   7.961
  618    HA   TYR  79           HA       TYR  79   9.813   8.697   5.871
  619   1HB   TYR  79          1HB       TYR  79  11.081   7.152   6.914
  620   2HB   TYR  79          2HB       TYR  79   9.680   6.218   7.428
  621    HD1  TYR  79           HD1      TYR  79  11.682   6.951   4.361
  622    HD2  TYR  79           HD2      TYR  79   9.339   4.122   6.508
  623    HE1  TYR  79           HE1      TYR  79  12.210   5.242   2.673
  624    HE2  TYR  79           HE2      TYR  79   9.861   2.405   4.826
  625    HH   TYR  79           HH       TYR  79  10.811   1.988   2.854
  626    H    SER  80           H        SER  80   7.045   6.554   5.819
  627    HA   SER  80           HA       SER  80   5.883   5.563   4.123
  628   1HB   SER  80          1HB       SER  80   5.904   7.144   1.977
  629   2HB   SER  80          2HB       SER  80   5.024   7.582   3.441
  630    HG   SER  80           HG       SER  80   6.318   9.306   2.729
  631    H    MET  81           H        MET  81   7.899   7.106   1.740
  632    HA   MET  81           HA       MET  81   9.093   4.487   1.105
  633   1HB   MET  81          1HB       MET  81   7.733   6.488  -0.590
  634   2HB   MET  81          2HB       MET  81   9.205   5.802  -1.264
  635   1HG   MET  81          1HG       MET  81   7.172   4.601  -1.951
  636   2HG   MET  81          2HG       MET  81   8.320   3.581  -1.086
  637   1HE   MET  81          1HE       MET  81   4.736   5.410  -0.802
  638   2HE   MET  81          2HE       MET  81   4.613   5.393   0.957
  639   3HE   MET  81          3HE       MET  81   5.913   6.291   0.173
  640    H    LYS  82           H        LYS  82  11.022   4.949  -0.556
  641    HA   LYS  82           HA       LYS  82  12.942   6.463   0.976
  642   1HB   LYS  82          1HB       LYS  82  13.010   4.438  -1.152
  643   2HB   LYS  82          2HB       LYS  82  14.274   5.654  -1.279
  644   1HG   LYS  82          1HG       LYS  82  13.788   4.319   1.342
  645   2HG   LYS  82          2HG       LYS  82  14.675   3.466   0.076
  646   1HD   LYS  82          1HD       LYS  82  16.183   5.466  -0.082
  647   2HD   LYS  82          2HD       LYS  82  15.375   6.106   1.352
  648   1HE   LYS  82          1HE       LYS  82  16.047   3.489   2.020
  649   2HE   LYS  82          2HE       LYS  82  17.445   4.097   1.135
  650   1HZ   LYS  82          1HZ       LYS  82  17.516   4.500   3.568
  651   2HZ   LYS  82          2HZ       LYS  82  16.183   5.529   3.406
  652   3HZ   LYS  82          3HZ       LYS  82  17.643   5.910   2.641
  653    H    GLU  83           H        GLU  83  13.187   8.576   0.715
  654    HA   GLU  83           HA       GLU  83  12.144  10.039  -1.459
  655   1HB   GLU  83          1HB       GLU  83  13.895  10.656   0.872
  656   2HB   GLU  83          2HB       GLU  83  13.843  11.816  -0.448
  657   1HG   GLU  83          1HG       GLU  83  11.192  10.964   0.316
  658   2HG   GLU  83          2HG       GLU  83  12.083  11.631   1.682
  659    H    ASP  84           H        ASP  84  15.311   8.691  -0.796
  660    HA   ASP  84           HA       ASP  84  16.837  10.054  -2.683
  661   1HB   ASP  84          1HB       ASP  84  17.087   7.181  -1.766
  662   2HB   ASP  84          2HB       ASP  84  18.329   8.073  -2.640
  663    H    THR  85           H        THR  85  14.687   7.296  -3.057
  664    HA   THR  85           HA       THR  85  15.196   7.342  -5.958
  665    HB   THR  85           HB       THR  85  14.025   5.049  -5.875
  666    HG1  THR  85           HG1      THR  85  13.251   5.005  -3.797
  667   1HG2  THR  85          1HG2      THR  85  16.503   5.526  -6.187
  668   2HG2  THR  85          2HG2      THR  85  16.085   3.928  -5.568
  669   3HG2  THR  85          3HG2      THR  85  16.684   5.170  -4.469
  670    H    ARG  86           H        ARG  86  13.185   8.717  -3.919
  671    HA   ARG  86           HA       ARG  86  10.600   7.957  -4.753
  672   1HB   ARG  86          1HB       ARG  86  10.862   9.203  -2.719
  673   2HB   ARG  86          2HB       ARG  86  11.650  10.527  -3.567
  674   1HG   ARG  86          1HG       ARG  86   9.665  11.285  -4.494
  675   2HG   ARG  86          2HG       ARG  86   8.848   9.740  -4.251
  676   1HD   ARG  86          1HD       ARG  86   8.351  10.189  -2.080
  677   2HD   ARG  86          2HD       ARG  86   9.816  11.137  -1.829
  678    HE   ARG  86           HE       ARG  86   7.872  12.384  -3.554
  679   1HH1  ARG  86          1HH1      ARG  86   8.973  11.954  -0.279
  680   2HH1  ARG  86          2HH1      ARG  86   8.254  13.423   0.294
  681   1HH2  ARG  86          1HH2      ARG  86   6.920  14.319  -2.812
  682   2HH2  ARG  86          2HH2      ARG  86   7.085  14.767  -1.148
  683    H    LEU  87           H        LEU  87   9.570   8.300  -6.604
  684    HA   LEU  87           HA       LEU  87  10.701  10.226  -8.505
  685   1HB   LEU  87          1HB       LEU  87   9.846   7.599  -8.792
  686   2HB   LEU  87          2HB       LEU  87   8.561   8.558  -9.523
  687    HG   LEU  87           HG       LEU  87  11.464   8.451 -10.320
  688   1HD1  LEU  87          1HD1      LEU  87   8.878   7.559 -11.531
  689   2HD1  LEU  87          2HD1      LEU  87  10.386   6.666 -11.330
  690   3HD1  LEU  87          3HD1      LEU  87  10.268   7.934 -12.550
  691   1HD2  LEU  87          1HD2      LEU  87  10.711  10.064 -12.125
  692   2HD2  LEU  87          2HD2      LEU  87  10.919  10.736 -10.508
  693   3HD2  LEU  87          3HD2      LEU  87   9.300  10.381 -11.115
  694    H    GLU  88           H        GLU  88   7.473   9.055  -7.526
  695    HA   GLU  88           HA       GLU  88   6.500  11.820  -7.795
  696   1HB   GLU  88          1HB       GLU  88   5.749   9.636  -9.390
  697   2HB   GLU  88          2HB       GLU  88   4.413   9.883  -8.275
  698   1HG   GLU  88          1HG       GLU  88   3.975  12.015  -9.065
  699   2HG   GLU  88          2HG       GLU  88   5.581  12.190  -9.769
  700    H    GLY  89           H        GLY  89   4.214  11.967  -6.723
  701   1HA   GLY  89          1HA       GLY  89   2.815  11.509  -4.902
  702   2HA   GLY  89          2HA       GLY  89   3.937  10.260  -4.383
  703    HA   PRO  90           HA       PRO  90   3.381  10.032  -2.407
  704   1HB   PRO  90          1HB       PRO  90   2.091  10.851  -0.163
  705   2HB   PRO  90          2HB       PRO  90   3.780  10.330  -0.165
  706   1HG   PRO  90          1HG       PRO  90   2.654  13.103  -0.198
  707   2HG   PRO  90          2HG       PRO  90   4.014  12.460   0.740
  708   1HD   PRO  90          1HD       PRO  90   4.360  13.912  -1.519
  709   2HD   PRO  90          2HD       PRO  90   5.476  12.620  -1.035
  710    H    TRP  91           H        TRP  91   1.044   9.481  -2.021
  711    HA   TRP  91           HA       TRP  91  -0.818  11.521  -2.991
  712   1HB   TRP  91          1HB       TRP  91  -0.311   8.844  -4.279
  713   2HB   TRP  91          2HB       TRP  91  -1.832   9.706  -4.494
  714    HD1  TRP  91           HD1      TRP  91  -0.627  12.652  -4.823
  715    HE1  TRP  91           HE1      TRP  91   0.618  13.258  -6.993
  716    HE3  TRP  91           HE3      TRP  91   0.582   7.944  -6.405
  717    HZ2  TRP  91           HZ2      TRP  91   1.937  11.916  -9.098
  718    HZ3  TRP  91           HZ3      TRP  91   1.836   7.692  -8.507
  719    HH2  TRP  91           HH2      TRP  91   2.498   9.638  -9.824
  720    H    GLU  92           H        GLU  92  -2.771  11.446  -2.031
  721    HA   GLU  92           HA       GLU  92  -3.346   9.114  -0.322
  722   1HB   GLU  92          1HB       GLU  92  -3.970  12.033   0.146
  723   2HB   GLU  92          2HB       GLU  92  -4.611  10.723   1.128
  724   1HG   GLU  92          1HG       GLU  92  -2.428  10.127   1.885
  725   2HG   GLU  92          2HG       GLU  92  -1.675  11.250   0.754
  726    H    TYR  93           H        TYR  93  -5.331   8.195  -0.438
  727    HA   TYR  93           HA       TYR  93  -7.430   9.530  -1.977
  728   1HB   TYR  93          1HB       TYR  93  -6.237   6.836  -2.613
  729   2HB   TYR  93          2HB       TYR  93  -7.855   7.286  -3.138
  730    HD1  TYR  93           HD1      TYR  93  -8.180   9.015  -4.831
  731    HD2  TYR  93           HD2      TYR  93  -4.277   7.836  -3.617
  732    HE1  TYR  93           HE1      TYR  93  -7.235  10.129  -6.810
  733    HE2  TYR  93           HE2      TYR  93  -3.320   8.948  -5.592
  734    HH   TYR  93           HH       TYR  93  -4.028  10.866  -7.148
  735    H    GLY  94           H        GLY  94  -9.546   8.426  -1.763
  736   1HA   GLY  94          1HA       GLY  94 -11.177   7.325  -0.554
  737   2HA   GLY  94          2HA       GLY  94  -9.903   6.464   0.297
  738    H    GLU  95           H        GLU  95 -10.684   6.681   2.351
  739    HA   GLU  95           HA       GLU  95 -11.763   9.040   3.437
  740   1HB   GLU  95          1HB       GLU  95 -11.774   7.934   5.500
  741   2HB   GLU  95          2HB       GLU  95 -11.913   6.634   4.325
  742   1HG   GLU  95          1HG       GLU  95 -10.311   5.724   5.622
  743   2HG   GLU  95          2HG       GLU  95  -9.264   6.672   4.567
  Start of MODEL   28
    1   1H    ALA   2          1H        ALA   2  -9.141   1.474  23.046
    2    HA   ALA   2           HA       ALA   2  -8.015   1.791  20.619
    3   1HB   ALA   2          1HB       ALA   2  -7.059  -0.650  21.939
    4   2HB   ALA   2          2HB       ALA   2  -6.190   0.820  21.496
    5   3HB   ALA   2          3HB       ALA   2  -7.145   0.773  22.977
    6    H    ARG   3           H        ARG   3  -8.537   1.078  18.667
    7    HA   ARG   3           HA       ARG   3  -8.806  -1.718  18.116
    8   1HB   ARG   3          1HB       ARG   3 -11.096  -1.501  17.099
    9   2HB   ARG   3          2HB       ARG   3 -11.056  -1.429  18.856
   10   1HG   ARG   3          1HG       ARG   3 -10.841   1.192  17.613
   11   2HG   ARG   3          2HG       ARG   3 -12.329   0.342  17.192
   12   1HD   ARG   3          1HD       ARG   3 -13.101   0.342  19.343
   13   2HD   ARG   3          2HD       ARG   3 -11.480   0.336  20.037
   14    HE   ARG   3           HE       ARG   3 -11.861   2.786  18.758
   15   1HH1  ARG   3          1HH1      ARG   3 -13.114   1.011  21.478
   16   2HH1  ARG   3          2HH1      ARG   3 -13.518   2.431  22.385
   17   1HH2  ARG   3          1HH2      ARG   3 -12.388   4.663  19.942
   18   2HH2  ARG   3          2HH2      ARG   3 -13.105   4.508  21.510
   19    H    GLN   4           H        GLN   4  -6.902  -0.593  16.998
   20    HA   GLN   4           HA       GLN   4  -7.783   0.456  14.390
   21   1HB   GLN   4          1HB       GLN   4  -5.770   1.377  16.255
   22   2HB   GLN   4          2HB       GLN   4  -5.062   1.040  14.681
   23   1HG   GLN   4          1HG       GLN   4  -6.214   2.707  13.645
   24   2HG   GLN   4          2HG       GLN   4  -7.572   2.617  14.766
   25   1HE2  GLN   4          1HE2      GLN   4  -5.205   4.564  13.775
   26   2HE2  GLN   4          2HE2      GLN   4  -4.915   5.475  15.214
   27    H    VAL   5           H        VAL   5  -6.660  -0.239  12.516
   28    HA   VAL   5           HA       VAL   5  -5.438  -2.894  12.833
   29    HB   VAL   5           HB       VAL   5  -6.018  -3.302  10.500
   30   1HG1  VAL   5          1HG1      VAL   5  -7.858  -4.102  11.474
   31   2HG1  VAL   5          2HG1      VAL   5  -7.953  -2.739  12.590
   32   3HG1  VAL   5          3HG1      VAL   5  -8.650  -2.608  10.975
   33   1HG2  VAL   5          1HG2      VAL   5  -6.473  -1.678   9.051
   34   2HG2  VAL   5          2HG2      VAL   5  -7.779  -1.064  10.065
   35   3HG2  VAL   5          3HG2      VAL   5  -6.124  -0.514  10.330
   36    H    ILE   6           H        ILE   6  -3.672  -3.470  11.392
   37    HA   ILE   6           HA       ILE   6  -1.769  -1.292  11.165
   38    HB   ILE   6           HB       ILE   6  -1.375  -4.219  10.536
   39   1HG1  ILE   6          1HG1      ILE   6  -0.055  -3.918  12.827
   40   2HG1  ILE   6          2HG1      ILE   6  -1.260  -2.659  13.076
   41   1HG2  ILE   6          1HG2      ILE   6   1.058  -3.372  11.159
   42   2HG2  ILE   6          2HG2      ILE   6   0.421  -3.257   9.520
   43   3HG2  ILE   6          3HG2      ILE   6   0.402  -1.844  10.574
   44   1HD1  ILE   6          1HD1      ILE   6  -1.741  -5.005  13.973
   45   2HD1  ILE   6          2HD1      ILE   6  -3.017  -4.178  13.078
   46   3HD1  ILE   6          3HD1      ILE   6  -2.060  -5.433  12.292
   47    H    CYS   7           H        CYS   7  -0.661  -0.735   9.259
   48    HA   CYS   7           HA       CYS   7  -2.281  -0.866   6.889
   49   1HB   CYS   7          1HB       CYS   7   0.517   0.230   6.985
   50   2HB   CYS   7          2HB       CYS   7  -0.831   0.741   5.976
   51    HG   CYS   7           HG       CYS   7  -1.596   2.654   7.498
   52    H    TRP   8           H        TRP   8  -1.478  -1.561   4.796
   53    HA   TRP   8           HA       TRP   8   0.241  -3.934   5.049
   54   1HB   TRP   8          1HB       TRP   8  -1.916  -3.250   3.045
   55   2HB   TRP   8          2HB       TRP   8  -0.850  -4.644   2.893
   56    HD1  TRP   8           HD1      TRP   8  -3.250  -3.247   5.621
   57    HE1  TRP   8           HE1      TRP   8  -4.487  -5.244   6.673
   58    HE3  TRP   8           HE3      TRP   8  -1.048  -7.039   2.994
   59    HZ2  TRP   8           HZ2      TRP   8  -4.524  -8.055   6.422
   60    HZ3  TRP   8           HZ3      TRP   8  -1.740  -9.354   3.461
   61    HH2  TRP   8           HH2      TRP   8  -3.442  -9.849   5.140
   62    H    CYS   9           H        CYS   9   2.250  -3.662   4.357
   63    HA   CYS   9           HA       CYS   9   2.822  -1.615   2.350
   64   1HB   CYS   9          1HB       CYS   9   5.208  -2.037   2.981
   65   2HB   CYS   9          2HB       CYS   9   4.201  -1.486   4.315
   66    HG   CYS   9           HG       CYS   9   4.164  -4.764   4.259
   67    H    PHE  10           H        PHE  10   2.948  -2.183   0.292
   68    HA   PHE  10           HA       PHE  10   4.070  -4.815  -0.383
   69   1HB   PHE  10          1HB       PHE  10   2.364  -5.344  -1.864
   70   2HB   PHE  10          2HB       PHE  10   1.473  -4.551  -0.569
   71    HD1  PHE  10           HD2      PHE  10   0.615  -2.274  -0.866
   72    HD2  PHE  10           HD1      PHE  10   2.537  -4.371  -4.033
   73    HE1  PHE  10           HE2      PHE  10  -0.312  -0.671  -2.486
   74    HE2  PHE  10           HE1      PHE  10   1.613  -2.771  -5.658
   75    HZ   PHE  10           HZ       PHE  10   0.185  -0.919  -4.885
   76    H    THR  11           H        THR  11   4.794  -4.938  -2.677
   77    HA   THR  11           HA       THR  11   5.594  -2.323  -3.755
   78    HB   THR  11           HB       THR  11   7.486  -4.669  -3.711
   79    HG1  THR  11           HG1      THR  11   8.324  -3.915  -1.841
   80   1HG2  THR  11          1HG2      THR  11   9.014  -2.460  -3.817
   81   2HG2  THR  11          2HG2      THR  11   7.566  -1.857  -4.623
   82   3HG2  THR  11          3HG2      THR  11   8.399  -3.277  -5.253
   83    H    LEU  12           H        LEU  12   5.232  -2.119  -5.871
   84    HA   LEU  12           HA       LEU  12   4.829  -4.570  -7.456
   85   1HB   LEU  12          1HB       LEU  12   2.696  -3.643  -7.261
   86   2HB   LEU  12          2HB       LEU  12   3.301  -1.994  -7.412
   87    HG   LEU  12           HG       LEU  12   3.573  -2.213  -9.757
   88   1HD1  LEU  12          1HD1      LEU  12   4.379  -4.185 -10.445
   89   2HD1  LEU  12          2HD1      LEU  12   2.684  -4.648 -10.592
   90   3HD1  LEU  12          3HD1      LEU  12   3.591  -5.075  -9.142
   91   1HD2  LEU  12          1HD2      LEU  12   1.272  -2.999 -10.466
   92   2HD2  LEU  12          2HD2      LEU  12   1.322  -1.737  -9.235
   93   3HD2  LEU  12          3HD2      LEU  12   0.994  -3.407  -8.773
   94    H    ASN  13           H        ASN  13   6.254  -4.811  -9.034
   95    HA   ASN  13           HA       ASN  13   7.719  -2.455  -9.992
   96   1HB   ASN  13          1HB       ASN  13   9.455  -3.953 -10.696
   97   2HB   ASN  13          2HB       ASN  13   8.996  -4.411  -9.058
   98   1HD2  ASN  13          1HD2      ASN  13   7.838  -6.318  -8.726
   99   2HD2  ASN  13          2HD2      ASN  13   7.778  -7.565  -9.921
  100    H    ASN  14           H        ASN  14   7.714  -1.848 -12.102
  101    HA   ASN  14           HA       ASN  14   6.855  -1.570 -14.196
  102   1HB   ASN  14          1HB       ASN  14   7.034  -4.590 -14.267
  103   2HB   ASN  14          2HB       ASN  14   7.004  -3.510 -15.658
  104   1HD2  ASN  14          1HD2      ASN  14   9.005  -5.454 -14.945
  105   2HD2  ASN  14          2HD2      ASN  14  10.489  -4.591 -14.750
  106    HA   PRO  15           HA       PRO  15   2.572  -2.796 -12.743
  107   1HB   PRO  15          1HB       PRO  15   1.626  -0.260 -12.526
  108   2HB   PRO  15          2HB       PRO  15   2.449  -1.095 -11.203
  109   1HG   PRO  15          1HG       PRO  15   3.532   0.914 -13.141
  110   2HG   PRO  15          2HG       PRO  15   3.794   0.792 -11.391
  111   1HD   PRO  15          1HD       PRO  15   5.609  -0.082 -13.200
  112   2HD   PRO  15          2HD       PRO  15   5.390  -0.856 -11.617
  113    H    LEU  16           H        LEU  16   0.601  -2.552 -13.915
  114    HA   LEU  16           HA       LEU  16   1.025  -1.706 -16.695
  115   1HB   LEU  16          1HB       LEU  16  -0.818  -3.683 -15.401
  116   2HB   LEU  16          2HB       LEU  16  -1.151  -3.056 -17.014
  117    HG   LEU  16           HG       LEU  16   1.555  -4.152 -16.626
  118   1HD1  LEU  16          1HD1      LEU  16  -0.789  -6.033 -16.766
  119   2HD1  LEU  16          2HD1      LEU  16   0.089  -5.679 -15.279
  120   3HD1  LEU  16          3HD1      LEU  16   0.922  -6.440 -16.635
  121   1HD2  LEU  16          1HD2      LEU  16   0.735  -3.370 -18.788
  122   2HD2  LEU  16          2HD2      LEU  16  -0.584  -4.538 -18.719
  123   3HD2  LEU  16          3HD2      LEU  16   1.085  -5.098 -18.828
  124    H    SER  17           H        SER  17  -0.345  -0.616 -13.882
  125    HA   SER  17           HA       SER  17  -1.564   1.614 -15.035
  126   1HB   SER  17          1HB       SER  17  -3.976   0.831 -14.169
  127   2HB   SER  17          2HB       SER  17  -3.439   0.564 -15.827
  128    HG   SER  17           HG       SER  17  -4.193  -1.374 -15.066
  129    HA   PRO  18           HA       PRO  18  -1.423   3.019 -10.883
  130   1HB   PRO  18          1HB       PRO  18  -3.482   4.787 -10.788
  131   2HB   PRO  18          2HB       PRO  18  -1.982   5.105 -11.668
  132   1HG   PRO  18          1HG       PRO  18  -4.621   4.151 -12.708
  133   2HG   PRO  18          2HG       PRO  18  -3.524   5.366 -13.389
  134   1HD   PRO  18          1HD       PRO  18  -3.645   2.827 -14.322
  135   2HD   PRO  18          2HD       PRO  18  -2.145   3.777 -14.329
  136    H    LEU  19           H        LEU  19  -2.364   2.837  -8.826
  137    HA   LEU  19           HA       LEU  19  -4.306   0.737  -8.579
  138   1HB   LEU  19          1HB       LEU  19  -3.311   2.436  -6.320
  139   2HB   LEU  19          2HB       LEU  19  -3.838   0.755  -6.286
  140    HG   LEU  19           HG       LEU  19  -1.322   1.664  -7.670
  141   1HD1  LEU  19          1HD1      LEU  19  -1.474   2.097  -5.129
  142   2HD1  LEU  19          2HD1      LEU  19  -0.072   1.238  -5.765
  143   3HD1  LEU  19          3HD1      LEU  19  -1.375   0.341  -4.986
  144   1HD2  LEU  19          1HD2      LEU  19  -1.079  -0.953  -6.815
  145   2HD2  LEU  19          2HD2      LEU  19  -1.416  -0.416  -8.461
  146   3HD2  LEU  19          3HD2      LEU  19  -2.745  -0.848  -7.384
  147    H    SER  20           H        SER  20  -6.107   1.035  -6.896
  148    HA   SER  20           HA       SER  20  -7.314   3.681  -6.914
  149   1HB   SER  20          1HB       SER  20  -8.666   1.275  -8.158
  150   2HB   SER  20          2HB       SER  20  -9.468   2.806  -7.807
  151    HG   SER  20           HG       SER  20  -8.094   2.162  -9.963
  152    H    LEU  21           H        LEU  21  -9.216   3.812  -5.511
  153    HA   LEU  21           HA       LEU  21  -8.790   2.575  -3.033
  154   1HB   LEU  21          1HB       LEU  21  -9.894   4.657  -3.056
  155   2HB   LEU  21          2HB       LEU  21 -11.119   4.081  -4.184
  156    HG   LEU  21           HG       LEU  21 -11.963   2.584  -2.354
  157   1HD1  LEU  21          1HD1      LEU  21 -10.905   4.142  -0.190
  158   2HD1  LEU  21          2HD1      LEU  21  -9.594   3.386  -1.096
  159   3HD1  LEU  21          3HD1      LEU  21 -10.889   2.394  -0.425
  160   1HD2  LEU  21          1HD2      LEU  21 -13.421   4.282  -2.435
  161   2HD2  LEU  21          2HD2      LEU  21 -12.147   5.499  -2.529
  162   3HD2  LEU  21          3HD2      LEU  21 -12.622   4.837  -0.964
  163    H    HIS  22           H        HIS  22 -10.039   1.040  -1.885
  164    HA   HIS  22           HA       HIS  22 -11.515  -0.827  -3.623
  165   1HB   HIS  22          1HB       HIS  22  -9.281  -1.570  -2.573
  166   2HB   HIS  22          2HB       HIS  22 -10.166  -1.619  -1.051
  167    HD1  HIS  22           HD1      HIS  22 -10.341  -4.076  -0.647
  168    HD2  HIS  22           HD2      HIS  22 -11.488  -3.022  -4.499
  169    HE1  HIS  22           HE1      HIS  22 -11.275  -6.176  -1.669
  170    H    ASP  23           H        ASP  23 -13.487  -1.567  -2.976
  171    HA   ASP  23           HA       ASP  23 -14.984  -0.009  -1.169
  172   1HB   ASP  23          1HB       ASP  23 -15.459  -2.259  -2.953
  173   2HB   ASP  23          2HB       ASP  23 -16.395  -2.388  -1.466
  174    H    SER  24           H        SER  24 -13.021  -2.808  -0.735
  175    HA   SER  24           HA       SER  24 -14.221  -3.546   1.795
  176   1HB   SER  24          1HB       SER  24 -11.600  -4.573   0.714
  177   2HB   SER  24          2HB       SER  24 -12.716  -5.374   1.820
  178    HG   SER  24           HG       SER  24 -13.393  -4.704  -0.848
  179    H    MET  25           H        MET  25 -11.275  -1.971   0.643
  180    HA   MET  25           HA       MET  25 -10.110  -1.692   3.232
  181   1HB   MET  25          1HB       MET  25  -8.379  -0.536   2.178
  182   2HB   MET  25          2HB       MET  25  -8.951  -1.631   0.926
  183   1HG   MET  25          1HG       MET  25 -10.117   0.116  -0.183
  184   2HG   MET  25          2HG       MET  25  -9.852   1.225   1.161
  185   1HE   MET  25          1HE       MET  25  -7.947  -1.329  -0.759
  186   2HE   MET  25          2HE       MET  25  -7.797  -0.300  -2.184
  187   3HE   MET  25          3HE       MET  25  -6.395  -0.588  -1.152
  188    H    LYS  26           H        LYS  26  -9.345   0.811   3.627
  189    HA   LYS  26           HA       LYS  26 -11.791   2.446   3.642
  190   1HB   LYS  26          1HB       LYS  26 -10.489   1.289   5.900
  191   2HB   LYS  26          2HB       LYS  26 -10.256   3.030   5.972
  192   1HG   LYS  26          1HG       LYS  26 -12.864   2.984   5.409
  193   2HG   LYS  26          2HG       LYS  26 -12.725   1.431   6.238
  194   1HD   LYS  26          1HD       LYS  26 -11.779   2.505   8.181
  195   2HD   LYS  26          2HD       LYS  26 -11.744   4.060   7.348
  196   1HE   LYS  26          1HE       LYS  26 -13.752   4.449   8.230
  197   2HE   LYS  26          2HE       LYS  26 -14.378   3.231   7.119
  198   1HZ   LYS  26          1HZ       LYS  26 -13.222   2.301   9.637
  199   2HZ   LYS  26          2HZ       LYS  26 -14.522   1.681   8.752
  200   3HZ   LYS  26          3HZ       LYS  26 -14.732   3.060   9.709
  201    H    TYR  27           H        TYR  27  -8.275   2.331   3.813
  202    HA   TYR  27           HA       TYR  27  -8.209   5.067   2.735
  203   1HB   TYR  27          1HB       TYR  27  -7.543   4.787   5.235
  204   2HB   TYR  27          2HB       TYR  27  -6.064   4.081   4.593
  205    HD1  TYR  27           HD1      TYR  27  -8.103   6.980   3.420
  206    HD2  TYR  27           HD2      TYR  27  -4.366   5.620   4.931
  207    HE1  TYR  27           HE1      TYR  27  -7.166   9.234   3.115
  208    HE2  TYR  27           HE2      TYR  27  -3.419   7.870   4.632
  209    HH   TYR  27           HH       TYR  27  -5.403  10.602   3.790
  210    H    LEU  28           H        LEU  28  -6.677   5.473   1.176
  211    HA   LEU  28           HA       LEU  28  -5.001   3.198   0.349
  212   1HB   LEU  28          1HB       LEU  28  -6.779   3.254  -1.208
  213   2HB   LEU  28          2HB       LEU  28  -6.705   5.010  -1.337
  214    HG   LEU  28           HG       LEU  28  -4.664   4.889  -2.599
  215   1HD1  LEU  28          1HD1      LEU  28  -3.261   3.226  -2.128
  216   2HD1  LEU  28          2HD1      LEU  28  -4.239   2.233  -3.208
  217   3HD1  LEU  28          3HD1      LEU  28  -4.550   2.216  -1.472
  218   1HD2  LEU  28          1HD2      LEU  28  -5.453   3.807  -4.594
  219   2HD2  LEU  28          2HD2      LEU  28  -6.822   4.565  -3.781
  220   3HD2  LEU  28          3HD2      LEU  28  -6.582   2.821  -3.665
  221    H    VAL  29           H        VAL  29  -2.911   3.668   0.241
  222    HA   VAL  29           HA       VAL  29  -2.068   6.376  -0.477
  223    HB   VAL  29           HB       VAL  29  -1.080   4.924   1.981
  224   1HG1  VAL  29          1HG1      VAL  29   0.013   7.164   0.400
  225   2HG1  VAL  29          2HG1      VAL  29   0.019   7.367   2.153
  226   3HG1  VAL  29          3HG1      VAL  29   0.836   5.986   1.421
  227   1HG2  VAL  29          1HG2      VAL  29  -1.900   7.147   3.025
  228   2HG2  VAL  29          2HG2      VAL  29  -2.863   7.291   1.554
  229   3HG2  VAL  29          3HG2      VAL  29  -3.084   5.905   2.621
  230    H    TYR  30           H        TYR  30  -0.615   6.254  -2.045
  231    HA   TYR  30           HA       TYR  30   1.501   4.280  -1.962
  232   1HB   TYR  30          1HB       TYR  30   1.036   3.208  -4.016
  233   2HB   TYR  30          2HB       TYR  30  -0.497   3.221  -3.151
  234    HD1  TYR  30           HD1      TYR  30   1.380   4.639  -5.969
  235    HD2  TYR  30           HD2      TYR  30  -2.357   4.548  -3.937
  236    HE1  TYR  30           HE1      TYR  30   0.314   5.742  -7.892
  237    HE2  TYR  30           HE2      TYR  30  -3.433   5.650  -5.854
  238    HH   TYR  30           HH       TYR  30  -1.668   6.281  -8.840
  239    H    GLN  31           H        GLN  31   3.287   4.829  -3.222
  240    HA   GLN  31           HA       GLN  31   3.126   7.361  -4.701
  241   1HB   GLN  31          1HB       GLN  31   5.639   6.943  -3.233
  242   2HB   GLN  31          2HB       GLN  31   4.696   8.410  -3.460
  243   1HG   GLN  31          1HG       GLN  31   3.121   7.619  -1.729
  244   2HG   GLN  31          2HG       GLN  31   4.167   6.225  -1.461
  245   1HE2  GLN  31          1HE2      GLN  31   6.646   7.432  -1.648
  246   2HE2  GLN  31          2HE2      GLN  31   6.850   8.514  -0.317
  247    H    THR  32           H        THR  32   4.894   7.691  -6.216
  248    HA   THR  32           HA       THR  32   5.708   5.162  -7.418
  249    HB   THR  32           HB       THR  32   6.398   7.750  -8.709
  250    HG1  THR  32           HG1      THR  32   4.185   7.834  -9.511
  251   1HG2  THR  32          1HG2      THR  32   5.347   6.357 -10.652
  252   2HG2  THR  32          2HG2      THR  32   5.546   5.005  -9.536
  253   3HG2  THR  32          3HG2      THR  32   6.950   5.943 -10.045
  254    H    GLU  33           H        GLU  33   7.834   4.623  -7.900
  255    HA   GLU  33           HA       GLU  33   9.954   6.370  -6.899
  256   1HB   GLU  33          1HB       GLU  33   9.331   3.612  -5.906
  257   2HB   GLU  33          2HB       GLU  33  10.996   4.176  -5.928
  258   1HG   GLU  33          1HG       GLU  33  10.698   5.497  -4.157
  259   2HG   GLU  33          2HG       GLU  33   9.139   6.081  -4.736
  260    H    GLN  34           H        GLN  34  12.137   5.578  -7.555
  261    HA   GLN  34           HA       GLN  34  11.972   4.285 -10.195
  262   1HB   GLN  34          1HB       GLN  34  12.795   6.726  -9.930
  263   2HB   GLN  34          2HB       GLN  34  14.265   6.003  -9.291
  264   1HG   GLN  34          1HG       GLN  34  15.001   5.779 -11.360
  265   2HG   GLN  34          2HG       GLN  34  13.701   4.628 -11.664
  266   1HE2  GLN  34          1HE2      GLN  34  12.064   5.187 -12.980
  267   2HE2  GLN  34          2HE2      GLN  34  11.911   6.724 -13.753
  268    H    GLY  35           H        GLY  35  12.998   2.413 -10.511
  269   1HA   GLY  35          1HA       GLY  35  15.380   1.714  -9.045
  270   2HA   GLY  35          2HA       GLY  35  13.969   0.781  -8.568
  271    H    GLU  36           H        GLU  36  14.599  -1.190  -9.334
  272    HA   GLU  36           HA       GLU  36  15.940  -1.831 -11.625
  273   1HB   GLU  36          1HB       GLU  36  14.720  -4.012 -11.564
  274   2HB   GLU  36          2HB       GLU  36  15.413  -3.533 -10.021
  275   1HG   GLU  36          1HG       GLU  36  13.097  -2.580  -9.494
  276   2HG   GLU  36          2HG       GLU  36  12.541  -3.540 -10.864
  277    H    ALA  37           H        ALA  37  15.282  -2.582 -13.714
  278    HA   ALA  37           HA       ALA  37  14.148  -2.465 -15.686
  279   1HB   ALA  37          1HB       ALA  37  12.112  -3.302 -15.429
  280   2HB   ALA  37          2HB       ALA  37  12.142  -2.872 -13.718
  281   3HB   ALA  37          3HB       ALA  37  11.525  -1.723 -14.905
  282    H    GLY  38           H        GLY  38  13.874  -0.903 -17.208
  283   1HA   GLY  38          1HA       GLY  38  14.543   1.727 -16.692
  284   2HA   GLY  38          2HA       GLY  38  13.687   1.192 -18.130
  285    H    ASN  39           H        ASN  39  11.443   0.197 -16.395
  286    HA   ASN  39           HA       ASN  39   9.958   2.668 -16.386
  287   1HB   ASN  39          1HB       ASN  39   9.039  -0.063 -15.469
  288   2HB   ASN  39          2HB       ASN  39   8.024   1.303 -15.924
  289   1HD2  ASN  39          1HD2      ASN  39   9.730  -1.433 -16.995
  290   2HD2  ASN  39          2HD2      ASN  39   9.415  -1.260 -18.685
  291    H    ILE  40           H        ILE  40   8.206   2.400 -14.309
  292    HA   ILE  40           HA       ILE  40   9.949   2.710 -11.952
  293    HB   ILE  40           HB       ILE  40   8.031   4.182 -11.093
  294   1HG1  ILE  40          1HG1      ILE  40   7.401   4.153 -14.052
  295   2HG1  ILE  40          2HG1      ILE  40   6.357   3.583 -12.754
  296   1HG2  ILE  40          1HG2      ILE  40   8.956   6.155 -12.159
  297   2HG2  ILE  40          2HG2      ILE  40  10.241   5.013 -11.771
  298   3HG2  ILE  40          3HG2      ILE  40   9.665   5.161 -13.431
  299   1HD1  ILE  40          1HD1      ILE  40   6.988   6.234 -12.123
  300   2HD1  ILE  40          2HD1      ILE  40   6.624   6.210 -13.849
  301   3HD1  ILE  40          3HD1      ILE  40   5.446   5.592 -12.690
  302    H    HIS  41           H        HIS  41   8.792   2.369  -9.846
  303    HA   HIS  41           HA       HIS  41   6.828   0.183 -10.075
  304   1HB   HIS  41          1HB       HIS  41   7.890  -0.636  -7.879
  305   2HB   HIS  41          2HB       HIS  41   8.786  -0.906  -9.370
  306    HD1  HIS  41           HD1      HIS  41  11.028  -1.002  -8.086
  307    HD2  HIS  41           HD2      HIS  41   9.004   2.607  -7.709
  308    HE1  HIS  41           HE1      HIS  41  12.690   0.601  -7.090
  309    H    PHE  42           H        PHE  42   5.400  -0.073  -8.229
  310    HA   PHE  42           HA       PHE  42   4.833   2.515  -6.952
  311   1HB   PHE  42          1HB       PHE  42   3.089   0.240  -7.830
  312   2HB   PHE  42          2HB       PHE  42   2.539   1.321  -6.555
  313    HD1  PHE  42           HD1      PHE  42   4.511   2.118  -9.598
  314    HD2  PHE  42           HD2      PHE  42   0.811   2.522  -7.535
  315    HE1  PHE  42           HE1      PHE  42   3.742   3.722 -11.298
  316    HE2  PHE  42           HE2      PHE  42   0.036   4.126  -9.231
  317    HZ   PHE  42           HZ       PHE  42   1.502   4.728 -11.116
  318    H    GLN  43           H        GLN  43   4.807   2.711  -4.787
  319    HA   GLN  43           HA       GLN  43   4.736   0.327  -3.110
  320   1HB   GLN  43          1HB       GLN  43   7.155   1.684  -3.727
  321   2HB   GLN  43          2HB       GLN  43   6.765   2.036  -2.049
  322   1HG   GLN  43          1HG       GLN  43   6.967  -0.151  -1.396
  323   2HG   GLN  43          2HG       GLN  43   6.615  -0.778  -3.006
  324   1HE2  GLN  43          1HE2      GLN  43   8.368   0.425  -4.604
  325   2HE2  GLN  43          2HE2      GLN  43   9.993   0.053  -4.148
  326    H    GLY  44           H        GLY  44   3.961   0.683  -1.042
  327   1HA   GLY  44          1HA       GLY  44   3.764   3.085   0.319
  328   2HA   GLY  44          2HA       GLY  44   2.334   2.994  -0.698
  329    H    TYR  45           H        TYR  45   1.282   3.060   1.463
  330    HA   TYR  45           HA       TYR  45   1.074   0.338   2.572
  331   1HB   TYR  45          1HB       TYR  45   0.559   1.363   4.759
  332   2HB   TYR  45          2HB       TYR  45   2.167   1.796   4.189
  333    HD1  TYR  45           HD1      TYR  45  -1.253   3.032   4.759
  334    HD2  TYR  45           HD2      TYR  45   2.723   4.070   3.654
  335    HE1  TYR  45           HE1      TYR  45  -1.802   5.413   5.041
  336    HE2  TYR  45           HE2      TYR  45   2.185   6.453   3.935
  337    HH   TYR  45           HH       TYR  45   0.666   7.914   4.760
  338    H    ILE  46           H        ILE  46  -0.927  -0.506   2.789
  339    HA   ILE  46           HA       ILE  46  -3.225   1.255   2.255
  340    HB   ILE  46           HB       ILE  46  -2.963  -1.573   1.234
  341   1HG1  ILE  46          1HG1      ILE  46  -2.744   1.026  -0.301
  342   2HG1  ILE  46          2HG1      ILE  46  -1.389  -0.019   0.110
  343   1HG2  ILE  46          1HG2      ILE  46  -5.254  -0.602   1.756
  344   2HG2  ILE  46          2HG2      ILE  46  -4.968   0.509   0.418
  345   3HG2  ILE  46          3HG2      ILE  46  -5.008  -1.230   0.126
  346   1HD1  ILE  46          1HD1      ILE  46  -2.150  -1.726  -1.323
  347   2HD1  ILE  46          2HD1      ILE  46  -3.724  -0.957  -1.524
  348   3HD1  ILE  46          3HD1      ILE  46  -2.286  -0.220  -2.230
  349    H    GLU  47           H        GLU  47  -4.784   1.147   3.733
  350    HA   GLU  47           HA       GLU  47  -4.681  -1.026   5.703
  351   1HB   GLU  47          1HB       GLU  47  -6.124   1.626   5.859
  352   2HB   GLU  47          2HB       GLU  47  -5.981   0.445   7.154
  353   1HG   GLU  47          1HG       GLU  47  -3.836   1.007   7.624
  354   2HG   GLU  47          2HG       GLU  47  -3.470   1.457   5.960
  355    H    MET  48           H        MET  48  -6.108  -2.613   5.553
  356    HA   MET  48           HA       MET  48  -8.370  -2.409   3.779
  357   1HB   MET  48          1HB       MET  48  -7.290  -4.619   5.518
  358   2HB   MET  48          2HB       MET  48  -8.792  -4.784   4.620
  359   1HG   MET  48          1HG       MET  48  -6.626  -3.829   2.953
  360   2HG   MET  48          2HG       MET  48  -6.253  -5.372   3.716
  361   1HE   MET  48          1HE       MET  48  -8.591  -4.438   0.158
  362   2HE   MET  48          2HE       MET  48  -9.656  -3.934   1.470
  363   3HE   MET  48          3HE       MET  48  -8.005  -3.319   1.389
  364    H    LYS  49           H        LYS  49 -10.438  -3.643   4.769
  365    HA   LYS  49           HA       LYS  49 -11.762  -1.830   6.373
  366   1HB   LYS  49          1HB       LYS  49 -12.438  -4.153   5.061
  367   2HB   LYS  49          2HB       LYS  49 -12.680  -4.588   6.748
  368   1HG   LYS  49          1HG       LYS  49 -14.350  -3.016   7.051
  369   2HG   LYS  49          2HG       LYS  49 -13.827  -2.047   5.671
  370   1HD   LYS  49          1HD       LYS  49 -14.441  -4.288   4.371
  371   2HD   LYS  49          2HD       LYS  49 -15.516  -4.487   5.757
  372   1HE   LYS  49          1HE       LYS  49 -15.425  -1.905   4.240
  373   2HE   LYS  49          2HE       LYS  49 -16.390  -3.260   3.656
  374   1HZ   LYS  49          1HZ       LYS  49 -17.049  -1.400   5.631
  375   2HZ   LYS  49          2HZ       LYS  49 -16.908  -2.906   6.387
  376   3HZ   LYS  49          3HZ       LYS  49 -17.969  -2.710   5.084
  377    H    LYS  50           H        LYS  50 -10.513  -5.006   7.416
  378    HA   LYS  50           HA       LYS  50  -9.332  -4.125   9.775
  379   1HB   LYS  50          1HB       LYS  50 -12.205  -4.322   9.937
  380   2HB   LYS  50          2HB       LYS  50 -11.456  -5.481  11.027
  381   1HG   LYS  50          1HG       LYS  50 -10.341  -3.798  12.226
  382   2HG   LYS  50          2HG       LYS  50 -10.646  -2.592  10.973
  383   1HD   LYS  50          1HD       LYS  50 -12.257  -1.999  12.484
  384   2HD   LYS  50          2HD       LYS  50 -13.165  -3.171  11.526
  385   1HE   LYS  50          1HE       LYS  50 -13.386  -4.551  13.264
  386   2HE   LYS  50          2HE       LYS  50 -11.673  -4.438  13.664
  387   1HZ   LYS  50          1HZ       LYS  50 -12.050  -2.521  14.956
  388   2HZ   LYS  50          2HZ       LYS  50 -13.259  -3.616  15.404
  389   3HZ   LYS  50          3HZ       LYS  50 -13.626  -2.326  14.373
  390    H    ARG  51           H        ARG  51 -11.593  -6.842   9.387
  391    HA   ARG  51           HA       ARG  51  -9.425  -8.691   9.990
  392   1HB   ARG  51          1HB       ARG  51 -11.322 -10.387   9.968
  393   2HB   ARG  51          2HB       ARG  51 -11.387  -9.153  11.220
  394   1HG   ARG  51          1HG       ARG  51 -13.121  -7.996  10.144
  395   2HG   ARG  51          2HG       ARG  51 -12.868  -8.863   8.628
  396   1HD   ARG  51          1HD       ARG  51 -13.562 -10.955   9.785
  397   2HD   ARG  51          2HD       ARG  51 -13.952  -9.987  11.206
  398    HE   ARG  51           HE       ARG  51 -15.261  -9.086   8.816
  399   1HH1  ARG  51          1HH1      ARG  51 -15.415 -11.308  11.491
  400   2HH1  ARG  51          2HH1      ARG  51 -17.138 -11.478  11.420
  401   1HH2  ARG  51          1HH2      ARG  51 -17.529  -9.301   8.712
  402   2HH2  ARG  51          2HH2      ARG  51 -18.339 -10.336   9.838
  403    H    THR  52           H        THR  52  -9.048  -7.497   7.552
  404    HA   THR  52           HA       THR  52  -9.893  -9.500   5.574
  405    HB   THR  52           HB       THR  52  -8.451  -7.069   4.678
  406    HG1  THR  52           HG1      THR  52 -10.961  -7.036   5.971
  407   1HG2  THR  52          1HG2      THR  52  -9.246  -8.610   3.023
  408   2HG2  THR  52          2HG2      THR  52 -10.252  -7.164   2.939
  409   3HG2  THR  52          3HG2      THR  52 -10.861  -8.617   3.731
  410    H    SER  53           H        SER  53  -8.481 -11.056   5.151
  411    HA   SER  53           HA       SER  53  -5.722 -10.855   5.896
  412   1HB   SER  53          1HB       SER  53  -5.692 -13.125   4.558
  413   2HB   SER  53          2HB       SER  53  -6.485 -13.029   6.130
  414    HG   SER  53           HG       SER  53  -8.371 -13.285   5.203
  415    H    LEU  54           H        LEU  54  -4.137 -11.851   4.108
  416    HA   LEU  54           HA       LEU  54  -3.580  -9.837   2.302
  417   1HB   LEU  54          1HB       LEU  54  -1.992 -11.578   3.011
  418   2HB   LEU  54          2HB       LEU  54  -2.871 -12.756   2.038
  419    HG   LEU  54           HG       LEU  54  -2.202 -11.658   0.006
  420   1HD1  LEU  54          1HD1      LEU  54  -0.817  -9.684  -0.028
  421   2HD1  LEU  54          2HD1      LEU  54  -0.791  -9.631   1.734
  422   3HD1  LEU  54          3HD1      LEU  54  -2.300  -9.348   0.866
  423   1HD2  LEU  54          1HD2      LEU  54  -0.051 -12.258   2.000
  424   2HD2  LEU  54          2HD2      LEU  54   0.359 -11.729   0.368
  425   3HD2  LEU  54          3HD2      LEU  54  -0.581 -13.203   0.608
  426    H    ALA  55           H        ALA  55  -5.724 -12.562   1.972
  427    HA   ALA  55           HA       ALA  55  -6.002 -12.733  -0.781
  428   1HB   ALA  55          1HB       ALA  55  -8.236 -13.033   1.221
  429   2HB   ALA  55          2HB       ALA  55  -8.137 -13.755  -0.386
  430   3HB   ALA  55          3HB       ALA  55  -7.026 -14.271   0.883
  431    H    GLY  56           H        GLY  56  -7.242 -10.341   1.447
  432   1HA   GLY  56          1HA       GLY  56  -9.160  -9.199  -0.328
  433   2HA   GLY  56          2HA       GLY  56  -8.520  -8.452   1.129
  434    H    MET  57           H        MET  57  -5.858  -8.235   0.591
  435    HA   MET  57           HA       MET  57  -5.822  -6.011  -1.201
  436   1HB   MET  57          1HB       MET  57  -3.509  -7.425   0.137
  437   2HB   MET  57          2HB       MET  57  -3.454  -5.838  -0.618
  438   1HG   MET  57          1HG       MET  57  -5.478  -6.185   1.490
  439   2HG   MET  57          2HG       MET  57  -3.797  -6.243   2.014
  440   1HE   MET  57          1HE       MET  57  -6.398  -4.548  -0.005
  441   2HE   MET  57          2HE       MET  57  -6.202  -2.823   0.305
  442   3HE   MET  57          3HE       MET  57  -5.263  -3.602  -0.969
  443    H    LYS  58           H        LYS  58  -4.324  -9.236  -1.247
  444    HA   LYS  58           HA       LYS  58  -2.958  -9.046  -3.649
  445   1HB   LYS  58          1HB       LYS  58  -2.918 -10.945  -1.954
  446   2HB   LYS  58          2HB       LYS  58  -4.381 -11.541  -2.728
  447   1HG   LYS  58          1HG       LYS  58  -3.125 -11.648  -4.874
  448   2HG   LYS  58          2HG       LYS  58  -1.663 -11.223  -3.980
  449   1HD   LYS  58          1HD       LYS  58  -3.396 -13.650  -3.508
  450   2HD   LYS  58          2HD       LYS  58  -1.821 -13.637  -4.304
  451   1HE   LYS  58          1HE       LYS  58  -2.441 -13.008  -1.425
  452   2HE   LYS  58          2HE       LYS  58  -1.484 -14.349  -2.054
  453   1HZ   LYS  58          1HZ       LYS  58  -0.144 -12.288  -3.053
  454   2HZ   LYS  58          2HZ       LYS  58   0.206 -12.975  -1.548
  455   3HZ   LYS  58          3HZ       LYS  58  -0.736 -11.573  -1.639
  456    H    LYS  59           H        LYS  59  -6.360  -9.408  -3.057
  457    HA   LYS  59           HA       LYS  59  -7.161 -10.397  -5.566
  458   1HB   LYS  59          1HB       LYS  59  -8.428  -9.287  -3.206
  459   2HB   LYS  59          2HB       LYS  59  -9.223  -8.735  -4.674
  460   1HG   LYS  59          1HG       LYS  59  -9.509 -11.055  -5.391
  461   2HG   LYS  59          2HG       LYS  59  -8.721 -11.605  -3.911
  462   1HD   LYS  59          1HD       LYS  59 -10.496 -10.502  -2.595
  463   2HD   LYS  59          2HD       LYS  59 -11.298 -10.045  -4.100
  464   1HE   LYS  59          1HE       LYS  59 -11.166 -12.603  -4.606
  465   2HE   LYS  59          2HE       LYS  59 -10.975 -12.745  -2.860
  466   1HZ   LYS  59          1HZ       LYS  59 -13.191 -11.186  -4.037
  467   2HZ   LYS  59          2HZ       LYS  59 -13.070 -11.841  -2.483
  468   3HZ   LYS  59          3HZ       LYS  59 -13.320 -12.857  -3.812
  469    H    LEU  60           H        LEU  60  -6.383  -7.176  -4.444
  470    HA   LEU  60           HA       LEU  60  -7.395  -5.883  -6.817
  471   1HB   LEU  60          1HB       LEU  60  -5.820  -4.942  -4.439
  472   2HB   LEU  60          2HB       LEU  60  -6.148  -3.893  -5.817
  473    HG   LEU  60           HG       LEU  60  -8.631  -4.456  -5.354
  474   1HD1  LEU  60          1HD1      LEU  60  -7.301  -5.810  -3.170
  475   2HD1  LEU  60          2HD1      LEU  60  -8.980  -5.900  -3.700
  476   3HD1  LEU  60          3HD1      LEU  60  -8.472  -4.625  -2.593
  477   1HD2  LEU  60          1HD2      LEU  60  -8.697  -2.372  -4.578
  478   2HD2  LEU  60          2HD2      LEU  60  -6.933  -2.401  -4.581
  479   3HD2  LEU  60          3HD2      LEU  60  -7.820  -2.815  -3.113
  480    H    ILE  61           H        ILE  61  -4.260  -6.869  -5.537
  481    HA   ILE  61           HA       ILE  61  -3.138  -6.601  -8.223
  482    HB   ILE  61           HB       ILE  61  -1.763  -5.485  -5.776
  483   1HG1  ILE  61          1HG1      ILE  61  -1.976  -3.370  -7.384
  484   2HG1  ILE  61          2HG1      ILE  61  -3.393  -4.251  -7.946
  485   1HG2  ILE  61          1HG2      ILE  61  -0.933  -5.706  -8.659
  486   2HG2  ILE  61          2HG2      ILE  61  -0.154  -4.616  -7.515
  487   3HG2  ILE  61          3HG2      ILE  61  -0.117  -6.357  -7.238
  488   1HD1  ILE  61          1HD1      ILE  61  -2.899  -2.886  -5.385
  489   2HD1  ILE  61          2HD1      ILE  61  -4.390  -3.079  -6.307
  490   3HD1  ILE  61          3HD1      ILE  61  -3.795  -4.403  -5.305
  491    HA   PRO  62           HA       PRO  62  -2.036 -10.602  -6.173
  492   1HB   PRO  62          1HB       PRO  62  -2.518 -12.117  -8.373
  493   2HB   PRO  62          2HB       PRO  62  -3.780 -11.673  -7.218
  494   1HG   PRO  62          1HG       PRO  62  -3.119 -10.444  -9.866
  495   2HG   PRO  62          2HG       PRO  62  -4.707 -10.826  -9.175
  496   1HD   PRO  62          1HD       PRO  62  -3.676  -8.323  -9.159
  497   2HD   PRO  62          2HD       PRO  62  -4.736  -8.927  -7.869
  498    H    GLY  63           H        GLY  63  -0.871  -8.680  -8.695
  499   1HA   GLY  63          1HA       GLY  63   1.411 -10.476  -9.189
  500   2HA   GLY  63          2HA       GLY  63   0.926  -9.145 -10.228
  501    H    ALA  64           H        ALA  64   1.305  -9.098  -6.714
  502    HA   ALA  64           HA       ALA  64   3.760  -7.540  -6.964
  503   1HB   ALA  64          1HB       ALA  64   1.316  -6.492  -5.540
  504   2HB   ALA  64          2HB       ALA  64   2.910  -5.736  -5.549
  505   3HB   ALA  64          3HB       ALA  64   1.989  -5.868  -7.047
  506    H    HIS  65           H        HIS  65   4.759  -7.119  -4.811
  507    HA   HIS  65           HA       HIS  65   4.431  -9.483  -3.128
  508   1HB   HIS  65          1HB       HIS  65   6.687  -8.629  -4.057
  509   2HB   HIS  65          2HB       HIS  65   6.577  -7.401  -2.799
  510    HD1  HIS  65           HD1      HIS  65   7.795  -8.034  -0.756
  511    HD2  HIS  65           HD2      HIS  65   6.320 -11.365  -2.753
  512    HE1  HIS  65           HE1      HIS  65   8.552 -10.017   0.593
  513    H    PHE  66           H        PHE  66   3.283  -9.390  -1.324
  514    HA   PHE  66           HA       PHE  66   2.888  -6.770  -0.040
  515   1HB   PHE  66          1HB       PHE  66   1.098  -9.078  -0.520
  516   2HB   PHE  66          2HB       PHE  66   0.936  -8.292   1.047
  517    HD1  PHE  66           HD1      PHE  66   0.851  -7.690  -2.603
  518    HD2  PHE  66           HD2      PHE  66  -0.203  -6.257   1.264
  519    HE1  PHE  66           HE1      PHE  66  -0.535  -5.937  -3.634
  520    HE2  PHE  66           HE2      PHE  66  -1.591  -4.503   0.240
  521    HZ   PHE  66           HZ       PHE  66  -1.760  -4.342  -2.212
  522    H    GLU  67           H        GLU  67   2.710  -6.757   2.309
  523    HA   GLU  67           HA       GLU  67   3.822  -9.029   3.735
  524   1HB   GLU  67          1HB       GLU  67   5.397  -6.689   3.022
  525   2HB   GLU  67          2HB       GLU  67   5.335  -6.934   4.762
  526   1HG   GLU  67          1HG       GLU  67   6.037  -9.306   4.354
  527   2HG   GLU  67          2HG       GLU  67   6.314  -8.857   2.672
  528    H    LYS  68           H        LYS  68   2.373  -9.271   5.300
  529    HA   LYS  68           HA       LYS  68   1.170  -6.903   6.534
  530   1HB   LYS  68          1HB       LYS  68  -0.197  -8.885   5.631
  531   2HB   LYS  68          2HB       LYS  68   0.370  -9.760   7.047
  532   1HG   LYS  68          1HG       LYS  68  -0.555  -7.703   8.347
  533   2HG   LYS  68          2HG       LYS  68  -1.491  -7.436   6.875
  534   1HD   LYS  68          1HD       LYS  68  -2.947  -8.776   8.017
  535   2HD   LYS  68          2HD       LYS  68  -2.014 -10.013   7.171
  536   1HE   LYS  68          1HE       LYS  68  -0.512 -10.012   9.255
  537   2HE   LYS  68          2HE       LYS  68  -1.836  -9.153  10.041
  538   1HZ   LYS  68          1HZ       LYS  68  -1.828 -11.894   8.936
  539   2HZ   LYS  68          2HZ       LYS  68  -3.274 -11.064   9.223
  540   3HZ   LYS  68          3HZ       LYS  68  -2.217 -11.390  10.504
  541    H    ARG  69           H        ARG  69   3.926  -8.138   7.038
  542    HA   ARG  69           HA       ARG  69   3.855  -9.145   9.708
  543   1HB   ARG  69          1HB       ARG  69   5.890  -8.546   7.687
  544   2HB   ARG  69          2HB       ARG  69   6.424  -8.232   9.333
  545   1HG   ARG  69          1HG       ARG  69   5.793 -10.530   9.951
  546   2HG   ARG  69          2HG       ARG  69   5.339 -10.832   8.272
  547   1HD   ARG  69          1HD       ARG  69   7.507 -11.685   8.437
  548   2HD   ARG  69          2HD       ARG  69   7.725 -10.101   7.695
  549    HE   ARG  69           HE       ARG  69   7.955  -9.864  10.489
  550   1HH1  ARG  69          1HH1      ARG  69   9.654 -11.167   7.744
  551   2HH1  ARG  69          2HH1      ARG  69  11.219 -10.994   8.466
  552   1HH2  ARG  69          1HH2      ARG  69  10.010  -9.631  11.450
  553   2HH2  ARG  69          2HH2      ARG  69  11.421 -10.121  10.574
  554    H    ARG  70           H        ARG  70   3.298  -6.116   8.518
  555    HA   ARG  70           HA       ARG  70   3.054  -4.080   9.507
  556   1HB   ARG  70          1HB       ARG  70   3.920  -5.302  12.119
  557   2HB   ARG  70          2HB       ARG  70   2.866  -3.919  11.859
  558   1HG   ARG  70          1HG       ARG  70   1.124  -5.359  11.005
  559   2HG   ARG  70          2HG       ARG  70   2.186  -6.762  11.137
  560   1HD   ARG  70          1HD       ARG  70   1.647  -5.090  13.550
  561   2HD   ARG  70          2HD       ARG  70   0.429  -6.243  13.005
  562    HE   ARG  70           HE       ARG  70   3.044  -7.394  13.238
  563   1HH1  ARG  70          1HH1      ARG  70   0.151  -6.537  14.975
  564   2HH1  ARG  70          2HH1      ARG  70   0.397  -7.712  16.225
  565   1HH2  ARG  70          1HH2      ARG  70   3.378  -8.945  14.877
  566   2HH2  ARG  70          2HH2      ARG  70   2.233  -9.080  16.168
  567    H    GLY  71           H        GLY  71   5.429  -4.611   8.213
  568   1HA   GLY  71          1HA       GLY  71   7.709  -3.964   9.808
  569   2HA   GLY  71          2HA       GLY  71   7.639  -3.979   8.052
  570    H    THR  72           H        THR  72   5.155  -2.077   8.804
  571    HA   THR  72           HA       THR  72   6.770   0.360   9.120
  572    HB   THR  72           HB       THR  72   5.111   1.451   7.490
  573    HG1  THR  72           HG1      THR  72   3.673   0.135   6.687
  574   1HG2  THR  72          1HG2      THR  72   6.807  -0.518   6.032
  575   2HG2  THR  72          2HG2      THR  72   7.594   0.619   7.127
  576   3HG2  THR  72          3HG2      THR  72   6.625   1.218   5.782
  577    H    GLN  73           H        GLN  73   4.863  -1.322  10.806
  578    HA   GLN  73           HA       GLN  73   2.554   0.305  11.233
  579   1HB   GLN  73          1HB       GLN  73   2.373  -2.002  11.794
  580   2HB   GLN  73          2HB       GLN  73   3.809  -1.939  12.808
  581   1HG   GLN  73          1HG       GLN  73   1.591  -0.150  13.569
  582   2HG   GLN  73          2HG       GLN  73   1.314  -1.880  13.768
  583   1HE2  GLN  73          1HE2      GLN  73   1.721   0.381  15.691
  584   2HE2  GLN  73          2HE2      GLN  73   2.977  -0.164  16.745
  585    H    GLY  74           H        GLY  74   2.610   2.259  12.117
  586   1HA   GLY  74          1HA       GLY  74   2.943   3.368  14.326
  587   2HA   GLY  74          2HA       GLY  74   4.589   2.758  14.255
  588    H    GLU  75           H        GLU  75   5.944   4.386  13.926
  589    HA   GLU  75           HA       GLU  75   5.260   6.879  12.859
  590   1HB   GLU  75          1HB       GLU  75   7.481   5.789  14.092
  591   2HB   GLU  75          2HB       GLU  75   8.065   6.161  12.476
  592   1HG   GLU  75          1HG       GLU  75   7.075   8.475  12.819
  593   2HG   GLU  75          2HG       GLU  75   6.923   8.034  14.519
  594    H    ALA  76           H        ALA  76   6.431   3.955  11.333
  595    HA   ALA  76           HA       ALA  76   7.164   5.053   8.844
  596   1HB   ALA  76          1HB       ALA  76   6.687   2.654   8.037
  597   2HB   ALA  76          2HB       ALA  76   7.961   2.903   9.231
  598   3HB   ALA  76          3HB       ALA  76   6.383   2.303   9.739
  599    H    ARG  77           H        ARG  77   4.096   4.425  10.265
  600    HA   ARG  77           HA       ARG  77   2.547   4.081   7.933
  601   1HB   ARG  77          1HB       ARG  77   1.710   3.526  10.168
  602   2HB   ARG  77          2HB       ARG  77   1.753   5.226  10.616
  603   1HG   ARG  77          1HG       ARG  77   0.183   4.580   8.212
  604   2HG   ARG  77          2HG       ARG  77  -0.446   3.957   9.739
  605   1HD   ARG  77          1HD       ARG  77   0.460   6.750   9.816
  606   2HD   ARG  77          2HD       ARG  77  -0.926   6.448   8.769
  607    HE   ARG  77           HE       ARG  77  -1.471   5.180  11.161
  608   1HH1  ARG  77          1HH1      ARG  77  -0.852   8.429  10.076
  609   2HH1  ARG  77          2HH1      ARG  77  -1.822   9.165  11.309
  610   1HH2  ARG  77          1HH2      ARG  77  -2.750   6.136  12.789
  611   2HH2  ARG  77          2HH2      ARG  77  -2.901   7.860  12.852
  612    H    ALA  78           H        ALA  78   4.172   6.789   9.159
  613    HA   ALA  78           HA       ALA  78   2.419   8.697   7.801
  614   1HB   ALA  78          1HB       ALA  78   4.707   9.963   8.925
  615   2HB   ALA  78          2HB       ALA  78   3.019  10.083   9.424
  616   3HB   ALA  78          3HB       ALA  78   4.053   8.828  10.106
  617    H    TYR  79           H        TYR  79   5.879   7.840   7.889
  618    HA   TYR  79           HA       TYR  79   6.340   9.258   5.400
  619   1HB   TYR  79          1HB       TYR  79   8.178   9.559   6.753
  620   2HB   TYR  79          2HB       TYR  79   8.055   7.953   7.463
  621    HD1  TYR  79           HD1      TYR  79   8.971   9.711   4.312
  622    HD2  TYR  79           HD2      TYR  79   9.440   6.229   6.712
  623    HE1  TYR  79           HE1      TYR  79  10.744   8.917   2.804
  624    HE2  TYR  79           HE2      TYR  79  11.215   5.426   5.212
  625    HH   TYR  79           HH       TYR  79  12.933   6.970   3.402
  626    H    SER  80           H        SER  80   7.048   5.946   6.529
  627    HA   SER  80           HA       SER  80   7.304   3.991   5.372
  628   1HB   SER  80          1HB       SER  80   5.310   3.894   3.525
  629   2HB   SER  80          2HB       SER  80   5.076   3.573   5.243
  630    HG   SER  80           HG       SER  80   4.435   5.726   5.506
  631    H    MET  81           H        MET  81   6.929   3.158   2.833
  632    HA   MET  81           HA       MET  81   8.061   3.023   0.859
  633   1HB   MET  81          1HB       MET  81   7.604   6.009   0.791
  634   2HB   MET  81          2HB       MET  81   7.875   4.954  -0.589
  635   1HG   MET  81          1HG       MET  81   5.629   5.099  -0.720
  636   2HG   MET  81          2HG       MET  81   5.731   3.749   0.407
  637   1HE   MET  81          1HE       MET  81   3.371   5.013  -0.098
  638   2HE   MET  81          2HE       MET  81   2.714   5.068   1.538
  639   3HE   MET  81          3HE       MET  81   2.932   6.561   0.623
  640    H    LYS  82           H        LYS  82   9.786   4.629  -0.502
  641    HA   LYS  82           HA       LYS  82  11.977   5.123   1.404
  642   1HB   LYS  82          1HB       LYS  82  11.905   3.425  -1.029
  643   2HB   LYS  82          2HB       LYS  82  13.355   4.390  -0.787
  644   1HG   LYS  82          1HG       LYS  82  12.460   2.937   1.593
  645   2HG   LYS  82          2HG       LYS  82  12.943   1.912   0.239
  646   1HD   LYS  82          1HD       LYS  82  15.091   3.048   0.120
  647   2HD   LYS  82          2HD       LYS  82  14.607   4.135   1.423
  648   1HE   LYS  82          1HE       LYS  82  15.893   2.542   2.519
  649   2HE   LYS  82          2HE       LYS  82  14.246   1.975   2.787
  650   1HZ   LYS  82          1HZ       LYS  82  14.577   0.157   1.535
  651   2HZ   LYS  82          2HZ       LYS  82  16.213   0.435   1.863
  652   3HZ   LYS  82          3HZ       LYS  82  15.542   0.959   0.401
  653    H    GLU  83           H        GLU  83  12.373   7.234   1.396
  654    HA   GLU  83           HA       GLU  83  11.635   9.000  -0.672
  655   1HB   GLU  83          1HB       GLU  83  12.785   9.184   1.941
  656   2HB   GLU  83          2HB       GLU  83  13.739  10.166   0.838
  657   1HG   GLU  83          1HG       GLU  83  11.767  11.388   0.162
  658   2HG   GLU  83          2HG       GLU  83  10.755  10.360   1.175
  659    H    ASP  84           H        ASP  84  14.607   7.282   0.032
  660    HA   ASP  84           HA       ASP  84  16.403   8.653  -1.573
  661   1HB   ASP  84          1HB       ASP  84  16.382   6.233  -0.141
  662   2HB   ASP  84          2HB       ASP  84  16.844   5.808  -1.787
  663    H    THR  85           H        THR  85  13.973   6.270  -2.451
  664    HA   THR  85           HA       THR  85  14.714   6.608  -5.282
  665    HB   THR  85           HB       THR  85  13.311   4.511  -5.623
  666    HG1  THR  85           HG1      THR  85  13.269   3.220  -3.592
  667   1HG2  THR  85          1HG2      THR  85  15.129   3.008  -4.890
  668   2HG2  THR  85          2HG2      THR  85  15.823   4.333  -3.957
  669   3HG2  THR  85          3HG2      THR  85  15.736   4.443  -5.714
  670    H    ARG  86           H        ARG  86  12.747   8.000  -3.215
  671    HA   ARG  86           HA       ARG  86  10.149   7.723  -4.231
  672   1HB   ARG  86          1HB       ARG  86  10.347   8.796  -2.146
  673   2HB   ARG  86          2HB       ARG  86  11.550   9.930  -2.746
  674   1HG   ARG  86          1HG       ARG  86   9.970  11.249  -3.805
  675   2HG   ARG  86          2HG       ARG  86   8.773   9.953  -3.849
  676   1HD   ARG  86          1HD       ARG  86   7.911  11.197  -2.145
  677   2HD   ARG  86          2HD       ARG  86   8.991  10.153  -1.222
  678    HE   ARG  86           HE       ARG  86  10.529  12.310  -1.845
  679   1HH1  ARG  86          1HH1      ARG  86   7.446  11.877  -0.286
  680   2HH1  ARG  86          2HH1      ARG  86   7.614  13.273   0.725
  681   1HH2  ARG  86          1HH2      ARG  86  10.762  14.151  -0.518
  682   2HH2  ARG  86          2HH2      ARG  86   9.500  14.566   0.592
  683    H    LEU  87           H        LEU  87   9.352   8.232  -6.152
  684    HA   LEU  87           HA       LEU  87  10.751  10.248  -7.773
  685   1HB   LEU  87          1HB       LEU  87   9.738   7.646  -8.350
  686   2HB   LEU  87          2HB       LEU  87   8.858   8.823  -9.323
  687    HG   LEU  87           HG       LEU  87  11.832   8.330  -9.304
  688   1HD1  LEU  87          1HD1      LEU  87   9.613   7.801 -11.249
  689   2HD1  LEU  87          2HD1      LEU  87  10.832   6.690 -10.627
  690   3HD1  LEU  87          3HD1      LEU  87  11.289   7.945 -11.777
  691   1HD2  LEU  87          1HD2      LEU  87  11.601  10.670  -9.534
  692   2HD2  LEU  87          2HD2      LEU  87  10.204  10.504 -10.597
  693   3HD2  LEU  87          3HD2      LEU  87  11.807  10.039 -11.168
  694    H    GLU  88           H        GLU  88   7.434   8.997  -7.340
  695    HA   GLU  88           HA       GLU  88   6.466  11.763  -7.652
  696   1HB   GLU  88          1HB       GLU  88   5.845   9.581  -9.232
  697   2HB   GLU  88          2HB       GLU  88   4.484   9.671  -8.123
  698   1HG   GLU  88          1HG       GLU  88   4.023  10.917 -10.141
  699   2HG   GLU  88          2HG       GLU  88   4.117  12.000  -8.754
  700    H    GLY  89           H        GLY  89   4.124  11.925  -6.695
  701   1HA   GLY  89          1HA       GLY  89   2.643  11.471  -4.922
  702   2HA   GLY  89          2HA       GLY  89   3.831  10.370  -4.241
  703    HA   PRO  90           HA       PRO  90   3.191  10.276  -2.279
  704   1HB   PRO  90          1HB       PRO  90   1.728  11.185  -0.180
  705   2HB   PRO  90          2HB       PRO  90   3.450  10.806  -0.058
  706   1HG   PRO  90          1HG       PRO  90   2.116  13.463  -0.401
  707   2HG   PRO  90          2HG       PRO  90   3.472  13.020   0.653
  708   1HD   PRO  90          1HD       PRO  90   3.821  14.286  -1.715
  709   2HD   PRO  90          2HD       PRO  90   5.007  13.138  -1.062
  710    H    TRP  91           H        TRP  91   0.920   9.534  -2.029
  711    HA   TRP  91           HA       TRP  91  -1.068  11.334  -3.204
  712   1HB   TRP  91          1HB       TRP  91  -0.233   8.659  -4.310
  713   2HB   TRP  91          2HB       TRP  91  -1.821   9.344  -4.644
  714    HD1  TRP  91           HD1      TRP  91  -0.837  12.393  -5.038
  715    HE1  TRP  91           HE1      TRP  91   0.421  13.008  -7.197
  716    HE3  TRP  91           HE3      TRP  91   0.757   7.732  -6.404
  717    HZ2  TRP  91           HZ2      TRP  91   1.895  11.691  -9.213
  718    HZ3  TRP  91           HZ3      TRP  91   2.085   7.495  -8.461
  719    HH2  TRP  91           HH2      TRP  91   2.641   9.435  -9.836
  720    H    GLU  92           H        GLU  92  -2.996  11.190  -2.235
  721    HA   GLU  92           HA       GLU  92  -3.496   8.852  -0.513
  722   1HB   GLU  92          1HB       GLU  92  -4.269  11.742  -0.100
  723   2HB   GLU  92          2HB       GLU  92  -4.888  10.418   0.876
  724   1HG   GLU  92          1HG       GLU  92  -2.982  10.205   2.043
  725   2HG   GLU  92          2HG       GLU  92  -1.962  10.552   0.648
  726    H    TYR  93           H        TYR  93  -5.423   7.825  -0.673
  727    HA   TYR  93           HA       TYR  93  -7.551   9.032  -2.276
  728   1HB   TYR  93          1HB       TYR  93  -6.345   6.312  -2.817
  729   2HB   TYR  93          2HB       TYR  93  -7.838   6.901  -3.538
  730    HD1  TYR  93           HD1      TYR  93  -7.748   8.908  -5.055
  731    HD2  TYR  93           HD2      TYR  93  -4.241   6.907  -3.713
  732    HE1  TYR  93           HE1      TYR  93  -6.463   9.953  -6.873
  733    HE2  TYR  93           HE2      TYR  93  -2.946   7.947  -5.527
  734    HH   TYR  93           HH       TYR  93  -3.487   8.911  -7.854
  735    H    GLY  94           H        GLY  94  -9.621   7.913  -2.052
  736   1HA   GLY  94          1HA       GLY  94 -11.169   6.583  -0.920
  737   2HA   GLY  94          2HA       GLY  94  -9.870   5.981   0.099
  738    H    GLU  95           H        GLU  95 -10.966   6.262   2.026
  739    HA   GLU  95           HA       GLU  95 -12.167   8.772   2.722
  740   1HB   GLU  95          1HB       GLU  95 -13.122   6.812   3.690
  741   2HB   GLU  95          2HB       GLU  95 -11.563   6.273   4.297
  742   1HG   GLU  95          1HG       GLU  95 -12.896   7.122   6.108
  743   2HG   GLU  95          2HG       GLU  95 -11.517   8.186   5.835
  Start of MODEL   29
    1   1H    ALA   2          1H        ALA   2 -12.200   2.661  19.863
    2    HA   ALA   2           HA       ALA   2 -13.744   0.733  18.641
    3   1HB   ALA   2          1HB       ALA   2 -14.304   1.402  16.589
    4   2HB   ALA   2          2HB       ALA   2 -13.953   3.037  17.150
    5   3HB   ALA   2          3HB       ALA   2 -12.717   2.115  16.296
    6    H    ARG   3           H        ARG   3 -12.505  -0.830  17.455
    7    HA   ARG   3           HA       ARG   3  -9.801  -0.991  18.342
    8   1HB   ARG   3          1HB       ARG   3 -11.742  -2.736  17.072
    9   2HB   ARG   3          2HB       ARG   3 -10.143  -2.931  16.368
   10   1HG   ARG   3          1HG       ARG   3  -9.565  -4.212  18.073
   11   2HG   ARG   3          2HG       ARG   3  -9.812  -2.851  19.169
   12   1HD   ARG   3          1HD       ARG   3 -12.332  -3.538  18.954
   13   2HD   ARG   3          2HD       ARG   3 -11.654  -5.092  18.471
   14    HE   ARG   3           HE       ARG   3 -10.479  -4.115  20.879
   15   1HH1  ARG   3          1HH1      ARG   3 -13.279  -5.723  19.577
   16   2HH1  ARG   3          2HH1      ARG   3 -13.661  -6.538  21.057
   17   1HH2  ARG   3          1HH2      ARG   3 -10.972  -5.182  22.834
   18   2HH2  ARG   3          2HH2      ARG   3 -12.348  -6.229  22.909
   19    H    GLN   4           H        GLN   4  -7.921  -1.244  16.986
   20    HA   GLN   4           HA       GLN   4  -8.122   0.299  14.484
   21   1HB   GLN   4          1HB       GLN   4  -6.329   0.518  16.775
   22   2HB   GLN   4          2HB       GLN   4  -5.464   0.401  15.248
   23   1HG   GLN   4          1HG       GLN   4  -6.745   2.291  14.378
   24   2HG   GLN   4          2HG       GLN   4  -7.602   2.412  15.913
   25   1HE2  GLN   4          1HE2      GLN   4  -4.419   2.605  14.422
   26   2HE2  GLN   4          2HE2      GLN   4  -3.739   3.689  15.583
   27    H    VAL   5           H        VAL   5  -6.668  -0.279  12.767
   28    HA   VAL   5           HA       VAL   5  -5.765  -3.083  12.902
   29    HB   VAL   5           HB       VAL   5  -6.312  -3.346  10.548
   30   1HG1  VAL   5          1HG1      VAL   5  -8.200  -4.100  11.478
   31   2HG1  VAL   5          2HG1      VAL   5  -8.299  -2.737  12.595
   32   3HG1  VAL   5          3HG1      VAL   5  -8.917  -2.578  10.950
   33   1HG2  VAL   5          1HG2      VAL   5  -7.954  -1.037  10.132
   34   2HG2  VAL   5          2HG2      VAL   5  -6.314  -0.532  10.540
   35   3HG2  VAL   5          3HG2      VAL   5  -6.589  -1.618   9.178
   36    H    ILE   6           H        ILE   6  -3.979  -3.635  11.484
   37    HA   ILE   6           HA       ILE   6  -2.007  -1.507  11.415
   38    HB   ILE   6           HB       ILE   6  -1.667  -4.406  10.646
   39   1HG1  ILE   6          1HG1      ILE   6  -0.427  -4.232  13.015
   40   2HG1  ILE   6          2HG1      ILE   6  -1.670  -3.013  13.273
   41   1HG2  ILE   6          1HG2      ILE   6   0.744  -3.865  11.193
   42   2HG2  ILE   6          2HG2      ILE   6   0.100  -3.150   9.717
   43   3HG2  ILE   6          3HG2      ILE   6   0.268  -2.167  11.171
   44   1HD1  ILE   6          1HD1      ILE   6  -3.006  -4.667  13.884
   45   2HD1  ILE   6          2HD1      ILE   6  -3.030  -5.174  12.195
   46   3HD1  ILE   6          3HD1      ILE   6  -1.867  -5.886  13.313
   47    H    CYS   7           H        CYS   7  -0.834  -0.893   9.568
   48    HA   CYS   7           HA       CYS   7  -2.389  -0.865   7.153
   49   1HB   CYS   7          1HB       CYS   7  -0.751   0.660   6.306
   50   2HB   CYS   7          2HB       CYS   7  -1.026   1.076   7.993
   51    HG   CYS   7           HG       CYS   7   1.746   1.232   7.046
   52    H    TRP   8           H        TRP   8  -1.616  -1.541   5.067
   53    HA   TRP   8           HA       TRP   8   0.073  -3.942   5.247
   54   1HB   TRP   8          1HB       TRP   8  -2.072  -3.169   3.262
   55   2HB   TRP   8          2HB       TRP   8  -1.030  -4.577   3.077
   56    HD1  TRP   8           HD1      TRP   8  -3.476  -3.200   5.770
   57    HE1  TRP   8           HE1      TRP   8  -4.724  -5.204   6.794
   58    HE3  TRP   8           HE3      TRP   8  -1.178  -6.981   3.209
   59    HZ2  TRP   8           HZ2      TRP   8  -4.733  -8.016   6.550
   60    HZ3  TRP   8           HZ3      TRP   8  -1.864  -9.300   3.664
   61    HH2  TRP   8           HH2      TRP   8  -3.605  -9.805   5.300
   62    H    CYS   9           H        CYS   9   2.094  -3.630   4.603
   63    HA   CYS   9           HA       CYS   9   2.666  -1.581   2.593
   64   1HB   CYS   9          1HB       CYS   9   5.046  -1.936   3.283
   65   2HB   CYS   9          2HB       CYS   9   3.998  -1.389   4.585
   66    HG   CYS   9           HG       CYS   9   6.068  -3.535   5.076
   67    H    PHE  10           H        PHE  10   2.930  -2.151   0.548
   68    HA   PHE  10           HA       PHE  10   4.120  -4.763  -0.063
   69   1HB   PHE  10          1HB       PHE  10   2.471  -5.356  -1.611
   70   2HB   PHE  10          2HB       PHE  10   1.540  -4.677  -0.280
   71    HD1  PHE  10           HD2      PHE  10   0.808  -2.247  -0.461
   72    HD2  PHE  10           HD1      PHE  10   2.270  -4.499  -3.764
   73    HE1  PHE  10           HE2      PHE  10  -0.245  -0.652  -2.009
   74    HE2  PHE  10           HE1      PHE  10   1.220  -2.907  -5.318
   75    HZ   PHE  10           HZ       PHE  10  -0.041  -0.981  -4.442
   76    H    THR  11           H        THR  11   4.833  -4.894  -2.378
   77    HA   THR  11           HA       THR  11   5.598  -2.261  -3.442
   78    HB   THR  11           HB       THR  11   7.493  -4.600  -3.498
   79    HG1  THR  11           HG1      THR  11   7.513  -2.477  -1.598
   80   1HG2  THR  11          1HG2      THR  11   8.819  -2.125  -3.412
   81   2HG2  THR  11          2HG2      THR  11   7.479  -1.921  -4.541
   82   3HG2  THR  11          3HG2      THR  11   8.657  -3.209  -4.793
   83    H    LEU  12           H        LEU  12   4.933  -2.039  -5.467
   84    HA   LEU  12           HA       LEU  12   4.548  -4.459  -7.098
   85   1HB   LEU  12          1HB       LEU  12   2.468  -3.384  -6.799
   86   2HB   LEU  12          2HB       LEU  12   3.163  -1.793  -7.101
   87    HG   LEU  12           HG       LEU  12   3.298  -2.190  -9.429
   88   1HD1  LEU  12          1HD1      LEU  12   3.204  -5.002  -8.613
   89   2HD1  LEU  12          2HD1      LEU  12   3.992  -4.243  -9.995
   90   3HD1  LEU  12          3HD1      LEU  12   2.271  -4.624 -10.061
   91   1HD2  LEU  12          1HD2      LEU  12   0.697  -3.465  -8.616
   92   2HD2  LEU  12          2HD2      LEU  12   1.028  -2.467 -10.032
   93   3HD2  LEU  12          3HD2      LEU  12   1.024  -1.743  -8.423
   94    H    ASN  13           H        ASN  13   5.865  -4.745  -8.765
   95    HA   ASN  13           HA       ASN  13   7.432  -2.451  -9.724
   96   1HB   ASN  13          1HB       ASN  13   8.913  -4.272 -10.717
   97   2HB   ASN  13          2HB       ASN  13   8.896  -4.152  -8.960
   98   1HD2  ASN  13          1HD2      ASN  13   8.290  -6.118 -11.670
   99   2HD2  ASN  13          2HD2      ASN  13   7.722  -7.513 -10.824
  100    H    ASN  14           H        ASN  14   7.404  -1.843 -11.833
  101    HA   ASN  14           HA       ASN  14   6.504  -1.532 -13.905
  102   1HB   ASN  14          1HB       ASN  14   6.503  -4.545 -14.089
  103   2HB   ASN  14          2HB       ASN  14   6.706  -3.382 -15.395
  104   1HD2  ASN  14          1HD2      ASN  14   8.394  -5.619 -14.394
  105   2HD2  ASN  14          2HD2      ASN  14   9.948  -4.915 -14.121
  106    HA   PRO  15           HA       PRO  15   2.225  -2.684 -12.375
  107   1HB   PRO  15          1HB       PRO  15   1.339  -0.133 -12.099
  108   2HB   PRO  15          2HB       PRO  15   2.170  -1.006 -10.806
  109   1HG   PRO  15          1HG       PRO  15   3.258   1.010 -12.733
  110   2HG   PRO  15          2HG       PRO  15   3.552   0.855 -10.991
  111   1HD   PRO  15          1HD       PRO  15   5.311  -0.030 -12.850
  112   2HD   PRO  15          2HD       PRO  15   5.106  -0.824 -11.276
  113    H    LEU  16           H        LEU  16   0.476  -2.814 -13.702
  114    HA   LEU  16           HA       LEU  16   0.792  -1.804 -16.405
  115   1HB   LEU  16          1HB       LEU  16  -1.126  -3.707 -15.098
  116   2HB   LEU  16          2HB       LEU  16  -1.375  -3.121 -16.741
  117    HG   LEU  16           HG       LEU  16   1.100  -4.036 -17.039
  118   1HD1  LEU  16          1HD1      LEU  16   1.669  -4.844 -14.961
  119   2HD1  LEU  16          2HD1      LEU  16   1.049  -6.297 -15.745
  120   3HD1  LEU  16          3HD1      LEU  16   0.034  -5.406 -14.611
  121   1HD2  LEU  16          1HD2      LEU  16  -1.162  -4.706 -18.106
  122   2HD2  LEU  16          2HD2      LEU  16  -1.109  -6.055 -16.970
  123   3HD2  LEU  16          3HD2      LEU  16   0.182  -5.848 -18.155
  124    H    SER  17           H        SER  17  -0.486  -0.621 -13.609
  125    HA   SER  17           HA       SER  17  -1.719   1.586 -14.807
  126   1HB   SER  17          1HB       SER  17  -3.917   1.094 -14.993
  127   2HB   SER  17          2HB       SER  17  -3.386  -0.588 -14.983
  128    HG   SER  17           HG       SER  17  -4.443  -0.793 -13.192
  129    HA   PRO  18           HA       PRO  18  -1.346   3.177 -10.737
  130   1HB   PRO  18          1HB       PRO  18  -3.369   4.983 -10.625
  131   2HB   PRO  18          2HB       PRO  18  -1.910   5.234 -11.590
  132   1HG   PRO  18          1HG       PRO  18  -4.613   4.281 -12.454
  133   2HG   PRO  18          2HG       PRO  18  -3.532   5.443 -13.244
  134   1HD   PRO  18          1HD       PRO  18  -3.739   2.867 -14.050
  135   2HD   PRO  18          2HD       PRO  18  -2.226   3.788 -14.175
  136    H    LEU  19           H        LEU  19  -2.212   3.147  -8.628
  137    HA   LEU  19           HA       LEU  19  -4.032   1.026  -8.112
  138   1HB   LEU  19          1HB       LEU  19  -2.950   3.148  -6.264
  139   2HB   LEU  19          2HB       LEU  19  -3.802   1.691  -5.757
  140    HG   LEU  19           HG       LEU  19  -1.085   1.851  -7.056
  141   1HD1  LEU  19          1HD1      LEU  19  -1.506   0.474  -4.492
  142   2HD1  LEU  19          2HD1      LEU  19  -1.709   2.226  -4.458
  143   3HD1  LEU  19          3HD1      LEU  19  -0.191   1.525  -5.019
  144   1HD2  LEU  19          1HD2      LEU  19  -1.337  -0.720  -6.298
  145   2HD2  LEU  19          2HD2      LEU  19  -1.682  -0.141  -7.928
  146   3HD2  LEU  19          3HD2      LEU  19  -2.999  -0.373  -6.777
  147    H    SER  20           H        SER  20  -5.971   1.273  -6.707
  148    HA   SER  20           HA       SER  20  -7.371   3.812  -6.926
  149   1HB   SER  20          1HB       SER  20  -9.367   2.751  -7.962
  150   2HB   SER  20          2HB       SER  20  -7.963   2.743  -9.030
  151    HG   SER  20           HG       SER  20  -8.814   0.710  -9.103
  152    H    LEU  21           H        LEU  21  -9.074   4.041  -5.464
  153    HA   LEU  21           HA       LEU  21  -8.848   2.814  -3.010
  154   1HB   LEU  21          1HB       LEU  21 -10.031   4.878  -3.243
  155   2HB   LEU  21          2HB       LEU  21 -11.232   4.131  -4.294
  156    HG   LEU  21           HG       LEU  21 -12.005   2.778  -2.359
  157   1HD1  LEU  21          1HD1      LEU  21  -9.621   3.794  -1.191
  158   2HD1  LEU  21          2HD1      LEU  21 -10.773   2.638  -0.525
  159   3HD1  LEU  21          3HD1      LEU  21 -10.996   4.365  -0.246
  160   1HD2  LEU  21          1HD2      LEU  21 -12.126   5.752  -2.437
  161   2HD2  LEU  21          2HD2      LEU  21 -12.835   4.910  -1.059
  162   3HD2  LEU  21          3HD2      LEU  21 -13.402   4.561  -2.693
  163    H    HIS  22           H        HIS  22 -10.174   1.299  -1.879
  164    HA   HIS  22           HA       HIS  22 -11.500  -0.655  -3.642
  165   1HB   HIS  22          1HB       HIS  22  -9.250  -1.310  -2.549
  166   2HB   HIS  22          2HB       HIS  22 -10.171  -1.409  -1.051
  167    HD1  HIS  22           HD1      HIS  22 -10.328  -3.860  -0.652
  168    HD2  HIS  22           HD2      HIS  22 -11.280  -2.844  -4.566
  169    HE1  HIS  22           HE1      HIS  22 -11.136  -5.988  -1.721
  170    H    ASP  23           H        ASP  23 -13.540  -1.173  -3.159
  171    HA   ASP  23           HA       ASP  23 -15.046   0.248  -1.299
  172   1HB   ASP  23          1HB       ASP  23 -15.483  -2.062  -3.069
  173   2HB   ASP  23          2HB       ASP  23 -16.532  -2.020  -1.655
  174    H    SER  24           H        SER  24 -13.097  -2.568  -0.899
  175    HA   SER  24           HA       SER  24 -14.347  -3.364   1.589
  176   1HB   SER  24          1HB       SER  24 -11.698  -4.387   0.596
  177   2HB   SER  24          2HB       SER  24 -12.910  -5.220   1.568
  178    HG   SER  24           HG       SER  24 -12.960  -5.948  -0.580
  179    H    MET  25           H        MET  25 -11.404  -1.735   0.526
  180    HA   MET  25           HA       MET  25 -10.314  -1.519   3.171
  181   1HB   MET  25          1HB       MET  25  -8.497  -0.448   2.190
  182   2HB   MET  25          2HB       MET  25  -9.063  -1.501   0.900
  183   1HG   MET  25          1HG       MET  25 -10.112   0.310  -0.227
  184   2HG   MET  25          2HG       MET  25  -9.847   1.389   1.141
  185   1HE   MET  25          1HE       MET  25  -8.012  -1.226  -0.735
  186   2HE   MET  25          2HE       MET  25  -7.647  -0.207  -2.127
  187   3HE   MET  25          3HE       MET  25  -6.380  -0.597  -0.963
  188    H    LYS  26           H        LYS  26  -9.508   0.943   3.624
  189    HA   LYS  26           HA       LYS  26 -11.935   2.614   3.574
  190   1HB   LYS  26          1HB       LYS  26 -10.573   1.535   5.829
  191   2HB   LYS  26          2HB       LYS  26 -10.320   3.275   5.833
  192   1HG   LYS  26          1HG       LYS  26 -12.601   3.728   5.999
  193   2HG   LYS  26          2HG       LYS  26 -13.054   2.102   5.483
  194   1HD   LYS  26          1HD       LYS  26 -11.607   1.541   7.700
  195   2HD   LYS  26          2HD       LYS  26 -12.292   3.106   8.146
  196   1HE   LYS  26          1HE       LYS  26 -14.412   2.305   8.226
  197   2HE   LYS  26          2HE       LYS  26 -14.141   1.153   6.919
  198   1HZ   LYS  26          1HZ       LYS  26 -13.463   0.872   9.782
  199   2HZ   LYS  26          2HZ       LYS  26 -12.730  -0.095   8.604
  200   3HZ   LYS  26          3HZ       LYS  26 -14.407  -0.148   8.817
  201    H    TYR  27           H        TYR  27  -8.406   2.546   3.731
  202    HA   TYR  27           HA       TYR  27  -8.374   5.178   2.429
  203   1HB   TYR  27          1HB       TYR  27  -7.778   5.052   5.014
  204   2HB   TYR  27          2HB       TYR  27  -6.214   4.543   4.386
  205    HD1  TYR  27           HD1      TYR  27  -8.739   7.265   4.142
  206    HD2  TYR  27           HD2      TYR  27  -4.669   6.132   3.643
  207    HE1  TYR  27           HE1      TYR  27  -8.138   9.618   3.753
  208    HE2  TYR  27           HE2      TYR  27  -4.056   8.482   3.254
  209    HH   TYR  27           HH       TYR  27  -5.880  11.016   4.061
  210    H    LEU  28           H        LEU  28  -6.561   5.579   1.091
  211    HA   LEU  28           HA       LEU  28  -4.891   3.235   0.490
  212   1HB   LEU  28          1HB       LEU  28  -6.447   3.137  -1.239
  213   2HB   LEU  28          2HB       LEU  28  -6.537   4.891  -1.384
  214    HG   LEU  28           HG       LEU  28  -4.448   4.980  -2.529
  215   1HD1  LEU  28          1HD1      LEU  28  -2.865   3.549  -1.896
  216   2HD1  LEU  28          2HD1      LEU  28  -3.621   2.387  -2.987
  217   3HD1  LEU  28          3HD1      LEU  28  -4.045   2.394  -1.275
  218   1HD2  LEU  28          1HD2      LEU  28  -6.378   4.381  -3.893
  219   2HD2  LEU  28          2HD2      LEU  28  -6.081   2.671  -3.580
  220   3HD2  LEU  28          3HD2      LEU  28  -4.912   3.615  -4.504
  221    H    VAL  29           H        VAL  29  -2.790   3.684   0.454
  222    HA   VAL  29           HA       VAL  29  -1.914   6.401  -0.226
  223    HB   VAL  29           HB       VAL  29  -0.979   4.847   2.190
  224   1HG1  VAL  29          1HG1      VAL  29   0.209   7.209   2.487
  225   2HG1  VAL  29          2HG1      VAL  29   0.972   5.871   1.626
  226   3HG1  VAL  29          3HG1      VAL  29   0.166   7.156   0.725
  227   1HG2  VAL  29          1HG2      VAL  29  -2.639   5.908   3.225
  228   2HG2  VAL  29          2HG2      VAL  29  -1.768   7.412   2.929
  229   3HG2  VAL  29          3HG2      VAL  29  -3.003   6.871   1.793
  230    H    TYR  30           H        TYR  30  -0.455   6.322  -1.791
  231    HA   TYR  30           HA       TYR  30   1.657   4.345  -1.761
  232   1HB   TYR  30          1HB       TYR  30   1.169   3.247  -3.756
  233   2HB   TYR  30          2HB       TYR  30  -0.418   3.396  -3.009
  234    HD1  TYR  30           HD2      TYR  30  -2.069   4.970  -3.897
  235    HD2  TYR  30           HD1      TYR  30   1.726   4.477  -5.758
  236    HE1  TYR  30           HE2      TYR  30  -2.913   6.107  -5.908
  237    HE2  TYR  30           HE1      TYR  30   0.892   5.614  -7.773
  238    HH   TYR  30           HH       TYR  30  -1.596   5.936  -8.809
  239    H    GLN  31           H        GLN  31   3.329   4.794  -3.351
  240    HA   GLN  31           HA       GLN  31   3.199   7.422  -4.622
  241   1HB   GLN  31          1HB       GLN  31   5.220   8.216  -3.640
  242   2HB   GLN  31          2HB       GLN  31   4.187   7.678  -2.322
  243   1HG   GLN  31          1HG       GLN  31   5.454   5.700  -2.017
  244   2HG   GLN  31          2HG       GLN  31   6.348   5.966  -3.513
  245   1HE2  GLN  31          1HE2      GLN  31   5.546   8.225  -0.918
  246   2HE2  GLN  31          2HE2      GLN  31   7.179   8.608  -0.505
  247    H    THR  32           H        THR  32   4.854   7.763  -6.227
  248    HA   THR  32           HA       THR  32   5.657   5.248  -7.479
  249    HB   THR  32           HB       THR  32   5.763   8.055  -8.601
  250    HG1  THR  32           HG1      THR  32   3.757   6.128  -8.464
  251   1HG2  THR  32          1HG2      THR  32   6.030   6.944 -10.762
  252   2HG2  THR  32          2HG2      THR  32   6.028   5.372  -9.963
  253   3HG2  THR  32          3HG2      THR  32   7.342   6.510  -9.667
  254    H    GLU  33           H        GLU  33   7.741   4.666  -7.872
  255    HA   GLU  33           HA       GLU  33   9.868   6.529  -7.076
  256   1HB   GLU  33          1HB       GLU  33   9.286   3.830  -5.976
  257   2HB   GLU  33          2HB       GLU  33  10.974   4.235  -6.249
  258   1HG   GLU  33          1HG       GLU  33  10.911   6.015  -4.730
  259   2HG   GLU  33          2HG       GLU  33   9.149   6.043  -4.706
  260    H    GLN  34           H        GLN  34  11.967   6.022  -7.974
  261    HA   GLN  34           HA       GLN  34  11.716   4.762 -10.603
  262   1HB   GLN  34          1HB       GLN  34  12.945   7.120  -9.726
  263   2HB   GLN  34          2HB       GLN  34  14.270   6.027 -10.102
  264   1HG   GLN  34          1HG       GLN  34  12.286   5.915 -12.169
  265   2HG   GLN  34          2HG       GLN  34  12.773   7.584 -11.877
  266   1HE2  GLN  34          1HE2      GLN  34  13.726   7.587 -13.961
  267   2HE2  GLN  34          2HE2      GLN  34  15.267   6.854 -14.229
  268    H    GLY  35           H        GLY  35  12.821   2.974 -11.191
  269   1HA   GLY  35          1HA       GLY  35  15.217   2.028 -10.194
  270   2HA   GLY  35          2HA       GLY  35  13.974   1.344  -9.157
  271    H    GLU  36           H        GLU  36  15.453  -0.435 -10.436
  272    HA   GLU  36           HA       GLU  36  15.561  -2.029 -12.098
  273   1HB   GLU  36          1HB       GLU  36  13.305  -3.199 -12.330
  274   2HB   GLU  36          2HB       GLU  36  13.976  -3.078 -10.710
  275   1HG   GLU  36          1HG       GLU  36  12.516  -1.191 -10.230
  276   2HG   GLU  36          2HG       GLU  36  11.858  -1.277 -11.863
  277    H    ALA  37           H        ALA  37  16.145  -0.687 -13.867
  278    HA   ALA  37           HA       ALA  37  15.962   0.017 -16.025
  279   1HB   ALA  37          1HB       ALA  37  13.358  -0.758 -16.795
  280   2HB   ALA  37          2HB       ALA  37  14.891  -1.536 -17.191
  281   3HB   ALA  37          3HB       ALA  37  13.997  -2.031 -15.754
  282    H    GLY  38           H        GLY  38  14.465   1.369 -17.524
  283   1HA   GLY  38          1HA       GLY  38  13.919   3.795 -16.303
  284   2HA   GLY  38          2HA       GLY  38  13.267   3.299 -17.858
  285    H    ASN  39           H        ASN  39  11.918   0.971 -16.499
  286    HA   ASN  39           HA       ASN  39   9.383   2.076 -16.210
  287   1HB   ASN  39          1HB       ASN  39  10.249  -0.458 -14.825
  288   2HB   ASN  39          2HB       ASN  39   8.662  -0.062 -15.479
  289   1HD2  ASN  39          1HD2      ASN  39  10.554  -2.302 -15.982
  290   2HD2  ASN  39          2HD2      ASN  39  10.766  -2.329 -17.696
  291    H    ILE  40           H        ILE  40   8.035   1.741 -14.129
  292    HA   ILE  40           HA       ILE  40   9.558   2.733 -11.811
  293    HB   ILE  40           HB       ILE  40   7.173   3.870 -11.348
  294   1HG1  ILE  40          1HG1      ILE  40   7.499   4.010 -14.352
  295   2HG1  ILE  40          2HG1      ILE  40   6.274   3.058 -13.522
  296   1HG2  ILE  40          1HG2      ILE  40   8.479   5.664 -11.318
  297   2HG2  ILE  40          2HG2      ILE  40   9.745   4.706 -12.084
  298   3HG2  ILE  40          3HG2      ILE  40   8.624   5.640 -13.075
  299   1HD1  ILE  40          1HD1      ILE  40   6.243   5.810 -12.654
  300   2HD1  ILE  40          2HD1      ILE  40   6.038   5.667 -14.400
  301   3HD1  ILE  40          3HD1      ILE  40   4.944   4.815 -13.311
  302    H    HIS  41           H        HIS  41   8.311   2.499  -9.735
  303    HA   HIS  41           HA       HIS  41   6.542   0.153  -9.765
  304   1HB   HIS  41          1HB       HIS  41   7.785  -0.444  -7.538
  305   2HB   HIS  41          2HB       HIS  41   8.484  -0.912  -9.085
  306    HD1  HIS  41           HD1      HIS  41  10.915  -0.849  -8.422
  307    HD2  HIS  41           HD2      HIS  41   8.912   2.684  -7.546
  308    HE1  HIS  41           HE1      HIS  41  12.702   0.786  -7.745
  309    H    PHE  42           H        PHE  42   5.063   0.022  -8.038
  310    HA   PHE  42           HA       PHE  42   4.586   2.601  -6.719
  311   1HB   PHE  42          1HB       PHE  42   2.734   0.294  -7.333
  312   2HB   PHE  42          2HB       PHE  42   2.266   1.685  -6.362
  313    HD1  PHE  42           HD1      PHE  42   3.749   3.788  -7.957
  314    HD2  PHE  42           HD2      PHE  42   1.242   0.556  -9.134
  315    HE1  PHE  42           HE1      PHE  42   3.139   5.011 -10.003
  316    HE2  PHE  42           HE2      PHE  42   0.629   1.773 -11.183
  317    HZ   PHE  42           HZ       PHE  42   1.578   4.003 -11.619
  318    H    GLN  43           H        GLN  43   4.680   2.804  -4.566
  319    HA   GLN  43           HA       GLN  43   4.613   0.404  -2.892
  320   1HB   GLN  43          1HB       GLN  43   6.910   2.235  -3.264
  321   2HB   GLN  43          2HB       GLN  43   6.550   1.772  -1.607
  322   1HG   GLN  43          1HG       GLN  43   7.246  -0.341  -1.903
  323   2HG   GLN  43          2HG       GLN  43   6.598  -0.438  -3.539
  324   1HE2  GLN  43          1HE2      GLN  43   7.811   0.962  -5.151
  325   2HE2  GLN  43          2HE2      GLN  43   9.535   0.918  -5.055
  326    H    GLY  44           H        GLY  44   4.023   0.776  -0.714
  327   1HA   GLY  44          1HA       GLY  44   3.699   3.077   0.676
  328   2HA   GLY  44          2HA       GLY  44   2.302   3.074  -0.390
  329    H    TYR  45           H        TYR  45   1.324   3.093   1.876
  330    HA   TYR  45           HA       TYR  45   0.991   0.321   2.820
  331   1HB   TYR  45          1HB       TYR  45   0.646   1.114   5.019
  332   2HB   TYR  45          2HB       TYR  45   2.022   2.029   4.414
  333    HD1  TYR  45           HD1      TYR  45  -1.522   2.193   5.351
  334    HD2  TYR  45           HD2      TYR  45   1.853   4.406   4.004
  335    HE1  TYR  45           HE1      TYR  45  -2.687   4.289   5.896
  336    HE2  TYR  45           HE2      TYR  45   0.697   6.508   4.546
  337    HH   TYR  45           HH       TYR  45  -1.491   7.367   4.904
  338    H    ILE  46           H        ILE  46  -1.065  -0.460   3.193
  339    HA   ILE  46           HA       ILE  46  -3.320   1.294   2.514
  340    HB   ILE  46           HB       ILE  46  -3.008  -1.513   1.445
  341   1HG1  ILE  46          1HG1      ILE  46  -2.823   1.128  -0.021
  342   2HG1  ILE  46          2HG1      ILE  46  -1.454   0.095   0.376
  343   1HG2  ILE  46          1HG2      ILE  46  -5.147  -1.427   0.825
  344   2HG2  ILE  46          2HG2      ILE  46  -5.300  -0.042   1.905
  345   3HG2  ILE  46          3HG2      ILE  46  -4.976   0.210   0.190
  346   1HD1  ILE  46          1HD1      ILE  46  -3.759  -0.802  -1.328
  347   2HD1  ILE  46          2HD1      ILE  46  -2.287  -0.077  -1.973
  348   3HD1  ILE  46          3HD1      ILE  46  -2.206  -1.604  -1.094
  349    H    GLU  47           H        GLU  47  -4.935   1.162   3.931
  350    HA   GLU  47           HA       GLU  47  -4.913  -1.061   5.851
  351   1HB   GLU  47          1HB       GLU  47  -6.435   1.523   6.145
  352   2HB   GLU  47          2HB       GLU  47  -6.011   0.365   7.398
  353   1HG   GLU  47          1HG       GLU  47  -3.580   1.164   6.297
  354   2HG   GLU  47          2HG       GLU  47  -4.540   2.636   6.425
  355    H    MET  48           H        MET  48  -6.356  -2.613   5.555
  356    HA   MET  48           HA       MET  48  -8.600  -2.248   3.786
  357   1HB   MET  48          1HB       MET  48  -7.710  -4.614   5.443
  358   2HB   MET  48          2HB       MET  48  -9.065  -4.644   4.321
  359   1HG   MET  48          1HG       MET  48  -6.175  -4.167   3.637
  360   2HG   MET  48          2HG       MET  48  -7.118  -5.615   3.295
  361   1HE   MET  48          1HE       MET  48  -9.038  -4.998   0.257
  362   2HE   MET  48          2HE       MET  48  -8.711  -5.969   1.693
  363   3HE   MET  48          3HE       MET  48  -9.900  -4.667   1.760
  364    H    LYS  49           H        LYS  49 -10.700  -3.501   4.680
  365    HA   LYS  49           HA       LYS  49 -12.026  -1.778   6.360
  366   1HB   LYS  49          1HB       LYS  49 -12.724  -4.000   4.946
  367   2HB   LYS  49          2HB       LYS  49 -12.884  -4.589   6.595
  368   1HG   LYS  49          1HG       LYS  49 -14.790  -3.493   6.885
  369   2HG   LYS  49          2HG       LYS  49 -14.089  -1.983   6.296
  370   1HD   LYS  49          1HD       LYS  49 -14.810  -2.323   4.156
  371   2HD   LYS  49          2HD       LYS  49 -14.733  -4.081   4.294
  372   1HE   LYS  49          1HE       LYS  49 -17.046  -3.155   4.120
  373   2HE   LYS  49          2HE       LYS  49 -16.761  -4.143   5.552
  374   1HZ   LYS  49          1HZ       LYS  49 -16.322  -1.270   5.810
  375   2HZ   LYS  49          2HZ       LYS  49 -16.954  -2.373   6.926
  376   3HZ   LYS  49          3HZ       LYS  49 -17.927  -1.788   5.671
  377    H    LYS  50           H        LYS  50 -10.884  -5.021   7.324
  378    HA   LYS  50           HA       LYS  50  -9.632  -4.241   9.685
  379   1HB   LYS  50          1HB       LYS  50 -12.507  -4.285   9.874
  380   2HB   LYS  50          2HB       LYS  50 -11.819  -5.516  10.924
  381   1HG   LYS  50          1HG       LYS  50 -10.539  -3.907  12.112
  382   2HG   LYS  50          2HG       LYS  50 -10.918  -2.648  10.935
  383   1HD   LYS  50          1HD       LYS  50 -13.219  -3.966  12.241
  384   2HD   LYS  50          2HD       LYS  50 -12.221  -2.932  13.266
  385   1HE   LYS  50          1HE       LYS  50 -12.557  -1.060  11.801
  386   2HE   LYS  50          2HE       LYS  50 -13.382  -2.075  10.619
  387   1HZ   LYS  50          1HZ       LYS  50 -14.594  -0.620  12.548
  388   2HZ   LYS  50          2HZ       LYS  50 -14.567  -2.164  13.237
  389   3HZ   LYS  50          3HZ       LYS  50 -15.295  -1.924  11.728
  390    H    ARG  51           H        ARG  51 -12.029  -6.834   9.250
  391    HA   ARG  51           HA       ARG  51  -9.994  -8.808   9.869
  392   1HB   ARG  51          1HB       ARG  51 -12.532  -8.714  10.621
  393   2HB   ARG  51          2HB       ARG  51 -12.776  -9.564   9.101
  394   1HG   ARG  51          1HG       ARG  51 -12.139 -11.476  10.013
  395   2HG   ARG  51          2HG       ARG  51 -10.612 -10.765  10.538
  396   1HD   ARG  51          1HD       ARG  51 -11.370 -10.349  12.638
  397   2HD   ARG  51          2HD       ARG  51 -13.023 -10.056  12.099
  398    HE   ARG  51           HE       ARG  51 -12.468 -12.768  11.744
  399   1HH1  ARG  51          1HH1      ARG  51 -12.826 -10.469  14.334
  400   2HH1  ARG  51          2HH1      ARG  51 -13.386 -11.645  15.475
  401   1HH2  ARG  51          1HH2      ARG  51 -13.205 -14.326  13.238
  402   2HH2  ARG  51          2HH2      ARG  51 -13.601 -13.839  14.851
  403    H    THR  52           H        THR  52  -9.262  -7.665   7.564
  404    HA   THR  52           HA       THR  52 -10.080  -9.565   5.464
  405    HB   THR  52           HB       THR  52  -8.612  -7.072   4.754
  406    HG1  THR  52           HG1      THR  52 -10.946  -6.205   4.604
  407   1HG2  THR  52          1HG2      THR  52  -9.855  -9.129   3.366
  408   2HG2  THR  52          2HG2      THR  52  -9.319  -7.588   2.696
  409   3HG2  THR  52          3HG2      THR  52 -10.985  -7.781   3.240
  410    H    SER  53           H        SER  53  -8.643 -11.119   5.129
  411    HA   SER  53           HA       SER  53  -5.926 -10.907   6.015
  412   1HB   SER  53          1HB       SER  53  -5.801 -13.180   4.717
  413   2HB   SER  53          2HB       SER  53  -6.728 -13.080   6.213
  414    HG   SER  53           HG       SER  53  -7.939 -14.103   4.596
  415    H    LEU  54           H        LEU  54  -4.251 -11.904   4.307
  416    HA   LEU  54           HA       LEU  54  -3.614  -9.888   2.527
  417   1HB   LEU  54          1HB       LEU  54  -2.030 -11.577   3.302
  418   2HB   LEU  54          2HB       LEU  54  -2.872 -12.806   2.360
  419    HG   LEU  54           HG       LEU  54  -2.222 -11.624   0.293
  420   1HD1  LEU  54          1HD1      LEU  54  -0.406  -9.942   1.992
  421   2HD1  LEU  54          2HD1      LEU  54  -2.003  -9.388   1.489
  422   3HD1  LEU  54          3HD1      LEU  54  -0.781  -9.774   0.277
  423   1HD2  LEU  54          1HD2      LEU  54  -0.859 -13.460   1.135
  424   2HD2  LEU  54          2HD2      LEU  54   0.070 -12.333   2.123
  425   3HD2  LEU  54          3HD2      LEU  54   0.146 -12.234   0.363
  426    H    ALA  55           H        ALA  55  -5.709 -12.640   2.093
  427    HA   ALA  55           HA       ALA  55  -5.846 -12.804  -0.672
  428   1HB   ALA  55          1HB       ALA  55  -7.971 -13.875  -0.388
  429   2HB   ALA  55          2HB       ALA  55  -6.919 -14.368   0.940
  430   3HB   ALA  55          3HB       ALA  55  -8.173 -13.158   1.211
  431    H    GLY  56           H        GLY  56  -7.316 -10.491   1.519
  432   1HA   GLY  56          1HA       GLY  56  -9.110  -9.360  -0.391
  433   2HA   GLY  56          2HA       GLY  56  -8.636  -8.642   1.141
  434    H    MET  57           H        MET  57  -5.918  -8.370   0.822
  435    HA   MET  57           HA       MET  57  -5.790  -6.040  -0.813
  436   1HB   MET  57          1HB       MET  57  -3.672  -7.578   0.692
  437   2HB   MET  57          2HB       MET  57  -3.347  -6.085  -0.178
  438   1HG   MET  57          1HG       MET  57  -5.584  -5.966   1.720
  439   2HG   MET  57          2HG       MET  57  -3.995  -6.224   2.436
  440   1HE   MET  57          1HE       MET  57  -5.724  -4.052  -0.392
  441   2HE   MET  57          2HE       MET  57  -4.540  -2.752  -0.531
  442   3HE   MET  57          3HE       MET  57  -4.089  -4.404  -0.953
  443    H    LYS  58           H        LYS  58  -4.306  -9.264  -1.033
  444    HA   LYS  58           HA       LYS  58  -2.805  -8.910  -3.330
  445   1HB   LYS  58          1HB       LYS  58  -3.254 -10.997  -1.693
  446   2HB   LYS  58          2HB       LYS  58  -4.237 -11.495  -3.064
  447   1HG   LYS  58          1HG       LYS  58  -2.274 -11.257  -4.529
  448   2HG   LYS  58          2HG       LYS  58  -1.300 -10.834  -3.119
  449   1HD   LYS  58          1HD       LYS  58  -2.818 -13.422  -3.430
  450   2HD   LYS  58          2HD       LYS  58  -1.103 -13.220  -3.800
  451   1HE   LYS  58          1HE       LYS  58  -0.849 -12.385  -1.411
  452   2HE   LYS  58          2HE       LYS  58  -2.478 -13.000  -1.134
  453   1HZ   LYS  58          1HZ       LYS  58  -1.232 -15.085  -2.323
  454   2HZ   LYS  58          2HZ       LYS  58  -1.456 -14.907  -0.657
  455   3HZ   LYS  58          3HZ       LYS  58   0.003 -14.431  -1.369
  456    H    LYS  59           H        LYS  59  -6.249  -9.455  -2.980
  457    HA   LYS  59           HA       LYS  59  -6.909 -10.149  -5.594
  458   1HB   LYS  59          1HB       LYS  59  -8.292  -9.375  -3.228
  459   2HB   LYS  59          2HB       LYS  59  -8.940  -8.432  -4.563
  460   1HG   LYS  59          1HG       LYS  59  -9.315 -10.531  -5.813
  461   2HG   LYS  59          2HG       LYS  59  -8.766 -11.433  -4.398
  462   1HD   LYS  59          1HD       LYS  59 -10.622  -9.896  -3.234
  463   2HD   LYS  59          2HD       LYS  59 -11.300  -9.972  -4.862
  464   1HE   LYS  59          1HE       LYS  59 -11.224 -12.414  -4.780
  465   2HE   LYS  59          2HE       LYS  59 -10.531 -12.342  -3.161
  466   1HZ   LYS  59          1HZ       LYS  59 -12.562 -12.229  -2.328
  467   2HZ   LYS  59          2HZ       LYS  59 -13.228 -12.319  -3.880
  468   3HZ   LYS  59          3HZ       LYS  59 -12.879 -10.812  -3.197
  469    H    LEU  60           H        LEU  60  -6.163  -7.033  -4.188
  470    HA   LEU  60           HA       LEU  60  -7.014  -5.553  -6.514
  471   1HB   LEU  60          1HB       LEU  60  -5.574  -4.808  -3.985
  472   2HB   LEU  60          2HB       LEU  60  -5.824  -3.658  -5.297
  473    HG   LEU  60           HG       LEU  60  -8.310  -4.127  -5.031
  474   1HD1  LEU  60          1HD1      LEU  60  -8.845  -5.820  -3.691
  475   2HD1  LEU  60          2HD1      LEU  60  -8.410  -4.769  -2.344
  476   3HD1  LEU  60          3HD1      LEU  60  -7.222  -5.892  -3.005
  477   1HD2  LEU  60          1HD2      LEU  60  -6.538  -2.412  -3.623
  478   2HD2  LEU  60          2HD2      LEU  60  -7.814  -2.915  -2.513
  479   3HD2  LEU  60          3HD2      LEU  60  -8.230  -2.143  -4.044
  480    H    ILE  61           H        ILE  61  -3.977  -6.680  -5.123
  481    HA   ILE  61           HA       ILE  61  -2.617  -5.841  -7.601
  482    HB   ILE  61           HB       ILE  61  -1.040  -6.309  -5.119
  483   1HG1  ILE  61          1HG1      ILE  61  -2.848  -4.872  -4.327
  484   2HG1  ILE  61          2HG1      ILE  61  -1.349  -3.956  -4.436
  485   1HG2  ILE  61          1HG2      ILE  61   0.432  -4.678  -6.095
  486   2HG2  ILE  61          2HG2      ILE  61   0.002  -5.865  -7.325
  487   3HG2  ILE  61          3HG2      ILE  61  -0.764  -4.277  -7.327
  488   1HD1  ILE  61          1HD1      ILE  61  -2.785  -3.751  -6.900
  489   2HD1  ILE  61          2HD1      ILE  61  -3.835  -3.323  -5.548
  490   3HD1  ILE  61          3HD1      ILE  61  -2.302  -2.482  -5.775
  491    HA   PRO  62           HA       PRO  62  -2.474 -10.468  -7.339
  492   1HB   PRO  62          1HB       PRO  62  -3.013 -10.859  -9.971
  493   2HB   PRO  62          2HB       PRO  62  -4.276 -10.663  -8.751
  494   1HG   PRO  62          1HG       PRO  62  -3.162  -8.648 -10.664
  495   2HG   PRO  62          2HG       PRO  62  -4.850  -8.944 -10.208
  496   1HD   PRO  62          1HD       PRO  62  -3.393  -6.915  -9.163
  497   2HD   PRO  62          2HD       PRO  62  -4.660  -7.752  -8.244
  498    H    GLY  63           H        GLY  63  -0.262 -10.587  -7.024
  499   1HA   GLY  63          1HA       GLY  63   1.657 -11.573  -8.170
  500   2HA   GLY  63          2HA       GLY  63   1.359 -10.450  -9.489
  501    H    ALA  64           H        ALA  64   1.128  -9.428  -6.168
  502    HA   ALA  64           HA       ALA  64   3.655  -7.944  -6.497
  503   1HB   ALA  64          1HB       ALA  64   1.013  -7.073  -5.400
  504   2HB   ALA  64          2HB       ALA  64   2.503  -6.295  -4.865
  505   3HB   ALA  64          3HB       ALA  64   2.058  -6.270  -6.571
  506    H    HIS  65           H        HIS  65   4.656  -7.288  -4.397
  507    HA   HIS  65           HA       HIS  65   4.596  -9.567  -2.567
  508   1HB   HIS  65          1HB       HIS  65   6.740  -8.586  -3.628
  509   2HB   HIS  65          2HB       HIS  65   6.563  -7.293  -2.445
  510    HD1  HIS  65           HD1      HIS  65   8.455  -7.807  -0.892
  511    HD2  HIS  65           HD2      HIS  65   6.088 -11.132  -1.662
  512    HE1  HIS  65           HE1      HIS  65   9.280  -9.595   0.672
  513    H    PHE  66           H        PHE  66   3.255  -9.406  -0.899
  514    HA   PHE  66           HA       PHE  66   2.865  -6.770   0.350
  515   1HB   PHE  66          1HB       PHE  66   1.061  -9.043  -0.191
  516   2HB   PHE  66          2HB       PHE  66   0.870  -8.294   1.391
  517    HD1  PHE  66           HD1      PHE  66   0.827  -7.638  -2.244
  518    HD2  PHE  66           HD2      PHE  66  -0.201  -6.215   1.633
  519    HE1  PHE  66           HE1      PHE  66  -0.515  -5.844  -3.262
  520    HE2  PHE  66           HE2      PHE  66  -1.545  -4.420   0.622
  521    HZ   PHE  66           HZ       PHE  66  -1.704  -4.233  -1.829
  522    H    GLU  67           H        GLU  67   2.625  -6.718   2.690
  523    HA   GLU  67           HA       GLU  67   3.661  -8.986   4.179
  524   1HB   GLU  67          1HB       GLU  67   5.561  -7.378   3.303
  525   2HB   GLU  67          2HB       GLU  67   5.042  -6.378   4.653
  526   1HG   GLU  67          1HG       GLU  67   5.289  -8.637   5.981
  527   2HG   GLU  67          2HG       GLU  67   6.385  -9.026   4.656
  528    H    LYS  68           H        LYS  68   2.184  -9.194   5.720
  529    HA   LYS  68           HA       LYS  68   0.991  -6.788   6.902
  530   1HB   LYS  68          1HB       LYS  68  -0.438  -8.668   5.927
  531   2HB   LYS  68          2HB       LYS  68   0.070  -9.629   7.310
  532   1HG   LYS  68          1HG       LYS  68  -0.786  -7.456   8.603
  533   2HG   LYS  68          2HG       LYS  68  -1.803  -7.350   7.164
  534   1HD   LYS  68          1HD       LYS  68  -2.905  -9.314   7.635
  535   2HD   LYS  68          2HD       LYS  68  -1.558  -9.970   8.568
  536   1HE   LYS  68          1HE       LYS  68  -2.577  -7.571   9.794
  537   2HE   LYS  68          2HE       LYS  68  -3.873  -8.741   9.548
  538   1HZ   LYS  68          1HZ       LYS  68  -2.224 -10.392  10.578
  539   2HZ   LYS  68          2HZ       LYS  68  -3.017  -9.307  11.605
  540   3HZ   LYS  68          3HZ       LYS  68  -1.413  -9.022  11.150
  541    H    ARG  69           H        ARG  69   3.675  -8.129   7.503
  542    HA   ARG  69           HA       ARG  69   3.367  -9.019  10.237
  543   1HB   ARG  69          1HB       ARG  69   5.720  -8.651   8.400
  544   2HB   ARG  69          2HB       ARG  69   5.945  -8.977  10.113
  545   1HG   ARG  69          1HG       ARG  69   4.703 -11.062   9.890
  546   2HG   ARG  69          2HG       ARG  69   4.452 -10.732   8.175
  547   1HD   ARG  69          1HD       ARG  69   6.571 -11.295   7.621
  548   2HD   ARG  69          2HD       ARG  69   7.246 -10.641   9.114
  549    HE   ARG  69           HE       ARG  69   5.815 -12.907   9.812
  550   1HH1  ARG  69          1HH1      ARG  69   8.571 -12.108   7.840
  551   2HH1  ARG  69          2HH1      ARG  69   9.344 -13.641   8.071
  552   1HH2  ARG  69          1HH2      ARG  69   6.824 -14.929  10.123
  553   2HH2  ARG  69          2HH2      ARG  69   8.349 -15.245   9.369
  554    H    ARG  70           H        ARG  70   3.061  -6.099   8.991
  555    HA   ARG  70           HA       ARG  70   3.148  -3.993   9.853
  556   1HB   ARG  70          1HB       ARG  70   2.610  -5.309  11.999
  557   2HB   ARG  70          2HB       ARG  70   4.315  -5.121  12.387
  558   1HG   ARG  70          1HG       ARG  70   4.120  -2.751  12.456
  559   2HG   ARG  70          2HG       ARG  70   2.484  -2.810  11.797
  560   1HD   ARG  70          1HD       ARG  70   2.510  -4.452  14.091
  561   2HD   ARG  70          2HD       ARG  70   3.341  -2.958  14.522
  562    HE   ARG  70           HE       ARG  70   0.936  -2.394  13.140
  563   1HH1  ARG  70          1HH1      ARG  70   2.145  -3.463  16.225
  564   2HH1  ARG  70          2HH1      ARG  70   0.791  -2.850  17.115
  565   1HH2  ARG  70          1HH2      ARG  70  -0.852  -1.582  14.301
  566   2HH2  ARG  70          2HH2      ARG  70  -0.914  -1.781  16.019
  567    H    GLY  71           H        GLY  71   4.967  -4.060   8.177
  568   1HA   GLY  71          1HA       GLY  71   7.650  -4.272   8.744
  569   2HA   GLY  71          2HA       GLY  71   6.989  -3.154   7.560
  570    H    THR  72           H        THR  72   5.474  -1.675   9.607
  571    HA   THR  72           HA       THR  72   7.170  -0.666  11.607
  572    HB   THR  72           HB       THR  72   8.458   0.154   9.630
  573    HG1  THR  72           HG1      THR  72   8.740   2.195  10.529
  574   1HG2  THR  72          1HG2      THR  72   6.047   0.707   8.518
  575   2HG2  THR  72          2HG2      THR  72   7.568   1.431   7.994
  576   3HG2  THR  72          3HG2      THR  72   6.513   2.301   9.108
  577    H    GLN  73           H        GLN  73   4.395  -1.358  11.133
  578    HA   GLN  73           HA       GLN  73   2.279  -0.623  11.555
  579   1HB   GLN  73          1HB       GLN  73   3.896   0.190  13.600
  580   2HB   GLN  73          2HB       GLN  73   3.157   1.711  13.117
  581   1HG   GLN  73          1HG       GLN  73   1.116  -0.251  13.237
  582   2HG   GLN  73          2HG       GLN  73   2.073  -0.362  14.713
  583   1HE2  GLN  73          1HE2      GLN  73   2.400   1.627  15.924
  584   2HE2  GLN  73          2HE2      GLN  73   1.158   2.828  15.916
  585    H    GLY  74           H        GLY  74   1.228   1.921  12.033
  586   1HA   GLY  74          1HA       GLY  74   0.955   2.886   9.379
  587   2HA   GLY  74          2HA       GLY  74   0.311   3.648  10.826
  588    H    GLU  75           H        GLU  75   3.396   3.398  11.618
  589    HA   GLU  75           HA       GLU  75   3.999   6.103  11.367
  590   1HB   GLU  75          1HB       GLU  75   5.109   4.096  12.737
  591   2HB   GLU  75          2HB       GLU  75   6.256   4.166  11.406
  592   1HG   GLU  75          1HG       GLU  75   7.295   5.677  12.679
  593   2HG   GLU  75          2HG       GLU  75   6.073   6.785  12.058
  594    H    ALA  76           H        ALA  76   4.375   3.506   9.108
  595    HA   ALA  76           HA       ALA  76   6.351   4.611   7.437
  596   1HB   ALA  76          1HB       ALA  76   4.663   2.330   7.434
  597   2HB   ALA  76          2HB       ALA  76   4.524   3.118   5.862
  598   3HB   ALA  76          3HB       ALA  76   6.108   2.633   6.467
  599    H    ARG  77           H        ARG  77   3.154   5.577   8.023
  600    HA   ARG  77           HA       ARG  77   2.446   6.613   5.491
  601   1HB   ARG  77          1HB       ARG  77   0.749   6.268   7.167
  602   2HB   ARG  77          2HB       ARG  77   1.555   7.370   8.275
  603   1HG   ARG  77          1HG       ARG  77   1.121   9.216   6.684
  604   2HG   ARG  77          2HG       ARG  77   0.207   8.086   5.682
  605   1HD   ARG  77          1HD       ARG  77  -1.530   8.880   6.891
  606   2HD   ARG  77          2HD       ARG  77  -0.991   7.655   8.039
  607    HE   ARG  77           HE       ARG  77   0.257  10.221   8.400
  608   1HH1  ARG  77          1HH1      ARG  77  -2.487   8.228   9.184
  609   2HH1  ARG  77          2HH1      ARG  77  -2.852   9.079  10.649
  610   1HH2  ARG  77          1HH2      ARG  77  -0.214  11.350  10.326
  611   2HH2  ARG  77          2HH2      ARG  77  -1.559  10.855  11.297
  612    H    ALA  78           H        ALA  78   4.616   7.698   7.919
  613    HA   ALA  78           HA       ALA  78   4.791  10.346   6.641
  614   1HB   ALA  78          1HB       ALA  78   5.001   9.456   9.427
  615   2HB   ALA  78          2HB       ALA  78   6.242  10.605   8.924
  616   3HB   ALA  78          3HB       ALA  78   4.536  11.023   8.765
  617    H    TYR  79           H        TYR  79   6.450   7.400   7.279
  618    HA   TYR  79           HA       TYR  79   9.076   8.492   6.711
  619   1HB   TYR  79          1HB       TYR  79   9.048   6.749   8.335
  620   2HB   TYR  79          2HB       TYR  79   8.080   5.705   7.300
  621    HD1  TYR  79           HD1      TYR  79  11.148   7.664   6.498
  622    HD2  TYR  79           HD2      TYR  79   9.389   3.815   6.938
  623    HE1  TYR  79           HE1      TYR  79  13.204   6.632   5.628
  624    HE2  TYR  79           HE2      TYR  79  11.441   2.772   6.070
  625    HH   TYR  79           HH       TYR  79  13.369   3.433   4.618
  626    H    SER  80           H        SER  80   6.564   6.668   5.092
  627    HA   SER  80           HA       SER  80   6.240   6.108   2.911
  628   1HB   SER  80          1HB       SER  80   8.504   7.702   1.873
  629   2HB   SER  80          2HB       SER  80   6.812   7.685   1.375
  630    HG   SER  80           HG       SER  80   6.473   8.801   3.497
  631    H    MET  81           H        MET  81   8.244   5.966   0.826
  632    HA   MET  81           HA       MET  81   9.672   3.576   1.767
  633   1HB   MET  81          1HB       MET  81   9.705   3.898  -1.097
  634   2HB   MET  81          2HB       MET  81   9.051   2.580  -0.134
  635   1HG   MET  81          1HG       MET  81   7.601   5.152  -0.714
  636   2HG   MET  81          2HG       MET  81   7.397   3.656  -1.622
  637   1HE   MET  81          1HE       MET  81   4.715   4.886   1.514
  638   2HE   MET  81          2HE       MET  81   6.001   5.852   0.790
  639   3HE   MET  81          3HE       MET  81   4.787   5.087  -0.237
  640    H    LYS  82           H        LYS  82  11.549   3.295  -0.201
  641    HA   LYS  82           HA       LYS  82  13.703   4.748   0.681
  642   1HB   LYS  82          1HB       LYS  82  13.110   3.177  -1.758
  643   2HB   LYS  82          2HB       LYS  82  14.482   4.272  -1.860
  644   1HG   LYS  82          1HG       LYS  82  15.403   3.209   0.191
  645   2HG   LYS  82          2HG       LYS  82  14.086   2.036   0.115
  646   1HD   LYS  82          1HD       LYS  82  15.064   1.910  -2.420
  647   2HD   LYS  82          2HD       LYS  82  16.532   2.243  -1.499
  648   1HE   LYS  82          1HE       LYS  82  16.463  -0.060  -1.448
  649   2HE   LYS  82          2HE       LYS  82  15.650   0.352   0.060
  650   1HZ   LYS  82          1HZ       LYS  82  13.562  -0.109  -0.870
  651   2HZ   LYS  82          2HZ       LYS  82  14.550  -1.385  -1.374
  652   3HZ   LYS  82          3HZ       LYS  82  14.163  -0.140  -2.452
  653    H    GLU  83           H        GLU  83  13.696   6.914   0.831
  654    HA   GLU  83           HA       GLU  83  12.431   8.664  -0.980
  655   1HB   GLU  83          1HB       GLU  83  14.469   9.020   1.191
  656   2HB   GLU  83          2HB       GLU  83  14.052  10.370   0.145
  657   1HG   GLU  83          1HG       GLU  83  11.787  10.329   0.852
  658   2HG   GLU  83          2HG       GLU  83  12.015   8.798   1.696
  659    H    ASP  84           H        ASP  84  15.677   7.352  -0.820
  660    HA   ASP  84           HA       ASP  84  16.972   9.063  -2.603
  661   1HB   ASP  84          1HB       ASP  84  17.497   6.514  -1.364
  662   2HB   ASP  84          2HB       ASP  84  18.022   6.488  -3.045
  663    H    THR  85           H        THR  85  14.574   6.670  -3.161
  664    HA   THR  85           HA       THR  85  15.041   6.846  -6.067
  665    HB   THR  85           HB       THR  85  13.639   4.736  -6.188
  666    HG1  THR  85           HG1      THR  85  12.917   5.049  -3.903
  667   1HG2  THR  85          1HG2      THR  85  16.036   4.067  -4.573
  668   2HG2  THR  85          2HG2      THR  85  16.290   5.032  -6.028
  669   3HG2  THR  85          3HG2      THR  85  15.519   3.450  -6.141
  670    H    ARG  86           H        ARG  86  13.286   8.297  -3.840
  671    HA   ARG  86           HA       ARG  86  10.602   7.987  -4.557
  672   1HB   ARG  86          1HB       ARG  86  11.958   9.480  -2.711
  673   2HB   ARG  86          2HB       ARG  86  11.405  10.720  -3.828
  674   1HG   ARG  86          1HG       ARG  86   9.205  10.393  -3.326
  675   2HG   ARG  86          2HG       ARG  86   9.440   8.694  -2.907
  676   1HD   ARG  86          1HD       ARG  86   9.311   9.373  -0.781
  677   2HD   ARG  86          2HD       ARG  86  10.945   9.992  -1.017
  678    HE   ARG  86           HE       ARG  86  10.096  12.094  -0.824
  679   1HH1  ARG  86          1HH1      ARG  86   7.525   9.956  -1.795
  680   2HH1  ARG  86          2HH1      ARG  86   6.302  11.181  -1.717
  681   1HH2  ARG  86          1HH2      ARG  86   8.494  13.714  -0.718
  682   2HH2  ARG  86          2HH2      ARG  86   6.854  13.318  -1.105
  683    H    LEU  87           H        LEU  87   9.589   8.404  -6.397
  684    HA   LEU  87           HA       LEU  87  10.784  10.342  -8.259
  685   1HB   LEU  87          1HB       LEU  87   9.922   7.712  -8.633
  686   2HB   LEU  87          2HB       LEU  87   8.689   8.715  -9.395
  687    HG   LEU  87           HG       LEU  87  11.623   8.576 -10.062
  688   1HD1  LEU  87          1HD1      LEU  87  10.528   6.829 -11.146
  689   2HD1  LEU  87          2HD1      LEU  87  10.556   8.116 -12.350
  690   3HD1  LEU  87          3HD1      LEU  87   9.080   7.792 -11.441
  691   1HD2  LEU  87          1HD2      LEU  87  11.084  10.882 -10.189
  692   2HD2  LEU  87          2HD2      LEU  87   9.527  10.547 -10.946
  693   3HD2  LEU  87          3HD2      LEU  87  11.021  10.257 -11.837
  694    H    GLU  88           H        GLU  88   7.720   9.281  -6.840
  695    HA   GLU  88           HA       GLU  88   6.682  11.983  -7.137
  696   1HB   GLU  88          1HB       GLU  88   6.007  10.097  -9.028
  697   2HB   GLU  88          2HB       GLU  88   4.676   9.985  -7.885
  698   1HG   GLU  88          1HG       GLU  88   4.140  11.547  -9.640
  699   2HG   GLU  88          2HG       GLU  88   4.296  12.394  -8.102
  700    H    GLY  89           H        GLY  89   4.375  12.046  -6.110
  701   1HA   GLY  89          1HA       GLY  89   2.919  11.385  -4.389
  702   2HA   GLY  89          2HA       GLY  89   4.059  10.126  -3.938
  703    HA   PRO  90           HA       PRO  90   3.401   9.753  -2.000
  704   1HB   PRO  90          1HB       PRO  90   2.009  10.398   0.240
  705   2HB   PRO  90          2HB       PRO  90   3.702   9.892   0.273
  706   1HG   PRO  90          1HG       PRO  90   2.547  12.651   0.390
  707   2HG   PRO  90          2HG       PRO  90   3.874  11.953   1.337
  708   1HD   PRO  90          1HD       PRO  90   4.298  13.567  -0.796
  709   2HD   PRO  90          2HD       PRO  90   5.408  12.252  -0.357
  710    H    TRP  91           H        TRP  91   1.034   9.182  -1.687
  711    HA   TRP  91           HA       TRP  91  -0.791  11.264  -2.630
  712   1HB   TRP  91          1HB       TRP  91  -0.215   8.667  -4.041
  713   2HB   TRP  91          2HB       TRP  91  -1.745   9.512  -4.255
  714    HD1  TRP  91           HD1      TRP  91  -0.599  12.492  -4.397
  715    HE1  TRP  91           HE1      TRP  91   0.702  13.236  -6.489
  716    HE3  TRP  91           HE3      TRP  91   0.774   7.900  -6.174
  717    HZ2  TRP  91           HZ2      TRP  91   2.122  12.035  -8.613
  718    HZ3  TRP  91           HZ3      TRP  91   2.102   7.784  -8.242
  719    HH2  TRP  91           HH2      TRP  91   2.761   9.810  -9.435
  720    H    GLU  92           H        GLU  92  -2.789  11.130  -1.766
  721    HA   GLU  92           HA       GLU  92  -3.417   8.715  -0.196
  722   1HB   GLU  92          1HB       GLU  92  -3.786  11.623   0.422
  723   2HB   GLU  92          2HB       GLU  92  -4.880  10.440   1.125
  724   1HG   GLU  92          1HG       GLU  92  -3.368  10.398   2.775
  725   2HG   GLU  92          2HG       GLU  92  -2.512   9.296   1.699
  726    H    TYR  93           H        TYR  93  -5.388   7.795  -0.444
  727    HA   TYR  93           HA       TYR  93  -7.438   9.205  -1.981
  728   1HB   TYR  93          1HB       TYR  93  -6.295   6.504  -2.710
  729   2HB   TYR  93          2HB       TYR  93  -7.807   7.130  -3.356
  730    HD1  TYR  93           HD1      TYR  93  -7.774   9.179  -4.789
  731    HD2  TYR  93           HD2      TYR  93  -4.202   7.209  -3.579
  732    HE1  TYR  93           HE1      TYR  93  -6.538  10.339  -6.571
  733    HE2  TYR  93           HE2      TYR  93  -2.956   8.364  -5.357
  734    HH   TYR  93           HH       TYR  93  -4.578  10.291  -7.784
  735    H    GLY  94           H        GLY  94  -9.552   8.093  -1.903
  736   1HA   GLY  94          1HA       GLY  94 -11.083   6.600  -0.896
  737   2HA   GLY  94          2HA       GLY  94  -9.853   6.172   0.284
  738    H    GLU  95           H        GLU  95 -11.282   6.465   2.016
  739    HA   GLU  95           HA       GLU  95 -12.913   8.633   2.516
  740   1HB   GLU  95          1HB       GLU  95 -13.045   6.710   3.929
  741   2HB   GLU  95          2HB       GLU  95 -11.366   6.879   4.421
  742   1HG   GLU  95          1HG       GLU  95 -13.114   9.176   5.001
  743   2HG   GLU  95          2HG       GLU  95 -13.449   7.697   5.899
  Start of MODEL   30
    1   1H    ALA   2          1H        ALA   2 -11.596   2.915  21.504
    2    HA   ALA   2           HA       ALA   2 -12.887   1.635  19.505
    3   1HB   ALA   2          1HB       ALA   2 -10.494   3.340  18.884
    4   2HB   ALA   2          2HB       ALA   2 -12.008   3.196  17.990
    5   3HB   ALA   2          3HB       ALA   2 -11.980   4.017  19.551
    6    H    ARG   3           H        ARG   3 -12.168   0.626  17.498
    7    HA   ARG   3           HA       ARG   3  -9.961  -1.241  18.004
    8   1HB   ARG   3          1HB       ARG   3 -12.471  -1.375  16.389
    9   2HB   ARG   3          2HB       ARG   3 -11.098  -2.358  15.900
   10   1HG   ARG   3          1HG       ARG   3 -11.333  -2.780  18.639
   11   2HG   ARG   3          2HG       ARG   3 -12.989  -2.772  18.031
   12   1HD   ARG   3          1HD       ARG   3 -12.620  -4.909  17.489
   13   2HD   ARG   3          2HD       ARG   3 -11.673  -4.265  16.149
   14    HE   ARG   3           HE       ARG   3  -9.970  -4.402  18.324
   15   1HH1  ARG   3          1HH1      ARG   3 -11.851  -6.606  16.395
   16   2HH1  ARG   3          2HH1      ARG   3 -10.770  -7.939  16.629
   17   1HH2  ARG   3          1HH2      ARG   3  -8.539  -6.149  18.640
   18   2HH2  ARG   3          2HH2      ARG   3  -8.886  -7.679  17.907
   19    H    GLN   4           H        GLN   4  -8.095  -0.898  17.013
   20    HA   GLN   4           HA       GLN   4  -8.092   0.657  14.512
   21   1HB   GLN   4          1HB       GLN   4  -5.828   1.349  15.064
   22   2HB   GLN   4          2HB       GLN   4  -6.918   1.740  16.388
   23   1HG   GLN   4          1HG       GLN   4  -6.078   0.023  17.738
   24   2HG   GLN   4          2HG       GLN   4  -5.293  -0.777  16.378
   25   1HE2  GLN   4          1HE2      GLN   4  -3.919  -0.251  18.684
   26   2HE2  GLN   4          2HE2      GLN   4  -2.733   0.970  18.390
   27    H    VAL   5           H        VAL   5  -6.556   0.065  12.874
   28    HA   VAL   5           HA       VAL   5  -5.643  -2.730  13.035
   29    HB   VAL   5           HB       VAL   5  -6.240  -3.085  10.705
   30   1HG1  VAL   5          1HG1      VAL   5  -8.862  -2.390  11.166
   31   2HG1  VAL   5          2HG1      VAL   5  -8.078  -3.880  11.695
   32   3HG1  VAL   5          3HG1      VAL   5  -8.187  -2.502  12.791
   33   1HG2  VAL   5          1HG2      VAL   5  -6.625  -1.415   9.292
   34   2HG2  VAL   5          2HG2      VAL   5  -7.978  -0.847  10.270
   35   3HG2  VAL   5          3HG2      VAL   5  -6.344  -0.278  10.610
   36    H    ILE   6           H        ILE   6  -3.874  -3.261  11.589
   37    HA   ILE   6           HA       ILE   6  -1.985  -1.066  11.402
   38    HB   ILE   6           HB       ILE   6  -1.555  -3.972  10.709
   39   1HG1  ILE   6          1HG1      ILE   6  -0.280  -3.727  13.034
   40   2HG1  ILE   6          2HG1      ILE   6  -1.509  -2.494  13.299
   41   1HG2  ILE   6          1HG2      ILE   6   0.341  -1.685  11.203
   42   2HG2  ILE   6          2HG2      ILE   6   0.836  -3.375  11.111
   43   3HG2  ILE   6          3HG2      ILE   6   0.116  -2.590   9.706
   44   1HD1  ILE   6          1HD1      ILE   6  -1.950  -4.900  14.093
   45   2HD1  ILE   6          2HD1      ILE   6  -3.236  -4.030  13.257
   46   3HD1  ILE   6          3HD1      ILE   6  -2.279  -5.234  12.394
   47    H    CYS   7           H        CYS   7  -0.874  -0.478   9.505
   48    HA   CYS   7           HA       CYS   7  -2.493  -0.562   7.136
   49   1HB   CYS   7          1HB       CYS   7  -0.915   0.969   6.196
   50   2HB   CYS   7          2HB       CYS   7  -1.141   1.429   7.879
   51    HG   CYS   7           HG       CYS   7   1.582   0.000   6.422
   52    H    TRP   8           H        TRP   8  -1.756  -1.277   5.045
   53    HA   TRP   8           HA       TRP   8  -0.047  -3.660   5.252
   54   1HB   TRP   8          1HB       TRP   8  -2.221  -2.925   3.285
   55   2HB   TRP   8          2HB       TRP   8  -1.165  -4.321   3.087
   56    HD1  TRP   8           HD1      TRP   8  -3.518  -2.970   5.879
   57    HE1  TRP   8           HE1      TRP   8  -4.749  -4.983   6.906
   58    HE3  TRP   8           HE3      TRP   8  -1.372  -6.717   3.143
   59    HZ2  TRP   8           HZ2      TRP   8  -4.803  -7.788   6.598
   60    HZ3  TRP   8           HZ3      TRP   8  -2.068  -9.038   3.571
   61    HH2  TRP   8           HH2      TRP   8  -3.748  -9.560   5.264
   62    H    CYS   9           H        CYS   9   1.966  -3.371   4.576
   63    HA   CYS   9           HA       CYS   9   2.512  -1.367   2.508
   64   1HB   CYS   9          1HB       CYS   9   4.897  -1.659   3.212
   65   2HB   CYS   9          2HB       CYS   9   3.839  -1.079   4.493
   66    HG   CYS   9           HG       CYS   9   4.312  -2.965   6.176
   67    H    PHE  10           H        PHE  10   2.692  -2.044   0.488
   68    HA   PHE  10           HA       PHE  10   3.921  -4.668  -0.018
   69   1HB   PHE  10          1HB       PHE  10   2.266  -5.338  -1.479
   70   2HB   PHE  10          2HB       PHE  10   1.312  -4.438  -0.306
   71    HD1  PHE  10           HD2      PHE  10   1.162  -1.823  -0.879
   72    HD2  PHE  10           HD1      PHE  10   1.836  -4.947  -3.690
   73    HE1  PHE  10           HE2      PHE  10   0.307  -0.382  -2.681
   74    HE2  PHE  10           HE1      PHE  10   0.983  -3.511  -5.496
   75    HZ   PHE  10           HZ       PHE  10   0.216  -1.226  -4.993
   76    H    THR  11           H        THR  11   4.743  -4.887  -2.263
   77    HA   THR  11           HA       THR  11   5.493  -2.310  -3.463
   78    HB   THR  11           HB       THR  11   7.461  -4.579  -3.195
   79    HG1  THR  11           HG1      THR  11   7.391  -3.979  -1.134
   80   1HG2  THR  11          1HG2      THR  11   8.309  -3.239  -4.847
   81   2HG2  THR  11          2HG2      THR  11   8.963  -2.407  -3.436
   82   3HG2  THR  11          3HG2      THR  11   7.514  -1.791  -4.230
   83    H    LEU  12           H        LEU  12   5.109  -2.248  -5.577
   84    HA   LEU  12           HA       LEU  12   4.823  -4.801  -7.019
   85   1HB   LEU  12          1HB       LEU  12   2.718  -3.649  -6.864
   86   2HB   LEU  12          2HB       LEU  12   3.447  -2.156  -7.453
   87    HG   LEU  12           HG       LEU  12   3.635  -3.007  -9.654
   88   1HD1  LEU  12          1HD1      LEU  12   4.396  -5.170  -9.539
   89   2HD1  LEU  12          2HD1      LEU  12   2.722  -5.427 -10.027
   90   3HD1  LEU  12          3HD1      LEU  12   3.192  -5.648  -8.342
   91   1HD2  LEU  12          1HD2      LEU  12   1.412  -3.164 -10.252
   92   2HD2  LEU  12          2HD2      LEU  12   1.305  -2.418  -8.657
   93   3HD2  LEU  12          3HD2      LEU  12   0.992  -4.144  -8.847
   94    H    ASN  13           H        ASN  13   6.334  -5.192  -8.484
   95    HA   ASN  13           HA       ASN  13   7.941  -2.963  -9.501
   96   1HB   ASN  13          1HB       ASN  13   9.622  -4.575 -10.051
   97   2HB   ASN  13          2HB       ASN  13   9.051  -4.958  -8.429
   98   1HD2  ASN  13          1HD2      ASN  13   9.777  -6.201 -11.404
   99   2HD2  ASN  13          2HD2      ASN  13   8.933  -7.705 -11.292
  100    H    ASN  14           H        ASN  14   7.876  -2.328 -11.569
  101    HA   ASN  14           HA       ASN  14   7.088  -2.089 -13.695
  102   1HB   ASN  14          1HB       ASN  14   7.657  -5.051 -13.577
  103   2HB   ASN  14          2HB       ASN  14   7.167  -4.241 -15.063
  104   1HD2  ASN  14          1HD2      ASN  14   9.125  -4.757 -16.048
  105   2HD2  ASN  14          2HD2      ASN  14  10.590  -3.932 -15.652
  106    HA   PRO  15           HA       PRO  15   2.803  -3.447 -12.417
  107   1HB   PRO  15          1HB       PRO  15   1.747  -0.947 -12.366
  108   2HB   PRO  15          2HB       PRO  15   2.542  -1.682 -10.969
  109   1HG   PRO  15          1HG       PRO  15   3.630   0.277 -12.953
  110   2HG   PRO  15          2HG       PRO  15   3.817   0.250 -11.190
  111   1HD   PRO  15          1HD       PRO  15   5.746  -0.631 -12.873
  112   2HD   PRO  15          2HD       PRO  15   5.486  -1.338 -11.265
  113    H    LEU  16           H        LEU  16   0.759  -3.020 -13.605
  114    HA   LEU  16           HA       LEU  16   1.314  -2.403 -16.431
  115   1HB   LEU  16          1HB       LEU  16  -0.167  -4.550 -15.103
  116   2HB   LEU  16          2HB       LEU  16  -1.039  -3.798 -16.438
  117    HG   LEU  16           HG       LEU  16   0.158  -5.784 -17.176
  118   1HD1  LEU  16          1HD1      LEU  16   1.624  -3.416 -18.290
  119   2HD1  LEU  16          2HD1      LEU  16  -0.091  -3.679 -18.604
  120   3HD1  LEU  16          3HD1      LEU  16   1.093  -4.881 -19.117
  121   1HD2  LEU  16          1HD2      LEU  16   2.777  -4.437 -16.685
  122   2HD2  LEU  16          2HD2      LEU  16   2.416  -6.149 -16.908
  123   3HD2  LEU  16          3HD2      LEU  16   2.009  -5.353 -15.387
  124    H    SER  17           H        SER  17  -0.436  -1.482 -13.671
  125    HA   SER  17           HA       SER  17  -1.614   0.742 -15.000
  126   1HB   SER  17          1HB       SER  17  -3.769   0.118 -15.292
  127   2HB   SER  17          2HB       SER  17  -3.133  -1.526 -15.244
  128    HG   SER  17           HG       SER  17  -4.611  -1.602 -13.694
  129    HA   PRO  18           HA       PRO  18  -1.569   2.407 -10.943
  130   1HB   PRO  18          1HB       PRO  18  -3.688   4.104 -10.985
  131   2HB   PRO  18          2HB       PRO  18  -2.187   4.419 -11.865
  132   1HG   PRO  18          1HG       PRO  18  -4.778   3.308 -12.874
  133   2HG   PRO  18          2HG       PRO  18  -3.713   4.516 -13.618
  134   1HD   PRO  18          1HD       PRO  18  -3.733   1.920 -14.389
  135   2HD   PRO  18          2HD       PRO  18  -2.267   2.920 -14.439
  136    H    LEU  19           H        LEU  19  -2.741   2.590  -8.910
  137    HA   LEU  19           HA       LEU  19  -4.617   0.385  -8.579
  138   1HB   LEU  19          1HB       LEU  19  -3.586   2.092  -6.350
  139   2HB   LEU  19          2HB       LEU  19  -4.086   0.403  -6.316
  140    HG   LEU  19           HG       LEU  19  -1.557   1.447  -7.590
  141   1HD1  LEU  19          1HD1      LEU  19  -1.748   1.533  -5.049
  142   2HD1  LEU  19          2HD1      LEU  19  -0.375   0.662  -5.729
  143   3HD1  LEU  19          3HD1      LEU  19  -1.765  -0.229  -5.110
  144   1HD2  LEU  19          1HD2      LEU  19  -1.534  -0.499  -8.660
  145   2HD2  LEU  19          2HD2      LEU  19  -2.980  -1.048  -7.812
  146   3HD2  LEU  19          3HD2      LEU  19  -1.388  -1.294  -7.092
  147    H    SER  20           H        SER  20  -6.379   0.782  -6.870
  148    HA   SER  20           HA       SER  20  -7.514   3.463  -6.976
  149   1HB   SER  20          1HB       SER  20  -9.716   2.591  -7.750
  150   2HB   SER  20          2HB       SER  20  -8.451   2.441  -8.970
  151    HG   SER  20           HG       SER  20  -9.692   0.525  -8.767
  152    H    LEU  21           H        LEU  21  -9.486   3.632  -5.591
  153    HA   LEU  21           HA       LEU  21  -8.971   2.551  -3.034
  154   1HB   LEU  21          1HB       LEU  21 -10.059   4.697  -3.330
  155   2HB   LEU  21          2HB       LEU  21 -11.428   3.919  -4.122
  156    HG   LEU  21           HG       LEU  21 -11.922   2.755  -1.973
  157   1HD1  LEU  21          1HD1      LEU  21  -9.738   4.564  -0.959
  158   2HD1  LEU  21          2HD1      LEU  21  -9.776   2.802  -0.916
  159   3HD1  LEU  21          3HD1      LEU  21 -10.901   3.732   0.074
  160   1HD2  LEU  21          1HD2      LEU  21 -13.359   4.495  -2.192
  161   2HD2  LEU  21          2HD2      LEU  21 -12.071   5.680  -2.407
  162   3HD2  LEU  21          3HD2      LEU  21 -12.462   5.086  -0.793
  163    H    HIS  22           H        HIS  22 -10.259   1.129  -1.767
  164    HA   HIS  22           HA       HIS  22 -11.809  -0.799  -3.369
  165   1HB   HIS  22          1HB       HIS  22  -9.549  -1.520  -2.324
  166   2HB   HIS  22          2HB       HIS  22 -10.426  -1.515  -0.797
  167    HD1  HIS  22           HD1      HIS  22 -10.648  -3.952  -0.314
  168    HD2  HIS  22           HD2      HIS  22 -11.760  -3.009  -4.205
  169    HE1  HIS  22           HE1      HIS  22 -11.605  -6.071  -1.272
  170    H    ASP  23           H        ASP  23 -13.858  -1.145  -2.794
  171    HA   ASP  23           HA       ASP  23 -15.207   0.434  -0.954
  172   1HB   ASP  23          1HB       ASP  23 -15.866  -2.132  -2.350
  173   2HB   ASP  23          2HB       ASP  23 -16.953  -1.521  -1.106
  174    H    SER  24           H        SER  24 -13.393  -2.460  -0.467
  175    HA   SER  24           HA       SER  24 -14.577  -3.081   2.092
  176   1HB   SER  24          1HB       SER  24 -11.969  -4.189   1.069
  177   2HB   SER  24          2HB       SER  24 -13.137  -4.947   2.152
  178    HG   SER  24           HG       SER  24 -14.109  -4.259  -0.340
  179    H    MET  25           H        MET  25 -11.611  -1.581   0.896
  180    HA   MET  25           HA       MET  25 -10.519  -1.212   3.532
  181   1HB   MET  25          1HB       MET  25  -8.645  -0.309   2.487
  182   2HB   MET  25          2HB       MET  25  -9.241  -1.457   1.295
  183   1HG   MET  25          1HG       MET  25 -10.129   0.246  -0.058
  184   2HG   MET  25          2HG       MET  25  -9.981   1.447   1.222
  185   1HE   MET  25          1HE       MET  25  -6.696  -0.063  -1.586
  186   2HE   MET  25          2HE       MET  25  -7.867  -1.132  -0.814
  187   3HE   MET  25          3HE       MET  25  -8.410   0.083  -1.971
  188    H    LYS  26           H        LYS  26  -9.611   1.229   3.807
  189    HA   LYS  26           HA       LYS  26 -12.026   2.910   3.816
  190   1HB   LYS  26          1HB       LYS  26 -10.021   2.319   5.808
  191   2HB   LYS  26          2HB       LYS  26 -10.095   4.051   5.511
  192   1HG   LYS  26          1HG       LYS  26 -12.617   2.521   5.957
  193   2HG   LYS  26          2HG       LYS  26 -11.603   2.971   7.330
  194   1HD   LYS  26          1HD       LYS  26 -11.702   5.329   6.570
  195   2HD   LYS  26          2HD       LYS  26 -12.814   4.837   5.290
  196   1HE   LYS  26          1HE       LYS  26 -14.504   4.292   6.815
  197   2HE   LYS  26          2HE       LYS  26 -13.382   4.231   8.173
  198   1HZ   LYS  26          1HZ       LYS  26 -13.630   6.784   6.791
  199   2HZ   LYS  26          2HZ       LYS  26 -13.440   6.459   8.440
  200   3HZ   LYS  26          3HZ       LYS  26 -14.960   6.295   7.716
  201    H    TYR  27           H        TYR  27  -8.558   2.911   3.152
  202    HA   TYR  27           HA       TYR  27  -8.899   4.981   1.178
  203   1HB   TYR  27          1HB       TYR  27  -7.000   6.349   2.302
  204   2HB   TYR  27          2HB       TYR  27  -8.646   6.535   2.897
  205    HD1  TYR  27           HD1      TYR  27  -5.464   4.722   3.560
  206    HD2  TYR  27           HD2      TYR  27  -9.130   6.177   5.156
  207    HE1  TYR  27           HE1      TYR  27  -4.704   4.136   5.824
  208    HE2  TYR  27           HE2      TYR  27  -8.379   5.597   7.425
  209    HH   TYR  27           HH       TYR  27  -6.226   3.569   8.186
  210    H    LEU  28           H        LEU  28  -7.211   5.071  -0.294
  211    HA   LEU  28           HA       LEU  28  -5.169   2.975   0.032
  212   1HB   LEU  28          1HB       LEU  28  -5.989   2.220  -1.893
  213   2HB   LEU  28          2HB       LEU  28  -6.941   3.682  -2.142
  214    HG   LEU  28           HG       LEU  28  -4.817   4.747  -3.030
  215   1HD1  LEU  28          1HD1      LEU  28  -2.965   3.561  -2.604
  216   2HD1  LEU  28          2HD1      LEU  28  -3.434   2.627  -4.024
  217   3HD1  LEU  28          3HD1      LEU  28  -3.854   2.050  -2.411
  218   1HD2  LEU  28          1HD2      LEU  28  -5.058   3.666  -5.237
  219   2HD2  LEU  28          2HD2      LEU  28  -6.608   4.076  -4.503
  220   3HD2  LEU  28          3HD2      LEU  28  -6.038   2.406  -4.487
  221    H    VAL  29           H        VAL  29  -3.078   3.525  -0.003
  222    HA   VAL  29           HA       VAL  29  -2.342   6.195  -0.997
  223    HB   VAL  29           HB       VAL  29  -1.345   4.926   1.558
  224   1HG1  VAL  29          1HG1      VAL  29  -0.375   7.423   1.634
  225   2HG1  VAL  29          2HG1      VAL  29   0.528   6.057   0.976
  226   3HG1  VAL  29          3HG1      VAL  29  -0.336   7.149  -0.107
  227   1HG2  VAL  29          1HG2      VAL  29  -2.300   7.284   2.337
  228   2HG2  VAL  29          2HG2      VAL  29  -3.346   7.027   0.940
  229   3HG2  VAL  29          3HG2      VAL  29  -3.312   5.842   2.246
  230    H    TYR  30           H        TYR  30  -0.817   6.092  -2.498
  231    HA   TYR  30           HA       TYR  30   1.336   4.150  -2.282
  232   1HB   TYR  30          1HB       TYR  30   0.985   3.068  -4.324
  233   2HB   TYR  30          2HB       TYR  30  -0.635   3.174  -3.644
  234    HD1  TYR  30           HD2      TYR  30  -2.229   4.872  -4.523
  235    HD2  TYR  30           HD1      TYR  30   1.547   4.176  -6.355
  236    HE1  TYR  30           HE2      TYR  30  -3.013   6.009  -6.558
  237    HE2  TYR  30           HE1      TYR  30   0.774   5.312  -8.394
  238    HH   TYR  30           HH       TYR  30  -2.523   6.146  -8.896
  239    H    GLN  31           H        GLN  31   3.067   4.559  -3.872
  240    HA   GLN  31           HA       GLN  31   3.032   7.198  -5.110
  241   1HB   GLN  31          1HB       GLN  31   5.076   7.922  -4.049
  242   2HB   GLN  31          2HB       GLN  31   3.895   7.529  -2.808
  243   1HG   GLN  31          1HG       GLN  31   5.836   6.595  -1.987
  244   2HG   GLN  31          2HG       GLN  31   5.041   5.224  -2.759
  245   1HE2  GLN  31          1HE2      GLN  31   6.380   3.992  -3.844
  246   2HE2  GLN  31          2HE2      GLN  31   7.787   4.512  -4.701
  247    H    THR  32           H        THR  32   4.783   7.531  -6.619
  248    HA   THR  32           HA       THR  32   5.644   5.006  -7.818
  249    HB   THR  32           HB       THR  32   6.258   7.528  -9.225
  250    HG1  THR  32           HG1      THR  32   4.032   7.759  -9.852
  251   1HG2  THR  32          1HG2      THR  32   5.047   4.864  -9.946
  252   2HG2  THR  32          2HG2      THR  32   6.634   5.494 -10.387
  253   3HG2  THR  32          3HG2      THR  32   5.179   6.197 -11.092
  254    H    GLU  33           H        GLU  33   7.747   4.435  -8.094
  255    HA   GLU  33           HA       GLU  33   9.823   6.339  -7.269
  256   1HB   GLU  33          1HB       GLU  33   9.095   3.825  -5.960
  257   2HB   GLU  33          2HB       GLU  33  10.801   3.922  -6.375
  258   1HG   GLU  33          1HG       GLU  33  11.170   5.741  -4.995
  259   2HG   GLU  33          2HG       GLU  33   9.465   6.187  -4.960
  260    H    GLN  34           H        GLN  34  11.946   5.853  -8.079
  261    HA   GLN  34           HA       GLN  34  11.828   4.413 -10.627
  262   1HB   GLN  34          1HB       GLN  34  12.907   6.888  -9.901
  263   2HB   GLN  34          2HB       GLN  34  14.300   5.843 -10.144
  264   1HG   GLN  34          1HG       GLN  34  12.431   5.441 -12.267
  265   2HG   GLN  34          2HG       GLN  34  12.759   7.164 -12.085
  266   1HE2  GLN  34          1HE2      GLN  34  13.813   7.128 -14.109
  267   2HE2  GLN  34          2HE2      GLN  34  15.417   6.508 -14.267
  268    H    GLY  35           H        GLY  35  13.152   2.719 -11.118
  269   1HA   GLY  35          1HA       GLY  35  15.334   1.984  -9.358
  270   2HA   GLY  35          2HA       GLY  35  13.958   0.891  -9.314
  271    H    GLU  36           H        GLU  36  14.497  -0.884 -10.399
  272    HA   GLU  36           HA       GLU  36  16.450  -1.284 -12.238
  273   1HB   GLU  36          1HB       GLU  36  14.891  -3.111 -13.190
  274   2HB   GLU  36          2HB       GLU  36  15.375  -3.217 -11.503
  275   1HG   GLU  36          1HG       GLU  36  13.258  -2.336 -10.785
  276   2HG   GLU  36          2HG       GLU  36  12.773  -2.044 -12.454
  277    H    ALA  37           H        ALA  37  16.906  -0.425 -14.143
  278    HA   ALA  37           HA       ALA  37  16.696   0.723 -16.104
  279   1HB   ALA  37          1HB       ALA  37  14.138  -0.811 -16.475
  280   2HB   ALA  37          2HB       ALA  37  15.273  -0.256 -17.707
  281   3HB   ALA  37          3HB       ALA  37  15.727  -1.564 -16.615
  282    H    GLY  38           H        GLY  38  14.619   1.687 -17.579
  283   1HA   GLY  38          1HA       GLY  38  13.916   4.037 -16.189
  284   2HA   GLY  38          2HA       GLY  38  13.254   3.526 -17.735
  285    H    ASN  39           H        ASN  39  12.347   0.958 -16.433
  286    HA   ASN  39           HA       ASN  39   9.696   1.573 -16.019
  287   1HB   ASN  39          1HB       ASN  39  11.078  -0.698 -14.594
  288   2HB   ASN  39          2HB       ASN  39   9.416  -0.632 -15.172
  289   1HD2  ASN  39          1HD2      ASN  39   9.222  -0.287 -17.583
  290   2HD2  ASN  39          2HD2      ASN  39  10.301  -1.197 -18.579
  291    H    ILE  40           H        ILE  40   8.446   1.220 -13.943
  292    HA   ILE  40           HA       ILE  40   9.861   2.344 -11.624
  293    HB   ILE  40           HB       ILE  40   7.707   3.624 -11.131
  294   1HG1  ILE  40          1HG1      ILE  40   7.297   3.021 -14.066
  295   2HG1  ILE  40          2HG1      ILE  40   6.239   2.563 -12.735
  296   1HG2  ILE  40          1HG2      ILE  40   9.900   4.574 -11.936
  297   2HG2  ILE  40          2HG2      ILE  40   9.210   4.570 -13.558
  298   3HG2  ILE  40          3HG2      ILE  40   8.469   5.544 -12.289
  299   1HD1  ILE  40          1HD1      ILE  40   6.267   4.961 -14.290
  300   2HD1  ILE  40          2HD1      ILE  40   5.096   4.418 -13.088
  301   3HD1  ILE  40          3HD1      ILE  40   6.509   5.345 -12.586
  302    H    HIS  41           H        HIS  41   8.571   2.109  -9.585
  303    HA   HIS  41           HA       HIS  41   6.861  -0.285  -9.645
  304   1HB   HIS  41          1HB       HIS  41   8.018  -0.647  -7.271
  305   2HB   HIS  41          2HB       HIS  41   8.710  -1.298  -8.753
  306    HD1  HIS  41           HD1      HIS  41  11.150  -1.179  -8.184
  307    HD2  HIS  41           HD2      HIS  41   9.185   2.425  -7.545
  308    HE1  HIS  41           HE1      HIS  41  12.959   0.492  -7.672
  309    H    PHE  42           H        PHE  42   5.253  -0.403  -8.055
  310    HA   PHE  42           HA       PHE  42   4.561   2.195  -6.891
  311   1HB   PHE  42          1HB       PHE  42   2.975  -0.235  -7.651
  312   2HB   PHE  42          2HB       PHE  42   2.321   0.913  -6.488
  313    HD1  PHE  42           HD1      PHE  42   4.438   1.790  -9.378
  314    HD2  PHE  42           HD2      PHE  42   0.502   1.718  -7.760
  315    HE1  PHE  42           HE1      PHE  42   3.655   3.211 -11.228
  316    HE2  PHE  42           HE2      PHE  42  -0.287   3.138  -9.607
  317    HZ   PHE  42           HZ       PHE  42   1.289   3.886 -11.345
  318    H    GLN  43           H        GLN  43   4.536   2.546  -4.755
  319    HA   GLN  43           HA       GLN  43   4.494   0.283  -2.911
  320   1HB   GLN  43          1HB       GLN  43   6.863   1.728  -3.555
  321   2HB   GLN  43          2HB       GLN  43   6.409   2.140  -1.907
  322   1HG   GLN  43          1HG       GLN  43   6.724   0.011  -1.137
  323   2HG   GLN  43          2HG       GLN  43   6.414  -0.722  -2.710
  324   1HE2  GLN  43          1HE2      GLN  43   8.126   0.480  -4.361
  325   2HE2  GLN  43          2HE2      GLN  43   9.761   0.202  -3.878
  326    H    GLY  44           H        GLY  44   3.817   0.808  -0.795
  327   1HA   GLY  44          1HA       GLY  44   3.421   3.259   0.351
  328   2HA   GLY  44          2HA       GLY  44   2.021   3.047  -0.691
  329    H    TYR  45           H        TYR  45   1.057   3.273   1.571
  330    HA   TYR  45           HA       TYR  45   0.813   0.588   2.760
  331   1HB   TYR  45          1HB       TYR  45   0.481   1.601   4.929
  332   2HB   TYR  45          2HB       TYR  45   1.982   2.212   4.242
  333    HD1  TYR  45           HD2      TYR  45   2.148   4.532   3.481
  334    HD2  TYR  45           HD1      TYR  45  -1.416   3.055   5.275
  335    HE1  TYR  45           HE2      TYR  45   1.367   6.840   3.817
  336    HE2  TYR  45           HE1      TYR  45  -2.208   5.359   5.614
  337    HH   TYR  45           HH       TYR  45  -1.591   7.731   4.280
  338    H    ILE  46           H        ILE  46  -1.174  -0.251   2.857
  339    HA   ILE  46           HA       ILE  46  -3.465   1.546   2.397
  340    HB   ILE  46           HB       ILE  46  -3.088  -1.253   1.327
  341   1HG1  ILE  46          1HG1      ILE  46  -3.722   0.991  -0.478
  342   2HG1  ILE  46          2HG1      ILE  46  -2.138   1.081   0.285
  343   1HG2  ILE  46          1HG2      ILE  46  -5.298  -0.587   0.128
  344   2HG2  ILE  46          2HG2      ILE  46  -5.350  -1.197   1.782
  345   3HG2  ILE  46          3HG2      ILE  46  -5.476   0.536   1.476
  346   1HD1  ILE  46          1HD1      ILE  46  -1.587  -0.090  -1.572
  347   2HD1  ILE  46          2HD1      ILE  46  -2.029  -1.438  -0.523
  348   3HD1  ILE  46          3HD1      ILE  46  -3.180  -0.833  -1.714
  349    H    GLU  47           H        GLU  47  -5.011   1.470   3.892
  350    HA   GLU  47           HA       GLU  47  -4.907  -0.680   5.886
  351   1HB   GLU  47          1HB       GLU  47  -6.175   2.061   5.985
  352   2HB   GLU  47          2HB       GLU  47  -6.301   0.866   7.269
  353   1HG   GLU  47          1HG       GLU  47  -3.582   1.577   6.344
  354   2HG   GLU  47          2HG       GLU  47  -4.470   2.788   7.267
  355    H    MET  48           H        MET  48  -6.340  -2.262   5.725
  356    HA   MET  48           HA       MET  48  -8.640  -2.020   4.007
  357   1HB   MET  48          1HB       MET  48  -7.611  -4.270   5.737
  358   2HB   MET  48          2HB       MET  48  -9.061  -4.395   4.750
  359   1HG   MET  48          1HG       MET  48  -6.880  -3.426   3.166
  360   2HG   MET  48          2HG       MET  48  -6.416  -4.909   3.997
  361   1HE   MET  48          1HE       MET  48  -8.820  -4.367   0.336
  362   2HE   MET  48          2HE       MET  48  -9.738  -3.665   1.667
  363   3HE   MET  48          3HE       MET  48  -8.075  -3.154   1.378
  364    H    LYS  49           H        LYS  49 -10.704  -3.223   5.014
  365    HA   LYS  49           HA       LYS  49 -11.947  -1.416   6.700
  366   1HB   LYS  49          1HB       LYS  49 -12.705  -3.689   5.323
  367   2HB   LYS  49          2HB       LYS  49 -12.973  -4.136   7.002
  368   1HG   LYS  49          1HG       LYS  49 -14.478  -2.332   7.333
  369   2HG   LYS  49          2HG       LYS  49 -14.048  -1.607   5.782
  370   1HD   LYS  49          1HD       LYS  49 -14.855  -4.130   5.063
  371   2HD   LYS  49          2HD       LYS  49 -15.944  -3.744   6.397
  372   1HE   LYS  49          1HE       LYS  49 -15.456  -1.779   4.187
  373   2HE   LYS  49          2HE       LYS  49 -16.625  -3.085   3.993
  374   1HZ   LYS  49          1HZ       LYS  49 -16.667  -1.061   6.166
  375   2HZ   LYS  49          2HZ       LYS  49 -17.806  -2.289   5.929
  376   3HZ   LYS  49          3HZ       LYS  49 -17.658  -1.042   4.795
  377    H    LYS  50           H        LYS  50 -10.820  -4.681   7.602
  378    HA   LYS  50           HA       LYS  50  -9.562  -3.934   9.972
  379   1HB   LYS  50          1HB       LYS  50 -12.434  -4.018  10.175
  380   2HB   LYS  50          2HB       LYS  50 -11.726  -5.265  11.193
  381   1HG   LYS  50          1HG       LYS  50 -10.459  -3.668  12.412
  382   2HG   LYS  50          2HG       LYS  50 -10.859  -2.387  11.266
  383   1HD   LYS  50          1HD       LYS  50 -13.327  -3.323  12.084
  384   2HD   LYS  50          2HD       LYS  50 -12.355  -3.375  13.556
  385   1HE   LYS  50          1HE       LYS  50 -13.003  -1.215  13.711
  386   2HE   LYS  50          2HE       LYS  50 -11.636  -0.962  12.627
  387   1HZ   LYS  50          1HZ       LYS  50 -13.360   0.167  11.605
  388   2HZ   LYS  50          2HZ       LYS  50 -14.514  -1.009  11.986
  389   3HZ   LYS  50          3HZ       LYS  50 -13.362  -1.313  10.785
  390    H    ARG  51           H        ARG  51 -11.926  -6.549   9.495
  391    HA   ARG  51           HA       ARG  51  -9.838  -8.502  10.027
  392   1HB   ARG  51          1HB       ARG  51 -12.342  -8.456  10.892
  393   2HB   ARG  51          2HB       ARG  51 -12.641  -9.291   9.374
  394   1HG   ARG  51          1HG       ARG  51 -11.492 -11.164  10.017
  395   2HG   ARG  51          2HG       ARG  51 -10.467 -10.280  11.148
  396   1HD   ARG  51          1HD       ARG  51 -12.356 -10.010  12.665
  397   2HD   ARG  51          2HD       ARG  51 -13.403 -10.854  11.525
  398    HE   ARG  51           HE       ARG  51 -11.408 -12.631  11.999
  399   1HH1  ARG  51          1HH1      ARG  51 -13.575 -10.827  14.041
  400   2HH1  ARG  51          2HH1      ARG  51 -13.606 -12.027  15.290
  401   1HH2  ARG  51          1HH2      ARG  51 -11.441 -14.218  13.636
  402   2HH2  ARG  51          2HH2      ARG  51 -12.391 -13.955  15.059
  403    H    THR  52           H        THR  52  -9.254  -7.295   7.698
  404    HA   THR  52           HA       THR  52 -10.150  -9.164   5.605
  405    HB   THR  52           HB       THR  52  -8.659  -6.782   4.737
  406    HG1  THR  52           HG1      THR  52 -11.320  -6.431   5.675
  407   1HG2  THR  52          1HG2      THR  52 -11.233  -8.132   3.928
  408   2HG2  THR  52          2HG2      THR  52  -9.676  -8.198   3.101
  409   3HG2  THR  52          3HG2      THR  52 -10.593  -6.692   3.136
  410    H    SER  53           H        SER  53  -8.746 -10.720   5.161
  411    HA   SER  53           HA       SER  53  -5.989 -10.548   5.941
  412   1HB   SER  53          1HB       SER  53  -5.966 -12.805   4.578
  413   2HB   SER  53          2HB       SER  53  -6.763 -12.721   6.149
  414    HG   SER  53           HG       SER  53  -7.851 -12.984   3.610
  415    H    LEU  54           H        LEU  54  -4.394 -11.524   4.157
  416    HA   LEU  54           HA       LEU  54  -3.842  -9.493   2.362
  417   1HB   LEU  54          1HB       LEU  54  -2.222 -11.184   3.077
  418   2HB   LEU  54          2HB       LEU  54  -3.083 -12.403   2.141
  419    HG   LEU  54           HG       LEU  54  -2.442 -11.356   0.077
  420   1HD1  LEU  54          1HD1      LEU  54  -1.109  -9.233   1.753
  421   2HD1  LEU  54          2HD1      LEU  54  -2.593  -9.026   0.823
  422   3HD1  LEU  54          3HD1      LEU  54  -1.073  -9.355  -0.007
  423   1HD2  LEU  54          1HD2      LEU  54  -0.813 -12.876   0.887
  424   2HD2  LEU  54          2HD2      LEU  54  -0.183 -11.697   2.038
  425   3HD2  LEU  54          3HD2      LEU  54   0.064 -11.460   0.307
  426    H    ALA  55           H        ALA  55  -5.918 -12.272   2.000
  427    HA   ALA  55           HA       ALA  55  -6.168 -12.427  -0.756
  428   1HB   ALA  55          1HB       ALA  55  -8.273 -13.516  -0.390
  429   2HB   ALA  55          2HB       ALA  55  -7.158 -14.010   0.885
  430   3HB   ALA  55          3HB       ALA  55  -8.409 -12.812   1.222
  431    H    GLY  56           H        GLY  56  -7.512 -10.102   1.486
  432   1HA   GLY  56          1HA       GLY  56  -9.449  -9.000  -0.287
  433   2HA   GLY  56          2HA       GLY  56  -8.830  -8.242   1.173
  434    H    MET  57           H        MET  57  -6.167  -7.968   0.621
  435    HA   MET  57           HA       MET  57  -6.187  -5.714  -1.126
  436   1HB   MET  57          1HB       MET  57  -3.938  -7.152   0.286
  437   2HB   MET  57          2HB       MET  57  -3.715  -5.684  -0.655
  438   1HG   MET  57          1HG       MET  57  -5.501  -5.938   1.753
  439   2HG   MET  57          2HG       MET  57  -3.871  -5.268   1.761
  440   1HE   MET  57          1HE       MET  57  -3.203  -3.149   0.189
  441   2HE   MET  57          2HE       MET  57  -4.050  -3.822  -1.204
  442   3HE   MET  57          3HE       MET  57  -4.393  -2.175  -0.674
  443    H    LYS  58           H        LYS  58  -4.728  -8.947  -1.296
  444    HA   LYS  58           HA       LYS  58  -3.369  -8.699  -3.697
  445   1HB   LYS  58          1HB       LYS  58  -3.691 -10.704  -1.944
  446   2HB   LYS  58          2HB       LYS  58  -4.784 -11.263  -3.202
  447   1HG   LYS  58          1HG       LYS  58  -3.090 -11.989  -4.426
  448   2HG   LYS  58          2HG       LYS  58  -2.312 -10.405  -4.372
  449   1HD   LYS  58          1HD       LYS  58  -0.851 -12.123  -3.446
  450   2HD   LYS  58          2HD       LYS  58  -1.327 -10.967  -2.200
  451   1HE   LYS  58          1HE       LYS  58  -1.432 -13.235  -1.339
  452   2HE   LYS  58          2HE       LYS  58  -3.047 -12.533  -1.421
  453   1HZ   LYS  58          1HZ       LYS  58  -2.209 -14.921  -2.521
  454   2HZ   LYS  58          2HZ       LYS  58  -2.424 -13.878  -3.835
  455   3HZ   LYS  58          3HZ       LYS  58  -3.699 -14.156  -2.759
  456    H    LYS  59           H        LYS  59  -6.782  -9.153  -3.098
  457    HA   LYS  59           HA       LYS  59  -7.620  -9.994  -5.622
  458   1HB   LYS  59          1HB       LYS  59  -9.037  -9.902  -3.567
  459   2HB   LYS  59          2HB       LYS  59  -9.119  -8.155  -3.749
  460   1HG   LYS  59          1HG       LYS  59 -10.178  -8.478  -5.962
  461   2HG   LYS  59          2HG       LYS  59 -10.185 -10.218  -5.665
  462   1HD   LYS  59          1HD       LYS  59 -11.841 -10.082  -4.098
  463   2HD   LYS  59          2HD       LYS  59 -11.374  -8.457  -3.590
  464   1HE   LYS  59          1HE       LYS  59 -12.277  -7.584  -5.728
  465   2HE   LYS  59          2HE       LYS  59 -12.832  -9.211  -6.121
  466   1HZ   LYS  59          1HZ       LYS  59 -13.654  -8.064  -3.558
  467   2HZ   LYS  59          2HZ       LYS  59 -14.486  -9.120  -4.584
  468   3HZ   LYS  59          3HZ       LYS  59 -14.396  -7.473  -4.958
  469    H    LEU  60           H        LEU  60  -6.726  -6.826  -4.448
  470    HA   LEU  60           HA       LEU  60  -7.743  -5.434  -6.755
  471   1HB   LEU  60          1HB       LEU  60  -5.974  -4.600  -4.468
  472   2HB   LEU  60          2HB       LEU  60  -6.435  -3.513  -5.777
  473    HG   LEU  60           HG       LEU  60  -8.864  -4.114  -5.073
  474   1HD1  LEU  60          1HD1      LEU  60  -8.531  -5.862  -3.543
  475   2HD1  LEU  60          2HD1      LEU  60  -8.929  -4.458  -2.554
  476   3HD1  LEU  60          3HD1      LEU  60  -7.254  -4.991  -2.694
  477   1HD2  LEU  60          1HD2      LEU  60  -7.073  -2.062  -4.422
  478   2HD2  LEU  60          2HD2      LEU  60  -7.905  -2.469  -2.920
  479   3HD2  LEU  60          3HD2      LEU  60  -8.835  -2.015  -4.350
  480    H    ILE  61           H        ILE  61  -4.605  -6.582  -5.617
  481    HA   ILE  61           HA       ILE  61  -3.572  -6.257  -8.340
  482    HB   ILE  61           HB       ILE  61  -2.055  -5.406  -5.871
  483   1HG1  ILE  61          1HG1      ILE  61  -2.164  -3.240  -7.543
  484   2HG1  ILE  61          2HG1      ILE  61  -3.748  -3.965  -7.798
  485   1HG2  ILE  61          1HG2      ILE  61  -0.887  -4.557  -8.337
  486   2HG2  ILE  61          2HG2      ILE  61  -0.195  -5.567  -7.068
  487   3HG2  ILE  61          3HG2      ILE  61  -1.126  -6.304  -8.372
  488   1HD1  ILE  61          1HD1      ILE  61  -2.933  -2.290  -5.708
  489   2HD1  ILE  61          2HD1      ILE  61  -4.477  -3.122  -5.892
  490   3HD1  ILE  61          3HD1      ILE  61  -3.163  -3.889  -5.000
  491    HA   PRO  62           HA       PRO  62  -2.710 -10.458  -6.587
  492   1HB   PRO  62          1HB       PRO  62  -3.421 -11.791  -8.843
  493   2HB   PRO  62          2HB       PRO  62  -4.584 -11.325  -7.596
  494   1HG   PRO  62          1HG       PRO  62  -3.960  -9.987 -10.200
  495   2HG   PRO  62          2HG       PRO  62  -5.537 -10.289  -9.447
  496   1HD   PRO  62          1HD       PRO  62  -4.309  -7.878  -9.341
  497   2HD   PRO  62          2HD       PRO  62  -5.349  -8.479  -8.033
  498    H    GLY  63           H        GLY  63  -0.488 -10.238  -6.552
  499   1HA   GLY  63          1HA       GLY  63   1.324 -11.501  -7.796
  500   2HA   GLY  63          2HA       GLY  63   0.894 -10.469  -9.152
  501    H    ALA  64           H        ALA  64   1.800 -10.169  -5.716
  502    HA   ALA  64           HA       ALA  64   4.033  -8.504  -6.313
  503   1HB   ALA  64          1HB       ALA  64   3.176  -6.461  -6.216
  504   2HB   ALA  64          2HB       ALA  64   1.563  -7.174  -6.168
  505   3HB   ALA  64          3HB       ALA  64   2.412  -6.811  -4.665
  506    H    HIS  65           H        HIS  65   4.856  -7.453  -4.175
  507    HA   HIS  65           HA       HIS  65   4.761  -9.556  -2.151
  508   1HB   HIS  65          1HB       HIS  65   6.929  -8.548  -3.125
  509   2HB   HIS  65          2HB       HIS  65   6.584  -7.162  -2.094
  510    HD1  HIS  65           HD1      HIS  65   9.119  -8.747  -1.591
  511    HD2  HIS  65           HD2      HIS  65   5.499  -9.587   0.266
  512    HE1  HIS  65           HE1      HIS  65   9.715  -9.985   0.515
  513    H    PHE  66           H        PHE  66   3.390  -9.351  -0.521
  514    HA   PHE  66           HA       PHE  66   2.719  -6.643   0.425
  515   1HB   PHE  66          1HB       PHE  66   1.086  -9.050  -0.057
  516   2HB   PHE  66          2HB       PHE  66   0.743  -8.212   1.453
  517    HD1  PHE  66           HD1      PHE  66   0.890  -7.822  -2.213
  518    HD2  PHE  66           HD2      PHE  66  -0.430  -6.167   1.479
  519    HE1  PHE  66           HE1      PHE  66  -0.476  -6.185  -3.440
  520    HE2  PHE  66           HE2      PHE  66  -1.799  -4.528   0.259
  521    HZ   PHE  66           HZ       PHE  66  -1.825  -4.535  -2.204
  522    H    GLU  67           H        GLU  67   2.288  -6.420   2.731
  523    HA   GLU  67           HA       GLU  67   3.462  -8.476   4.442
  524   1HB   GLU  67          1HB       GLU  67   4.685  -5.889   3.826
  525   2HB   GLU  67          2HB       GLU  67   4.492  -6.171   5.550
  526   1HG   GLU  67          1HG       GLU  67   5.598  -8.426   4.027
  527   2HG   GLU  67          2HG       GLU  67   6.612  -6.986   4.097
  528    H    LYS  68           H        LYS  68   2.042  -8.861   5.993
  529    HA   LYS  68           HA       LYS  68   0.374  -6.635   6.966
  530   1HB   LYS  68          1HB       LYS  68  -0.872  -8.976   7.777
  531   2HB   LYS  68          2HB       LYS  68  -1.350  -7.957   6.425
  532   1HG   LYS  68          1HG       LYS  68  -0.234  -9.320   4.867
  533   2HG   LYS  68          2HG       LYS  68   0.659 -10.169   6.132
  534   1HD   LYS  68          1HD       LYS  68  -1.984 -10.581   6.819
  535   2HD   LYS  68          2HD       LYS  68  -1.998 -10.678   5.057
  536   1HE   LYS  68          1HE       LYS  68  -0.049 -12.270   5.253
  537   2HE   LYS  68          2HE       LYS  68  -0.354 -12.301   6.989
  538   1HZ   LYS  68          1HZ       LYS  68  -1.823 -13.549   4.833
  539   2HZ   LYS  68          2HZ       LYS  68  -2.791 -12.806   6.004
  540   3HZ   LYS  68          3HZ       LYS  68  -1.686 -14.004   6.457
  541    H    ARG  69           H        ARG  69  -0.625  -7.565   9.251
  542    HA   ARG  69           HA       ARG  69  -0.221  -8.051  11.446
  543   1HB   ARG  69          1HB       ARG  69   1.356  -9.864  10.168
  544   2HB   ARG  69          2HB       ARG  69   2.558  -8.964  11.083
  545   1HG   ARG  69          1HG       ARG  69   0.177  -9.747  12.608
  546   2HG   ARG  69          2HG       ARG  69   1.174 -11.083  12.031
  547   1HD   ARG  69          1HD       ARG  69   2.360  -8.715  13.446
  548   2HD   ARG  69          2HD       ARG  69   1.714 -10.097  14.330
  549    HE   ARG  69           HE       ARG  69   3.524 -10.980  12.354
  550   1HH1  ARG  69          1HH1      ARG  69   3.437  -9.349  15.429
  551   2HH1  ARG  69          2HH1      ARG  69   5.020  -9.875  15.899
  552   1HH2  ARG  69          1HH2      ARG  69   5.608 -11.679  12.963
  553   2HH2  ARG  69          2HH2      ARG  69   6.254 -11.199  14.496
  554    H    ARG  70           H        ARG  70   2.906  -7.080  10.021
  555    HA   ARG  70           HA       ARG  70   2.921  -4.471  10.980
  556   1HB   ARG  70          1HB       ARG  70   3.546  -6.460  13.000
  557   2HB   ARG  70          2HB       ARG  70   4.884  -5.345  12.758
  558   1HG   ARG  70          1HG       ARG  70   3.813  -3.664  13.757
  559   2HG   ARG  70          2HG       ARG  70   2.292  -4.022  12.936
  560   1HD   ARG  70          1HD       ARG  70   1.830  -4.392  15.198
  561   2HD   ARG  70          2HD       ARG  70   2.105  -6.004  14.540
  562    HE   ARG  70           HE       ARG  70   4.486  -4.852  15.615
  563   1HH1  ARG  70          1HH1      ARG  70   1.542  -6.515  16.444
  564   2HH1  ARG  70          2HH1      ARG  70   2.183  -7.196  17.902
  565   1HH2  ARG  70          1HH2      ARG  70   5.342  -5.742  17.533
  566   2HH2  ARG  70          2HH2      ARG  70   4.344  -6.755  18.521
  567    H    GLY  71           H        GLY  71   3.787  -4.458   8.813
  568   1HA   GLY  71          1HA       GLY  71   6.346  -5.663   8.286
  569   2HA   GLY  71          2HA       GLY  71   5.467  -4.572   7.225
  570    H    THR  72           H        THR  72   5.245  -2.594   9.475
  571    HA   THR  72           HA       THR  72   7.907  -1.802  10.145
  572    HB   THR  72           HB       THR  72   6.901   0.412   8.595
  573    HG1  THR  72           HG1      THR  72   6.246  -0.636   6.883
  574   1HG2  THR  72          1HG2      THR  72   9.304  -0.444   9.435
  575   2HG2  THR  72          2HG2      THR  72   9.099   0.670   8.082
  576   3HG2  THR  72          3HG2      THR  72   9.341  -1.050   7.780
  577    H    GLN  73           H        GLN  73   5.148  -2.157  11.258
  578    HA   GLN  73           HA       GLN  73   3.710  -1.153  12.716
  579   1HB   GLN  73          1HB       GLN  73   6.037   0.629  13.417
  580   2HB   GLN  73          2HB       GLN  73   4.731   0.091  14.465
  581   1HG   GLN  73          1HG       GLN  73   5.949  -2.244  13.544
  582   2HG   GLN  73          2HG       GLN  73   7.269  -1.138  13.921
  583   1HE2  GLN  73          1HE2      GLN  73   6.481  -3.588  15.266
  584   2HE2  GLN  73          2HE2      GLN  73   6.144  -3.156  16.904
  585    H    GLY  74           H        GLY  74   3.431   1.402  13.692
  586   1HA   GLY  74          1HA       GLY  74   2.194   2.705  11.462
  587   2HA   GLY  74          2HA       GLY  74   2.248   3.297  13.116
  588    H    GLU  75           H        GLU  75   5.354   2.684  12.506
  589    HA   GLU  75           HA       GLU  75   6.118   5.375  12.328
  590   1HB   GLU  75          1HB       GLU  75   7.403   3.009  12.860
  591   2HB   GLU  75          2HB       GLU  75   8.083   3.452  11.301
  592   1HG   GLU  75          1HG       GLU  75   8.703   5.647  12.218
  593   2HG   GLU  75          2HG       GLU  75   8.076   5.147  13.787
  594    H    ALA  76           H        ALA  76   5.361   3.032   9.886
  595    HA   ALA  76           HA       ALA  76   6.676   4.199   7.690
  596   1HB   ALA  76          1HB       ALA  76   4.098   2.907   7.127
  597   2HB   ALA  76          2HB       ALA  76   5.704   2.572   6.480
  598   3HB   ALA  76          3HB       ALA  76   5.238   1.934   8.056
  599    H    ARG  77           H        ARG  77   4.007   5.260   9.508
  600    HA   ARG  77           HA       ARG  77   2.510   6.614   7.547
  601   1HB   ARG  77          1HB       ARG  77   2.848   7.091  10.507
  602   2HB   ARG  77          2HB       ARG  77   1.737   8.021   9.511
  603   1HG   ARG  77          1HG       ARG  77   1.427   5.139   9.203
  604   2HG   ARG  77          2HG       ARG  77   1.137   5.713  10.847
  605   1HD   ARG  77          1HD       ARG  77  -0.108   7.031   8.452
  606   2HD   ARG  77          2HD       ARG  77  -0.855   5.648   9.250
  607    HE   ARG  77           HE       ARG  77  -0.733   8.354  10.218
  608   1HH1  ARG  77          1HH1      ARG  77  -1.097   5.004  11.093
  609   2HH1  ARG  77          2HH1      ARG  77  -1.932   5.346  12.573
  610   1HH2  ARG  77          1HH2      ARG  77  -1.830   8.817  12.163
  611   2HH2  ARG  77          2HH2      ARG  77  -2.349   7.516  13.180
  612    H    ALA  78           H        ALA  78   5.526   7.333   9.058
  613    HA   ALA  78           HA       ALA  78   5.451  10.112   8.134
  614   1HB   ALA  78          1HB       ALA  78   6.472  10.434  10.086
  615   2HB   ALA  78          2HB       ALA  78   6.792   8.711  10.288
  616   3HB   ALA  78          3HB       ALA  78   7.902   9.709   9.350
  617    H    TYR  79           H        TYR  79   8.031   7.657   8.228
  618    HA   TYR  79           HA       TYR  79   9.479   8.691   6.082
  619   1HB   TYR  79          1HB       TYR  79  10.701   7.204   7.368
  620   2HB   TYR  79          2HB       TYR  79   9.389   6.033   7.452
  621    HD1  TYR  79           HD1      TYR  79  11.178   7.648   4.591
  622    HD2  TYR  79           HD2      TYR  79  10.072   4.029   6.536
  623    HE1  TYR  79           HE1      TYR  79  12.220   6.360   2.773
  624    HE2  TYR  79           HE2      TYR  79  11.111   2.731   4.724
  625    HH   TYR  79           HH       TYR  79  11.756   2.989   2.411
  626    H    SER  80           H        SER  80   7.278   5.884   6.102
  627    HA   SER  80           HA       SER  80   6.059   4.893   4.457
  628   1HB   SER  80          1HB       SER  80   6.297   7.672   3.299
  629   2HB   SER  80          2HB       SER  80   5.352   6.398   2.529
  630    HG   SER  80           HG       SER  80   4.388   7.972   4.217
  631    H    MET  81           H        MET  81   7.689   6.967   2.142
  632    HA   MET  81           HA       MET  81   9.240   4.639   1.215
  633   1HB   MET  81          1HB       MET  81   7.471   6.502  -0.280
  634   2HB   MET  81          2HB       MET  81   8.952   5.992  -1.078
  635   1HG   MET  81          1HG       MET  81   7.148   4.547  -1.723
  636   2HG   MET  81          2HG       MET  81   8.302   3.647  -0.741
  637   1HE   MET  81          1HE       MET  81   4.333   5.300   0.892
  638   2HE   MET  81          2HE       MET  81   5.548   6.193  -0.022
  639   3HE   MET  81          3HE       MET  81   4.503   5.032  -0.843
  640    H    LYS  82           H        LYS  82  10.995   5.449  -0.418
  641    HA   LYS  82           HA       LYS  82  12.687   7.234   1.057
  642   1HB   LYS  82          1HB       LYS  82  12.956   5.448  -1.283
  643   2HB   LYS  82          2HB       LYS  82  14.022   6.848  -1.272
  644   1HG   LYS  82          1HG       LYS  82  13.814   5.134   1.161
  645   2HG   LYS  82          2HG       LYS  82  14.794   4.605  -0.209
  646   1HD   LYS  82          1HD       LYS  82  15.945   6.846  -0.103
  647   2HD   LYS  82          2HD       LYS  82  15.102   7.119   1.424
  648   1HE   LYS  82          1HE       LYS  82  16.500   5.784   2.548
  649   2HE   LYS  82          2HE       LYS  82  16.426   4.529   1.312
  650   1HZ   LYS  82          1HZ       LYS  82  18.564   6.136   1.850
  651   2HZ   LYS  82          2HZ       LYS  82  17.906   6.817   0.448
  652   3HZ   LYS  82          3HZ       LYS  82  18.357   5.186   0.464
  653    H    GLU  83           H        GLU  83  12.449   9.365   0.968
  654    HA   GLU  83           HA       GLU  83  11.062  10.726  -1.087
  655   1HB   GLU  83          1HB       GLU  83  11.663  11.383   1.421
  656   2HB   GLU  83          2HB       GLU  83  13.005  12.194   0.627
  657   1HG   GLU  83          1HG       GLU  83  11.691  13.776  -0.289
  658   2HG   GLU  83          2HG       GLU  83  10.343  12.667  -0.540
  659    H    ASP  84           H        ASP  84  14.454  10.052  -0.516
  660    HA   ASP  84           HA       ASP  84  15.481  11.839  -2.471
  661   1HB   ASP  84          1HB       ASP  84  16.528   9.760  -0.702
  662   2HB   ASP  84          2HB       ASP  84  17.356   9.820  -2.255
  663    H    THR  85           H        THR  85  14.453   8.474  -2.535
  664    HA   THR  85           HA       THR  85  15.117   8.310  -5.388
  665    HB   THR  85           HB       THR  85  13.986   5.923  -4.080
  666    HG1  THR  85           HG1      THR  85  16.530   6.967  -3.318
  667   1HG2  THR  85          1HG2      THR  85  15.343   4.806  -5.537
  668   2HG2  THR  85          2HG2      THR  85  16.643   5.990  -5.406
  669   3HG2  THR  85          3HG2      THR  85  15.229   6.339  -6.399
  670    H    ARG  86           H        ARG  86  12.661   9.484  -3.752
  671    HA   ARG  86           HA       ARG  86  10.421   8.057  -4.798
  672   1HB   ARG  86          1HB       ARG  86  10.835  10.088  -2.902
  673   2HB   ARG  86          2HB       ARG  86   9.818  10.804  -4.144
  674   1HG   ARG  86          1HG       ARG  86   8.187   9.042  -3.880
  675   2HG   ARG  86          2HG       ARG  86   9.228   8.222  -2.714
  676   1HD   ARG  86          1HD       ARG  86   8.462  11.051  -2.199
  677   2HD   ARG  86          2HD       ARG  86   7.254   9.793  -1.938
  678    HE   ARG  86           HE       ARG  86   9.390   8.846  -0.599
  679   1HH1  ARG  86          1HH1      ARG  86   7.772  11.928  -0.587
  680   2HH1  ARG  86          2HH1      ARG  86   8.154  12.269   1.069
  681   1HH2  ARG  86          1HH2      ARG  86   9.899   9.282   1.581
  682   2HH2  ARG  86          2HH2      ARG  86   9.365  10.763   2.300
  683    H    LEU  87           H        LEU  87   9.546   8.179  -6.756
  684    HA   LEU  87           HA       LEU  87  10.535  10.190  -8.621
  685   1HB   LEU  87          1HB       LEU  87   9.856   7.487  -8.836
  686   2HB   LEU  87          2HB       LEU  87   8.610   8.354  -9.730
  687    HG   LEU  87           HG       LEU  87  11.577   8.336 -10.242
  688   1HD1  LEU  87          1HD1      LEU  87   9.153   7.390 -11.741
  689   2HD1  LEU  87          2HD1      LEU  87  10.562   6.462 -11.231
  690   3HD1  LEU  87          3HD1      LEU  87  10.710   7.649 -12.527
  691   1HD2  LEU  87          1HD2      LEU  87   9.441  10.137 -11.365
  692   2HD2  LEU  87          2HD2      LEU  87  11.003   9.876 -12.143
  693   3HD2  LEU  87          3HD2      LEU  87  10.927  10.603 -10.537
  694    H    GLU  88           H        GLU  88   7.516   9.085  -7.170
  695    HA   GLU  88           HA       GLU  88   6.306  11.656  -7.799
  696   1HB   GLU  88          1HB       GLU  88   5.775   9.455  -9.414
  697   2HB   GLU  88          2HB       GLU  88   4.407   9.513  -8.311
  698   1HG   GLU  88          1HG       GLU  88   3.921  10.756 -10.320
  699   2HG   GLU  88          2HG       GLU  88   4.005  11.843  -8.935
  700    H    GLY  89           H        GLY  89   3.981  11.682  -6.808
  701   1HA   GLY  89          1HA       GLY  89   2.551  11.187  -5.025
  702   2HA   GLY  89          2HA       GLY  89   3.714  10.002  -4.450
  703    HA   PRO  90           HA       PRO  90   3.081   9.782  -2.491
  704   1HB   PRO  90          1HB       PRO  90   1.667  10.580  -0.315
  705   2HB   PRO  90          2HB       PRO  90   3.376  10.134  -0.240
  706   1HG   PRO  90          1HG       PRO  90   2.132  12.853  -0.368
  707   2HG   PRO  90          2HG       PRO  90   3.480  12.286   0.635
  708   1HD   PRO  90          1HD       PRO  90   3.853  13.715  -1.634
  709   2HD   PRO  90          2HD       PRO  90   5.005  12.481  -1.083
  710    H    TRP  91           H        TRP  91   0.767   9.123  -2.218
  711    HA   TRP  91           HA       TRP  91  -1.150  11.066  -3.274
  712   1HB   TRP  91          1HB       TRP  91  -0.455   8.416  -4.528
  713   2HB   TRP  91          2HB       TRP  91  -2.009   9.197  -4.809
  714    HD1  TRP  91           HD1      TRP  91  -0.949  12.201  -5.102
  715    HE1  TRP  91           HE1      TRP  91   0.352  12.867  -7.221
  716    HE3  TRP  91           HE3      TRP  91   0.574   7.560  -6.610
  717    HZ2  TRP  91           HZ2      TRP  91   1.828  11.592  -9.262
  718    HZ3  TRP  91           HZ3      TRP  91   1.927   7.370  -8.657
  719    HH2  TRP  91           HH2      TRP  91   2.539   9.345  -9.954
  720    H    GLU  92           H        GLU  92  -3.142  10.892  -2.407
  721    HA   GLU  92           HA       GLU  92  -3.670   8.544  -0.705
  722   1HB   GLU  92          1HB       GLU  92  -4.341  11.451  -0.287
  723   2HB   GLU  92          2HB       GLU  92  -5.159  10.169   0.595
  724   1HG   GLU  92          1HG       GLU  92  -3.477   9.967   2.021
  725   2HG   GLU  92          2HG       GLU  92  -2.298   9.846   0.716
  726    H    TYR  93           H        TYR  93  -5.783   7.732  -0.633
  727    HA   TYR  93           HA       TYR  93  -7.716   8.833  -2.533
  728   1HB   TYR  93          1HB       TYR  93  -6.595   6.037  -2.596
  729   2HB   TYR  93          2HB       TYR  93  -8.163   6.424  -3.295
  730    HD1  TYR  93           HD2      TYR  93  -4.557   7.309  -3.464
  731    HD2  TYR  93           HD1      TYR  93  -8.314   7.306  -5.460
  732    HE1  TYR  93           HE2      TYR  93  -3.447   8.022  -5.540
  733    HE2  TYR  93           HE1      TYR  93  -7.215   8.018  -7.542
  734    HH   TYR  93           HH       TYR  93  -3.821   7.982  -7.933
  735    H    GLY  94           H        GLY  94  -9.885   7.817  -2.290
  736   1HA   GLY  94          1HA       GLY  94 -11.680   7.244  -0.980
  737   2HA   GLY  94          2HA       GLY  94 -10.578   6.181  -0.118
  738    H    GLU  95           H        GLU  95 -11.298   6.569   1.933
  739    HA   GLU  95           HA       GLU  95 -11.532   7.634   3.930
  740   1HB   GLU  95          1HB       GLU  95  -9.233   8.113   3.914
  741   2HB   GLU  95          2HB       GLU  95  -9.395   9.285   2.613
  742   1HG   GLU  95          1HG       GLU  95 -10.875   9.947   5.055
  743   2HG   GLU  95          2HG       GLU  95  -9.122   9.907   5.233
  Start of MODEL   31
    1   1H    ALA   2          1H        ALA   2 -14.674  -0.310  15.813
    2    HA   ALA   2           HA       ALA   2 -13.431  -0.030  18.291
    3   1HB   ALA   2          1HB       ALA   2 -13.800  -2.340  18.612
    4   2HB   ALA   2          2HB       ALA   2 -15.125  -1.772  17.596
    5   3HB   ALA   2          3HB       ALA   2 -13.782  -2.661  16.878
    6    H    ARG   3           H        ARG   3 -11.354   0.205  18.762
    7    HA   ARG   3           HA       ARG   3  -9.085   0.070  18.691
    8   1HB   ARG   3          1HB       ARG   3  -9.904  -2.600  17.593
    9   2HB   ARG   3          2HB       ARG   3  -8.205  -2.156  17.670
   10   1HG   ARG   3          1HG       ARG   3  -8.843  -1.574  20.169
   11   2HG   ARG   3          2HG       ARG   3 -10.112  -2.759  19.858
   12   1HD   ARG   3          1HD       ARG   3  -7.385  -3.498  18.997
   13   2HD   ARG   3          2HD       ARG   3  -7.656  -3.406  20.736
   14    HE   ARG   3           HE       ARG   3  -8.705  -5.373  18.917
   15   1HH1  ARG   3          1HH1      ARG   3  -9.112  -3.798  21.994
   16   2HH1  ARG   3          2HH1      ARG   3 -10.022  -5.099  22.687
   17   1HH2  ARG   3          1HH2      ARG   3  -9.903  -7.093  19.817
   18   2HH2  ARG   3          2HH2      ARG   3 -10.471  -6.973  21.448
   19    H    GLN   4           H        GLN   4  -7.170  -0.468  17.057
   20    HA   GLN   4           HA       GLN   4  -7.924   0.745  14.480
   21   1HB   GLN   4          1HB       GLN   4  -5.906   1.466  16.424
   22   2HB   GLN   4          2HB       GLN   4  -5.178   1.145  14.856
   23   1HG   GLN   4          1HG       GLN   4  -6.290   2.881  13.831
   24   2HG   GLN   4          2HG       GLN   4  -7.575   2.909  15.037
   25   1HE2  GLN   4          1HE2      GLN   4  -5.776   5.021  13.972
   26   2HE2  GLN   4          2HE2      GLN   4  -5.047   5.734  15.366
   27    H    VAL   5           H        VAL   5  -6.633   0.139  12.624
   28    HA   VAL   5           HA       VAL   5  -5.599  -2.612  12.855
   29    HB   VAL   5           HB       VAL   5  -6.201  -2.946  10.520
   30   1HG1  VAL   5          1HG1      VAL   5  -8.135  -2.302  12.605
   31   2HG1  VAL   5          2HG1      VAL   5  -8.802  -2.192  10.975
   32   3HG1  VAL   5          3HG1      VAL   5  -8.054  -3.692  11.524
   33   1HG2  VAL   5          1HG2      VAL   5  -6.548  -1.265   9.110
   34   2HG2  VAL   5          2HG2      VAL   5  -7.874  -0.653  10.099
   35   3HG2  VAL   5          3HG2      VAL   5  -6.220  -0.139  10.427
   36    H    ILE   6           H        ILE   6  -3.849  -3.206  11.410
   37    HA   ILE   6           HA       ILE   6  -1.886  -1.075  11.220
   38    HB   ILE   6           HB       ILE   6  -1.570  -4.006  10.565
   39   1HG1  ILE   6          1HG1      ILE   6  -0.240  -3.766  12.853
   40   2HG1  ILE   6          2HG1      ILE   6  -1.397  -2.465  13.114
   41   1HG2  ILE   6          1HG2      ILE   6   0.439  -1.800  10.987
   42   2HG2  ILE   6          2HG2      ILE   6   0.845  -3.512  10.873
   43   3HG2  ILE   6          3HG2      ILE   6   0.123  -2.683   9.493
   44   1HD1  ILE   6          1HD1      ILE   6  -3.212  -3.921  13.101
   45   2HD1  ILE   6          2HD1      ILE   6  -2.289  -5.211  12.328
   46   3HD1  ILE   6          3HD1      ILE   6  -1.969  -4.783  14.008
   47    H    CYS   7           H        CYS   7  -0.771  -0.511   9.326
   48    HA   CYS   7           HA       CYS   7  -2.384  -0.577   6.950
   49   1HB   CYS   7          1HB       CYS   7  -0.819   0.955   6.026
   50   2HB   CYS   7          2HB       CYS   7  -0.977   1.386   7.725
   51    HG   CYS   7           HG       CYS   7   1.595  -0.507   6.500
   52    H    TRP   8           H        TRP   8  -1.638  -1.302   4.863
   53    HA   TRP   8           HA       TRP   8   0.033  -3.711   5.087
   54   1HB   TRP   8          1HB       TRP   8  -2.101  -2.949   3.085
   55   2HB   TRP   8          2HB       TRP   8  -1.079  -4.375   2.931
   56    HD1  TRP   8           HD1      TRP   8  -3.492  -2.908   5.606
   57    HE1  TRP   8           HE1      TRP   8  -4.776  -4.872   6.665
   58    HE3  TRP   8           HE3      TRP   8  -1.282  -6.772   3.092
   59    HZ2  TRP   8           HZ2      TRP   8  -4.842  -7.686   6.462
   60    HZ3  TRP   8           HZ3      TRP   8  -2.012  -9.070   3.584
   61    HH2  TRP   8           HH2      TRP   8  -3.755  -9.515   5.235
   62    H    CYS   9           H        CYS   9   2.053  -3.466   4.414
   63    HA   CYS   9           HA       CYS   9   2.662  -1.442   2.390
   64   1HB   CYS   9          1HB       CYS   9   5.036  -1.854   3.061
   65   2HB   CYS   9          2HB       CYS   9   4.014  -1.286   4.375
   66    HG   CYS   9           HG       CYS   9   3.850  -4.504   4.511
   67    H    PHE  10           H        PHE  10   2.887  -2.027   0.345
   68    HA   PHE  10           HA       PHE  10   4.018  -4.662  -0.272
   69   1HB   PHE  10          1HB       PHE  10   2.316  -5.282  -1.720
   70   2HB   PHE  10          2HB       PHE  10   1.412  -4.476  -0.443
   71    HD1  PHE  10           HD2      PHE  10   0.403  -2.301  -0.814
   72    HD2  PHE  10           HD1      PHE  10   2.535  -4.301  -3.907
   73    HE1  PHE  10           HE2      PHE  10  -0.579  -0.773  -2.473
   74    HE2  PHE  10           HE1      PHE  10   1.557  -2.776  -5.572
   75    HZ   PHE  10           HZ       PHE  10  -0.003  -1.010  -4.856
   76    H    THR  11           H        THR  11   4.705  -4.820  -2.584
   77    HA   THR  11           HA       THR  11   5.464  -2.204  -3.696
   78    HB   THR  11           HB       THR  11   7.319  -4.587  -3.590
   79    HG1  THR  11           HG1      THR  11   7.901  -3.879  -1.690
   80   1HG2  THR  11          1HG2      THR  11   7.877  -3.244  -5.456
   81   2HG2  THR  11          2HG2      THR  11   9.001  -2.773  -4.181
   82   3HG2  THR  11          3HG2      THR  11   7.614  -1.751  -4.556
   83    H    LEU  12           H        LEU  12   5.451  -2.043  -5.902
   84    HA   LEU  12           HA       LEU  12   4.687  -4.461  -7.401
   85   1HB   LEU  12          1HB       LEU  12   3.050  -2.342  -6.949
   86   2HB   LEU  12          2HB       LEU  12   3.797  -1.875  -8.476
   87    HG   LEU  12           HG       LEU  12   2.813  -4.622  -8.474
   88   1HD1  LEU  12          1HD1      LEU  12   0.416  -3.443  -8.831
   89   2HD1  LEU  12          2HD1      LEU  12   1.070  -2.446  -7.532
   90   3HD1  LEU  12          3HD1      LEU  12   0.930  -4.191  -7.319
   91   1HD2  LEU  12          1HD2      LEU  12   3.511  -2.817 -10.337
   92   2HD2  LEU  12          2HD2      LEU  12   1.765  -2.562 -10.309
   93   3HD2  LEU  12          3HD2      LEU  12   2.418  -4.166 -10.650
   94    H    ASN  13           H        ASN  13   5.904  -4.931  -9.119
   95    HA   ASN  13           HA       ASN  13   7.864  -2.923 -10.002
   96   1HB   ASN  13          1HB       ASN  13   9.251  -4.771 -10.746
   97   2HB   ASN  13          2HB       ASN  13   8.789  -5.030  -9.067
   98   1HD2  ASN  13          1HD2      ASN  13   8.977  -6.393 -12.094
   99   2HD2  ASN  13          2HD2      ASN  13   7.964  -7.768 -11.834
  100    H    ASN  14           H        ASN  14   7.770  -2.145 -12.011
  101    HA   ASN  14           HA       ASN  14   6.970  -1.710 -14.100
  102   1HB   ASN  14          1HB       ASN  14   8.358  -3.808 -14.443
  103   2HB   ASN  14          2HB       ASN  14   6.845  -4.710 -14.415
  104   1HD2  ASN  14          1HD2      ASN  14   7.704  -5.296 -16.585
  105   2HD2  ASN  14          2HD2      ASN  14   7.263  -4.285 -17.915
  106    HA   PRO  15           HA       PRO  15   2.594  -2.657 -12.757
  107   1HB   PRO  15          1HB       PRO  15   1.828  -0.063 -12.528
  108   2HB   PRO  15          2HB       PRO  15   2.571  -0.965 -11.203
  109   1HG   PRO  15          1HG       PRO  15   3.821   0.978 -13.106
  110   2HG   PRO  15          2HG       PRO  15   4.050   0.823 -11.355
  111   1HD   PRO  15          1HD       PRO  15   5.823  -0.163 -13.148
  112   2HD   PRO  15          2HD       PRO  15   5.527  -0.932 -11.576
  113    H    LEU  16           H        LEU  16   0.838  -2.640 -14.105
  114    HA   LEU  16           HA       LEU  16   1.296  -1.599 -16.798
  115   1HB   LEU  16          1HB       LEU  16  -0.223  -3.813 -15.624
  116   2HB   LEU  16          2HB       LEU  16  -1.068  -2.958 -16.912
  117    HG   LEU  16           HG       LEU  16   1.154  -3.340 -18.234
  118   1HD1  LEU  16          1HD1      LEU  16   2.002  -5.684 -17.522
  119   2HD1  LEU  16          2HD1      LEU  16   1.365  -5.243 -15.938
  120   3HD1  LEU  16          3HD1      LEU  16   2.614  -4.253 -16.693
  121   1HD2  LEU  16          1HD2      LEU  16  -0.752  -5.611 -17.676
  122   2HD2  LEU  16          2HD2      LEU  16   0.257  -5.414 -19.109
  123   3HD2  LEU  16          3HD2      LEU  16  -1.054  -4.276 -18.789
  124    H    SER  17           H        SER  17  -0.180  -0.620 -13.998
  125    HA   SER  17           HA       SER  17  -1.382   1.638 -15.115
  126   1HB   SER  17          1HB       SER  17  -3.543   1.119 -15.527
  127   2HB   SER  17          2HB       SER  17  -2.969  -0.547 -15.607
  128    HG   SER  17           HG       SER  17  -4.792   0.201 -14.057
  129    HA   PRO  18           HA       PRO  18  -1.393   2.897 -10.914
  130   1HB   PRO  18          1HB       PRO  18  -3.464   4.652 -10.833
  131   2HB   PRO  18          2HB       PRO  18  -1.935   5.007 -11.646
  132   1HG   PRO  18          1HG       PRO  18  -4.530   4.078 -12.814
  133   2HG   PRO  18          2HG       PRO  18  -3.415   5.321 -13.412
  134   1HD   PRO  18          1HD       PRO  18  -3.488   2.815 -14.436
  135   2HD   PRO  18          2HD       PRO  18  -1.994   3.771 -14.356
  136    H    LEU  19           H        LEU  19  -2.424   2.665  -8.898
  137    HA   LEU  19           HA       LEU  19  -4.346   0.534  -8.788
  138   1HB   LEU  19          1HB       LEU  19  -3.444   2.196  -6.458
  139   2HB   LEU  19          2HB       LEU  19  -3.995   0.522  -6.465
  140    HG   LEU  19           HG       LEU  19  -1.442   1.335  -7.821
  141   1HD1  LEU  19          1HD1      LEU  19  -1.662   0.392  -4.971
  142   2HD1  LEU  19          2HD1      LEU  19  -1.449   2.082  -5.429
  143   3HD1  LEU  19          3HD1      LEU  19  -0.210   0.895  -5.837
  144   1HD2  LEU  19          1HD2      LEU  19  -2.899  -1.057  -7.606
  145   2HD2  LEU  19          2HD2      LEU  19  -1.490  -1.240  -6.561
  146   3HD2  LEU  19          3HD2      LEU  19  -1.277  -0.833  -8.264
  147    H    SER  20           H        SER  20  -6.217   0.772  -7.166
  148    HA   SER  20           HA       SER  20  -7.482   3.406  -7.312
  149   1HB   SER  20          1HB       SER  20  -9.620   2.361  -8.066
  150   2HB   SER  20          2HB       SER  20  -8.338   2.266  -9.273
  151    HG   SER  20           HG       SER  20  -9.563   0.282  -8.889
  152    H    LEU  21           H        LEU  21  -9.396   3.571  -5.905
  153    HA   LEU  21           HA       LEU  21  -8.864   2.528  -3.334
  154   1HB   LEU  21          1HB       LEU  21  -9.923   4.622  -3.434
  155   2HB   LEU  21          2HB       LEU  21 -11.176   4.028  -4.521
  156    HG   LEU  21           HG       LEU  21 -12.047   2.649  -2.614
  157   1HD1  LEU  21          1HD1      LEU  21  -9.651   3.630  -1.389
  158   2HD1  LEU  21          2HD1      LEU  21 -10.803   2.435  -0.793
  159   3HD1  LEU  21          3HD1      LEU  21 -11.057   4.148  -0.458
  160   1HD2  LEU  21          1HD2      LEU  21 -12.109   5.578  -2.867
  161   2HD2  LEU  21          2HD2      LEU  21 -12.664   4.942  -1.319
  162   3HD2  LEU  21          3HD2      LEU  21 -13.430   4.411  -2.817
  163    H    HIS  22           H        HIS  22 -10.121   1.108  -2.049
  164    HA   HIS  22           HA       HIS  22 -11.655  -0.854  -3.624
  165   1HB   HIS  22          1HB       HIS  22  -9.432  -1.545  -2.507
  166   2HB   HIS  22          2HB       HIS  22 -10.328  -1.465  -0.993
  167    HD1  HIS  22           HD1      HIS  22 -10.643  -3.852  -0.376
  168    HD2  HIS  22           HD2      HIS  22 -11.550  -3.135  -4.366
  169    HE1  HIS  22           HE1      HIS  22 -11.578  -6.015  -1.251
  170    H    ASP  23           H        ASP  23 -13.722  -1.176  -3.106
  171    HA   ASP  23           HA       ASP  23 -15.128   0.451  -1.355
  172   1HB   ASP  23          1HB       ASP  23 -15.712  -2.070  -2.813
  173   2HB   ASP  23          2HB       ASP  23 -16.796  -1.650  -1.489
  174    H    SER  24           H        SER  24 -13.333  -2.430  -0.727
  175    HA   SER  24           HA       SER  24 -14.589  -2.959   1.820
  176   1HB   SER  24          1HB       SER  24 -13.105  -4.482   0.048
  177   2HB   SER  24          2HB       SER  24 -11.985  -4.213   1.383
  178    HG   SER  24           HG       SER  24 -13.968  -4.842   2.698
  179    H    MET  25           H        MET  25 -11.570  -1.543   0.651
  180    HA   MET  25           HA       MET  25 -10.531  -1.099   3.292
  181   1HB   MET  25          1HB       MET  25  -8.631  -0.252   2.260
  182   2HB   MET  25          2HB       MET  25  -9.229  -1.395   1.064
  183   1HG   MET  25          1HG       MET  25 -10.083   0.321  -0.301
  184   2HG   MET  25          2HG       MET  25  -9.905   1.525   0.974
  185   1HE   MET  25          1HE       MET  25  -8.271   0.053  -2.208
  186   2HE   MET  25          2HE       MET  25  -6.599  -0.192  -1.703
  187   3HE   MET  25          3HE       MET  25  -7.891  -1.150  -0.976
  188    H    LYS  26           H        LYS  26  -9.631   1.330   3.560
  189    HA   LYS  26           HA       LYS  26 -12.037   3.018   3.498
  190   1HB   LYS  26          1HB       LYS  26 -10.025   2.489   5.497
  191   2HB   LYS  26          2HB       LYS  26 -10.096   4.211   5.148
  192   1HG   LYS  26          1HG       LYS  26 -12.606   4.022   5.479
  193   2HG   LYS  26          2HG       LYS  26 -12.286   2.424   6.157
  194   1HD   LYS  26          1HD       LYS  26 -10.805   3.435   7.828
  195   2HD   LYS  26          2HD       LYS  26 -11.130   5.031   7.149
  196   1HE   LYS  26          1HE       LYS  26 -13.581   4.568   7.618
  197   2HE   LYS  26          2HE       LYS  26 -13.037   3.185   8.566
  198   1HZ   LYS  26          1HZ       LYS  26 -13.422   5.244   9.873
  199   2HZ   LYS  26          2HZ       LYS  26 -12.133   5.969   9.051
  200   3HZ   LYS  26          3HZ       LYS  26 -11.858   4.618  10.031
  201    H    TYR  27           H        TYR  27  -8.562   3.030   2.850
  202    HA   TYR  27           HA       TYR  27  -8.916   5.021   0.797
  203   1HB   TYR  27          1HB       TYR  27  -7.016   6.431   1.901
  204   2HB   TYR  27          2HB       TYR  27  -8.680   6.654   2.430
  205    HD1  TYR  27           HD1      TYR  27  -5.575   4.776   3.279
  206    HD2  TYR  27           HD2      TYR  27  -9.208   6.483   4.690
  207    HE1  TYR  27           HE1      TYR  27  -4.897   4.290   5.593
  208    HE2  TYR  27           HE2      TYR  27  -8.540   6.002   7.008
  209    HH   TYR  27           HH       TYR  27  -6.735   4.042   8.033
  210    H    LEU  28           H        LEU  28  -7.190   5.116  -0.647
  211    HA   LEU  28           HA       LEU  28  -5.159   3.019  -0.262
  212   1HB   LEU  28          1HB       LEU  28  -6.043   2.272  -2.176
  213   2HB   LEU  28          2HB       LEU  28  -6.827   3.812  -2.523
  214    HG   LEU  28           HG       LEU  28  -4.621   4.647  -3.364
  215   1HD1  LEU  28          1HD1      LEU  28  -3.830   1.960  -2.485
  216   2HD1  LEU  28          2HD1      LEU  28  -2.869   3.426  -2.673
  217   3HD1  LEU  28          3HD1      LEU  28  -3.243   2.431  -4.080
  218   1HD2  LEU  28          1HD2      LEU  28  -6.316   3.933  -4.919
  219   2HD2  LEU  28          2HD2      LEU  28  -5.849   2.245  -4.712
  220   3HD2  LEU  28          3HD2      LEU  28  -4.741   3.379  -5.487
  221    H    VAL  29           H        VAL  29  -3.101   3.614  -0.101
  222    HA   VAL  29           HA       VAL  29  -2.317   6.262  -1.131
  223    HB   VAL  29           HB       VAL  29  -1.464   4.979   1.466
  224   1HG1  VAL  29          1HG1      VAL  29  -0.283   7.339   1.610
  225   2HG1  VAL  29          2HG1      VAL  29   0.514   5.952   0.865
  226   3HG1  VAL  29          3HG1      VAL  29  -0.265   7.171  -0.145
  227   1HG2  VAL  29          1HG2      VAL  29  -3.117   6.168   2.350
  228   2HG2  VAL  29          2HG2      VAL  29  -2.322   7.642   1.797
  229   3HG2  VAL  29          3HG2      VAL  29  -3.516   6.847   0.772
  230    H    TYR  30           H        TYR  30  -0.757   6.158  -2.596
  231    HA   TYR  30           HA       TYR  30   1.415   4.257  -2.320
  232   1HB   TYR  30          1HB       TYR  30   1.120   3.134  -4.372
  233   2HB   TYR  30          2HB       TYR  30  -0.477   3.137  -3.633
  234    HD1  TYR  30           HD2      TYR  30  -2.275   4.493  -4.559
  235    HD2  TYR  30           HD1      TYR  30   1.582   4.454  -6.355
  236    HE1  TYR  30           HE2      TYR  30  -3.211   5.537  -6.579
  237    HE2  TYR  30           HE1      TYR  30   0.656   5.500  -8.380
  238    HH   TYR  30           HH       TYR  30  -2.032   7.095  -8.560
  239    H    GLN  31           H        GLN  31   3.228   4.747  -3.659
  240    HA   GLN  31           HA       GLN  31   3.112   7.312  -5.075
  241   1HB   GLN  31          1HB       GLN  31   5.444   6.685  -3.293
  242   2HB   GLN  31          2HB       GLN  31   4.937   8.238  -3.943
  243   1HG   GLN  31          1HG       GLN  31   2.927   8.113  -2.475
  244   2HG   GLN  31          2HG       GLN  31   3.622   6.668  -1.742
  245   1HE2  GLN  31          1HE2      GLN  31   3.650   7.743   0.267
  246   2HE2  GLN  31          2HE2      GLN  31   4.862   8.917   0.637
  247    H    THR  32           H        THR  32   4.883   7.651  -6.565
  248    HA   THR  32           HA       THR  32   5.785   5.123  -7.719
  249    HB   THR  32           HB       THR  32   5.991   7.903  -8.892
  250    HG1  THR  32           HG1      THR  32   4.173   6.995 -10.201
  251   1HG2  THR  32          1HG2      THR  32   6.277   6.688 -11.019
  252   2HG2  THR  32          2HG2      THR  32   6.269   5.163 -10.133
  253   3HG2  THR  32          3HG2      THR  32   7.566   6.328  -9.872
  254    H    GLU  33           H        GLU  33   7.861   4.484  -7.778
  255    HA   GLU  33           HA       GLU  33   9.912   6.387  -6.853
  256   1HB   GLU  33          1HB       GLU  33   9.332   3.597  -5.984
  257   2HB   GLU  33          2HB       GLU  33  11.015   4.098  -6.061
  258   1HG   GLU  33          1HG       GLU  33   9.648   6.162  -4.745
  259   2HG   GLU  33          2HG       GLU  33   9.045   4.653  -4.063
  260    H    GLN  34           H        GLN  34  12.058   6.029  -7.657
  261    HA   GLN  34           HA       GLN  34  12.034   4.870 -10.344
  262   1HB   GLN  34          1HB       GLN  34  13.115   7.234  -9.270
  263   2HB   GLN  34          2HB       GLN  34  14.492   6.215  -9.666
  264   1HG   GLN  34          1HG       GLN  34  12.548   6.193 -11.791
  265   2HG   GLN  34          2HG       GLN  34  13.040   7.838 -11.393
  266   1HE2  GLN  34          1HE2      GLN  34  14.008   7.896 -13.492
  267   2HE2  GLN  34          2HE2      GLN  34  15.562   7.188 -13.751
  268    H    GLY  35           H        GLY  35  13.198   3.122 -10.897
  269   1HA   GLY  35          1HA       GLY  35  15.585   2.266  -9.722
  270   2HA   GLY  35          2HA       GLY  35  14.270   1.434  -8.905
  271    H    GLU  36           H        GLU  36  15.678  -0.357  -9.924
  272    HA   GLU  36           HA       GLU  36  16.049  -1.923 -11.560
  273   1HB   GLU  36          1HB       GLU  36  14.035  -2.978 -12.336
  274   2HB   GLU  36          2HB       GLU  36  13.769  -2.433 -10.686
  275   1HG   GLU  36          1HG       GLU  36  12.405  -0.652 -11.379
  276   2HG   GLU  36          2HG       GLU  36  12.919  -0.807 -13.057
  277    H    ALA  37           H        ALA  37  14.545  -2.316 -13.984
  278    HA   ALA  37           HA       ALA  37  16.088  -0.865 -15.793
  279   1HB   ALA  37          1HB       ALA  37  13.394  -2.038 -16.437
  280   2HB   ALA  37          2HB       ALA  37  14.779  -1.830 -17.510
  281   3HB   ALA  37          3HB       ALA  37  14.841  -3.021 -16.210
  282    H    GLY  38           H        GLY  38  14.551   0.202 -17.743
  283   1HA   GLY  38          1HA       GLY  38  14.141   2.821 -16.966
  284   2HA   GLY  38          2HA       GLY  38  13.411   2.089 -18.388
  285    H    ASN  39           H        ASN  39  12.032   0.114 -16.544
  286    HA   ASN  39           HA       ASN  39   9.609   1.594 -16.272
  287   1HB   ASN  39          1HB       ASN  39  10.042  -1.069 -14.962
  288   2HB   ASN  39          2HB       ASN  39   8.595  -0.435 -15.740
  289   1HD2  ASN  39          1HD2      ASN  39  10.775  -2.739 -16.038
  290   2HD2  ASN  39          2HD2      ASN  39  10.880  -2.882 -17.757
  291    H    ILE  40           H        ILE  40   8.354   1.690 -14.238
  292    HA   ILE  40           HA       ILE  40  10.125   2.290 -11.962
  293    HB   ILE  40           HB       ILE  40   8.162   3.732 -11.187
  294   1HG1  ILE  40          1HG1      ILE  40   7.416   3.447 -14.106
  295   2HG1  ILE  40          2HG1      ILE  40   6.502   2.789 -12.753
  296   1HG2  ILE  40          1HG2      ILE  40  10.348   4.502 -12.209
  297   2HG2  ILE  40          2HG2      ILE  40   9.467   4.670 -13.726
  298   3HG2  ILE  40          3HG2      ILE  40   8.994   5.625 -12.321
  299   1HD1  ILE  40          1HD1      ILE  40   5.817   5.047 -13.870
  300   2HD1  ILE  40          2HD1      ILE  40   5.704   4.835 -12.123
  301   3HD1  ILE  40          3HD1      ILE  40   7.070   5.706 -12.819
  302    H    HIS  41           H        HIS  41   8.964   2.145  -9.801
  303    HA   HIS  41           HA       HIS  41   7.166  -0.188  -9.761
  304   1HB   HIS  41          1HB       HIS  41   8.337  -0.641  -7.476
  305   2HB   HIS  41          2HB       HIS  41   9.137  -1.132  -8.966
  306    HD1  HIS  41           HD1      HIS  41  11.507  -0.959  -8.066
  307    HD2  HIS  41           HD2      HIS  41   9.340   2.564  -7.669
  308    HE1  HIS  41           HE1      HIS  41  13.184   0.790  -7.396
  309    H    PHE  42           H        PHE  42   5.650  -0.276  -8.053
  310    HA   PHE  42           HA       PHE  42   5.019   2.366  -6.944
  311   1HB   PHE  42          1HB       PHE  42   3.371  -0.034  -7.652
  312   2HB   PHE  42          2HB       PHE  42   2.771   1.104  -6.449
  313    HD1  PHE  42           HD1      PHE  42   4.832   2.170  -9.283
  314    HD2  PHE  42           HD2      PHE  42   0.877   1.777  -7.760
  315    HE1  PHE  42           HE1      PHE  42   3.998   3.626 -11.083
  316    HE2  PHE  42           HE2      PHE  42   0.037   3.232  -9.558
  317    HZ   PHE  42           HZ       PHE  42   1.598   4.158 -11.223
  318    H    GLN  43           H        GLN  43   4.885   2.731  -4.792
  319    HA   GLN  43           HA       GLN  43   4.963   0.485  -2.936
  320   1HB   GLN  43          1HB       GLN  43   7.246   2.158  -3.554
  321   2HB   GLN  43          2HB       GLN  43   6.812   2.279  -1.854
  322   1HG   GLN  43          1HG       GLN  43   7.433   0.164  -1.401
  323   2HG   GLN  43          2HG       GLN  43   6.900  -0.445  -2.967
  324   1HE2  GLN  43          1HE2      GLN  43   8.265   0.133  -4.832
  325   2HE2  GLN  43          2HE2      GLN  43   9.975   0.203  -4.600
  326    H    GLY  44           H        GLY  44   3.822   0.858  -1.119
  327   1HA   GLY  44          1HA       GLY  44   3.506   3.342   0.151
  328   2HA   GLY  44          2HA       GLY  44   2.140   3.101  -0.928
  329    H    TYR  45           H        TYR  45   1.079   3.273   1.278
  330    HA   TYR  45           HA       TYR  45   0.884   0.576   2.450
  331   1HB   TYR  45          1HB       TYR  45   0.309   1.690   4.605
  332   2HB   TYR  45          2HB       TYR  45   1.951   2.021   4.064
  333    HD1  TYR  45           HD1      TYR  45  -1.468   3.457   4.222
  334    HD2  TYR  45           HD2      TYR  45   2.688   4.231   3.738
  335    HE1  TYR  45           HE1      TYR  45  -1.903   5.871   4.404
  336    HE2  TYR  45           HE2      TYR  45   2.265   6.647   3.920
  337    HH   TYR  45           HH       TYR  45  -0.336   7.970   5.176
  338    H    ILE  46           H        ILE  46  -1.149  -0.199   2.919
  339    HA   ILE  46           HA       ILE  46  -3.440   1.515   2.262
  340    HB   ILE  46           HB       ILE  46  -3.062  -1.305   1.248
  341   1HG1  ILE  46          1HG1      ILE  46  -3.340   1.246  -0.344
  342   2HG1  ILE  46          2HG1      ILE  46  -1.783   0.543   0.079
  343   1HG2  ILE  46          1HG2      ILE  46  -5.406   0.527   1.345
  344   2HG2  ILE  46          2HG2      ILE  46  -5.215  -0.534  -0.050
  345   3HG2  ILE  46          3HG2      ILE  46  -5.328  -1.220   1.570
  346   1HD1  ILE  46          1HD1      ILE  46  -2.330  -1.463  -1.164
  347   2HD1  ILE  46          2HD1      ILE  46  -3.923  -0.809  -1.547
  348   3HD1  ILE  46          3HD1      ILE  46  -2.474  -0.035  -2.189
  349    H    GLU  47           H        GLU  47  -5.001   1.428   3.742
  350    HA   GLU  47           HA       GLU  47  -4.910  -0.745   5.720
  351   1HB   GLU  47          1HB       GLU  47  -6.190   1.984   5.957
  352   2HB   GLU  47          2HB       GLU  47  -6.084   0.776   7.230
  353   1HG   GLU  47          1HG       GLU  47  -3.503   1.481   6.066
  354   2HG   GLU  47          2HG       GLU  47  -4.334   2.833   6.834
  355    H    MET  48           H        MET  48  -6.411  -2.260   5.549
  356    HA   MET  48           HA       MET  48  -8.731  -1.875   3.883
  357   1HB   MET  48          1HB       MET  48  -7.928  -4.241   5.586
  358   2HB   MET  48          2HB       MET  48  -9.212  -4.231   4.385
  359   1HG   MET  48          1HG       MET  48  -6.264  -3.903   3.887
  360   2HG   MET  48          2HG       MET  48  -7.269  -5.288   3.467
  361   1HE   MET  48          1HE       MET  48  -9.885  -4.139   1.770
  362   2HE   MET  48          2HE       MET  48  -8.955  -4.524   0.322
  363   3HE   MET  48          3HE       MET  48  -8.790  -5.521   1.767
  364    H    LYS  49           H        LYS  49 -10.817  -3.040   4.907
  365    HA   LYS  49           HA       LYS  49 -11.989  -1.242   6.633
  366   1HB   LYS  49          1HB       LYS  49 -12.916  -3.324   5.230
  367   2HB   LYS  49          2HB       LYS  49 -12.894  -4.068   6.824
  368   1HG   LYS  49          1HG       LYS  49 -15.070  -3.141   6.387
  369   2HG   LYS  49          2HG       LYS  49 -14.286  -2.225   7.676
  370   1HD   LYS  49          1HD       LYS  49 -14.806  -0.402   6.490
  371   2HD   LYS  49          2HD       LYS  49 -13.509  -0.889   5.395
  372   1HE   LYS  49          1HE       LYS  49 -15.046  -0.997   3.788
  373   2HE   LYS  49          2HE       LYS  49 -15.692  -2.417   4.610
  374   1HZ   LYS  49          1HZ       LYS  49 -17.557  -1.234   4.767
  375   2HZ   LYS  49          2HZ       LYS  49 -16.789   0.227   4.396
  376   3HZ   LYS  49          3HZ       LYS  49 -16.781  -0.352   5.985
  377    H    LYS  50           H        LYS  50 -10.934  -4.528   7.546
  378    HA   LYS  50           HA       LYS  50  -9.564  -3.781   9.860
  379   1HB   LYS  50          1HB       LYS  50 -12.431  -3.792  10.155
  380   2HB   LYS  50          2HB       LYS  50 -11.718  -5.037  11.171
  381   1HG   LYS  50          1HG       LYS  50 -10.371  -3.447  12.314
  382   2HG   LYS  50          2HG       LYS  50 -10.792  -2.176  11.165
  383   1HD   LYS  50          1HD       LYS  50 -12.214  -1.654  12.884
  384   2HD   LYS  50          2HD       LYS  50 -13.243  -2.743  11.951
  385   1HE   LYS  50          1HE       LYS  50 -12.067  -4.552  13.502
  386   2HE   LYS  50          2HE       LYS  50 -11.902  -3.158  14.569
  387   1HZ   LYS  50          1HZ       LYS  50 -13.931  -4.248  15.088
  388   2HZ   LYS  50          2HZ       LYS  50 -14.415  -4.285  13.468
  389   3HZ   LYS  50          3HZ       LYS  50 -14.334  -2.810  14.292
  390    H    ARG  51           H        ARG  51 -12.012  -6.339   9.523
  391    HA   ARG  51           HA       ARG  51  -9.983  -8.344  10.041
  392   1HB   ARG  51          1HB       ARG  51 -12.509  -8.210  10.864
  393   2HB   ARG  51          2HB       ARG  51 -12.788  -9.083   9.363
  394   1HG   ARG  51          1HG       ARG  51 -11.647 -10.949  10.075
  395   2HG   ARG  51          2HG       ARG  51 -10.688 -10.043  11.247
  396   1HD   ARG  51          1HD       ARG  51 -13.634 -10.160  11.629
  397   2HD   ARG  51          2HD       ARG  51 -12.692 -11.607  11.987
  398    HE   ARG  51           HE       ARG  51 -11.378  -9.600  13.288
  399   1HH1  ARG  51          1HH1      ARG  51 -14.643 -10.810  13.291
  400   2HH1  ARG  51          2HH1      ARG  51 -14.940 -10.376  14.942
  401   1HH2  ARG  51          1HH2      ARG  51 -11.758  -9.025  15.462
  402   2HH2  ARG  51          2HH2      ARG  51 -13.299  -9.360  16.175
  403    H    THR  52           H        THR  52  -9.259  -7.249   7.745
  404    HA   THR  52           HA       THR  52 -10.203  -9.098   5.652
  405    HB   THR  52           HB       THR  52  -8.743  -6.557   5.014
  406    HG1  THR  52           HG1      THR  52 -11.572  -6.699   5.215
  407   1HG2  THR  52          1HG2      THR  52  -9.954  -6.729   2.925
  408   2HG2  THR  52          2HG2      THR  52 -10.886  -8.094   3.541
  409   3HG2  THR  52          3HG2      THR  52  -9.153  -8.262   3.263
  410    H    SER  53           H        SER  53  -8.811 -10.680   5.260
  411    HA   SER  53           HA       SER  53  -6.055 -10.510   6.049
  412   1HB   SER  53          1HB       SER  53  -6.046 -12.806   4.756
  413   2HB   SER  53          2HB       SER  53  -6.852 -12.669   6.318
  414    HG   SER  53           HG       SER  53  -7.951 -12.881   3.752
  415    H    LEU  54           H        LEU  54  -4.471 -11.562   4.292
  416    HA   LEU  54           HA       LEU  54  -3.872  -9.591   2.453
  417   1HB   LEU  54          1HB       LEU  54  -2.304 -11.323   3.198
  418   2HB   LEU  54          2HB       LEU  54  -3.200 -12.525   2.271
  419    HG   LEU  54           HG       LEU  54  -2.604 -11.241   0.201
  420   1HD1  LEU  54          1HD1      LEU  54  -1.040  -9.522   0.222
  421   2HD1  LEU  54          2HD1      LEU  54  -0.510  -9.890   1.863
  422   3HD1  LEU  54          3HD1      LEU  54  -2.083  -9.141   1.593
  423   1HD2  LEU  54          1HD2      LEU  54  -0.145 -11.948   0.320
  424   2HD2  LEU  54          2HD2      LEU  54  -1.372 -13.193   0.558
  425   3HD2  LEU  54          3HD2      LEU  54  -0.523 -12.513   1.948
  426    H    ALA  55           H        ALA  55  -6.048 -12.295   2.156
  427    HA   ALA  55           HA       ALA  55  -6.310 -12.519  -0.592
  428   1HB   ALA  55          1HB       ALA  55  -8.569 -12.734   1.390
  429   2HB   ALA  55          2HB       ALA  55  -8.460 -13.500  -0.195
  430   3HB   ALA  55          3HB       ALA  55  -7.373 -13.998   1.102
  431    H    GLY  56           H        GLY  56  -7.586 -10.086   1.585
  432   1HA   GLY  56          1HA       GLY  56  -9.434  -8.943  -0.260
  433   2HA   GLY  56          2HA       GLY  56  -8.834  -8.188   1.209
  434    H    MET  57           H        MET  57  -6.124  -8.077   0.698
  435    HA   MET  57           HA       MET  57  -5.999  -5.811  -1.028
  436   1HB   MET  57          1HB       MET  57  -3.792  -7.392   0.303
  437   2HB   MET  57          2HB       MET  57  -3.573  -5.849  -0.513
  438   1HG   MET  57          1HG       MET  57  -5.651  -5.827   1.542
  439   2HG   MET  57          2HG       MET  57  -4.034  -6.178   2.148
  440   1HE   MET  57          1HE       MET  57  -4.687  -2.484  -0.520
  441   2HE   MET  57          2HE       MET  57  -4.401  -4.127  -1.093
  442   3HE   MET  57          3HE       MET  57  -5.935  -3.715  -0.325
  443    H    LYS  58           H        LYS  58  -4.672  -9.105  -1.212
  444    HA   LYS  58           HA       LYS  58  -3.331  -8.890  -3.631
  445   1HB   LYS  58          1HB       LYS  58  -3.697 -10.887  -1.861
  446   2HB   LYS  58          2HB       LYS  58  -4.787 -11.425  -3.133
  447   1HG   LYS  58          1HG       LYS  58  -3.084 -12.204  -4.307
  448   2HG   LYS  58          2HG       LYS  58  -2.316 -10.615  -4.308
  449   1HD   LYS  58          1HD       LYS  58  -0.792 -12.187  -3.330
  450   2HD   LYS  58          2HD       LYS  58  -1.398 -11.135  -2.048
  451   1HE   LYS  58          1HE       LYS  58  -2.528 -12.810  -1.024
  452   2HE   LYS  58          2HE       LYS  58  -2.922 -13.617  -2.541
  453   1HZ   LYS  58          1HZ       LYS  58  -0.141 -13.604  -1.585
  454   2HZ   LYS  58          2HZ       LYS  58  -0.929 -14.731  -2.570
  455   3HZ   LYS  58          3HZ       LYS  58  -1.246 -14.692  -0.909
  456    H    LYS  59           H        LYS  59  -6.745  -9.276  -2.985
  457    HA   LYS  59           HA       LYS  59  -7.639 -10.107  -5.490
  458   1HB   LYS  59          1HB       LYS  59  -8.799  -8.987  -3.089
  459   2HB   LYS  59          2HB       LYS  59  -9.580  -8.329  -4.521
  460   1HG   LYS  59          1HG       LYS  59 -10.480 -10.327  -5.121
  461   2HG   LYS  59          2HG       LYS  59  -9.158 -11.261  -4.416
  462   1HD   LYS  59          1HD       LYS  59 -10.277 -11.536  -2.509
  463   2HD   LYS  59          2HD       LYS  59 -10.604  -9.806  -2.383
  464   1HE   LYS  59          1HE       LYS  59 -12.488 -10.089  -3.959
  465   2HE   LYS  59          2HE       LYS  59 -12.183 -11.825  -3.975
  466   1HZ   LYS  59          1HZ       LYS  59 -13.494 -11.980  -2.215
  467   2HZ   LYS  59          2HZ       LYS  59 -13.649 -10.300  -2.102
  468   3HZ   LYS  59          3HZ       LYS  59 -12.374 -11.086  -1.315
  469    H    LEU  60           H        LEU  60  -6.638  -6.956  -4.359
  470    HA   LEU  60           HA       LEU  60  -7.662  -5.543  -6.645
  471   1HB   LEU  60          1HB       LEU  60  -5.845  -4.800  -4.373
  472   2HB   LEU  60          2HB       LEU  60  -6.160  -3.697  -5.711
  473    HG   LEU  60           HG       LEU  60  -8.596  -3.834  -5.134
  474   1HD1  LEU  60          1HD1      LEU  60  -9.124  -5.589  -3.840
  475   2HD1  LEU  60          2HD1      LEU  60  -8.658  -4.524  -2.514
  476   3HD1  LEU  60          3HD1      LEU  60  -7.506  -5.699  -3.147
  477   1HD2  LEU  60          1HD2      LEU  60  -8.152  -1.904  -4.138
  478   2HD2  LEU  60          2HD2      LEU  60  -6.486  -2.411  -3.859
  479   3HD2  LEU  60          3HD2      LEU  60  -7.730  -2.767  -2.659
  480    H    ILE  61           H        ILE  61  -4.532  -6.802  -5.606
  481    HA   ILE  61           HA       ILE  61  -3.599  -6.628  -8.369
  482    HB   ILE  61           HB       ILE  61  -1.981  -5.570  -6.048
  483   1HG1  ILE  61          1HG1      ILE  61  -2.140  -3.483  -7.694
  484   2HG1  ILE  61          2HG1      ILE  61  -3.644  -4.271  -8.155
  485   1HG2  ILE  61          1HG2      ILE  61  -0.180  -5.846  -7.312
  486   2HG2  ILE  61          2HG2      ILE  61  -1.172  -6.643  -8.532
  487   3HG2  ILE  61          3HG2      ILE  61  -0.918  -4.899  -8.604
  488   1HD1  ILE  61          1HD1      ILE  61  -2.914  -2.885  -5.665
  489   2HD1  ILE  61          2HD1      ILE  61  -4.466  -2.999  -6.496
  490   3HD1  ILE  61          3HD1      ILE  61  -3.903  -4.334  -5.491
  491    HA   PRO  62           HA       PRO  62  -2.620 -10.678  -6.364
  492   1HB   PRO  62          1HB       PRO  62  -3.332 -12.165  -8.520
  493   2HB   PRO  62          2HB       PRO  62  -4.490 -11.636  -7.294
  494   1HG   PRO  62          1HG       PRO  62  -3.913 -10.461  -9.986
  495   2HG   PRO  62          2HG       PRO  62  -5.477 -10.737  -9.198
  496   1HD   PRO  62          1HD       PRO  62  -4.286  -8.306  -9.262
  497   2HD   PRO  62          2HD       PRO  62  -5.303  -8.836  -7.906
  498    H    GLY  63           H        GLY  63  -0.428 -10.688  -6.340
  499   1HA   GLY  63          1HA       GLY  63   1.279 -12.001  -7.756
  500   2HA   GLY  63          2HA       GLY  63   0.993 -10.714  -8.918
  501    H    ALA  64           H        ALA  64   0.726  -8.672  -6.824
  502    HA   ALA  64           HA       ALA  64   3.442  -7.882  -6.681
  503   1HB   ALA  64          1HB       ALA  64   1.892  -6.134  -6.765
  504   2HB   ALA  64          2HB       ALA  64   0.917  -6.814  -5.462
  505   3HB   ALA  64          3HB       ALA  64   2.492  -6.103  -5.107
  506    H    HIS  65           H        HIS  65   4.486  -7.220  -4.577
  507    HA   HIS  65           HA       HIS  65   4.370  -9.494  -2.745
  508   1HB   HIS  65          1HB       HIS  65   6.534  -8.569  -3.817
  509   2HB   HIS  65          2HB       HIS  65   6.398  -7.274  -2.631
  510    HD1  HIS  65           HD1      HIS  65   8.308  -7.854  -1.116
  511    HD2  HIS  65           HD2      HIS  65   5.800 -11.089  -1.827
  512    HE1  HIS  65           HE1      HIS  65   9.087  -9.665   0.446
  513    H    PHE  66           H        PHE  66   3.081  -9.311  -1.042
  514    HA   PHE  66           HA       PHE  66   2.730  -6.660   0.187
  515   1HB   PHE  66          1HB       PHE  66   0.916  -8.973  -0.223
  516   2HB   PHE  66          2HB       PHE  66   0.737  -8.091   1.290
  517    HD1  PHE  66           HD1      PHE  66   0.698  -7.732  -2.390
  518    HD2  PHE  66           HD2      PHE  66  -0.348  -6.011   1.360
  519    HE1  PHE  66           HE1      PHE  66  -0.644  -6.028  -3.551
  520    HE2  PHE  66           HE2      PHE  66  -1.693  -4.305   0.205
  521    HZ   PHE  66           HZ       PHE  66  -1.843  -4.312  -2.253
  522    H    GLU  67           H        GLU  67   2.539  -6.579   2.529
  523    HA   GLU  67           HA       GLU  67   3.558  -8.829   4.042
  524   1HB   GLU  67          1HB       GLU  67   5.490  -7.312   3.058
  525   2HB   GLU  67          2HB       GLU  67   5.064  -6.279   4.415
  526   1HG   GLU  67          1HG       GLU  67   5.392  -9.095   5.121
  527   2HG   GLU  67          2HG       GLU  67   6.851  -8.329   4.494
  528    H    LYS  68           H        LYS  68   2.104  -8.928   5.618
  529    HA   LYS  68           HA       LYS  68   1.246  -6.418   6.900
  530   1HB   LYS  68          1HB       LYS  68  -0.507  -7.814   5.709
  531   2HB   LYS  68          2HB       LYS  68  -0.250  -9.038   6.945
  532   1HG   LYS  68          1HG       LYS  68  -0.665  -6.793   8.443
  533   2HG   LYS  68          2HG       LYS  68  -1.735  -6.530   7.065
  534   1HD   LYS  68          1HD       LYS  68  -2.571  -8.898   7.452
  535   2HD   LYS  68          2HD       LYS  68  -1.712  -8.840   8.994
  536   1HE   LYS  68          1HE       LYS  68  -3.625  -6.663   8.255
  537   2HE   LYS  68          2HE       LYS  68  -4.231  -8.193   8.886
  538   1HZ   LYS  68          1HZ       LYS  68  -2.228  -6.478  10.252
  539   2HZ   LYS  68          2HZ       LYS  68  -2.928  -7.890  10.866
  540   3HZ   LYS  68          3HZ       LYS  68  -3.879  -6.512  10.622
  541    H    ARG  69           H        ARG  69   3.576  -8.308   7.433
  542    HA   ARG  69           HA       ARG  69   2.971  -9.412  10.034
  543   1HB   ARG  69          1HB       ARG  69   5.235  -9.490   8.141
  544   2HB   ARG  69          2HB       ARG  69   5.676  -9.565   9.841
  545   1HG   ARG  69          1HG       ARG  69   3.476 -11.342   9.063
  546   2HG   ARG  69          2HG       ARG  69   5.035 -11.707   8.320
  547   1HD   ARG  69          1HD       ARG  69   5.301 -12.897  10.232
  548   2HD   ARG  69          2HD       ARG  69   5.853 -11.333  10.830
  549    HE   ARG  69           HE       ARG  69   3.033 -11.738  11.156
  550   1HH1  ARG  69          1HH1      ARG  69   6.173 -12.330  12.538
  551   2HH1  ARG  69          2HH1      ARG  69   5.575 -12.491  14.156
  552   1HH2  ARG  69          1HH2      ARG  69   2.233 -11.947  13.282
  553   2HH2  ARG  69          2HH2      ARG  69   3.334 -12.274  14.578
  554    H    ARG  70           H        ARG  70   3.132  -6.383   9.223
  555    HA   ARG  70           HA       ARG  70   3.583  -4.434  10.305
  556   1HB   ARG  70          1HB       ARG  70   3.672  -6.456  12.468
  557   2HB   ARG  70          2HB       ARG  70   4.433  -4.911  12.821
  558   1HG   ARG  70          1HG       ARG  70   2.403  -3.733  12.460
  559   2HG   ARG  70          2HG       ARG  70   1.621  -5.166  11.791
  560   1HD   ARG  70          1HD       ARG  70   1.016  -4.576  14.173
  561   2HD   ARG  70          2HD       ARG  70   1.556  -6.232  13.896
  562    HE   ARG  70           HE       ARG  70   3.669  -4.453  14.680
  563   1HH1  ARG  70          1HH1      ARG  70   1.109  -6.522  15.813
  564   2HH1  ARG  70          2HH1      ARG  70   1.836  -6.792  17.362
  565   1HH2  ARG  70          1HH2      ARG  70   4.636  -4.800  16.716
  566   2HH2  ARG  70          2HH2      ARG  70   3.842  -5.811  17.876
  567    H    GLY  71           H        GLY  71   5.451  -4.666   8.676
  568   1HA   GLY  71          1HA       GLY  71   8.040  -5.362   9.445
  569   2HA   GLY  71          2HA       GLY  71   7.644  -4.199   8.189
  570    H    THR  72           H        THR  72   6.149  -2.662  10.396
  571    HA   THR  72           HA       THR  72   8.388  -1.648  11.960
  572    HB   THR  72           HB       THR  72   7.023   0.651  10.973
  573    HG1  THR  72           HG1      THR  72   7.921   0.282   8.711
  574   1HG2  THR  72          1HG2      THR  72   9.165   1.452  10.618
  575   2HG2  THR  72          2HG2      THR  72   9.786  -0.124  10.130
  576   3HG2  THR  72          3HG2      THR  72   9.450   0.204  11.830
  577    H    GLN  73           H        GLN  73   5.571  -2.908  12.178
  578    HA   GLN  73           HA       GLN  73   3.773  -2.794  13.570
  579   1HB   GLN  73          1HB       GLN  73   5.738  -2.683  15.184
  580   2HB   GLN  73          2HB       GLN  73   5.455  -0.949  15.261
  581   1HG   GLN  73          1HG       GLN  73   3.029  -2.469  15.702
  582   2HG   GLN  73          2HG       GLN  73   4.298  -2.885  16.852
  583   1HE2  GLN  73          1HE2      GLN  73   1.715  -0.999  16.477
  584   2HE2  GLN  73          2HE2      GLN  73   2.152   0.345  17.470
  585    H    GLY  74           H        GLY  74   3.933  -0.842  11.437
  586   1HA   GLY  74          1HA       GLY  74   2.265   0.715  10.825
  587   2HA   GLY  74          2HA       GLY  74   2.009   1.073  12.527
  588    H    GLU  75           H        GLU  75   5.133   1.176  12.596
  589    HA   GLU  75           HA       GLU  75   5.371   3.954  12.652
  590   1HB   GLU  75          1HB       GLU  75   6.908   2.122  13.648
  591   2HB   GLU  75          2HB       GLU  75   7.713   2.159  12.085
  592   1HG   GLU  75          1HG       GLU  75   8.612   4.215  12.435
  593   2HG   GLU  75          2HG       GLU  75   7.286   4.743  13.470
  594    H    ALA  76           H        ALA  76   5.641   1.711  10.021
  595    HA   ALA  76           HA       ALA  76   7.117   3.292   8.217
  596   1HB   ALA  76          1HB       ALA  76   7.010   1.345   7.155
  597   2HB   ALA  76          2HB       ALA  76   5.651   0.814   8.146
  598   3HB   ALA  76          3HB       ALA  76   5.361   1.758   6.685
  599    H    ARG  77           H        ARG  77   3.978   3.666   9.443
  600    HA   ARG  77           HA       ARG  77   2.680   4.843   7.228
  601   1HB   ARG  77          1HB       ARG  77   2.240   5.007  10.202
  602   2HB   ARG  77          2HB       ARG  77   1.245   5.916   9.072
  603   1HG   ARG  77          1HG       ARG  77   1.385   3.204   8.203
  604   2HG   ARG  77          2HG       ARG  77   0.939   3.246   9.911
  605   1HD   ARG  77          1HD       ARG  77  -0.404   5.066   7.953
  606   2HD   ARG  77          2HD       ARG  77  -0.912   3.384   8.093
  607    HE   ARG  77           HE       ARG  77  -0.927   4.266  10.656
  608   1HH1  ARG  77          1HH1      ARG  77  -2.360   5.420   7.701
  609   2HH1  ARG  77          2HH1      ARG  77  -3.729   6.131   8.489
  610   1HH2  ARG  77          1HH2      ARG  77  -2.725   5.198  11.706
  611   2HH2  ARG  77          2HH2      ARG  77  -3.936   6.005  10.767
  612    H    ALA  78           H        ALA  78   5.094   5.994   9.381
  613    HA   ALA  78           HA       ALA  78   4.558   8.797   8.824
  614   1HB   ALA  78          1HB       ALA  78   5.316   8.735  10.957
  615   2HB   ALA  78          2HB       ALA  78   6.308   7.303  10.681
  616   3HB   ALA  78          3HB       ALA  78   6.877   8.885  10.149
  617    H    TYR  79           H        TYR  79   7.444   6.714   8.525
  618    HA   TYR  79           HA       TYR  79   8.825   8.431   6.787
  619   1HB   TYR  79          1HB       TYR  79  10.449   6.963   7.226
  620   2HB   TYR  79          2HB       TYR  79   9.278   5.912   8.014
  621    HD1  TYR  79           HD1      TYR  79  10.936   6.656   4.794
  622    HD2  TYR  79           HD2      TYR  79   8.555   3.897   6.988
  623    HE1  TYR  79           HE1      TYR  79  11.270   4.975   3.030
  624    HE2  TYR  79           HE2      TYR  79   8.883   2.207   5.231
  625    HH   TYR  79           HH       TYR  79  10.053   1.679   3.380
  626    H    SER  80           H        SER  80   6.568   5.803   6.185
  627    HA   SER  80           HA       SER  80   5.468   5.122   4.314
  628   1HB   SER  80          1HB       SER  80   6.227   7.916   3.453
  629   2HB   SER  80          2HB       SER  80   5.228   6.850   2.465
  630    HG   SER  80           HG       SER  80   4.485   8.383   4.506
  631    H    MET  81           H        MET  81   7.654   7.112   2.423
  632    HA   MET  81           HA       MET  81   9.101   4.697   1.573
  633   1HB   MET  81          1HB       MET  81   7.502   6.567  -0.060
  634   2HB   MET  81          2HB       MET  81   9.077   6.147  -0.720
  635   1HG   MET  81          1HG       MET  81   7.515   4.627  -1.628
  636   2HG   MET  81          2HG       MET  81   8.458   3.742  -0.431
  637   1HE   MET  81          1HE       MET  81   4.140   5.226   0.161
  638   2HE   MET  81          2HE       MET  81   5.487   6.288   0.572
  639   3HE   MET  81          3HE       MET  81   5.263   5.752  -1.094
  640    H    LYS  82           H        LYS  82  11.016   5.466   0.068
  641    HA   LYS  82           HA       LYS  82  12.546   7.342   1.682
  642   1HB   LYS  82          1HB       LYS  82  13.551   5.183   1.067
  643   2HB   LYS  82          2HB       LYS  82  13.395   5.593  -0.636
  644   1HG   LYS  82          1HG       LYS  82  15.388   6.543  -0.575
  645   2HG   LYS  82          2HG       LYS  82  14.788   7.712   0.604
  646   1HD   LYS  82          1HD       LYS  82  15.458   6.350   2.427
  647   2HD   LYS  82          2HD       LYS  82  15.762   4.968   1.372
  648   1HE   LYS  82          1HE       LYS  82  17.571   6.283   0.280
  649   2HE   LYS  82          2HE       LYS  82  17.314   7.551   1.477
  650   1HZ   LYS  82          1HZ       LYS  82  18.876   5.240   1.708
  651   2HZ   LYS  82          2HZ       LYS  82  17.617   5.124   2.830
  652   3HZ   LYS  82          3HZ       LYS  82  18.646   6.466   2.850
  653    H    GLU  83           H        GLU  83  12.683   9.416   1.169
  654    HA   GLU  83           HA       GLU  83  11.617  10.521  -1.188
  655   1HB   GLU  83          1HB       GLU  83  13.326  11.584   1.032
  656   2HB   GLU  83          2HB       GLU  83  13.029  12.573  -0.391
  657   1HG   GLU  83          1HG       GLU  83  10.726  12.672   0.019
  658   2HG   GLU  83          2HG       GLU  83  10.789  11.339   1.171
  659    H    ASP  84           H        ASP  84  14.865   9.546  -0.297
  660    HA   ASP  84           HA       ASP  84  16.314  10.803  -2.322
  661   1HB   ASP  84          1HB       ASP  84  16.803   8.831  -0.327
  662   2HB   ASP  84          2HB       ASP  84  17.433   8.218  -1.854
  663    H    THR  85           H        THR  85  14.446   7.826  -2.347
  664    HA   THR  85           HA       THR  85  15.086   7.478  -5.200
  665    HB   THR  85           HB       THR  85  13.812   5.180  -4.595
  666    HG1  THR  85           HG1      THR  85  14.948   4.665  -2.452
  667   1HG2  THR  85          1HG2      THR  85  16.326   5.887  -5.333
  668   2HG2  THR  85          2HG2      THR  85  15.816   4.228  -5.018
  669   3HG2  THR  85          3HG2      THR  85  16.635   5.153  -3.760
  670    H    ARG  86           H        ARG  86  12.893   9.025  -3.493
  671    HA   ARG  86           HA       ARG  86  10.434   7.969  -4.508
  672   1HB   ARG  86          1HB       ARG  86  10.620   9.284  -2.395
  673   2HB   ARG  86          2HB       ARG  86  10.975  10.711  -3.359
  674   1HG   ARG  86          1HG       ARG  86   8.806  10.706  -4.322
  675   2HG   ARG  86          2HG       ARG  86   8.448   9.111  -3.657
  676   1HD   ARG  86          1HD       ARG  86   7.679  10.027  -1.786
  677   2HD   ARG  86          2HD       ARG  86   9.210  10.866  -1.535
  678    HE   ARG  86           HE       ARG  86   7.458  12.131  -3.443
  679   1HH1  ARG  86          1HH1      ARG  86   8.374  11.870  -0.094
  680   2HH1  ARG  86          2HH1      ARG  86   7.760  13.434   0.330
  681   1HH2  ARG  86          1HH2      ARG  86   6.647  14.191  -2.896
  682   2HH2  ARG  86          2HH2      ARG  86   6.777  14.753  -1.264
  683    H    LEU  87           H        LEU  87   9.569   8.275  -6.448
  684    HA   LEU  87           HA       LEU  87  10.774  10.254  -8.233
  685   1HB   LEU  87          1HB       LEU  87   9.905   7.625  -8.579
  686   2HB   LEU  87          2HB       LEU  87   8.720   8.615  -9.428
  687    HG   LEU  87           HG       LEU  87  11.678   8.414  -9.950
  688   1HD1  LEU  87          1HD1      LEU  87   9.195   7.735 -11.501
  689   2HD1  LEU  87          2HD1      LEU  87  10.512   6.667 -11.018
  690   3HD1  LEU  87          3HD1      LEU  87  10.780   7.892 -12.258
  691   1HD2  LEU  87          1HD2      LEU  87  11.240  10.723 -10.156
  692   2HD2  LEU  87          2HD2      LEU  87   9.677  10.438 -10.924
  693   3HD2  LEU  87          3HD2      LEU  87  11.168  10.074 -11.795
  694    H    GLU  88           H        GLU  88   7.490   9.082  -7.461
  695    HA   GLU  88           HA       GLU  88   6.536  11.848  -7.783
  696   1HB   GLU  88          1HB       GLU  88   5.954   9.823  -9.543
  697   2HB   GLU  88          2HB       GLU  88   4.579   9.767  -8.449
  698   1HG   GLU  88          1HG       GLU  88   3.950  11.197 -10.196
  699   2HG   GLU  88          2HG       GLU  88   4.330  12.247  -8.833
  700    H    GLY  89           H        GLY  89   4.176  11.980  -6.877
  701   1HA   GLY  89          1HA       GLY  89   2.638  11.408  -5.182
  702   2HA   GLY  89          2HA       GLY  89   3.813  10.275  -4.529
  703    HA   PRO  90           HA       PRO  90   3.110  10.074  -2.595
  704   1HB   PRO  90          1HB       PRO  90   1.581  10.865  -0.496
  705   2HB   PRO  90          2HB       PRO  90   3.299  10.483  -0.341
  706   1HG   PRO  90          1HG       PRO  90   1.967  13.153  -0.581
  707   2HG   PRO  90          2HG       PRO  90   3.292  12.655   0.488
  708   1HD   PRO  90          1HD       PRO  90   3.708  14.049  -1.795
  709   2HD   PRO  90          2HD       PRO  90   4.878  12.869  -1.169
  710    H    TRP  91           H        TRP  91   0.803   9.347  -2.381
  711    HA   TRP  91           HA       TRP  91  -1.127  11.195  -3.576
  712   1HB   TRP  91          1HB       TRP  91  -0.295   8.532  -4.713
  713   2HB   TRP  91          2HB       TRP  91  -1.867   9.240  -5.074
  714    HD1  TRP  91           HD1      TRP  91  -0.860  12.283  -5.395
  715    HE1  TRP  91           HE1      TRP  91   0.468  12.926  -7.504
  716    HE3  TRP  91           HE3      TRP  91   0.764   7.637  -6.780
  717    HZ2  TRP  91           HZ2      TRP  91   2.000  11.635  -9.492
  718    HZ3  TRP  91           HZ3      TRP  91   2.156   7.428  -8.798
  719    HH2  TRP  91           HH2      TRP  91   2.760   9.386 -10.125
  720    H    GLU  92           H        GLU  92  -3.161  10.969  -2.812
  721    HA   GLU  92           HA       GLU  92  -3.674   8.681  -1.026
  722   1HB   GLU  92          1HB       GLU  92  -4.694  11.518  -0.794
  723   2HB   GLU  92          2HB       GLU  92  -5.167  10.188   0.254
  724   1HG   GLU  92          1HG       GLU  92  -2.463  10.089   0.461
  725   2HG   GLU  92          2HG       GLU  92  -2.736  11.818   0.253
  726    H    TYR  93           H        TYR  93  -5.753   7.780  -1.016
  727    HA   TYR  93           HA       TYR  93  -7.629   8.702  -3.065
  728   1HB   TYR  93          1HB       TYR  93  -6.384   5.964  -2.921
  729   2HB   TYR  93          2HB       TYR  93  -7.943   6.226  -3.695
  730    HD1  TYR  93           HD2      TYR  93  -4.403   7.383  -3.775
  731    HD2  TYR  93           HD1      TYR  93  -8.037   6.882  -5.930
  732    HE1  TYR  93           HE2      TYR  93  -3.255   8.033  -5.850
  733    HE2  TYR  93           HE1      TYR  93  -6.899   7.530  -8.012
  734    HH   TYR  93           HH       TYR  93  -5.018   8.469  -8.866
  735    H    GLY  94           H        GLY  94  -9.768   7.613  -2.874
  736   1HA   GLY  94          1HA       GLY  94 -11.608   7.054  -1.622
  737   2HA   GLY  94          2HA       GLY  94 -10.517   6.066  -0.662
  738    H    GLU  95           H        GLU  95 -11.315   6.517   1.342
  739    HA   GLU  95           HA       GLU  95 -11.669   7.659   3.277
  740   1HB   GLU  95          1HB       GLU  95  -9.396   8.242   3.325
  741   2HB   GLU  95          2HB       GLU  95  -9.555   9.339   1.961
  742   1HG   GLU  95          1HG       GLU  95 -10.501  11.015   3.251
  743   2HG   GLU  95          2HG       GLU  95 -10.971   9.899   4.531