*HEADER    HYDROLASE                               26-MAY-11   2LDI              
*TITLE     NMR SOLUTION STRUCTURE OF ZIAAN SUB MUTANT                            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: ZINC-TRANSPORTING ATPASE;                                  
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: HMA DOMAIN RESIDUES 6-76;                                  
*COMPND   5 SYNONYM: ZN(2+)-TRANSLOCATING P-TYPE ATPASE;                         
*COMPND   6 EC: 3.6.3.5;                                                         
*COMPND   7 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: SYNECHOCYSTIS SP.;                              
*SOURCE   3 ORGANISM_TAXID: 1148;                                                
*SOURCE   4 STRAIN: ATCC 27184 / PCC 6803 / N-1;                                 
*SOURCE   5 GENE: ZIAA, SLR0798;                                                 
*SOURCE   6 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   7 EXPRESSION_SYSTEM_TAXID: 562;                                        
*SOURCE   8 EXPRESSION_SYSTEM_STRAIN: ROSETTA STRAIN;                            
*SOURCE   9 EXPRESSION_SYSTEM_VECTOR: PET29                                      
*KEYWDS    METAL HOMEOSTASIS, METALLOCHAPERONES, HYDROLASE                       
*EXPDTA    SOLUTION NMR                                                          
*NUMMDL    30                                                                    
*AUTHOR    L.BANCI, I.BERTINI, I.C.FELLI, A.PAVELKOVA                            
*REVDAT   1   30-NOV-11 2LDI    0                                                


  7 LEU  HA     53 ASP  HA      4.57            #peak     8
  7 LEU  HA      7 LEU  QD2     3.70            #peak    28
  7 LEU  QD2    53 ASP  HA      4.56            #peak    29
  7 LEU  QD2    52 TYR  HA      5.73            #peak    32
  7 LEU  H       7 LEU  QD2     5.05            #peak    33
 30 LEU  HA     33 LEU  QD2     3.63            #peak    37
 30 LEU  HA     33 LEU  QD1     3.94            #peak    38
 30 LEU  HB3    30 LEU  QD2     3.75            #peak    46
 30 LEU  HB2    30 LEU  QD2     4.21            #peak    51
 30 LEU  H      30 LEU  HG      6.00            #peak    55
 30 LEU  HB2    30 LEU  QD1     3.44            #peak    56
 30 LEU  HA     30 LEU  QD1     4.25            #peak    57
 30 LEU  H      30 LEU  QD1     4.99            #peak    58
 37 ALA  QB     38 GLU  H       4.26            #peak    61
 37 ALA  H      37 ALA  QB      4.00            #peak    62
 38 GLU  QB     39 ALA  HA      5.10            #peak    74
 68 ALA  QB     69 LEU  H       4.85            #peak   103
  9 THR  HA     50 VAL  QG2     3.91            #peak   111
  9 THR  HA     52 TYR  H       5.21            #peak   116
  9 THR  QG2    10 GLN  H       4.26            #peak   121
  9 THR  HA      9 THR  QG2     4.24            #peak   123
 42 THR  HA     42 THR  QG2     4.19            #peak   126
 42 THR  QG2    47 ARG  QG      4.36            #peak   135
 42 THR  H      42 THR  QG2     5.00            #peak   137
 45 THR  HA     45 THR  QG2     3.84            #peak   138
 45 THR  HA     47 ARG  QG      5.47            #peak   139
 45 THR  HB     47 ARG  QG      4.92            #peak   141
 51 THR  HA     51 THR  QG2     4.09            #peak   144
  9 THR  HA     51 THR  HA      4.01            #peak   146
  9 THR  HA     51 THR  HB      5.22            #peak   151
 51 THR  H      51 THR  QG2     4.88            #peak   158
 51 THR  QG2    52 TYR  HA      5.51            #peak   161
  9 THR  HA     51 THR  QG2     5.87            #peak   163
 72 THR  HA     73 LEU  H       3.57            #peak   168
 72 THR  HA     72 THR  QG2     3.84            #peak   170
 67 ALA  HA     72 THR  HA      3.49            #peak   171
 72 THR  HA     73 LEU  QB      5.52            #peak   173
 72 THR  HB     73 LEU  H       4.30            #peak   176
 14 VAL  QG1    73 LEU  QB      4.52            #peak   191
 14 VAL  QG1    73 LEU  HA      5.66            #peak   193
 36 VAL  HA     36 VAL  QG1     3.99            #peak   201
 36 VAL  HA     52 TYR  HB3     4.32            #peak   203
 36 VAL  HA     52 TYR  HA      4.50            #peak   206
 36 VAL  HA     53 ASP  HB3     5.25            #peak   207
 36 VAL  H      36 VAL  QG2     5.07            #peak   218
 36 VAL  QG2    37 ALA  HA      6.00            #peak   220
 36 VAL  HA     36 VAL  QG2     4.19            #peak   222
 36 VAL  QG2    39 ALA  QB      4.69            #peak   225
 36 VAL  QG2    50 VAL  HB      3.55            #peak   228
 36 VAL  QG2    50 VAL  QG1     3.48            #peak   229
 36 VAL  QG1    52 TYR  HA      5.50            #peak   233
 36 VAL  QG1    37 ALA  H       5.86            #peak   236
 35 GLY  HA2    57 VAL  QG2     4.69            #peak   237
 35 GLY  HA2    56 GLN  HB2     5.06            #peak   238
 35 GLY  HA2    56 GLN  HB3     5.97            #peak   239
 41 VAL  QG1    48 LEU  HA      6.00            #peak   257
 41 VAL  QG2    48 LEU  HA      6.00            #peak   261
 43 VAL  HA     46 GLY  HA3     5.24            #peak   268
 43 VAL  HA     43 VAL  QG1     3.84            #peak   269
 43 VAL  HA     43 VAL  QG2     4.19            #peak   271
 43 VAL  HB     44 ALA  QB      4.47            #peak   277
 43 VAL  QG1    46 GLY  HA2     4.20            #peak   283
 43 VAL  QG1    46 GLY  HA3     4.58            #peak   285
 43 VAL  QG2    44 ALA  H       5.25            #peak   290
 43 VAL  QG2    46 GLY  HA2     4.30            #peak   291
 43 VAL  QG2    44 ALA  QB      5.28            #peak   293
 50 VAL  HA     50 VAL  QG2     4.16            #peak   296
 39 ALA  HA     50 VAL  HA      3.76            #peak   301
 50 VAL  HB     52 TYR  HB3     6.00            #peak   310
 50 VAL  QG1    62 ILE  QD1     5.11            #peak   313
 50 VAL  QG1    62 ILE  QG2     3.65            #peak   314
 50 VAL  QG2    52 TYR  QD      4.72            #peak   322
 50 VAL  QG2    75 GLU  HB2     4.27            #peak   327
 50 VAL  QG2    75 GLU  QG      4.98            #peak   328
 50 VAL  QG2    62 ILE  QG2     3.56            #peak   331
 57 VAL  HA     57 VAL  QG1     3.98            #peak   335
 57 VAL  HA     58 SER  HB3     4.74            #peak   338
 10 GLN  QG     11 GLN  HA      5.53            #peak   345
 57 VAL  QG1    60 ILE  HG12    5.16            #peak   353
 57 VAL  QG1    60 ILE  HB      4.91            #peak   354
 35 GLY  H      57 VAL  QG2     5.48            #peak   359
 52 TYR  QD     57 VAL  QG2     4.11            #peak   361
 34 LYS  HA     57 VAL  QG2     6.00            #peak   368
  8 LYS  H      53 ASP  HA      5.00            #peak   373
  7 LEU  QD2    53 ASP  HB2     4.28            #peak   376
 53 ASP  HB2    55 LYS  HG3     4.80            #peak   378
  7 LEU  QD2    53 ASP  HB3     4.22            #peak   381
 35 GLY  HA3    53 ASP  HB3     6.00            #peak   384
 35 GLY  HA3    53 ASP  HB2     5.71            #peak   388
 53 ASP  HB2    54 PRO  HD3     6.00            #peak   390
  7 LEU  HB2    53 ASP  HB2     4.57            #peak   391
 36 VAL  QG2    52 TYR  HA      5.15            #peak   394
 52 TYR  HA     57 VAL  QG2     5.33            #peak   402
 52 TYR  HA     52 TYR  QD      6.00            #peak   403
 36 VAL  QG1    52 TYR  HB2     4.10            #peak   407
 36 VAL  QG1    52 TYR  HB3     4.27            #peak   408
 50 VAL  QG2    52 TYR  HB2     5.27            #peak   409
 36 VAL  HA     52 TYR  HB2     4.66            #peak   410
 52 TYR  HB3    53 ASP  H       5.17            #peak   416
 52 TYR  HB2    53 ASP  H       5.16            #peak   417
 66 ILE  QG2    71 TYR  HB3     3.96            #peak   418
 66 ILE  QG2    71 TYR  HB2     4.02            #peak   431
 66 ILE  QG2    71 TYR  QD      5.42            #peak   432
 31 GLU  HA     36 VAL  QG1     5.72            #peak   443
 31 GLU  QB     32 ARG  HA      4.57            #peak   450
 31 GLU  QG     32 ARG  QG      5.30            #peak   453
 38 GLU  HA     39 ALA  H       3.27            #peak   457
 38 GLU  HA     51 THR  HB      4.18            #peak   465
 38 GLU  QB     51 THR  HB      4.59            #peak   469
 38 GLU  HG2    51 THR  HB      6.00            #peak   475
 38 GLU  HG3    51 THR  HB      5.08            #peak   476
 38 GLU  H      38 GLU  HG2     5.73            #peak   477
 38 GLU  HG3    39 ALA  H       5.65            #peak   479
 59 GLU  HA     62 ILE  QG2     4.30            #peak   481
 59 GLU  HA     63 GLN  H       4.57            #peak   484
 59 GLU  HA     59 GLU  HG3     4.25            #peak   489
 59 GLU  HA     75 GLU  HB3     4.62            #peak   490
 59 GLU  HB2    63 GLN  H       5.15            #peak   496
 59 GLU  HB2    75 GLU  HB3     4.64            #peak   500
 59 GLU  HB2    75 GLU  HG3     3.91            #peak   501
 27 GLU  HG3    41 VAL  H       5.45            #peak   505
 59 GLU  HG2    60 ILE  QD1     4.92            #peak   512
 59 GLU  HG2    60 ILE  HG13    4.96            #peak   513
 58 SER  HA     59 GLU  HG3     5.11            #peak   514
 59 GLU  HG3    63 GLN  H       5.29            #peak   519
 58 SER  HB3    59 GLU  HG2     4.50            #peak   521
 59 GLU  HG2    62 ILE  QG2     5.36            #peak   523
 59 GLU  HB2    59 GLU  HG2     2.76            #peak   525
 34 LYS  HA     35 GLY  HA2     5.78            #peak   530
 34 LYS  HA     34 LYS  HG2     4.22            #peak   532
 64 GLU  HA     68 ALA  QB      4.07            #peak   535
 64 GLU  HB3    65 ARG  HA      4.58            #peak   547
 60 ILE  QG2    64 GLU  HB2     5.20            #peak   551
 64 GLU  HA     64 GLU  HG3     4.20            #peak   555
 60 ILE  QG2    64 GLU  HG3     5.16            #peak   559
 60 ILE  QG2    64 GLU  HG2     4.89            #peak   560
 75 GLU  HA     76 PRO  HD2     3.96            #peak   564
 13 GLN  H      75 GLU  HB2     5.38            #peak   567
 74 ALA  H      75 GLU  HB3     4.76            #peak   571
 12 MET  HA     75 GLU  HB2     4.70            #peak   577
 75 GLU  HG2    76 PRO  HD2     6.00            #peak   580
 75 GLU  HG2    76 PRO  HD3     6.00            #peak   581
 12 MET  QG     75 GLU  HG2     6.00            #peak   585
 10 GLN  QB     11 GLN  H       5.37            #peak   587
 10 GLN  QB     52 TYR  QE      4.78            #peak   588
 10 GLN  QB     50 VAL  QG2     4.83            #peak   591
 10 GLN  QG     11 GLN  H       5.09            #peak   592
 10 GLN  QG     49 THR  HA      5.54            #peak   598
 10 GLN  QG     50 VAL  QG2     4.30            #peak   600
 10 GLN  QG     52 TYR  QE      6.00            #peak   601
 10 GLN  QG     52 TYR  QD      6.00            #peak   602
 10 GLN  QG     75 GLU  HG3     3.69            #peak   603
 10 GLN  QG     12 MET  H       6.00            #peak   606
 10 GLN  QB     12 MET  H       6.00            #peak   609
 13 GLN  HG2    47 ARG  HB3     3.54            #peak   626
 13 GLN  H      13 GLN  HG2     6.00            #peak   630
 11 GLN  HA     50 VAL  H       5.76            #peak   635
 11 GLN  HB3    12 MET  H       6.00            #peak   637
 11 GLN  HB2    12 MET  H       6.00            #peak   640
 11 GLN  QG     49 THR  HA      5.72            #peak   649
 63 GLN  HA     66 ILE  QD1     4.86            #peak   670
 63 GLN  HA     73 LEU  QD2     4.52            #peak   671
 63 GLN  HB3    64 GLU  H       5.24            #peak   678
 63 GLN  HB2    64 GLU  H       5.54            #peak   679
 63 GLN  HB2    73 LEU  QD1     4.20            #peak   685
 63 GLN  QG     73 LEU  QD1     6.00            #peak   696
 62 ILE  HB     66 ILE  QD1     4.94            #peak   698
 62 ILE  HB     63 GLN  H       5.04            #peak   709
 12 MET  QG     48 LEU  QD1     5.06            #peak   710
 12 MET  QG     73 LEU  QD1     4.99            #peak   712
 12 MET  QG     14 VAL  HB      3.86            #peak   719
 12 MET  QG     73 LEU  QB      4.40            #peak   720
 12 MET  QG     76 PRO  HD3     6.00            #peak   723
 17 MET  HB2    23 ALA  HA      4.71            #peak   732
 17 MET  HB2    48 LEU  HG      5.77            #peak   735
 17 MET  HG3    22 CYS  HB3     6.00            #peak   740
 17 MET  HG3    41 VAL  QG1     4.53            #peak   745
 17 MET  H      17 MET  HG2     5.04            #peak   746
 16 GLY  H      17 MET  HG2     6.00            #peak   747
 17 MET  HG2    46 GLY  HA3     5.16            #peak   753
 17 MET  HG2    41 VAL  QG1     4.46            #peak   754
 17 MET  HG3    26 ILE  QD1     6.00            #peak   756
 17 MET  HG2    26 ILE  HB      4.36            #peak   758
  7 LEU  HG      8 LYS  HB3     5.06            #peak   772
  8 LYS  QE     52 TYR  QD      5.37            #peak   798
  8 LYS  QE     54 PRO  HG3     6.00            #peak   806
  8 LYS  QE     54 PRO  HB3     6.00            #peak   807
 34 LYS  HA     36 VAL  H       5.39            #peak   808
 33 LEU  HA     34 LYS  QB      4.29            #peak   812
 26 ILE  HG12   41 VAL  QG1     4.60            #peak   827
 55 LYS  QB     56 GLN  H       6.00            #peak   839
 55 LYS  H      55 LYS  HG2     5.05            #peak   843
 55 LYS  HA     55 LYS  HG3     4.24            #peak   845
 55 LYS  H      55 LYS  QD      5.00            #peak   854
 55 LYS  HA     55 LYS  QD      4.77            #peak   855
  7 LEU  HA      7 LEU  HG      4.26            #peak   859
  7 LEU  HA      8 LYS  HG3     3.82            #peak   861
  7 LEU  HB2     8 LYS  H       5.35            #peak   867
  7 LEU  HB3     8 LYS  H       5.26            #peak   868
  7 LEU  HG      8 LYS  HA      6.00            #peak   880
  7 LEU  HG     51 THR  QG2     6.00            #peak   885
  7 LEU  HA      7 LEU  QD1     5.13            #peak   888
  7 LEU  HB2     7 LEU  QD1     3.53            #peak   889
  7 LEU  QD1    51 THR  QG2     3.59            #peak   890
  7 LEU  QD2     8 LYS  H       4.84            #peak   894
  7 LEU  QD2    53 ASP  H       6.00            #peak   895
 33 LEU  HA     33 LEU  QD1     4.07            #peak   898
 33 LEU  HA     33 LEU  HG      4.08            #peak   899
 33 LEU  HA     33 LEU  QD2     4.62            #peak   907
 33 LEU  QB     33 LEU  QD1     3.63            #peak   911
 30 LEU  HA     33 LEU  HG      4.25            #peak   916
 29 ALA  QB     33 LEU  HG      4.75            #peak   917
 33 LEU  QD1    62 ILE  HA      4.39            #peak   920
 33 LEU  QD1    61 THR  QG2     5.42            #peak   923
 33 LEU  QD1    65 ARG  H       5.90            #peak   925
 33 LEU  QD2    61 THR  QG2     4.47            #peak   928
 33 LEU  QD2    62 ILE  HA      4.98            #peak   930
 33 LEU  QD2    65 ARG  H       5.44            #peak   932
 29 ALA  QB     33 LEU  QD2     4.18            #peak   934
 30 LEU  HG     31 GLU  HA      4.90            #peak   939
 30 LEU  QD1    34 LYS  H       5.81            #peak   945
 30 LEU  QD1    33 LEU  H       5.51            #peak   947
 30 LEU  QD1    62 ILE  HA      4.88            #peak   949
 30 LEU  QD1    61 THR  QG2     4.46            #peak   951
 30 LEU  QD1    62 ILE  HG13    4.53            #peak   952
 30 LEU  QD1    62 ILE  QD1     5.47            #peak   953
 30 LEU  QD2    61 THR  QG2     5.85            #peak   956
 30 LEU  QD2    50 VAL  QG1     5.39            #peak   957
 48 LEU  HA     48 LEU  QD2     3.73            #peak   964
 14 VAL  QG2    48 LEU  HA      4.18            #peak   965
 48 LEU  HB3    66 ILE  QD1     4.63            #peak   979
 48 LEU  HB2    66 ILE  QD1     4.60            #peak   981
 48 LEU  HB3    62 ILE  QG2     4.51            #peak   982
 48 LEU  HA     48 LEU  QD1     5.50            #peak   991
 48 LEU  QD1    50 VAL  QG1     4.73            #peak   993
 48 LEU  HB2    48 LEU  QD1     4.05            #peak   995
 48 LEU  QD1    50 VAL  HB      4.40            #peak   996
 48 LEU  QD2    49 THR  H       4.31            #peak   999
 48 LEU  H      48 LEU  QD2     5.39            #peak  1000
 48 LEU  QD2    50 VAL  HB      4.05            #peak  1006
 48 LEU  QD2    50 VAL  QG1     4.86            #peak  1009
 69 LEU  HA     71 TYR  H       5.26            #peak  1013
 69 LEU  HA     69 LEU  QD2     5.75            #peak  1015
 25 SER  HB2    69 LEU  HA      4.96            #peak  1020
 25 SER  HB3    69 LEU  HA      5.60            #peak  1021
 69 LEU  HA     69 LEU  QD1     5.15            #peak  1023
 69 LEU  QB     69 LEU  QD1     3.69            #peak  1026
 73 LEU  QB     74 ALA  H       5.82            #peak  1041
 73 LEU  QB     73 LEU  QQD     3.85            #peak  1044
 73 LEU  HG     74 ALA  HA      4.40            #peak  1052
 66 ILE  HA     73 LEU  QD1     6.00            #peak  1054
 73 LEU  QD1    75 GLU  HB3     6.00            #peak  1062
 62 ILE  HB     73 LEU  QD1     6.00            #peak  1063
 67 ALA  QB     73 LEU  QD1     6.00            #peak  1064
 72 THR  QG2    73 LEU  QD1     6.00            #peak  1065
 62 ILE  HA     65 ARG  QB      4.77            #peak  1068
 62 ILE  HA     62 ILE  QG2     4.25            #peak  1074
 62 ILE  HA     65 ARG  H       6.00            #peak  1078
 62 ILE  HA     66 ILE  QD1     4.03            #peak  1079
 62 ILE  QG2    63 GLN  HA      5.94            #peak  1086
 62 ILE  QG2    64 GLU  HG3     5.37            #peak  1090
 62 ILE  QG2    62 ILE  HG12    4.04            #peak  1093
 62 ILE  HG13   66 ILE  QD1     4.94            #peak  1100
 48 LEU  QD1    62 ILE  HG13    5.24            #peak  1101
 50 VAL  QG2    62 ILE  HG12    5.64            #peak  1111
 52 TYR  QD     62 ILE  QD1     5.09            #peak  1112
 52 TYR  QE     62 ILE  QD1     5.60            #peak  1113
 62 ILE  HA     62 ILE  QD1     5.37            #peak  1116
 50 VAL  HB     62 ILE  QD1     4.82            #peak  1119
 62 ILE  HB     62 ILE  QD1     4.21            #peak  1120
 50 VAL  QG2    62 ILE  QD1     3.68            #peak  1122
 62 ILE  QG2    62 ILE  QD1     3.46            #peak  1123
 62 ILE  QD1    66 ILE  QD1     3.73            #peak  1125
 62 ILE  QD1    75 GLU  QB      6.00            #peak  1126
 62 ILE  QD1    75 GLU  HG3     4.84            #peak  1127
 60 ILE  HA     60 ILE  QG2     4.10            #peak  1129
 60 ILE  HA     64 GLU  HG3     4.46            #peak  1133
 60 ILE  HA     63 GLN  HB3     4.09            #peak  1134
 60 ILE  H      60 ILE  QG2     6.00            #peak  1154
 57 VAL  HB     60 ILE  QG2     4.80            #peak  1159
 60 ILE  QG2    63 GLN  HB2     5.07            #peak  1160
 57 VAL  QG1    60 ILE  QG2     3.97            #peak  1165
 60 ILE  QG2    63 GLN  HB3     4.88            #peak  1168
 60 ILE  QD1    61 THR  H       6.00            #peak  1170
 60 ILE  HA     60 ILE  QD1     4.95            #peak  1172
 60 ILE  QD1    63 GLN  HB3     4.99            #peak  1174
 60 ILE  HG13   64 GLU  HG3     5.71            #peak  1187
 66 ILE  HA     66 ILE  QD1     4.45            #peak  1227
 63 GLN  HG3    66 ILE  QD1     6.00            #peak  1228
 66 ILE  HB     66 ILE  QD1     4.21            #peak  1230
 26 ILE  QD1    66 ILE  QD1     6.00            #peak  1235
 32 ARG  HA     32 ARG  QG      3.84            #peak  1237
 28 ARG  HG3    32 ARG  QD      6.00            #peak  1252
 32 ARG  HA     32 ARG  QD      6.00            #peak  1255
 47 ARG  HB3    48 LEU  H       6.00            #peak  1261
 42 THR  HB     47 ARG  HB3     4.96            #peak  1263
 42 THR  QG2    47 ARG  HB3     4.58            #peak  1265
 47 ARG  HA     47 ARG  QD      5.08            #peak  1270
 47 ARG  QD     48 LEU  H       5.05            #peak  1271
 11 GLN  QG     47 ARG  QD      4.88            #peak  1274
 26 ILE  HB     65 ARG  HD2     4.57            #peak  1297
 65 ARG  HA     65 ARG  HD2     4.64            #peak  1300
 65 ARG  HA     65 ARG  HD3     4.79            #peak  1301
 65 ARG  QB     65 ARG  HD3     4.05            #peak  1305
 65 ARG  HD3    69 LEU  HG      4.70            #peak  1306
 19 CYS  HB2    20 ALA  H       5.45            #peak  1311
 26 ILE  HA     26 ILE  QG2     4.17            #peak  1314
 26 ILE  HA     65 ARG  HG3     5.43            #peak  1317
 26 ILE  HB     48 LEU  QD1     5.18            #peak  1327
 26 ILE  QG2    30 LEU  H       4.94            #peak  1330
 26 ILE  QG2    27 GLU  HG3     4.35            #peak  1334
 26 ILE  QG2    66 ILE  HG12    4.63            #peak  1335
 26 ILE  QG2    41 VAL  QG1     3.61            #peak  1337
 26 ILE  H      26 ILE  HG12    4.83            #peak  1345
 26 ILE  QD1    71 TYR  QD      4.70            #peak  1349
 25 SER  HA     26 ILE  QD1     4.83            #peak  1350
 26 ILE  HA     26 ILE  QD1     4.82            #peak  1351
 26 ILE  QD1    66 ILE  HG13    3.88            #peak  1355
 26 ILE  QG2    26 ILE  QD1     3.41            #peak  1358
 26 ILE  QD1    66 ILE  QG2     3.41            #peak  1359
 26 ILE  QD1    66 ILE  HG12    6.00            #peak  1360
 26 ILE  QD1    65 ARG  HG3     5.77            #peak  1362
 18 ARG  HB3    43 VAL  QG2     3.83            #peak  1370
 28 ARG  H      28 ARG  HG2     5.42            #peak  1371
 28 ARG  HA     28 ARG  HG2     3.97            #peak  1373
 18 ARG  HB3    18 ARG  HD3     4.01            #peak  1383
 27 GLU  H      27 GLU  HG2     4.92            #peak  1386
 27 GLU  HG2    41 VAL  QG2     6.00            #peak  1388
 27 GLU  HG2    48 LEU  QD2     5.78            #peak  1389
 27 GLU  HG2    41 VAL  QG1     5.27            #peak  1390
 27 GLU  HG2    39 ALA  QB      5.50            #peak  1391
 27 GLU  HG2    40 SER  HA      5.59            #peak  1393
 27 GLU  HG3    41 VAL  QG1     4.79            #peak  1396
 27 GLU  HG3    48 LEU  QD2     5.32            #peak  1397
 27 GLU  HA     30 LEU  H       6.00            #peak  1398
 27 GLU  HA     48 LEU  QD2     6.00            #peak  1399
 27 GLU  HA     39 ALA  QB      6.00            #peak  1400
 40 SER  QB     49 THR  HB      4.15            #peak  1404
 49 THR  HA     49 THR  QG2     4.22            #peak  1407
 49 THR  QG2    50 VAL  HA      5.02            #peak  1408
 40 SER  H      49 THR  QG2     5.71            #peak  1411
 39 ALA  HA     51 THR  H       5.05            #peak  1415
 39 ALA  HA     50 VAL  QG1     5.36            #peak  1417
 39 ALA  HA     40 SER  QB      6.00            #peak  1419
 41 VAL  HA     48 LEU  HA      5.01            #peak  1434
 14 VAL  QG1    47 ARG  HA      5.57            #peak  1435
 14 VAL  QG1    15 GLY  H       6.00            #peak  1437
 14 VAL  QG1    48 LEU  QD1     3.90            #peak  1438
 11 GLN  HA     49 THR  HA      5.04            #peak  1439
 10 GLN  H      49 THR  HA      4.14            #peak  1440
 37 ALA  QB     52 TYR  HA      5.21            #peak  1444
 37 ALA  QB     51 THR  HB      4.13            #peak  1445
 37 ALA  QB     38 GLU  HG3     4.20            #peak  1446
 52 TYR  QE     57 VAL  QG2     5.53            #peak  1448
  6 PRO  QG      7 LEU  QD2     4.22            #peak  1464
 68 ALA  QB     70 GLY  H       5.43            #peak  1466
 68 ALA  H      68 ALA  QB      4.15            #peak  1467
 15 GLY  QA     17 MET  H       5.68            #peak  1470
 15 GLY  QA     16 GLY  HA3     3.72            #peak  1472
 35 GLY  HA3    56 GLN  HB3     5.59            #peak  1482
 35 GLY  HA3    57 VAL  QG2     4.37            #peak  1483
 35 GLY  HA3    56 GLN  HB2     4.92            #peak  1485
 61 THR  HA     61 THR  QG2     3.87            #peak  1497
 61 THR  HA     64 GLU  HG3     4.43            #peak  1504
 61 THR  HB     62 ILE  HB      4.70            #peak  1511
 29 ALA  HA     32 ARG  QD      5.10            #peak  1523
 29 ALA  HA     32 ARG  QG      5.76            #peak  1525
 29 ALA  QB     30 LEU  H       4.82            #peak  1527
 29 ALA  QB     30 LEU  QD2     5.02            #peak  1531
 29 ALA  QB     30 LEU  HB3     4.62            #peak  1534
 28 ARG  HA     28 ARG  QD      5.75            #peak  1540
 28 ARG  HB3    29 ALA  H       6.00            #peak  1542
 28 ARG  H      28 ARG  HG3     5.89            #peak  1553
 27 GLU  HA     62 ILE  QD1     6.00            #peak  1557
 12 MET  HA     76 PRO  HD3     3.57            #peak  1586
 52 TYR  QE     54 PRO  HA      4.62            #peak  1612
 52 TYR  QD     54 PRO  HA      5.09            #peak  1613
 54 PRO  HD2    55 LYS  H       4.67            #peak  1615
 52 TYR  QE     54 PRO  HB2     4.81            #peak  1629
 52 TYR  QE     54 PRO  HB3     5.48            #peak  1630
 23 ALA  HA     26 ILE  QD1     4.91            #peak  1645
 23 ALA  HA     26 ILE  QG2     4.33            #peak  1646
 23 ALA  HA     41 VAL  QG1     5.08            #peak  1647
 23 ALA  HA     41 VAL  HB      4.79            #peak  1649
 23 ALA  HA     26 ILE  H       6.00            #peak  1651
 23 ALA  HA     43 VAL  HA      6.00            #peak  1653
 23 ALA  QB     41 VAL  QG2     4.05            #peak  1666
 23 ALA  QB     43 VAL  QG2     4.68            #peak  1667
 23 ALA  QB     41 VAL  QG1     4.80            #peak  1668
 24 SER  HA     28 ARG  HB2     5.37            #peak  1671
 24 SER  HA     28 ARG  HB3     5.37            #peak  1672
 23 ALA  QB     24 SER  HA      5.24            #peak  1679
 24 SER  H      24 SER  QB      3.98            #peak  1680
 24 SER  QB     25 SER  H       4.82            #peak  1681
 21 ALA  QB     24 SER  QB      5.41            #peak  1683
 18 ARG  HG3    22 CYS  HB2     4.38            #peak  1693
 18 ARG  HA     19 CYS  HB2     4.20            #peak  1698
 19 CYS  HB3    20 ALA  H       4.51            #peak  1701
  7 LEU  QD1    37 ALA  QB      4.06            #peak  1708
  7 LEU  QD2    37 ALA  QB      4.13            #peak  1709
 15 GLY  H      73 LEU  HA      4.44            #peak  1710
 73 LEU  HA     73 LEU  QD1     4.35            #peak  1711
 73 LEU  HA     73 LEU  HG      4.14            #peak  1713
  8 LYS  HA      8 LYS  QD      4.57            #peak  1715
  8 LYS  HA     51 THR  QG2     4.52            #peak  1718
  9 THR  QG2    51 THR  HA      5.89            #peak  1721
  9 THR  QG2    10 GLN  QB      4.61            #peak  1722
 50 VAL  QG2    52 TYR  QE      5.17            #peak  1736
 11 GLN  QG     49 THR  QG2     4.11            #peak  1738
 13 GLN  HG2    74 ALA  QB      4.25            #peak  1743
 29 ALA  QB     30 LEU  HA      4.31            #peak  1747
 31 GLU  HA     36 VAL  QG2     4.34            #peak  1748
 31 GLU  H      32 ARG  HA      5.10            #peak  1749
 34 LYS  HA     34 LYS  QD      6.00            #peak  1752
 32 ARG  H      33 LEU  HA      5.04            #peak  1757
 33 LEU  QD1    62 ILE  HG13    5.17            #peak  1760
 44 ALA  QB     45 THR  H       5.38            #peak  1763
 45 THR  H      45 THR  QG2     5.51            #peak  1766
  7 LEU  H       7 LEU  QD1     4.21            #peak     4
  7 LEU  H       8 LYS  HG3     4.72            #peak     5
  7 LEU  H       7 LEU  HG      4.20            #peak     6
  6 PRO  QD      7 LEU  H       4.93            #peak    10
  7 LEU  QD1     8 LYS  H       4.93            #peak    12
  8 LYS  H      51 THR  QG2     3.98            #peak    13
  8 LYS  H       8 LYS  QD      5.07            #peak    14
  8 LYS  H      52 TYR  H       4.99            #peak    24
  7 LEU  QD1    52 TYR  H       5.08            #peak    26
 50 VAL  QG2    52 TYR  H       4.31            #peak    27
 52 TYR  H      52 TYR  QE      4.82            #peak    28
  9 THR  H       9 THR  QG2     4.15            #peak    30
  9 THR  H       9 THR  HB      4.20            #peak    31
  8 LYS  QD      9 THR  H       6.00            #peak    34
  8 LYS  HG2     9 THR  H       4.95            #peak    35
 10 GLN  H      50 VAL  QG2     4.22            #peak    36
  9 THR  HB     10 GLN  H       6.00            #peak    39
 10 GLN  H      10 GLN  QG      5.86            #peak    42
 10 GLN  H      51 THR  HA      4.83            #peak    44
 10 GLN  H      52 TYR  QE      6.00            #peak    45
 11 GLN  H      11 GLN  QB      4.14            #peak    47
 11 GLN  H      11 GLN  QG      4.14            #peak    48
 11 GLN  H      75 GLU  HG3     4.35            #peak    51
 11 GLN  H      50 VAL  QG2     5.53            #peak    52
 10 GLN  H      11 GLN  H       5.75            #peak    53
 12 MET  H      49 THR  HA      4.78            #peak    57
 12 MET  H      13 GLN  HA      4.83            #peak    58
 12 MET  H      48 LEU  HB3     5.58            #peak    60
 12 MET  H      50 VAL  QG2     6.00            #peak    61
 12 MET  H      13 GLN  H       6.00            #peak    62
 14 VAL  H      14 VAL  QG1     3.99            #peak    63
 15 GLY  H      66 ILE  QG2     4.22            #peak    69
 15 GLY  H      72 THR  H       4.92            #peak    70
 16 GLY  H      17 MET  H       5.17            #peak    74
 30 LEU  H      30 LEU  QD2     3.92            #peak    84
 30 LEU  H      30 LEU  HB2     3.45            #peak    85
 30 LEU  QD1    31 GLU  H       5.17            #peak    89
 31 GLU  H      31 GLU  QB      3.82            #peak    91
 31 GLU  H      31 GLU  QG      4.64            #peak    92
 30 LEU  HB3    31 GLU  H       4.99            #peak    95
 31 GLU  H      33 LEU  H       5.78            #peak    97
 31 GLU  H      32 ARG  H       4.49            #peak    99
 29 ALA  HA     32 ARG  H       4.68            #peak   101
 32 ARG  H      33 LEU  QD2     5.99            #peak   103
 32 ARG  H      32 ARG  QB      4.06            #peak   104
 32 ARG  H      32 ARG  QG      3.63            #peak   105
 32 ARG  H      32 ARG  QD      6.00            #peak   106
 33 LEU  H      33 LEU  QD2     4.45            #peak   108
 29 ALA  QB     33 LEU  H       4.40            #peak   109
 33 LEU  H      33 LEU  HG      3.57            #peak   110
 31 GLU  HA     33 LEU  H       5.62            #peak   112
 32 ARG  H      33 LEU  H       4.08            #peak   114
 33 LEU  H      34 LYS  H       6.00            #peak   115
 31 GLU  QG     33 LEU  H       5.24            #peak   116
 34 LYS  H      34 LYS  HG2     4.77            #peak   119
 34 LYS  H      34 LYS  QB      3.50            #peak   120
 33 LEU  HA     34 LYS  H       3.55            #peak   122
 34 LYS  H      36 VAL  H       5.35            #peak   124
 33 LEU  QD2    34 LYS  H       4.43            #peak   125
 34 LYS  QB     35 GLY  H       4.82            #peak   128
 34 LYS  HG3    35 GLY  H       5.13            #peak   132
 36 VAL  H      36 VAL  QG1     4.44            #peak   133
 35 GLY  H      36 VAL  H       4.36            #peak   137
 36 VAL  QG2    37 ALA  H       4.22            #peak   139
 37 ALA  H      38 GLU  H       4.34            #peak   143
 37 ALA  H      52 TYR  HB3     4.95            #peak   144
 37 ALA  H      52 TYR  HA      4.41            #peak   145
 37 ALA  H      50 VAL  QG1     5.56            #peak   146
 38 GLU  H      39 ALA  QB      3.93            #peak   147
 38 GLU  H      51 THR  H       3.84            #peak   150
 36 VAL  QG2    38 GLU  H       4.21            #peak   151
 38 GLU  H      50 VAL  QG1     5.03            #peak   152
 38 GLU  H      51 THR  HB      4.33            #peak   153
 38 GLU  H      50 VAL  HA      6.00            #peak   155
 38 GLU  HB3    39 ALA  H       6.00            #peak   157
 39 ALA  QB     40 SER  H       4.45            #peak   163
 40 SER  H      48 LEU  QD2     4.33            #peak   167
 40 SER  H      50 VAL  QG1     5.46            #peak   169
 40 SER  H      50 VAL  HB      5.76            #peak   170
 40 SER  H      49 THR  H       5.45            #peak   172
 41 VAL  H      41 VAL  QG1     4.61            #peak   173
 41 VAL  H      41 VAL  HB      3.90            #peak   174
 27 GLU  HG2    41 VAL  H       5.12            #peak   175
 40 SER  QB     41 VAL  H       4.63            #peak   176
 41 VAL  H      42 THR  H       5.55            #peak   178
 41 VAL  H      41 VAL  QG2     4.80            #peak   179
 41 VAL  QG1    42 THR  H       4.66            #peak   180
 41 VAL  HB     42 THR  H       5.82            #peak   182
 42 THR  H      42 THR  HB      4.12            #peak   183
 42 THR  H      48 LEU  HA      4.92            #peak   186
 41 VAL  QG2    42 THR  H       4.21            #peak   187
 43 VAL  H      43 VAL  QG1     4.57            #peak   190
 42 THR  QG2    43 VAL  H       4.51            #peak   191
 44 ALA  H      44 ALA  QB      4.02            #peak   197
 43 VAL  HB     44 ALA  H       5.29            #peak   198
 42 THR  QG2    45 THR  H       3.98            #peak   200
 42 THR  HB     45 THR  H       5.01            #peak   201
 43 VAL  HA     45 THR  H       6.00            #peak   206
 45 THR  H      47 ARG  H       5.80            #peak   208
 45 THR  H      46 GLY  H       3.91            #peak   212
 18 ARG  HG2    46 GLY  H       4.91            #peak   213
 46 GLY  H      47 ARG  H       4.26            #peak   214
 47 ARG  H      47 ARG  HB3     3.67            #peak   215
 42 THR  H      47 ARG  H       5.72            #peak   220
 14 VAL  QG2    47 ARG  H       6.00            #peak   221
 47 ARG  H      48 LEU  HG      5.73            #peak   222
 48 LEU  H      48 LEU  QD1     5.16            #peak   223
 48 LEU  H      48 LEU  HB2     4.11            #peak   225
 48 LEU  QD1    49 THR  H       4.12            #peak   228
 48 LEU  HB2    49 THR  H       6.00            #peak   229
 49 THR  H      49 THR  QG2     5.13            #peak   232
 41 VAL  QG1    49 THR  H       4.94            #peak   234
 50 VAL  HB     51 THR  H       4.76            #peak   240
 36 VAL  QG2    51 THR  H       5.20            #peak   243
 36 VAL  HA     53 ASP  H       5.26            #peak   249
  7 LEU  QD1    53 ASP  H       4.97            #peak   252
 52 TYR  QD     53 ASP  H       5.58            #peak   253
 55 LYS  H      55 LYS  QB      3.35            #peak   254
 55 LYS  H      55 LYS  QE      5.83            #peak   255
 53 ASP  HA     55 LYS  H       5.49            #peak   257
 55 LYS  H      56 GLN  H       3.86            #peak   258
 55 LYS  H      55 LYS  HG3     4.00            #peak   260
 56 GLN  H      57 VAL  H       3.67            #peak   262
 56 GLN  H      57 VAL  QG2     5.43            #peak   266
 56 GLN  H      56 GLN  QG      4.83            #peak   267
 56 GLN  H      56 GLN  HB3     4.07            #peak   268
 57 VAL  H      57 VAL  QG2     4.12            #peak   269
 57 VAL  H      57 VAL  QG1     5.89            #peak   270
 57 VAL  QG2    58 SER  H       4.76            #peak   277
 57 VAL  QG1    58 SER  H       3.90            #peak   278
 57 VAL  HB     58 SER  H       5.00            #peak   279
 57 VAL  HA     58 SER  H       3.48            #peak   280
 58 SER  H      60 ILE  HG13    4.69            #peak   282
 58 SER  H      58 SER  HB2     4.03            #peak   284
 58 SER  H      62 ILE  H       5.45            #peak   285
 58 SER  HB3    59 GLU  H       5.23            #peak   290
 58 SER  HB2    59 GLU  H       4.89            #peak   291
 60 ILE  H      60 ILE  QD1     4.78            #peak   292
 60 ILE  H      60 ILE  HG13    4.84            #peak   293
 60 ILE  H      60 ILE  HB      4.01            #peak   294
 59 GLU  H      60 ILE  H       5.34            #peak   296
 60 ILE  H      60 ILE  HG12    4.82            #peak   297
 60 ILE  H      61 THR  HB      5.01            #peak   299
 60 ILE  QG2    61 THR  H       4.29            #peak   300
 61 THR  H      61 THR  QG2     4.57            #peak   301
 60 ILE  HB     61 THR  H       4.07            #peak   302
 61 THR  H      61 THR  HB      3.66            #peak   304
 61 THR  H      63 GLN  H       5.49            #peak   306
 59 GLU  H      61 THR  H       5.94            #peak   307
 62 ILE  H      62 ILE  QD1     4.80            #peak   308
 62 ILE  H      62 ILE  HG13    4.68            #peak   309
 62 ILE  H      62 ILE  QG2     4.39            #peak   310
 62 ILE  H      62 ILE  HB      3.85            #peak   312
 59 GLU  HA     62 ILE  H       4.84            #peak   314
 60 ILE  HA     62 ILE  H       5.08            #peak   315
 61 THR  HB     62 ILE  H       4.29            #peak   316
 62 ILE  H      63 GLN  H       4.43            #peak   317
 61 THR  H      62 ILE  H       3.94            #peak   319
 62 ILE  QG2    63 GLN  H       4.69            #peak   320
 63 GLN  H      63 GLN  QG      4.18            #peak   322
 64 GLU  H      64 GLU  HG3     3.49            #peak   329
 63 GLN  H      64 GLU  H       4.48            #peak   331
 60 ILE  QG2    64 GLU  H       4.99            #peak   332
 64 GLU  H      67 ALA  QB      5.38            #peak   333
 64 GLU  H      64 GLU  HB3     3.90            #peak   334
 64 GLU  H      64 GLU  HG2     4.08            #peak   335
 65 ARG  H      66 ILE  QD1     5.48            #peak   341
 65 ARG  H      65 ARG  HG3     5.44            #peak   342
 65 ARG  H      65 ARG  HG2     5.33            #peak   343
 66 ILE  H      66 ILE  QD1     4.32            #peak   346
 66 ILE  H      66 ILE  HG13    4.52            #peak   347
 66 ILE  H      66 ILE  HB      4.17            #peak   348
 66 ILE  QG2    67 ALA  H       4.34            #peak   352
 67 ALA  H      67 ALA  QB      3.67            #peak   353
 66 ILE  HB     67 ALA  H       4.20            #peak   354
 64 GLU  HA     67 ALA  H       4.92            #peak   356
 66 ILE  H      67 ALA  H       4.32            #peak   358
 65 ARG  HA     67 ALA  H       4.80            #peak   359
 68 ALA  H      69 LEU  QD1     6.00            #peak   364
 66 ILE  H      68 ALA  H       5.85            #peak   366
 65 ARG  HA     69 LEU  H       4.22            #peak   368
 68 ALA  H      69 LEU  H       4.50            #peak   369
 69 LEU  H      69 LEU  QD1     4.85            #peak   370
 66 ILE  HA     69 LEU  H       5.60            #peak   371
 69 LEU  H      71 TYR  H       4.80            #peak   375
 69 LEU  QD1    70 GLY  H       5.75            #peak   377
 70 GLY  H      71 TYR  H       4.06            #peak   381
 69 LEU  H      70 GLY  H       4.25            #peak   382
 66 ILE  QG2    71 TYR  H       4.40            #peak   387
 67 ALA  HA     71 TYR  H       4.75            #peak   392
 72 THR  H      72 THR  QG2     5.38            #peak   396
 14 VAL  QG1    72 THR  H       4.71            #peak   397
 71 TYR  HB3    72 THR  H       4.85            #peak   398
 71 TYR  HB2    72 THR  H       4.22            #peak   399
 14 VAL  HA     72 THR  H       5.25            #peak   401
 71 TYR  QD     72 THR  H       5.37            #peak   403
 73 LEU  H      73 LEU  QD1     4.45            #peak   405
 72 THR  QG2    73 LEU  H       4.75            #peak   406
 73 LEU  H      73 LEU  QB      3.69            #peak   407
 73 LEU  QD1    74 ALA  H       4.74            #peak   411
 74 ALA  H      74 ALA  QB      3.92            #peak   412
 13 GLN  HB2    74 ALA  H       5.06            #peak   416
 14 VAL  HA     74 ALA  H       4.53            #peak   417
 74 ALA  QB     75 GLU  H       4.12            #peak   419
 75 GLU  H      75 GLU  HG2     4.73            #peak   420
 74 ALA  HA     75 GLU  H       3.33            #peak   421
 75 GLU  H      75 GLU  HB3     3.94            #peak   423
 75 GLU  H      76 PRO  HD3     5.86            #peak   424
 75 GLU  H      76 PRO  HD2     5.66            #peak   425
 18 ARG  H      18 ARG  HG3     5.35            #peak   477
 13 GLN  H      47 ARG  HB3     4.48            #peak   486
 12 MET  HB2    13 GLN  H       4.10            #peak   488
 12 MET  QG     13 GLN  H       5.67            #peak   489
 13 GLN  H      14 VAL  QG2     5.67            #peak   491
 13 GLN  H      74 ALA  H       5.44            #peak   494
 26 ILE  H      26 ILE  QG2     4.70            #peak   495
 26 ILE  H      26 ILE  QD1     4.96            #peak   496
 26 ILE  H      69 LEU  QD2     5.01            #peak   497
 26 ILE  H      26 ILE  HB      3.75            #peak   498
 26 ILE  H      27 GLU  H       4.18            #peak   502
 23 ALA  H      41 VAL  QG2     5.79            #peak   508
 23 ALA  H      23 ALA  QB      3.76            #peak   510
 22 CYS  HB3    23 ALA  H       4.89            #peak   511
 22 CYS  HB2    23 ALA  H       4.51            #peak   512
 23 ALA  H      41 VAL  HB      5.57            #peak   516
 26 ILE  QG2    29 ALA  H       5.65            #peak   517
 29 ALA  H      69 LEU  QD1     5.33            #peak   518
 29 ALA  H      29 ALA  QB      3.62            #peak   519
 26 ILE  HA     29 ALA  H       4.83            #peak   522
 29 ALA  H      30 LEU  H       4.10            #peak   525
 28 ARG  H      29 ALA  H       4.36            #peak   526
 26 ILE  QG2    27 GLU  H       4.90            #peak   527
 27 GLU  H      41 VAL  QG1     5.37            #peak   528
 27 GLU  H      27 GLU  QB      3.80            #peak   533
 27 GLU  H      27 GLU  HG3     4.55            #peak   535
 28 ARG  H      28 ARG  HB3     3.99            #peak   538
 28 ARG  H      28 ARG  HB2     3.98            #peak   539
 26 ILE  HA     28 ARG  H       5.97            #peak   541
 28 ARG  H      28 ARG  QD      5.93            #peak   542
 28 ARG  H      30 LEU  H       5.78            #peak   544
 18 ARG  HB3    19 CYS  H       5.10            #peak   545
 18 ARG  HG3    19 CYS  H       5.46            #peak   546
 18 ARG  H      19 CYS  H       4.90            #peak   552
 23 ALA  QB     24 SER  H       3.94            #peak   561
 22 CYS  HA     24 SER  H       3.68            #peak   563
 50 VAL  H      50 VAL  QG2     4.20            #peak   574
 26 ILE  H      26 ILE  HG13    5.07            #peak   583
  7 LEU  H       7 LEU  HB2     4.10            #peak   584
  7 LEU  H      51 THR  QG2     5.09            #peak   585
  7 LEU  H       8 LYS  H       4.65            #peak   586
 10 GLN  H      50 VAL  H       4.93            #peak   588
 12 MET  H      48 LEU  H       4.99            #peak   589
 12 MET  H      12 MET  QG      5.96            #peak   590
 12 MET  H      48 LEU  QD1     6.00            #peak   592
 13 GLN  H      48 LEU  H       5.51            #peak   593
 13 GLN  H      75 GLU  HA      5.77            #peak   594
 13 GLN  H      13 GLN  HB3     3.99            #peak   595
 14 VAL  H      47 ARG  HA      3.76            #peak   596
  8 LYS  H       9 THR  H       5.62            #peak   600
 15 GLY  H      72 THR  HB      6.00            #peak   602
 14 VAL  QG2    17 MET  H       5.40            #peak   608
 14 VAL  HB     17 MET  H       5.18            #peak   610
 17 MET  H      46 GLY  HA2     6.00            #peak   612
 17 MET  H      71 TYR  QE      6.00            #peak   613
 22 CYS  H      23 ALA  H       3.95            #peak   616
 23 ALA  H      24 SER  H       4.48            #peak   617
 23 ALA  H      43 VAL  QG1     5.70            #peak   619
 23 ALA  H      43 VAL  QG2     6.00            #peak   620
 24 SER  H      25 SER  H       4.25            #peak   621
 25 SER  H      28 ARG  H       4.70            #peak   624
 25 SER  H      26 ILE  HB      5.04            #peak   625
 30 LEU  H      65 ARG  HG3     4.28            #peak   627
 30 LEU  HA     33 LEU  H       4.58            #peak   628
 33 LEU  H      33 LEU  QD1     4.86            #peak   629
 36 VAL  H      57 VAL  QG2     4.30            #peak   631
 36 VAL  H      36 VAL  HB      4.05            #peak   632
 38 GLU  H      52 TYR  HA      6.00            #peak   633
 38 GLU  H      38 GLU  HG3     5.64            #peak   634
 39 ALA  H      40 SER  HA      5.21            #peak   637
 38 GLU  QB     39 ALA  H       4.47            #peak   640
 38 GLU  HG2    39 ALA  H       4.58            #peak   641
 39 ALA  H      40 SER  H       6.00            #peak   642
 40 SER  H      50 VAL  HA      4.77            #peak   643
 42 THR  H      47 ARG  HB3     4.85            #peak   645
 43 VAL  H      44 ALA  H       4.94            #peak   646
 43 VAL  H      43 VAL  QG2     5.16            #peak   647
 41 VAL  QG2    43 VAL  H       6.00            #peak   648
 44 ALA  H      45 THR  H       5.86            #peak   649
 42 THR  HA     44 ALA  H       6.00            #peak   651
 43 VAL  HA     46 GLY  H       3.75            #peak   653
 44 ALA  QB     46 GLY  H       5.78            #peak   655
 43 VAL  HA     47 ARG  H       5.09            #peak   659
 13 GLN  HA     48 LEU  H       5.88            #peak   661
 14 VAL  QG2    48 LEU  H       5.32            #peak   663
 41 VAL  HA     49 THR  H       4.94            #peak   664
 42 THR  H      49 THR  H       5.27            #peak   666
 11 GLN  HB3    50 VAL  H       5.55            #peak   669
 51 THR  H      52 TYR  HA      6.00            #peak   671
 39 ALA  QB     51 THR  H       5.54            #peak   672
 50 VAL  QG1    51 THR  H       4.20            #peak   673
 10 GLN  H      52 TYR  H       5.95            #peak   675
 52 TYR  H      52 TYR  QD      4.89            #peak   676
 51 THR  QG2    52 TYR  H       4.45            #peak   677
 53 ASP  H      55 LYS  H       4.73            #peak   678
 55 LYS  H      57 VAL  H       2.90            #peak   684
 55 LYS  H      56 GLN  QG      4.86            #peak   685
 54 PRO  HA     56 GLN  H       6.00            #peak   688
 54 PRO  HA     57 VAL  H       4.69            #peak   690
 58 SER  H      61 THR  H       3.05            #peak   691
 59 GLU  H      59 GLU  HB3     3.93            #peak   692
 60 ILE  H      61 THR  H       3.91            #peak   695
 60 ILE  HA     64 GLU  H       4.36            #peak   696
 64 GLU  H      65 ARG  H       4.30            #peak   697
 65 ARG  H      65 ARG  HD2     6.00            #peak   699
 66 ILE  H      66 ILE  HG12    4.37            #peak   702
 64 GLU  HA     66 ILE  H       6.00            #peak   703
 63 GLN  HA     66 ILE  H       5.34            #peak   704
 65 ARG  H      66 ILE  H       4.40            #peak   705
 66 ILE  H      66 ILE  QG2     4.37            #peak   706
 65 ARG  QB     66 ILE  H       3.84            #peak   707
 66 ILE  H      67 ALA  QB      5.11            #peak   708
 67 ALA  H      68 ALA  H       4.21            #peak   710
 65 ARG  HA     68 ALA  H       4.59            #peak   711
 64 GLU  HA     68 ALA  H       5.59            #peak   712
 66 ILE  HA     68 ALA  H       5.89            #peak   714
 64 GLU  HB3    68 ALA  H       4.98            #peak   715
 68 ALA  H      69 LEU  QD2     6.00            #peak   716
 67 ALA  QB     68 ALA  H       3.46            #peak   717
 69 LEU  H      70 GLY  HA2     5.89            #peak   719
 65 ARG  HG3    69 LEU  H       4.66            #peak   720
 69 LEU  H      69 LEU  QD2     5.33            #peak   721
 66 ILE  QG2    70 GLY  H       6.00            #peak   723
 67 ALA  HA     70 GLY  H       4.86            #peak   724
 71 TYR  H      72 THR  H       6.00            #peak   726
 66 ILE  HA     71 TYR  H       5.87            #peak   727
 16 GLY  H      72 THR  H       5.43            #peak   728
 72 THR  H      73 LEU  H       4.69            #peak   729
 66 ILE  QG2    73 LEU  H       5.15            #peak   730
 15 GLY  H      74 ALA  H       6.00            #peak   731
 14 VAL  QG2    74 ALA  H       5.08            #peak   732
 75 GLU  H      76 PRO  HA      4.53            #peak   734
 17 MET  H      46 GLY  HA3     4.88            #peak   742
 22 CYS  HA     25 SER  H       4.02            #peak   748
 25 SER  H      69 LEU  QD1     5.63            #peak   750
 25 SER  HA     27 GLU  H       4.75            #peak   751
 24 SER  HA     27 GLU  H       4.30            #peak   752
 27 GLU  H      65 ARG  HD3     5.90            #peak   755
 24 SER  HA     28 ARG  H       5.02            #peak   757
 28 ARG  H      31 GLU  QG      6.00            #peak   758
 28 ARG  H      29 ALA  QB      6.00            #peak   759
 29 ALA  H      30 LEU  HB3     6.00            #peak   760
 29 ALA  H      31 GLU  QG      6.00            #peak   761
  6 PRO  QB      7 LEU  H       3.63            #peak   764
 54 PRO  HD3    55 LYS  H       5.21            #peak   765
 21 ALA  H      22 CYS  H       4.88            #peak   767
 12 MET
         H         48 LEU  O      2.0
  N         48 LEU  O      3.0
 10 GLN
         H         50 VAL  O      2.0
  N         50 VAL  O      3.0
 47 ARG 
         H         42 THR  O      2.0
  N         42 THR  O      3.0
 49 THR
         H         40 SER  O      2.0
  N         40 SER  O      3.0
 51 THR
         H         38 GLU  O      2.0
  N         38 GLU  O      3.0
 13 GLN
         H         74 ALA  O      2.0
  N         74 ALA  O      3.0
 15 GLY
         H         72 THR  O      2.0
  N         72 THR  O      3.0

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H2   PRO   6           2H       PRO   6  -9.664  -4.415 -15.659
    2    HA   PRO   6           HA       PRO   6  -7.503  -6.283 -16.262
    3    HB3  PRO   6           2HB      PRO   6  -6.471  -4.814 -17.666
    4    HG3  PRO   6           2HG      PRO   6  -8.231  -4.399 -19.150
    5    HD3  PRO   6           2HD      PRO   6  -9.413  -6.101 -18.056
    6    H    LEU   7           H        LEU   7  -5.662  -5.973 -14.891
    7    HA   LEU   7           HA       LEU   7  -5.673  -4.013 -12.768
    8    HB3  LEU   7           2HB      LEU   7  -7.271  -5.503 -11.771
    9    HG   LEU   7           HG       LEU   7  -5.214  -7.755 -11.913
   10   HD11  LEU   7          1HD1      LEU   7  -7.902  -7.554 -10.483
   11   HD12  LEU   7          2HD1      LEU   7  -6.308  -7.462  -9.705
   12   HD13  LEU   7          3HD1      LEU   7  -6.819  -8.962 -10.504
   13   HD21  LEU   7          3HD2      LEU   7  -6.503  -7.899 -13.956
   14   HD22  LEU   7          1HD2      LEU   7  -8.016  -7.502 -13.103
   15   HD23  LEU   7          2HD2      LEU   7  -7.215  -9.061 -12.848
   16    H    LYS   8           H        LYS   8  -3.737  -3.612 -11.953
   17    HA   LYS   8           HA       LYS   8  -1.436  -5.223 -12.931
   18    HB3  LYS   8           2HB      LYS   8  -2.057  -3.607 -14.681
   19    HG3  LYS   8           2HG      LYS   8  -1.214  -1.433 -12.722
   20    HD3  LYS   8           2HD      LYS   8  -2.302  -1.242 -15.567
   21    HE3  LYS   8           2HE      LYS   8  -1.062   0.829 -13.699
   22    HZ1  LYS   8           3HZ      LYS   8  -0.656   1.203 -16.110
   23    HZ2  LYS   8           1HZ      LYS   8  -1.606   2.382 -15.456
   24    HZ3  LYS   8           2HZ      LYS   8  -2.274   1.227 -16.370
   25    H    THR   9           H        THR   9   0.546  -4.848 -11.995
   26    HA   THR   9           HA       THR   9   0.575  -4.292  -9.188
   27    HB   THR   9           HB       THR   9   2.013  -5.920 -10.389
   28    HG1  THR   9           1HG      THR   9   3.072  -5.778  -8.665
   29   HG21  THR   9          3HG2      THR   9   2.741  -4.571 -12.309
   30   HG22  THR   9          1HG2      THR   9   4.136  -5.145 -11.370
   31   HG23  THR   9          2HG2      THR   9   3.606  -3.458 -11.243
   32    H    GLN  10           H        GLN  10   1.824  -2.774  -8.044
   33    HA   GLN  10           HA       GLN  10   2.883  -0.352  -9.232
   34    HB3  GLN  10           2HB      GLN  10   0.552  -0.183  -7.271
   35    HG3  GLN  10           2HG      GLN  10   2.102   1.829  -7.374
   36   HE21  GLN  10          1HE2      GLN  10   0.203   3.730  -9.266
   37   HE22  GLN  10          2HE2      GLN  10   1.269   3.831 -10.655
   38    H    GLN  11           H        GLN  11   4.348   0.621  -7.662
   39    HA   GLN  11           HA       GLN  11   4.424  -0.601  -4.980
   40    HB3  GLN  11           2HB      GLN  11   5.930  -1.926  -6.521
   41    HG3  GLN  11           2HG      GLN  11   7.662   0.567  -6.411
   42   HE21  GLN  11          1HE2      GLN  11   9.715   0.374  -7.346
   43   HE22  GLN  11          2HE2      GLN  11  10.316  -1.157  -7.992
   44    H    MET  12           H        MET  12   5.553   0.595  -3.427
   45    HA   MET  12           HA       MET  12   6.075   3.450  -4.038
   46    HB3  MET  12           2HB      MET  12   3.733   3.516  -3.788
   47    HG3  MET  12           2HG      MET  12   2.671   2.678  -1.575
   48    HE1  MET  12           3HE      MET  12   0.932   1.203  -4.793
   49    HE2  MET  12           1HE      MET  12   1.028   2.583  -3.677
   50    HE3  MET  12           2HE      MET  12   2.264   2.359  -4.942
   51    H    GLN  13           H        GLN  13   6.933   4.652  -2.401
   52    HA   GLN  13           HA       GLN  13   8.230   3.155  -0.187
   53    HB3  GLN  13           2HB      GLN  13   9.135   5.559   0.312
   54    HG3  GLN  13           2HG      GLN  13  10.121   4.344  -2.290
   55   HE21  GLN  13          1HE2      GLN  13  10.634   7.088  -1.863
   56   HE22  GLN  13          2HE2      GLN  13  12.248   7.265  -1.176
   57    H    VAL  14           H        VAL  14   7.918   3.950   1.982
   58    HA   VAL  14           HA       VAL  14   5.423   5.374   2.532
   59    HB   VAL  14           HB       VAL  14   4.437   3.244   2.365
   60   HG11  VAL  14          1HG1      VAL  14   6.351   1.752   2.408
   61   HG12  VAL  14          2HG1      VAL  14   6.589   2.065   4.141
   62   HG13  VAL  14          3HG1      VAL  14   5.129   1.235   3.569
   63   HG21  VAL  14          3HG2      VAL  14   4.894   3.689   5.331
   64   HG22  VAL  14          1HG2      VAL  14   3.759   4.599   4.318
   65   HG23  VAL  14          2HG2      VAL  14   3.528   2.860   4.561
   66    H    GLY  15           H        GLY  15   5.698   6.668   4.178
   67    HA2  GLY  15           2HA      GLY  15   8.240   6.746   5.586
   68    HA3  GLY  15           3HA      GLY  15   6.866   7.859   5.795
   69    H    GLY  16           H        GLY  16   8.601   5.273   7.105
   70    HA2  GLY  16           2HA      GLY  16   8.633   4.820   9.397
   71    HA3  GLY  16           3HA      GLY  16   6.970   5.418   9.563
   72    H    MET  17           H        MET  17   6.947   3.080   7.054
   73    HA   MET  17           HA       MET  17   5.709   1.120   8.819
   74    HB3  MET  17           2HB      MET  17   6.609   0.646   5.962
   75    HG3  MET  17           2HG      MET  17   4.157  -0.264   7.519
   76    HE1  MET  17           3HE      MET  17   6.251  -2.479   5.188
   77    HE2  MET  17           1HE      MET  17   5.485  -2.301   3.599
   78    HE3  MET  17           2HE      MET  17   6.454  -0.976   4.260
   79    H    ARG  18           H        ARG  18   9.011   1.537   7.716
   80    HA   ARG  18           HA       ARG  18   9.933  -1.097   7.733
   81    HB3  ARG  18           2HB      ARG  18  11.207   0.754   6.812
   82    HG3  ARG  18           2HG      ARG  18  11.859   1.614   9.659
   83    HD3  ARG  18           2HD      ARG  18  12.703   2.497   6.879
   84    HE   ARG  18           HE       ARG  18  12.551   4.139   9.280
   85   HH11  ARG  18          1HH1      ARG  18  14.418   3.679   6.267
   86   HH12  ARG  18          2HH1      ARG  18  14.724   5.411   6.165
   87   HH21  ARG  18          1HH2      ARG  18  12.916   6.348   8.888
   88   HH22  ARG  18          2HH2      ARG  18  13.997   6.793   7.571
   89    H    CYS  19           H        CYS  19  11.350  -2.222   9.047
   90    HA   CYS  19           HA       CYS  19  12.455  -3.022  10.837
   91    HB3  CYS  19           2HB      CYS  19  13.246  -1.355  12.520
   92    HG   CYS  19           HG       CYS  19  14.635  -1.775  10.438
   93    H    ALA  20           H        ALA  20   9.284  -2.775  11.094
   94    HA   ALA  20           HA       ALA  20   9.117  -4.175  13.665
   95    HB1  ALA  20           1HB      ALA  20   7.410  -2.561  14.532
   96    HB2  ALA  20           2HB      ALA  20   8.984  -1.777  14.317
   97    HB3  ALA  20           3HB      ALA  20   7.697  -1.515  13.127
   98    H    ALA  21           H        ALA  21   6.871  -5.013  14.016
   99    HA   ALA  21           HA       ALA  21   5.849  -6.240  11.652
  100    HB1  ALA  21           1HB      ALA  21   5.850  -7.255  13.916
  101    HB2  ALA  21           2HB      ALA  21   4.635  -6.069  14.445
  102    HB3  ALA  21           3HB      ALA  21   4.234  -7.258  13.193
  103    H    CYS  22           H        CYS  22   5.317  -3.074  12.509
  104    HA   CYS  22           HA       CYS  22   2.641  -2.467  12.322
  105    HB3  CYS  22           2HB      CYS  22   3.473  -0.237  11.554
  106    HG   CYS  22           HG       CYS  22   3.515  -0.754  14.105
  107    H    ALA  23           H        ALA  23   4.701  -3.290   9.557
  108    HA   ALA  23           HA       ALA  23   3.092  -2.648   7.347
  109    HB1  ALA  23           1HB      ALA  23   4.741  -5.155   7.901
  110    HB2  ALA  23           2HB      ALA  23   4.292  -4.499   6.316
  111    HB3  ALA  23           3HB      ALA  23   5.378  -3.582   7.349
  112    H    SER  24           H        SER  24   2.535  -5.194   9.779
  113    HA   SER  24           HA       SER  24   0.524  -6.651   8.279
  114    HB3  SER  24           2HB      SER  24   1.781  -7.653  10.141
  115    HG   SER  24           HG       SER  24   1.902  -6.076  11.671
  116    H    SER  25           H        SER  25   0.313  -3.610  10.093
  117    HA   SER  25           HA       SER  25  -2.620  -3.720  10.331
  118    HB3  SER  25           2HB      SER  25  -2.515  -1.466  11.053
  119    HG   SER  25           HG       SER  25  -1.316  -1.643  12.826
  120    H    ILE  26           H        ILE  26  -0.375  -3.101   7.826
  121    HA   ILE  26           HA       ILE  26  -2.307  -1.560   6.153
  122    HB   ILE  26           HB       ILE  26   0.509  -2.499   5.443
  123   HG13  ILE  26          2HG1      ILE  26   1.408  -0.318   5.988
  124   HG21  ILE  26          1HG2      ILE  26   0.381  -0.625   3.833
  125   HG22  ILE  26          2HG2      ILE  26  -0.826  -1.897   3.538
  126   HG23  ILE  26          3HG2      ILE  26  -1.314  -0.365   4.292
  127   HD11  ILE  26          3HD1      ILE  26  -1.246   0.276   7.354
  128   HD12  ILE  26          1HD1      ILE  26   0.254   1.199   7.558
  129   HD13  ILE  26          2HD1      ILE  26  -0.537   1.165   5.978
  130    H    GLU  27           H        GLU  27  -0.494  -4.632   6.167
  131    HA   GLU  27           HA       GLU  27  -1.639  -5.510   3.654
  132    HB3  GLU  27           2HB      GLU  27   0.031  -7.111   5.607
  133    HG3  GLU  27           2HG      GLU  27  -0.002  -7.052   2.548
  134    H    ARG  28           H        ARG  28  -2.462  -6.175   7.082
  135    HA   ARG  28           HA       ARG  28  -4.010  -8.520   6.593
  136    HB3  ARG  28           2HB      ARG  28  -4.392  -6.332   8.672
  137    HG3  ARG  28           2HG      ARG  28  -6.223  -8.251   8.442
  138    HD3  ARG  28           2HD      ARG  28  -5.699 -10.145   9.970
  139    HE   ARG  28           HE       ARG  28  -3.537 -10.450   8.018
  140   HH11  ARG  28          1HH1      ARG  28  -7.079 -10.576   8.396
  141   HH12  ARG  28          2HH1      ARG  28  -7.292 -11.406   6.884
  142   HH21  ARG  28          1HH2      ARG  28  -3.888 -11.511   6.098
  143   HH22  ARG  28          2HH2      ARG  28  -5.511 -11.961   5.615
  144    H    ALA  29           H        ALA  29  -4.936  -5.064   6.473
  145    HA   ALA  29           HA       ALA  29  -7.671  -5.402   5.850
  146    HB1  ALA  29           1HB      ALA  29  -5.642  -3.202   5.377
  147    HB2  ALA  29           2HB      ALA  29  -7.327  -3.058   4.820
  148    HB3  ALA  29           3HB      ALA  29  -6.980  -3.272   6.541
  149    H    LEU  30           H        LEU  30  -4.893  -5.539   3.606
  150    HA   LEU  30           HA       LEU  30  -5.847  -5.230   1.118
  151    HB3  LEU  30           2HB      LEU  30  -4.399  -7.731   2.098
  152    HG   LEU  30           HG       LEU  30  -3.177  -7.758   0.035
  153   HD11  LEU  30          1HD1      LEU  30  -6.023  -8.171  -0.824
  154   HD12  LEU  30          2HD1      LEU  30  -5.134  -9.278   0.256
  155   HD13  LEU  30          3HD1      LEU  30  -4.551  -8.955  -1.381
  156   HD21  LEU  30          3HD2      LEU  30  -3.487  -5.415  -0.673
  157   HD22  LEU  30          1HD2      LEU  30  -5.186  -5.744  -1.050
  158   HD23  LEU  30          2HD2      LEU  30  -3.905  -6.540  -1.982
  159    H    GLU  31           H        GLU  31  -6.642  -8.225   2.958
  160    HA   GLU  31           HA       GLU  31  -7.963  -9.291   0.641
  161    HB3  GLU  31           2HB      GLU  31  -6.810 -10.833   2.038
  162    HG3  GLU  31           2HG      GLU  31  -8.549  -9.829   4.327
  163    H    ARG  32           H        ARG  32  -9.012  -6.999   2.783
  164    HA   ARG  32           HA       ARG  32 -11.848  -7.816   2.749
  165    HB3  ARG  32           2HB      ARG  32 -12.220  -6.089   4.388
  166    HG3  ARG  32           2HG      ARG  32  -9.578  -7.452   5.096
  167    HD3  ARG  32           2HD      ARG  32 -11.835  -6.608   6.929
  168    HE   ARG  32           HE       ARG  32 -10.045  -8.334   7.619
  169   HH11  ARG  32          1HH1      ARG  32  -9.257  -4.871   7.872
  170   HH12  ARG  32          2HH1      ARG  32  -8.037  -5.178   9.069
  171   HH21  ARG  32          1HH2      ARG  32  -8.770  -8.545   9.481
  172   HH22  ARG  32          2HH2      ARG  32  -8.019  -7.117  10.169
  173    H    LEU  33           H        LEU  33  -9.601  -5.467   1.420
  174    HA   LEU  33           HA       LEU  33 -11.272  -3.452   0.424
  175    HB3  LEU  33           2HB      LEU  33  -9.463  -3.001  -1.191
  176    HG   LEU  33           HG       LEU  33  -8.275  -4.027   1.412
  177   HD11  LEU  33          1HD1      LEU  33  -6.980  -2.131  -0.563
  178   HD12  LEU  33          2HD1      LEU  33  -6.658  -3.878  -0.512
  179   HD13  LEU  33          3HD1      LEU  33  -6.292  -2.877   0.893
  180   HD21  LEU  33          3HD2      LEU  33  -9.856  -2.168   1.779
  181   HD22  LEU  33          1HD2      LEU  33  -9.004  -1.197   0.555
  182   HD23  LEU  33          2HD2      LEU  33  -8.182  -1.662   2.062
  183    H    LYS  34           H        LYS  34 -12.278  -3.007  -1.510
  184    HA   LYS  34           HA       LYS  34 -12.804  -5.222  -3.434
  185    HB3  LYS  34           2HB      LYS  34 -13.966  -2.411  -3.493
  186    HG3  LYS  34           2HG      LYS  34 -14.941  -5.139  -4.466
  187    HD3  LYS  34           2HD      LYS  34 -16.251  -2.415  -4.850
  188    HE3  LYS  34           2HE      LYS  34 -17.071  -5.278  -5.541
  189    HZ1  LYS  34           3HZ      LYS  34 -18.944  -4.253  -6.594
  190    HZ2  LYS  34           1HZ      LYS  34 -18.518  -2.748  -6.111
  191    HZ3  LYS  34           2HZ      LYS  34 -18.985  -3.870  -4.992
  192    H    GLY  35           H        GLY  35 -12.090  -5.098  -5.601
  193    HA2  GLY  35           2HA      GLY  35 -11.132  -4.184  -7.511
  194    HA3  GLY  35           3HA      GLY  35 -10.683  -2.717  -6.615
  195    H    VAL  36           H        VAL  36  -9.579  -5.668  -5.143
  196    HA   VAL  36           HA       VAL  36  -6.828  -5.226  -6.282
  197    HB   VAL  36           HB       VAL  36  -5.846  -6.004  -4.200
  198   HG11  VAL  36          1HG1      VAL  36  -6.202  -4.092  -2.795
  199   HG12  VAL  36          2HG1      VAL  36  -6.189  -3.568  -4.487
  200   HG13  VAL  36          3HG1      VAL  36  -7.733  -3.702  -3.604
  201   HG21  VAL  36          3HG2      VAL  36  -8.606  -5.921  -2.940
  202   HG22  VAL  36          1HG2      VAL  36  -7.735  -7.418  -3.362
  203   HG23  VAL  36          2HG2      VAL  36  -7.079  -6.313  -2.154
  204    H    ALA  37           H        ALA  37  -5.380  -7.167  -6.070
  205    HA   ALA  37           HA       ALA  37  -6.769  -9.784  -5.761
  206    HB1  ALA  37           1HB      ALA  37  -5.177  -9.034  -8.250
  207    HB2  ALA  37           2HB      ALA  37  -5.792 -10.654  -7.884
  208    HB3  ALA  37           3HB      ALA  37  -6.934  -9.332  -8.149
  209    H    GLU  38           H        GLU  38  -3.792  -7.986  -5.287
  210    HA   GLU  38           HA       GLU  38  -2.490 -10.198  -4.004
  211    HB3  GLU  38           2HB      GLU  38  -1.110  -9.157  -6.495
  212    HG3  GLU  38           2HG      GLU  38  -0.810 -11.816  -5.051
  213    H    ALA  39           H        ALA  39  -0.719  -9.397  -2.722
  214    HA   ALA  39           HA       ALA  39   0.571  -6.872  -3.312
  215    HB1  ALA  39           1HB      ALA  39  -0.104  -5.669  -1.280
  216    HB2  ALA  39           2HB      ALA  39  -1.535  -6.051  -2.264
  217    HB3  ALA  39           3HB      ALA  39  -1.168  -7.015  -0.814
  218    H    SER  40           H        SER  40   2.282  -6.333  -1.644
  219    HA   SER  40           HA       SER  40   3.091  -8.501   0.206
  220    HB3  SER  40           2HB      SER  40   4.798  -7.904  -2.235
  221    HG   SER  40           HG       SER  40   5.385 -10.197  -1.313
  222    H    VAL  41           H        VAL  41   3.618  -7.299   1.958
  223    HA   VAL  41           HA       VAL  41   5.068  -4.779   1.791
  224    HB   VAL  41           HB       VAL  41   5.300  -4.887   4.203
  225   HG11  VAL  41          1HG1      VAL  41   2.554  -5.605   3.128
  226   HG12  VAL  41          2HG1      VAL  41   2.843  -5.134   4.806
  227   HG13  VAL  41          3HG1      VAL  41   3.232  -4.016   3.507
  228   HG21  VAL  41          3HG2      VAL  41   4.331  -6.810   5.514
  229   HG22  VAL  41          1HG2      VAL  41   4.354  -7.767   4.023
  230   HG23  VAL  41          2HG2      VAL  41   5.859  -7.140   4.703
  231    H    THR  42           H        THR  42   7.190  -4.269   2.333
  232    HA   THR  42           HA       THR  42   8.992  -6.484   3.154
  233    HB   THR  42           HB       THR  42   9.686  -6.177   0.948
  234    HG1  THR  42           1HG      THR  42  11.777  -5.126   1.380
  235   HG21  THR  42          3HG2      THR  42   8.729  -4.005   0.358
  236   HG22  THR  42          1HG2      THR  42  10.442  -4.064  -0.029
  237   HG23  THR  42          2HG2      THR  42   9.902  -3.185   1.414
  238    H    VAL  43           H        VAL  43   9.558  -6.160   5.104
  239    HA   VAL  43           HA       VAL  43   9.081  -3.572   6.498
  240    HB   VAL  43           HB       VAL  43   9.781  -6.375   7.464
  241   HG11  VAL  43          1HG1      VAL  43   9.404  -5.518   9.787
  242   HG12  VAL  43          2HG1      VAL  43  10.857  -4.842   9.061
  243   HG13  VAL  43          3HG1      VAL  43   9.373  -3.860   9.148
  244   HG21  VAL  43          3HG2      VAL  43   7.521  -6.199   8.516
  245   HG22  VAL  43          1HG2      VAL  43   7.328  -4.601   7.780
  246   HG23  VAL  43          2HG2      VAL  43   7.436  -6.048   6.751
  247    H    ALA  44           H        ALA  44  11.684  -5.733   5.434
  248    HA   ALA  44           HA       ALA  44  13.871  -4.835   6.909
  249    HB1  ALA  44           1HB      ALA  44  13.859  -6.822   5.459
  250    HB2  ALA  44           2HB      ALA  44  13.726  -5.802   4.009
  251    HB3  ALA  44           3HB      ALA  44  15.193  -5.750   5.005
  252    H    THR  45           H        THR  45  12.749  -3.579   3.751
  253    HA   THR  45           HA       THR  45  14.497  -1.184   3.910
  254    HB   THR  45           HB       THR  45  13.644  -0.832   1.569
  255    HG1  THR  45           1HG      THR  45  12.785  -3.188   0.957
  256   HG21  THR  45          3HG2      THR  45  14.925  -2.635   0.543
  257   HG22  THR  45          1HG2      THR  45  14.881  -3.584   2.046
  258   HG23  THR  45          2HG2      THR  45  15.775  -2.053   1.979
  259    H    GLY  46           H        GLY  46  11.065  -2.065   4.092
  260    HA2  GLY  46           2HA      GLY  46   9.355  -0.810   5.076
  261    HA3  GLY  46           3HA      GLY  46  10.350   0.667   4.984
  262    H    ARG  47           H        ARG  47   9.127  -1.680   2.563
  263    HA   ARG  47           HA       ARG  47   7.807   0.561   1.098
  264    HB3  ARG  47           2HB      ARG  47   8.702  -0.165  -1.028
  265    HG3  ARG  47           2HG      ARG  47  11.121   0.175   0.781
  266    HD3  ARG  47           2HD      ARG  47  11.997   1.463  -1.136
  267    HE   ARG  47           HE       ARG  47  10.976  -1.047  -2.356
  268   HH11  ARG  47          1HH1      ARG  47  13.785   0.453  -0.720
  269   HH12  ARG  47          2HH1      ARG  47  14.868  -0.744  -1.385
  270   HH21  ARG  47          1HH2      ARG  47  12.386  -2.581  -2.988
  271   HH22  ARG  47          2HH2      ARG  47  14.081  -2.475  -2.596
  272    H    LEU  48           H        LEU  48   6.478  -0.388  -0.809
  273    HA   LEU  48           HA       LEU  48   5.297  -3.025  -0.134
  274    HB3  LEU  48           2HB      LEU  48   3.185  -1.026  -0.605
  275    HG   LEU  48           HG       LEU  48   3.885  -2.820   1.752
  276   HD11  LEU  48          1HD1      LEU  48   1.348  -1.212   1.281
  277   HD12  LEU  48          2HD1      LEU  48   2.603  -0.832   2.485
  278   HD13  LEU  48          3HD1      LEU  48   1.656  -2.325   2.628
  279   HD21  LEU  48          3HD2      LEU  48   1.874  -4.131   1.026
  280   HD22  LEU  48          1HD2      LEU  48   3.133  -4.118  -0.202
  281   HD23  LEU  48          2HD2      LEU  48   1.715  -3.070  -0.393
  282    H    THR  49           H        THR  49   4.177  -4.017  -1.725
  283    HA   THR  49           HA       THR  49   3.861  -2.689  -4.382
  284    HB   THR  49           HB       THR  49   4.438  -5.655  -4.043
  285    HG1  THR  49           1HG      THR  49   6.476  -5.067  -4.953
  286   HG21  THR  49          3HG2      THR  49   4.515  -3.776  -6.462
  287   HG22  THR  49          1HG2      THR  49   3.231  -4.968  -6.132
  288   HG23  THR  49          2HG2      THR  49   4.865  -5.517  -6.477
  289    H    VAL  50           H        VAL  50   1.887  -2.985  -5.296
  290    HA   VAL  50           HA       VAL  50  -0.111  -4.831  -4.084
  291    HB   VAL  50           HB       VAL  50  -0.347  -2.757  -2.822
  292   HG11  VAL  50          1HG1      VAL  50  -1.083  -0.643  -3.892
  293   HG12  VAL  50          2HG1      VAL  50   0.553  -1.105  -4.384
  294   HG13  VAL  50          3HG1      VAL  50  -0.811  -1.349  -5.487
  295   HG21  VAL  50          3HG2      VAL  50  -2.393  -4.012  -3.243
  296   HG22  VAL  50          1HG2      VAL  50  -2.701  -2.264  -3.165
  297   HG23  VAL  50          2HG2      VAL  50  -2.683  -3.092  -4.732
  298    H    THR  51           H        THR  51  -1.606  -5.614  -5.519
  299    HA   THR  51           HA       THR  51  -1.561  -4.627  -8.352
  300    HB   THR  51           HB       THR  51  -2.200  -7.384  -7.224
  301    HG1  THR  51           1HG      THR  51  -0.010  -6.949  -7.336
  302   HG21  THR  51          3HG2      THR  51  -2.300  -8.066  -9.627
  303   HG22  THR  51          1HG2      THR  51  -2.187  -6.363 -10.119
  304   HG23  THR  51          2HG2      THR  51  -3.607  -6.948  -9.227
  305    H    TYR  52           H        TYR  52  -3.259  -3.528  -8.939
  306    HA   TYR  52           HA       TYR  52  -5.956  -4.161  -7.920
  307    HB3  TYR  52           2HB      TYR  52  -5.084  -2.558  -6.320
  308    HD1  TYR  52           1HD      TYR  52  -5.933  -0.165  -9.105
  309    HD2  TYR  52           2HD      TYR  52  -2.991  -1.460  -6.241
  310    HE1  TYR  52           1HE      TYR  52  -4.658   1.932  -9.466
  311    HE2  TYR  52           2HE      TYR  52  -1.727   0.657  -6.577
  312    HH   TYR  52           HH       TYR  52  -2.912   3.254  -8.727
  313    H    ASP  53           H        ASP  53  -7.693  -2.916  -8.964
  314    HA   ASP  53           HA       ASP  53  -7.395  -2.979 -11.871
  315    HB3  ASP  53           2HB      ASP  53  -9.721  -2.804  -9.927
  316    HA   PRO  54           HA       PRO  54  -6.729   1.440 -11.221
  317    HB3  PRO  54           2HB      PRO  54  -4.898   1.180 -12.619
  318    HG3  PRO  54           2HG      PRO  54  -5.014  -0.198 -14.583
  319    HD3  PRO  54           2HD      PRO  54  -5.567  -1.559 -12.739
  320    H    LYS  55           H        LYS  55  -9.383   0.104 -12.507
  321    HA   LYS  55           HA       LYS  55 -10.609   2.727 -13.350
  322    HB3  LYS  55           2HB      LYS  55 -12.209   1.356 -14.707
  323    HG3  LYS  55           2HG      LYS  55  -9.317   1.086 -15.630
  324    HD3  LYS  55           2HD      LYS  55 -11.949   1.541 -17.114
  325    HE3  LYS  55           2HE      LYS  55  -9.091   1.197 -18.136
  326    HZ1  LYS  55           3HZ      LYS  55 -11.559   1.924 -19.599
  327    HZ2  LYS  55           1HZ      LYS  55 -10.918   0.417 -19.600
  328    HZ3  LYS  55           2HZ      LYS  55 -10.049   1.670 -20.242
  329    H    GLN  56           H        GLN  56 -11.213  -0.457 -11.767
  330    HA   GLN  56           HA       GLN  56 -13.585   0.532 -10.392
  331    HB3  GLN  56           2HB      GLN  56 -12.997  -1.285  -8.697
  332    HG3  GLN  56           2HG      GLN  56 -13.219  -2.283 -11.549
  333   HE21  GLN  56          1HE2      GLN  56 -12.220  -4.293 -10.879
  334   HE22  GLN  56          2HE2      GLN  56 -12.974  -5.351  -9.678
  335    H    VAL  57           H        VAL  57 -10.068   0.748  -9.685
  336    HA   VAL  57           HA       VAL  57 -10.626   2.664  -7.501
  337    HB   VAL  57           HB       VAL  57  -9.119   1.518  -5.960
  338   HG11  VAL  57          1HG1      VAL  57 -11.448  -0.297  -6.700
  339   HG12  VAL  57          2HG1      VAL  57 -10.623  -0.191  -5.143
  340   HG13  VAL  57          3HG1      VAL  57 -11.560   1.191  -5.727
  341   HG21  VAL  57          3HG2      VAL  57  -7.824   0.128  -7.565
  342   HG22  VAL  57          1HG2      VAL  57  -8.471  -0.818  -6.217
  343   HG23  VAL  57          2HG2      VAL  57  -9.252  -0.905  -7.806
  344    H    SER  58           H        SER  58  -8.207   3.160  -6.503
  345    HA   SER  58           HA       SER  58  -6.194   3.447  -8.643
  346    HB3  SER  58           2HB      SER  58  -7.799   5.414  -8.805
  347    HG   SER  58           HG       SER  58  -8.131   6.620  -7.106
  348    H    GLU  59           H        GLU  59  -4.379   5.071  -7.411
  349    HA   GLU  59           HA       GLU  59  -3.257   3.856  -5.163
  350    HB3  GLU  59           2HB      GLU  59  -2.015   5.440  -6.414
  351    HG3  GLU  59           2HG      GLU  59  -3.869   7.605  -5.348
  352    H    ILE  60           H        ILE  60  -6.209   5.744  -5.161
  353    HA   ILE  60           HA       ILE  60  -6.342   6.397  -2.350
  354    HB   ILE  60           HB       ILE  60  -8.412   5.955  -4.516
  355   HG13  ILE  60          2HG1      ILE  60  -8.686   8.387  -4.457
  356   HG21  ILE  60          1HG2      ILE  60  -9.614   5.449  -2.550
  357   HG22  ILE  60          2HG2      ILE  60  -8.927   6.836  -1.665
  358   HG23  ILE  60          3HG2      ILE  60 -10.060   7.085  -3.019
  359   HD11  ILE  60          3HD1      ILE  60  -6.195   8.545  -2.706
  360   HD12  ILE  60          1HD1      ILE  60  -7.117   9.882  -3.400
  361   HD13  ILE  60          2HD1      ILE  60  -7.844   8.888  -2.124
  362    H    THR  61           H        THR  61  -6.721   3.263  -3.915
  363    HA   THR  61           HA       THR  61  -7.912   2.037  -1.482
  364    HB   THR  61           HB       THR  61  -7.088   0.991  -4.189
  365    HG1  THR  61           1HG      THR  61  -9.053   2.095  -3.993
  366   HG21  THR  61          3HG2      THR  61  -8.268  -1.125  -3.564
  367   HG22  THR  61          1HG2      THR  61  -8.216  -0.618  -1.860
  368   HG23  THR  61          2HG2      THR  61  -6.708  -0.942  -2.761
  369    H    ILE  62           H        ILE  62  -4.860   3.142  -2.141
  370    HA   ILE  62           HA       ILE  62  -3.915   1.519   0.195
  371    HB   ILE  62           HB       ILE  62  -2.956   0.606  -1.819
  372   HG13  ILE  62          2HG1      ILE  62  -1.724   0.793   0.447
  373   HG21  ILE  62          1HG2      ILE  62  -1.323   1.796  -3.201
  374   HG22  ILE  62          2HG2      ILE  62  -2.911   2.519  -3.312
  375   HG23  ILE  62          3HG2      ILE  62  -1.656   3.310  -2.322
  376   HD11  ILE  62          3HD1      ILE  62  -0.012   0.414  -2.035
  377   HD12  ILE  62          1HD1      ILE  62   0.358  -0.145  -0.404
  378   HD13  ILE  62          2HD1      ILE  62  -1.029  -0.830  -1.277
  379    H    GLN  63           H        GLN  63  -4.091   4.708  -1.199
  380    HA   GLN  63           HA       GLN  63  -2.329   6.021   0.557
  381    HB3  GLN  63           2HB      GLN  63  -4.938   7.034  -0.672
  382    HG3  GLN  63           2HG      GLN  63  -2.462   8.488   0.354
  383   HE21  GLN  63          1HE2      GLN  63  -5.409  10.343  -0.111
  384   HE22  GLN  63          2HE2      GLN  63  -4.787  11.161  -1.530
  385    H    GLU  64           H        GLU  64  -5.884   5.511   1.085
  386    HA   GLU  64           HA       GLU  64  -5.930   7.107   3.486
  387    HB3  GLU  64           2HB      GLU  64  -8.167   6.242   3.796
  388    HG3  GLU  64           2HG      GLU  64  -7.712   6.496   0.784
  389    H    ARG  65           H        ARG  65  -5.726   3.645   2.832
  390    HA   ARG  65           HA       ARG  65  -5.539   2.589   5.460
  391    HB3  ARG  65           2HB      ARG  65  -4.560   1.678   2.726
  392    HG3  ARG  65           2HG      ARG  65  -4.994   0.058   5.266
  393    HD3  ARG  65           2HD      ARG  65  -6.322  -1.010   3.550
  394    HE   ARG  65           HE       ARG  65  -5.538  -0.310   1.429
  395   HH11  ARG  65          1HH1      ARG  65  -3.170  -2.577   2.899
  396   HH12  ARG  65          2HH1      ARG  65  -2.445  -2.852   1.321
  397   HH21  ARG  65          1HH2      ARG  65  -4.560  -0.832  -0.464
  398   HH22  ARG  65          2HH2      ARG  65  -3.181  -1.946  -0.472
  399    H    ILE  66           H        ILE  66  -3.213   4.492   3.832
  400    HA   ILE  66           HA       ILE  66  -1.061   3.606   5.759
  401    HB   ILE  66           HB       ILE  66  -0.956   5.012   3.059
  402   HG13  ILE  66          2HG1      ILE  66  -1.137   2.465   3.169
  403   HG21  ILE  66          1HG2      ILE  66   0.685   6.081   4.655
  404   HG22  ILE  66          2HG2      ILE  66   1.393   4.460   4.904
  405   HG23  ILE  66          3HG2      ILE  66   1.453   5.244   3.315
  406   HD11  ILE  66          3HD1      ILE  66   0.612   1.924   1.646
  407   HD12  ILE  66          1HD1      ILE  66   0.041   3.558   1.256
  408   HD13  ILE  66          2HD1      ILE  66   1.582   3.327   2.122
  409    H    ALA  67           H        ALA  67  -2.801   6.456   4.474
  410    HA   ALA  67           HA       ALA  67  -1.484   8.355   6.123
  411    HB1  ALA  67           1HB      ALA  67  -3.261   9.869   5.297
  412    HB2  ALA  67           2HB      ALA  67  -2.592   8.875   3.988
  413    HB3  ALA  67           3HB      ALA  67  -4.176   8.473   4.693
  414    H    ALA  68           H        ALA  68  -4.550   6.569   6.647
  415    HA   ALA  68           HA       ALA  68  -5.119   7.927   9.190
  416    HB1  ALA  68           1HB      ALA  68  -7.040   6.400   9.235
  417    HB2  ALA  68           2HB      ALA  68  -6.902   7.152   7.634
  418    HB3  ALA  68           3HB      ALA  68  -6.373   5.471   7.877
  419    H    LEU  69           H        LEU  69  -3.363   5.048   8.215
  420    HA   LEU  69           HA       LEU  69  -3.299   3.858  10.891
  421    HB3  LEU  69           2HB      LEU  69  -1.433   2.483   9.609
  422    HG   LEU  69           HG       LEU  69  -3.098   1.091   8.442
  423   HD11  LEU  69          1HD1      LEU  69  -2.597   0.825  10.874
  424   HD12  LEU  69          2HD1      LEU  69  -4.213   0.267  10.408
  425   HD13  LEU  69          3HD1      LEU  69  -4.022   1.812  11.253
  426   HD21  LEU  69          3HD2      LEU  69  -5.258   2.982   9.455
  427   HD22  LEU  69          1HD2      LEU  69  -5.464   1.490   8.521
  428   HD23  LEU  69          2HD2      LEU  69  -4.711   2.907   7.768
  429    H    GLY  70           H        GLY  70  -1.694   6.520   9.615
  430    HA2  GLY  70           2HA      GLY  70  -0.584   7.929  11.190
  431    HA3  GLY  70           3HA      GLY  70   0.175   6.523  11.954
  432    H    TYR  71           H        TYR  71   0.258   6.535   8.507
  433    HA   TYR  71           HA       TYR  71   3.148   7.356   8.469
  434    HB3  TYR  71           2HB      TYR  71   3.434   5.465   6.917
  435    HD1  TYR  71           1HD      TYR  71   4.412   5.433   9.539
  436    HD2  TYR  71           2HD      TYR  71   0.850   3.471   8.111
  437    HE1  TYR  71           1HE      TYR  71   4.400   3.985  11.564
  438    HE2  TYR  71           2HE      TYR  71   0.851   2.009  10.110
  439    HH   TYR  71           HH       TYR  71   1.685   1.729  12.207
  440    H    THR  72           H        THR  72   3.718   7.420   5.828
  441    HA   THR  72           HA       THR  72   1.521   8.804   4.356
  442    HB   THR  72           HB       THR  72   3.164  10.443   3.405
  443    HG1  THR  72           1HG      THR  72   5.098   9.790   3.910
  444   HG21  THR  72          3HG2      THR  72   3.078  12.001   5.297
  445   HG22  THR  72          1HG2      THR  72   2.636  10.673   6.390
  446   HG23  THR  72          2HG2      THR  72   1.535  11.154   5.086
  447    H    LEU  73           H        LEU  73   1.474   8.551   2.223
  448    HA   LEU  73           HA       LEU  73   3.029   6.321   1.065
  449    HB3  LEU  73           2HB      LEU  73   0.545   7.906   0.296
  450    HG   LEU  73           HG       LEU  73   1.643   7.223  -1.838
  451   HD11  LEU  73          1HD1      LEU  73   1.237   4.388  -0.780
  452   HD12  LEU  73          2HD1      LEU  73   2.811   5.173  -1.000
  453   HD13  LEU  73          3HD1      LEU  73   1.788   4.840  -2.407
  454   HD21  LEU  73          3HD2      LEU  73  -0.831   7.361  -1.611
  455   HD22  LEU  73          1HD2      LEU  73  -0.869   5.635  -1.177
  456   HD23  LEU  73          2HD2      LEU  73  -0.321   6.139  -2.787
  457    H    ALA  74           H        ALA  74   4.493   6.495  -0.565
  458    HA   ALA  74           HA       ALA  74   4.642   9.009  -2.174
  459    HB1  ALA  74           1HB      ALA  74   6.486   9.011  -0.535
  460    HB2  ALA  74           2HB      ALA  74   6.944   7.380  -1.027
  461    HB3  ALA  74           3HB      ALA  74   7.109   8.724  -2.175
  462    H    GLU  75           H        GLU  75   3.762   8.338  -4.050
  463    HA   GLU  75           HA       GLU  75   5.049   6.032  -5.467
  464    HB3  GLU  75           2HB      GLU  75   2.187   6.946  -5.964
  465    HG3  GLU  75           2HG      GLU  75   1.913   4.589  -6.678
  466    HA   PRO  76           HA       PRO  76   5.981  10.054  -7.561
  467    HB3  PRO  76           2HB      PRO  76   8.053  10.051  -6.528
  468    HG3  PRO  76           2HG      PRO  76   9.241   8.033  -6.114
  469    HD3  PRO  76           2HD      PRO  76   7.126   7.801  -5.089
  Start of MODEL    2
    1    H2   PRO   6           2H       PRO   6  -7.382  -3.709 -17.637
    2    HA   PRO   6           HA       PRO   6  -8.568  -5.149 -15.365
    3    HB3  PRO   6           2HB      PRO   6  -7.452  -7.110 -16.083
    4    HG3  PRO   6           2HG      PRO   6  -9.106  -7.080 -17.742
    5    HD3  PRO   6           2HD      PRO   6 -10.009  -5.001 -17.466
    6    H    LEU   7           H        LEU   7  -6.840  -5.961 -13.913
    7    HA   LEU   7           HA       LEU   7  -5.565  -4.016 -12.530
    8    HB3  LEU   7           2HB      LEU   7  -6.218  -6.297 -11.797
    9    HG   LEU   7           HG       LEU   7  -3.458  -7.191 -12.748
   10   HD11  LEU   7          1HD1      LEU   7  -4.210  -9.392 -11.855
   11   HD12  LEU   7          2HD1      LEU   7  -5.717  -8.643 -11.301
   12   HD13  LEU   7          3HD1      LEU   7  -4.157  -8.149 -10.609
   13   HD21  LEU   7          3HD2      LEU   7  -6.174  -8.092 -13.803
   14   HD22  LEU   7          1HD2      LEU   7  -4.642  -8.906 -14.133
   15   HD23  LEU   7          2HD2      LEU   7  -4.893  -7.274 -14.734
   16    H    LYS   8           H        LYS   8  -3.466  -3.452 -11.927
   17    HA   LYS   8           HA       LYS   8  -1.214  -4.086 -13.780
   18    HB3  LYS   8           2HB      LYS   8  -0.567  -1.704 -13.843
   19    HG3  LYS   8           2HG      LYS   8  -3.447  -1.900 -14.800
   20    HD3  LYS   8           2HD      LYS   8  -2.813  -0.344 -16.508
   21    HE3  LYS   8           2HE      LYS   8  -1.602   0.821 -13.967
   22    HZ1  LYS   8           3HZ      LYS   8  -2.602   2.833 -14.802
   23    HZ2  LYS   8           1HZ      LYS   8  -3.286   2.062 -16.077
   24    HZ3  LYS   8           2HZ      LYS   8  -1.654   2.222 -16.004
   25    H    THR   9           H        THR   9   0.577  -4.621 -12.639
   26    HA   THR   9           HA       THR   9   0.853  -4.283  -9.776
   27    HB   THR   9           HB       THR   9   1.741  -6.239 -10.901
   28    HG1  THR   9           1HG      THR   9   3.218  -6.258  -9.395
   29   HG21  THR   9          3HG2      THR   9   3.803  -4.389 -12.185
   30   HG22  THR   9          1HG2      THR   9   2.513  -5.244 -13.049
   31   HG23  THR   9          2HG2      THR   9   3.789  -6.162 -12.246
   32    H    GLN  10           H        GLN  10   2.370  -3.111  -8.534
   33    HA   GLN  10           HA       GLN  10   4.167  -1.209  -9.689
   34    HB3  GLN  10           2HB      GLN  10   2.186   0.129 -10.088
   35    HG3  GLN  10           2HG      GLN  10   1.523  -0.324  -7.150
   36   HE21  GLN  10          1HE2      GLN  10   0.785   1.524  -6.139
   37   HE22  GLN  10          2HE2      GLN  10  -0.087   2.806  -6.966
   38    H    GLN  11           H        GLN  11   5.339  -0.052  -8.029
   39    HA   GLN  11           HA       GLN  11   5.198  -1.146  -5.310
   40    HB3  GLN  11           2HB      GLN  11   6.612  -2.788  -6.353
   41    HG3  GLN  11           2HG      GLN  11   8.878  -2.127  -7.264
   42   HE21  GLN  11          1HE2      GLN  11   7.663  -0.003  -9.523
   43   HE22  GLN  11          2HE2      GLN  11   6.806  -1.156 -10.563
   44    H    MET  12           H        MET  12   6.545   0.039  -3.779
   45    HA   MET  12           HA       MET  12   7.023   2.864  -4.500
   46    HB3  MET  12           2HB      MET  12   4.549   2.479  -4.589
   47    HG3  MET  12           2HG      MET  12   4.710   2.053  -1.592
   48    HE1  MET  12           3HE      MET  12   2.931   3.348  -0.553
   49    HE2  MET  12           1HE      MET  12   3.119   4.351  -2.005
   50    HE3  MET  12           2HE      MET  12   1.492   3.926  -1.423
   51    H    GLN  13           H        GLN  13   7.205   4.244  -2.586
   52    HA   GLN  13           HA       GLN  13   8.479   2.869  -0.273
   53    HB3  GLN  13           2HB      GLN  13   9.650   5.134  -0.016
   54    HG3  GLN  13           2HG      GLN  13  10.114   3.460  -2.522
   55   HE21  GLN  13          1HE2      GLN  13  10.184   5.678  -3.688
   56   HE22  GLN  13          2HE2      GLN  13  11.719   6.532  -3.646
   57    H    VAL  14           H        VAL  14   8.218   4.068   1.783
   58    HA   VAL  14           HA       VAL  14   5.907   5.797   2.196
   59    HB   VAL  14           HB       VAL  14   4.587   3.847   1.914
   60   HG11  VAL  14          1HG1      VAL  14   6.418   2.343   3.790
   61   HG12  VAL  14          2HG1      VAL  14   4.894   1.729   3.119
   62   HG13  VAL  14          3HG1      VAL  14   6.245   2.066   2.038
   63   HG21  VAL  14          3HG2      VAL  14   3.515   3.476   4.040
   64   HG22  VAL  14          1HG2      VAL  14   4.908   4.134   4.915
   65   HG23  VAL  14          2HG2      VAL  14   3.935   5.182   3.863
   66    H    GLY  15           H        GLY  15   5.952   6.810   4.089
   67    HA2  GLY  15           2HA      GLY  15   8.323   6.583   5.822
   68    HA3  GLY  15           3HA      GLY  15   7.054   7.828   5.877
   69    H    GLY  16           H        GLY  16   8.347   5.355   7.495
   70    HA2  GLY  16           2HA      GLY  16   7.870   4.736   9.636
   71    HA3  GLY  16           3HA      GLY  16   6.178   5.253   9.453
   72    H    MET  17           H        MET  17   6.358   3.262   6.874
   73    HA   MET  17           HA       MET  17   5.003   1.166   8.307
   74    HB3  MET  17           2HB      MET  17   6.031   0.888   5.488
   75    HG3  MET  17           2HG      MET  17   3.283   0.257   6.607
   76    HE1  MET  17           3HE      MET  17   6.240  -0.859   4.070
   77    HE2  MET  17           1HE      MET  17   5.745  -2.228   5.095
   78    HE3  MET  17           2HE      MET  17   5.405  -2.243   3.356
   79    H    ARG  18           H        ARG  18   8.415   1.516   7.547
   80    HA   ARG  18           HA       ARG  18   9.210  -1.196   7.594
   81    HB3  ARG  18           2HB      ARG  18  10.712   0.632   7.003
   82    HG3  ARG  18           2HG      ARG  18  10.998   1.241   9.968
   83    HD3  ARG  18           2HD      ARG  18  12.067   2.509   7.408
   84    HE   ARG  18           HE       ARG  18  11.535   3.789   9.834
   85   HH11  ARG  18          1HH1      ARG  18  14.411   3.330   7.803
   86   HH12  ARG  18          2HH1      ARG  18  15.038   4.902   8.238
   87   HH21  ARG  18          1HH2      ARG  18  12.423   5.668  10.402
   88   HH22  ARG  18          2HH2      ARG  18  13.954   6.200   9.750
   89    H    CYS  19           H        CYS  19   9.831  -2.549   9.068
   90    HA   CYS  19           HA       CYS  19  10.107  -3.691  11.048
   91    HB3  CYS  19           2HB      CYS  19   9.250  -2.941  13.229
   92    HG   CYS  19           HG       CYS  19  10.731  -0.790  13.719
   93    H    ALA  20           H        ALA  20   8.920  -5.460  11.625
   94    HA   ALA  20           HA       ALA  20   6.773  -6.112   9.959
   95    HB1  ALA  20           1HB      ALA  20   6.650  -8.176  11.336
   96    HB2  ALA  20           2HB      ALA  20   8.323  -7.731  10.956
   97    HB3  ALA  20           3HB      ALA  20   7.662  -7.402  12.574
   98    H    ALA  21           H        ALA  21   6.512  -5.017  13.376
   99    HA   ALA  21           HA       ALA  21   3.685  -5.346  13.619
  100    HB1  ALA  21           1HB      ALA  21   3.910  -3.743  15.479
  101    HB2  ALA  21           2HB      ALA  21   5.203  -4.947  15.530
  102    HB3  ALA  21           3HB      ALA  21   5.536  -3.306  14.931
  103    H    CYS  22           H        CYS  22   5.554  -2.753  12.032
  104    HA   CYS  22           HA       CYS  22   3.190  -1.032  11.785
  105    HB3  CYS  22           2HB      CYS  22   4.832   0.390  10.456
  106    HG   CYS  22           HG       CYS  22   6.100  -0.607  13.389
  107    H    ALA  23           H        ALA  23   5.197  -2.917   9.462
  108    HA   ALA  23           HA       ALA  23   3.526  -2.674   7.211
  109    HB1  ALA  23           1HB      ALA  23   5.777  -3.711   7.308
  110    HB2  ALA  23           2HB      ALA  23   5.095  -5.094   8.202
  111    HB3  ALA  23           3HB      ALA  23   4.583  -4.765   6.533
  112    H    SER  24           H        SER  24   2.927  -4.489  10.177
  113    HA   SER  24           HA       SER  24   1.012  -6.358   9.089
  114    HB3  SER  24           2HB      SER  24   0.252  -6.597  11.475
  115    HG   SER  24           HG       SER  24   3.081  -6.718  11.085
  116    H    SER  25           H        SER  25   0.498  -3.017  10.330
  117    HA   SER  25           HA       SER  25  -2.368  -3.226  10.399
  118    HB3  SER  25           2HB      SER  25  -2.332  -0.832  10.629
  119    HG   SER  25           HG       SER  25  -0.729  -0.580  12.238
  120    H    ILE  26           H        ILE  26  -0.150  -1.968   7.870
  121    HA   ILE  26           HA       ILE  26  -2.179  -1.288   5.927
  122    HB   ILE  26           HB       ILE  26   0.795  -1.903   5.811
  123   HG13  ILE  26          2HG1      ILE  26  -0.840   0.503   4.864
  124   HG21  ILE  26          1HG2      ILE  26  -0.023  -2.968   3.744
  125   HG22  ILE  26          2HG2      ILE  26  -0.924  -1.485   3.329
  126   HG23  ILE  26          3HG2      ILE  26   0.849  -1.492   3.387
  127   HD11  ILE  26          3HD1      ILE  26   0.999   0.239   7.281
  128   HD12  ILE  26          1HD1      ILE  26   0.416   1.768   6.586
  129   HD13  ILE  26          2HD1      ILE  26  -0.743   0.627   7.296
  130    H    GLU  27           H        GLU  27  -0.376  -4.290   6.526
  131    HA   GLU  27           HA       GLU  27  -1.518  -5.776   4.388
  132    HB3  GLU  27           2HB      GLU  27  -0.344  -6.841   6.997
  133    HG3  GLU  27           2HG      GLU  27   0.831  -8.410   5.423
  134    H    ARG  28           H        ARG  28  -2.533  -5.445   7.833
  135    HA   ARG  28           HA       ARG  28  -4.456  -7.525   7.856
  136    HB3  ARG  28           2HB      ARG  28  -4.222  -4.977   9.506
  137    HG3  ARG  28           2HG      ARG  28  -5.684  -7.598  10.112
  138    HD3  ARG  28           2HD      ARG  28  -6.314  -6.591  12.230
  139    HE   ARG  28           HE       ARG  28  -4.235  -7.748  12.444
  140   HH11  ARG  28          1HH1      ARG  28  -3.785  -4.180  12.296
  141   HH12  ARG  28          2HH1      ARG  28  -2.161  -4.350  12.939
  142   HH21  ARG  28          1HH2      ARG  28  -2.158  -7.748  13.292
  143   HH22  ARG  28          2HH2      ARG  28  -1.323  -6.206  13.509
  144    H    ALA  29           H        ALA  29  -4.835  -4.113   6.880
  145    HA   ALA  29           HA       ALA  29  -7.727  -4.422   6.468
  146    HB1  ALA  29           1HB      ALA  29  -7.523  -2.128   5.507
  147    HB2  ALA  29           2HB      ALA  29  -6.917  -2.283   7.172
  148    HB3  ALA  29           3HB      ALA  29  -5.765  -2.201   5.826
  149    H    LEU  30           H        LEU  30  -4.943  -5.113   4.448
  150    HA   LEU  30           HA       LEU  30  -5.825  -4.563   1.855
  151    HB3  LEU  30           2HB      LEU  30  -4.370  -7.038   2.932
  152    HG   LEU  30           HG       LEU  30  -3.094  -7.112   0.895
  153   HD11  LEU  30          1HD1      LEU  30  -4.425  -8.461  -0.431
  154   HD12  LEU  30          2HD1      LEU  30  -5.926  -7.692   0.068
  155   HD13  LEU  30          3HD1      LEU  30  -5.005  -8.692   1.224
  156   HD21  LEU  30          3HD2      LEU  30  -3.513  -4.835   0.054
  157   HD22  LEU  30          1HD2      LEU  30  -5.185  -5.292  -0.340
  158   HD23  LEU  30          2HD2      LEU  30  -3.820  -6.070  -1.173
  159    H    GLU  31           H        GLU  31  -6.619  -7.441   3.813
  160    HA   GLU  31           HA       GLU  31  -7.782  -8.843   1.672
  161    HB3  GLU  31           2HB      GLU  31  -6.950 -10.106   3.522
  162    HG3  GLU  31           2HG      GLU  31  -8.676  -8.331   5.273
  163    H    ARG  32           H        ARG  32  -9.082  -6.391   3.780
  164    HA   ARG  32           HA       ARG  32 -11.847  -7.135   3.141
  165    HB3  ARG  32           2HB      ARG  32 -11.489  -6.999   5.470
  166    HG3  ARG  32           2HG      ARG  32 -10.685  -4.081   5.082
  167    HD3  ARG  32           2HD      ARG  32 -11.221  -5.716   7.605
  168    HE   ARG  32           HE       ARG  32 -10.668  -2.777   7.531
  169   HH11  ARG  32          1HH1      ARG  32  -9.581  -5.918   8.847
  170   HH12  ARG  32          2HH1      ARG  32  -8.793  -5.085  10.181
  171   HH21  ARG  32          1HH2      ARG  32  -9.524  -1.910   9.076
  172   HH22  ARG  32          2HH2      ARG  32  -8.612  -2.886  10.225
  173    H    LEU  33           H        LEU  33  -9.507  -4.842   2.093
  174    HA   LEU  33           HA       LEU  33 -11.300  -2.948   0.826
  175    HB3  LEU  33           2HB      LEU  33  -9.551  -2.679  -0.825
  176    HG   LEU  33           HG       LEU  33  -7.961  -3.233   1.694
  177   HD11  LEU  33          1HD1      LEU  33  -7.565  -1.646  -0.862
  178   HD12  LEU  33          2HD1      LEU  33  -6.508  -2.873  -0.125
  179   HD13  LEU  33          3HD1      LEU  33  -6.691  -1.258   0.597
  180   HD21  LEU  33          3HD2      LEU  33  -9.389  -0.655   0.941
  181   HD22  LEU  33          1HD2      LEU  33  -8.230  -0.863   2.269
  182   HD23  LEU  33          2HD2      LEU  33  -9.790  -1.703   2.328
  183    H    LYS  34           H        LYS  34 -11.766  -2.880  -1.461
  184    HA   LYS  34           HA       LYS  34 -11.982  -5.502  -2.888
  185    HB3  LYS  34           2HB      LYS  34 -13.852  -4.309  -4.203
  186    HG3  LYS  34           2HG      LYS  34 -14.302  -5.056  -1.280
  187    HD3  LYS  34           2HD      LYS  34 -16.243  -3.862  -2.298
  188    HE3  LYS  34           2HE      LYS  34 -15.988  -4.727  -4.669
  189    HZ1  LYS  34           3HZ      LYS  34 -17.162  -7.187  -3.466
  190    HZ2  LYS  34           1HZ      LYS  34 -15.729  -7.110  -4.249
  191    HZ3  LYS  34           2HZ      LYS  34 -17.106  -6.872  -5.085
  192    H    GLY  35           H        GLY  35 -11.725  -5.286  -5.230
  193    HA2  GLY  35           2HA      GLY  35 -10.950  -4.394  -7.210
  194    HA3  GLY  35           3HA      GLY  35 -10.479  -2.896  -6.373
  195    H    VAL  36           H        VAL  36  -8.983  -5.267  -4.652
  196    HA   VAL  36           HA       VAL  36  -6.425  -4.923  -6.167
  197    HB   VAL  36           HB       VAL  36  -6.191  -3.669  -4.241
  198   HG11  VAL  36          1HG1      VAL  36  -6.592  -4.372  -1.940
  199   HG12  VAL  36          2HG1      VAL  36  -8.083  -4.401  -2.867
  200   HG13  VAL  36          3HG1      VAL  36  -7.231  -5.927  -2.498
  201   HG21  VAL  36          3HG2      VAL  36  -4.926  -6.311  -3.419
  202   HG22  VAL  36          1HG2      VAL  36  -4.257  -5.209  -4.654
  203   HG23  VAL  36          2HG2      VAL  36  -4.411  -4.671  -2.982
  204    H    ALA  37           H        ALA  37  -5.183  -6.614  -6.611
  205    HA   ALA  37           HA       ALA  37  -6.356  -9.333  -6.123
  206    HB1  ALA  37           1HB      ALA  37  -5.884  -9.702  -8.545
  207    HB2  ALA  37           2HB      ALA  37  -7.007  -8.364  -8.266
  208    HB3  ALA  37           3HB      ALA  37  -5.312  -8.020  -8.662
  209    H    GLU  38           H        GLU  38  -3.427  -7.624  -5.732
  210    HA   GLU  38           HA       GLU  38  -2.106  -9.959  -4.787
  211    HB3  GLU  38           2HB      GLU  38  -0.265  -8.969  -6.855
  212    HG3  GLU  38           2HG      GLU  38  -0.381 -11.436  -7.544
  213    H    ALA  39           H        ALA  39  -0.384  -9.357  -3.386
  214    HA   ALA  39           HA       ALA  39   0.729  -6.701  -3.323
  215    HB1  ALA  39           1HB      ALA  39  -1.561  -6.121  -2.574
  216    HB2  ALA  39           2HB      ALA  39  -1.430  -7.313  -1.259
  217    HB3  ALA  39           3HB      ALA  39  -0.372  -5.887  -1.286
  218    H    SER  40           H        SER  40   2.345  -6.404  -1.791
  219    HA   SER  40           HA       SER  40   2.956  -8.436   0.246
  220    HB3  SER  40           2HB      SER  40   5.258  -8.783  -0.630
  221    HG   SER  40           HG       SER  40   3.473  -9.635  -2.637
  222    H    VAL  41           H        VAL  41   4.556  -7.730   1.753
  223    HA   VAL  41           HA       VAL  41   5.320  -4.824   1.614
  224    HB   VAL  41           HB       VAL  41   5.352  -4.897   4.147
  225   HG11  VAL  41          1HG1      VAL  41   3.578  -3.777   2.877
  226   HG12  VAL  41          2HG1      VAL  41   2.649  -5.290   2.790
  227   HG13  VAL  41          3HG1      VAL  41   2.939  -4.504   4.356
  228   HG21  VAL  41          3HG2      VAL  41   3.679  -7.431   3.813
  229   HG22  VAL  41          1HG2      VAL  41   5.299  -7.346   4.543
  230   HG23  VAL  41          2HG2      VAL  41   3.929  -6.539   5.308
  231    H    THR  42           H        THR  42   7.404  -4.317   1.770
  232    HA   THR  42           HA       THR  42   9.412  -6.486   2.265
  233    HB   THR  42           HB       THR  42   9.700  -3.904   0.700
  234    HG1  THR  42           1HG      THR  42   9.523  -6.628  -0.108
  235   HG21  THR  42          3HG2      THR  42  11.779  -5.075  -0.136
  236   HG22  THR  42          1HG2      THR  42  11.555  -6.301   1.126
  237   HG23  THR  42          2HG2      THR  42  11.873  -4.608   1.565
  238    H    VAL  43           H        VAL  43   9.556  -6.387   4.427
  239    HA   VAL  43           HA       VAL  43   9.290  -4.032   6.000
  240    HB   VAL  43           HB       VAL  43  10.251  -6.836   6.668
  241   HG11  VAL  43          1HG1      VAL  43  11.149  -5.426   8.459
  242   HG12  VAL  43          2HG1      VAL  43   9.588  -4.584   8.609
  243   HG13  VAL  43          3HG1      VAL  43   9.738  -6.295   9.060
  244   HG21  VAL  43          3HG2      VAL  43   7.981  -7.060   7.634
  245   HG22  VAL  43          1HG2      VAL  43   7.612  -5.387   7.172
  246   HG23  VAL  43          2HG2      VAL  43   7.880  -6.619   5.925
  247    H    ALA  44           H        ALA  44  12.235  -5.623   4.795
  248    HA   ALA  44           HA       ALA  44  14.212  -4.787   6.467
  249    HB1  ALA  44           1HB      ALA  44  14.281  -4.896   3.416
  250    HB2  ALA  44           2HB      ALA  44  15.700  -4.951   4.480
  251    HB3  ALA  44           3HB      ALA  44  14.513  -6.264   4.527
  252    H    THR  45           H        THR  45  12.848  -2.726   3.925
  253    HA   THR  45           HA       THR  45  14.017  -0.288   5.223
  254    HB   THR  45           HB       THR  45  13.931   0.720   2.902
  255    HG1  THR  45           1HG      THR  45  14.036  -0.959   1.245
  256   HG21  THR  45          3HG2      THR  45  16.014  -0.302   2.138
  257   HG22  THR  45          1HG2      THR  45  15.782  -1.685   3.225
  258   HG23  THR  45          2HG2      THR  45  16.056  -0.054   3.886
  259    H    GLY  46           H        GLY  46  11.146  -1.947   4.458
  260    HA2  GLY  46           2HA      GLY  46   8.963  -1.332   4.906
  261    HA3  GLY  46           3HA      GLY  46   9.486   0.341   5.248
  262    H    ARG  47           H        ARG  47   9.799  -1.719   2.324
  263    HA   ARG  47           HA       ARG  47   8.383   0.414   0.746
  264    HB3  ARG  47           2HB      ARG  47   9.322  -0.759  -1.253
  265    HG3  ARG  47           2HG      ARG  47  11.527   0.198   0.613
  266    HD3  ARG  47           2HD      ARG  47  11.093   0.304  -2.404
  267    HE   ARG  47           HE       ARG  47  13.126   1.618  -0.756
  268   HH11  ARG  47          1HH1      ARG  47  12.649   0.089  -3.895
  269   HH12  ARG  47          2HH1      ARG  47  13.904   1.030  -4.667
  270   HH21  ARG  47          1HH2      ARG  47  14.717   2.821  -1.788
  271   HH22  ARG  47          2HH2      ARG  47  14.976   2.656  -3.501
  272    H    LEU  48           H        LEU  48   7.101  -0.560  -1.122
  273    HA   LEU  48           HA       LEU  48   5.389  -2.848  -0.198
  274    HB3  LEU  48           2HB      LEU  48   3.715  -0.862  -1.353
  275    HG   LEU  48           HG       LEU  48   4.202  -1.472   1.582
  276   HD11  LEU  48          1HD1      LEU  48   2.149   0.266   0.168
  277   HD12  LEU  48          2HD1      LEU  48   3.374   0.809   1.331
  278   HD13  LEU  48          3HD1      LEU  48   2.035  -0.216   1.877
  279   HD21  LEU  48          3HD2      LEU  48   2.009  -2.286  -0.398
  280   HD22  LEU  48          1HD2      LEU  48   1.959  -2.595   1.352
  281   HD23  LEU  48          2HD2      LEU  48   3.203  -3.355   0.360
  282    H    THR  49           H        THR  49   4.132  -3.829  -1.731
  283    HA   THR  49           HA       THR  49   4.439  -3.257  -4.678
  284    HB   THR  49           HB       THR  49   4.483  -6.060  -3.499
  285    HG1  THR  49           1HG      THR  49   6.695  -6.084  -3.860
  286   HG21  THR  49          3HG2      THR  49   5.438  -4.939  -6.178
  287   HG22  THR  49          1HG2      THR  49   3.855  -5.700  -5.915
  288   HG23  THR  49          2HG2      THR  49   5.331  -6.650  -5.708
  289    H    VAL  50           H        VAL  50   2.492  -3.288  -5.642
  290    HA   VAL  50           HA       VAL  50   0.199  -4.709  -4.458
  291    HB   VAL  50           HB       VAL  50   0.384  -2.614  -3.116
  292   HG11  VAL  50          1HG1      VAL  50  -0.337  -1.120  -5.668
  293   HG12  VAL  50          2HG1      VAL  50  -0.176  -0.447  -4.037
  294   HG13  VAL  50          3HG1      VAL  50   1.253  -1.080  -4.864
  295   HG21  VAL  50          3HG2      VAL  50  -1.964  -1.961  -3.246
  296   HG22  VAL  50          1HG2      VAL  50  -2.136  -2.772  -4.812
  297   HG23  VAL  50          2HG2      VAL  50  -1.786  -3.723  -3.355
  298    H    THR  51           H        THR  51  -1.408  -5.155  -5.870
  299    HA   THR  51           HA       THR  51  -1.291  -4.108  -8.675
  300    HB   THR  51           HB       THR  51  -1.690  -6.991  -7.753
  301    HG1  THR  51           1HG      THR  51   0.343  -7.162  -9.024
  302   HG21  THR  51          3HG2      THR  51  -2.887  -6.412  -9.874
  303   HG22  THR  51          1HG2      THR  51  -1.574  -7.566 -10.124
  304   HG23  THR  51          2HG2      THR  51  -1.356  -5.862 -10.572
  305    H    TYR  52           H        TYR  52  -3.173  -3.153  -9.135
  306    HA   TYR  52           HA       TYR  52  -5.755  -4.296  -8.226
  307    HB3  TYR  52           2HB      TYR  52  -5.112  -2.706  -6.488
  308    HD1  TYR  52           2HD      TYR  52  -6.250  -0.264  -9.108
  309    HD2  TYR  52           1HD      TYR  52  -3.111  -1.396  -6.382
  310    HE1  TYR  52           2HE      TYR  52  -5.116   1.902  -9.525
  311    HE2  TYR  52           1HE      TYR  52  -1.999   0.792  -6.756
  312    HH   TYR  52           HH       TYR  52  -3.399   3.317  -8.902
  313    H    ASP  53           H        ASP  53  -7.657  -3.255  -9.299
  314    HA   ASP  53           HA       ASP  53  -7.101  -2.725 -12.143
  315    HB3  ASP  53           2HB      ASP  53  -9.603  -3.423 -10.626
  316    HA   PRO  54           HA       PRO  54  -7.579   1.713 -11.405
  317    HB3  PRO  54           2HB      PRO  54  -6.796   2.751 -13.373
  318    HG3  PRO  54           2HG      PRO  54  -5.175   1.100 -12.759
  319    HD3  PRO  54           2HD      PRO  54  -5.765  -1.151 -12.599
  320    H    LYS  55           H        LYS  55 -10.076  -0.302 -12.311
  321    HA   LYS  55           HA       LYS  55 -11.970   1.989 -12.766
  322    HB3  LYS  55           2HB      LYS  55 -13.348   0.137 -14.019
  323    HG3  LYS  55           2HG      LYS  55 -10.971   1.442 -15.398
  324    HD3  LYS  55           2HD      LYS  55 -13.746   0.567 -16.344
  325    HE3  LYS  55           2HE      LYS  55 -11.552   2.154 -17.747
  326    HZ1  LYS  55           3HZ      LYS  55 -13.064   2.112 -19.613
  327    HZ2  LYS  55           1HZ      LYS  55 -14.110   1.110 -18.818
  328    HZ3  LYS  55           2HZ      LYS  55 -12.587   0.598 -19.238
  329    H    GLN  56           H        GLN  56 -11.450  -1.160 -11.191
  330    HA   GLN  56           HA       GLN  56 -13.792  -0.799  -9.458
  331    HB3  GLN  56           2HB      GLN  56 -12.484  -2.188  -7.839
  332    HG3  GLN  56           2HG      GLN  56 -12.360  -4.280  -9.066
  333   HE21  GLN  56          1HE2      GLN  56 -14.297  -3.963 -11.576
  334   HE22  GLN  56          2HE2      GLN  56 -15.856  -3.847 -10.755
  335    H    VAL  57           H        VAL  57 -10.364   0.357  -9.391
  336    HA   VAL  57           HA       VAL  57 -10.987   2.286  -7.233
  337    HB   VAL  57           HB       VAL  57  -9.322   1.283  -5.717
  338   HG11  VAL  57          1HG1      VAL  57 -11.540  -0.715  -6.239
  339   HG12  VAL  57          2HG1      VAL  57 -10.676  -0.415  -4.742
  340   HG13  VAL  57          3HG1      VAL  57 -11.735   0.832  -5.380
  341   HG21  VAL  57          3HG2      VAL  57  -8.012  -0.075  -7.330
  342   HG22  VAL  57          1HG2      VAL  57  -8.614  -1.088  -6.008
  343   HG23  VAL  57          2HG2      VAL  57  -9.402  -1.143  -7.588
  344    H    SER  58           H        SER  58  -8.342   2.808  -6.341
  345    HA   SER  58           HA       SER  58  -6.587   3.343  -8.586
  346    HB3  SER  58           2HB      SER  58  -8.061   5.704  -7.374
  347    HG   SER  58           HG       SER  58  -6.937   6.875  -8.891
  348    H    GLU  59           H        GLU  59  -5.379   5.647  -7.215
  349    HA   GLU  59           HA       GLU  59  -3.601   4.529  -5.354
  350    HB3  GLU  59           2HB      GLU  59  -2.777   6.477  -5.973
  351    HG3  GLU  59           2HG      GLU  59  -4.597   7.372  -7.344
  352    H    ILE  60           H        ILE  60  -6.818   5.856  -4.675
  353    HA   ILE  60           HA       ILE  60  -6.923   5.877  -1.883
  354    HB   ILE  60           HB       ILE  60  -8.952   5.014  -3.944
  355   HG13  ILE  60          2HG1      ILE  60  -9.962   7.144  -3.557
  356   HG21  ILE  60          1HG2      ILE  60 -10.702   5.215  -2.167
  357   HG22  ILE  60          2HG2      ILE  60  -9.646   3.815  -1.978
  358   HG23  ILE  60          3HG2      ILE  60  -9.406   5.231  -0.950
  359   HD11  ILE  60          3HD1      ILE  60  -9.635   7.522  -1.130
  360   HD12  ILE  60          1HD1      ILE  60  -7.893   7.739  -1.407
  361   HD13  ILE  60          2HD1      ILE  60  -9.056   8.885  -2.090
  362    H    THR  61           H        THR  61  -6.754   2.975  -3.850
  363    HA   THR  61           HA       THR  61  -7.323   0.901  -2.031
  364    HB   THR  61           HB       THR  61  -5.157   1.078  -4.183
  365    HG1  THR  61           1HG      THR  61  -6.802   1.429  -5.280
  366   HG21  THR  61          3HG2      THR  61  -4.833  -1.048  -3.045
  367   HG22  THR  61          1HG2      THR  61  -5.664  -1.356  -4.569
  368   HG23  THR  61          2HG2      THR  61  -6.582  -1.375  -3.049
  369    H    ILE  62           H        ILE  62  -4.583   2.993  -2.092
  370    HA   ILE  62           HA       ILE  62  -3.674   1.625   0.407
  371    HB   ILE  62           HB       ILE  62  -2.536   0.744  -1.732
  372   HG13  ILE  62          2HG1      ILE  62  -1.949   0.354   0.729
  373   HG21  ILE  62          1HG2      ILE  62  -0.809   3.216  -1.377
  374   HG22  ILE  62          2HG2      ILE  62  -0.576   1.882  -2.530
  375   HG23  ILE  62          3HG2      ILE  62  -1.969   2.956  -2.699
  376   HD11  ILE  62          3HD1      ILE  62  -1.077  -1.021  -1.170
  377   HD12  ILE  62          1HD1      ILE  62   0.309   0.080  -1.287
  378   HD13  ILE  62          2HD1      ILE  62   0.039  -0.872   0.193
  379    H    GLN  63           H        GLN  63  -4.003   4.607  -1.250
  380    HA   GLN  63           HA       GLN  63  -2.619   6.373   0.432
  381    HB3  GLN  63           2HB      GLN  63  -5.470   6.698  -0.618
  382    HG3  GLN  63           2HG      GLN  63  -4.454   9.048  -1.134
  383   HE21  GLN  63          1HE2      GLN  63  -6.772   9.272  -0.614
  384   HE22  GLN  63          2HE2      GLN  63  -7.297   9.432   1.045
  385    H    GLU  64           H        GLU  64  -6.000   5.130   1.005
  386    HA   GLU  64           HA       GLU  64  -6.126   6.490   3.519
  387    HB3  GLU  64           2HB      GLU  64  -8.242   5.491   3.842
  388    HG3  GLU  64           2HG      GLU  64  -8.005   5.565   0.811
  389    H    ARG  65           H        ARG  65  -5.276   3.100   2.705
  390    HA   ARG  65           HA       ARG  65  -5.069   2.206   5.428
  391    HB3  ARG  65           2HB      ARG  65  -3.401   0.511   4.329
  392    HG3  ARG  65           2HG      ARG  65  -6.249   0.610   3.271
  393    HD3  ARG  65           2HD      ARG  65  -6.031  -1.840   3.321
  394    HE   ARG  65           HE       ARG  65  -5.095  -0.556   1.280
  395   HH11  ARG  65          1HH1      ARG  65  -3.088  -2.949   3.060
  396   HH12  ARG  65          2HH1      ARG  65  -2.240  -3.338   1.577
  397   HH21  ARG  65          1HH2      ARG  65  -4.033  -1.274  -0.485
  398   HH22  ARG  65          2HH2      ARG  65  -2.757  -2.496  -0.320
  399    H    ILE  66           H        ILE  66  -2.778   4.022   3.432
  400    HA   ILE  66           HA       ILE  66  -0.664   3.663   5.509
  401    HB   ILE  66           HB       ILE  66  -0.788   5.178   2.872
  402   HG13  ILE  66          2HG1      ILE  66  -0.634   2.591   2.907
  403   HG21  ILE  66          1HG2      ILE  66   1.589   4.811   4.734
  404   HG22  ILE  66          2HG2      ILE  66   1.606   5.656   3.203
  405   HG23  ILE  66          3HG2      ILE  66   0.693   6.347   4.536
  406   HD11  ILE  66          3HD1      ILE  66   1.819   3.965   1.751
  407   HD12  ILE  66          1HD1      ILE  66   1.192   2.374   1.340
  408   HD13  ILE  66          2HD1      ILE  66   0.219   3.802   0.955
  409    H    ALA  67           H        ALA  67  -2.726   6.332   4.268
  410    HA   ALA  67           HA       ALA  67  -1.657   8.287   6.045
  411    HB1  ALA  67           1HB      ALA  67  -4.328   8.166   4.563
  412    HB2  ALA  67           2HB      ALA  67  -3.601   9.621   5.270
  413    HB3  ALA  67           3HB      ALA  67  -2.797   8.797   3.922
  414    H    ALA  68           H        ALA  68  -4.693   6.298   6.357
  415    HA   ALA  68           HA       ALA  68  -5.362   7.670   8.841
  416    HB1  ALA  68           1HB      ALA  68  -7.038   6.860   7.158
  417    HB2  ALA  68           2HB      ALA  68  -6.638   5.189   7.634
  418    HB3  ALA  68           3HB      ALA  68  -7.343   6.306   8.815
  419    H    LEU  69           H        LEU  69  -3.662   4.623   8.121
  420    HA   LEU  69           HA       LEU  69  -4.043   3.676  10.873
  421    HB3  LEU  69           2HB      LEU  69  -2.877   1.683  10.170
  422    HG   LEU  69           HG       LEU  69  -4.668   2.485   7.838
  423   HD11  LEU  69          1HD1      LEU  69  -5.054   0.088   7.620
  424   HD12  LEU  69          2HD1      LEU  69  -4.076  -0.245   9.063
  425   HD13  LEU  69          3HD1      LEU  69  -3.308   0.380   7.592
  426   HD21  LEU  69          3HD2      LEU  69  -5.957   2.885   9.876
  427   HD22  LEU  69          1HD2      LEU  69  -5.459   1.305  10.523
  428   HD23  LEU  69          2HD2      LEU  69  -6.522   1.402   9.103
  429    H    GLY  70           H        GLY  70  -1.813   5.839   9.603
  430    HA2  GLY  70           2HA      GLY  70  -0.686   6.951  11.516
  431    HA3  GLY  70           3HA      GLY  70  -0.001   5.388  11.965
  432    H    TYR  71           H        TYR  71  -0.097   6.351   8.562
  433    HA   TYR  71           HA       TYR  71   2.873   6.787   8.553
  434    HB3  TYR  71           2HB      TYR  71   2.998   5.058   6.832
  435    HD1  TYR  71           2HD      TYR  71   4.169   4.351   8.991
  436    HD2  TYR  71           1HD      TYR  71   0.024   3.521   8.236
  437    HE1  TYR  71           2HE      TYR  71   4.183   2.631  10.804
  438    HE2  TYR  71           1HE      TYR  71   0.018   1.831  10.057
  439    HH   TYR  71           HH       TYR  71   1.201   0.966  11.824
  440    H    THR  72           H        THR  72   3.518   7.168   6.034
  441    HA   THR  72           HA       THR  72   1.534   8.813   4.553
  442    HB   THR  72           HB       THR  72   3.306  10.596   4.209
  443    HG1  THR  72           1HG      THR  72   4.350   9.701   6.691
  444   HG21  THR  72          3HG2      THR  72   1.315  10.980   5.647
  445   HG22  THR  72          1HG2      THR  72   2.750  11.882   6.164
  446   HG23  THR  72          2HG2      THR  72   2.251  10.435   7.055
  447    H    LEU  73           H        LEU  73   1.763   8.574   2.308
  448    HA   LEU  73           HA       LEU  73   3.717   6.512   1.529
  449    HB3  LEU  73           2HB      LEU  73   1.298   6.147   1.131
  450    HG   LEU  73           HG       LEU  73   1.541   8.269  -1.041
  451   HD11  LEU  73          1HD1      LEU  73  -0.496   6.028  -0.650
  452   HD12  LEU  73          2HD1      LEU  73   0.673   6.184  -1.980
  453   HD13  LEU  73          3HD1      LEU  73  -0.642   7.354  -1.825
  454   HD21  LEU  73          3HD2      LEU  73  -0.489   7.870   1.216
  455   HD22  LEU  73          1HD2      LEU  73  -0.660   9.036  -0.115
  456   HD23  LEU  73          2HD2      LEU  73   0.649   9.226   1.043
  457    H    ALA  74           H        ALA  74   4.819   6.379  -0.488
  458    HA   ALA  74           HA       ALA  74   5.009   8.821  -2.161
  459    HB1  ALA  74           1HB      ALA  74   6.910   8.952  -0.632
  460    HB2  ALA  74           2HB      ALA  74   7.380   7.287  -1.025
  461    HB3  ALA  74           3HB      ALA  74   7.475   8.553  -2.267
  462    H    GLU  75           H        GLU  75   3.814   7.934  -3.781
  463    HA   GLU  75           HA       GLU  75   5.147   5.792  -5.373
  464    HB3  GLU  75           2HB      GLU  75   2.116   6.044  -5.275
  465    HG3  GLU  75           2HG      GLU  75   2.390   3.570  -5.866
  466    HA   PRO  76           HA       PRO  76   4.778   9.977  -7.350
  467    HB3  PRO  76           2HB      PRO  76   6.907  10.564  -6.758
  468    HG3  PRO  76           2HG      PRO  76   8.589   8.902  -6.418
  469    HD3  PRO  76           2HD      PRO  76   6.714   8.344  -5.085
  Start of MODEL    3
    1    H2   PRO   6           2H       PRO   6  -6.885  -2.798 -17.017
    2    HA   PRO   6           HA       PRO   6  -8.004  -5.278 -15.932
    3    HB3  PRO   6           2HB      PRO   6  -6.608  -6.490 -17.390
    4    HG3  PRO   6           2HG      PRO   6  -7.929  -5.704 -19.165
    5    HD3  PRO   6           2HD      PRO   6  -9.261  -4.308 -17.897
    6    H    LEU   7           H        LEU   7  -6.406  -6.415 -14.506
    7    HA   LEU   7           HA       LEU   7  -5.286  -4.528 -12.667
    8    HB3  LEU   7           2HB      LEU   7  -6.481  -6.514 -11.968
    9    HG   LEU   7           HG       LEU   7  -5.130  -8.069 -13.751
   10   HD11  LEU   7          1HD1      LEU   7  -3.705  -8.623 -11.106
   11   HD12  LEU   7          2HD1      LEU   7  -2.930  -7.812 -12.478
   12   HD13  LEU   7          3HD1      LEU   7  -3.492  -9.483 -12.639
   13   HD21  LEU   7          3HD2      LEU   7  -7.127  -8.702 -12.477
   14   HD22  LEU   7          1HD2      LEU   7  -6.135  -8.927 -11.019
   15   HD23  LEU   7          2HD2      LEU   7  -5.923 -10.003 -12.425
   16    H    LYS   8           H        LYS   8  -3.335  -4.063 -12.133
   17    HA   LYS   8           HA       LYS   8  -0.957  -5.054 -13.586
   18    HB3  LYS   8           2HB      LYS   8  -1.959  -3.360 -15.086
   19    HG3  LYS   8           2HG      LYS   8  -1.551  -1.453 -12.753
   20    HD3  LYS   8           2HD      LYS   8  -2.481  -0.909 -15.597
   21    HE3  LYS   8           2HE      LYS   8  -3.766   0.384 -13.929
   22    HZ1  LYS   8           3HZ      LYS   8  -2.594   2.026 -12.593
   23    HZ2  LYS   8           1HZ      LYS   8  -1.131   1.420 -13.038
   24    HZ3  LYS   8           2HZ      LYS   8  -2.183   0.514 -12.142
   25    H    THR   9           H        THR   9   1.021  -4.298 -12.683
   26    HA   THR   9           HA       THR   9   0.764  -4.008  -9.733
   27    HB   THR   9           HB       THR   9   2.968  -5.148 -11.490
   28    HG1  THR   9           1HG      THR   9   1.067  -6.375  -9.768
   29   HG21  THR   9          3HG2      THR   9   3.942  -4.481  -9.335
   30   HG22  THR   9          1HG2      THR   9   3.745  -6.226  -9.387
   31   HG23  THR   9          2HG2      THR   9   2.589  -5.243  -8.459
   32    H    GLN  10           H        GLN  10   2.223  -2.752  -8.491
   33    HA   GLN  10           HA       GLN  10   4.077  -0.911  -9.705
   34    HB3  GLN  10           2HB      GLN  10   2.211   0.420 -10.243
   35    HG3  GLN  10           2HG      GLN  10   1.219   0.180  -7.369
   36   HE21  GLN  10          1HE2      GLN  10   0.159   1.162 -10.728
   37   HE22  GLN  10          2HE2      GLN  10  -0.649   2.615 -10.125
   38    H    GLN  11           H        GLN  11   5.432   0.053  -8.219
   39    HA   GLN  11           HA       GLN  11   5.212  -0.873  -5.407
   40    HB3  GLN  11           2HB      GLN  11   7.698  -0.311  -7.077
   41    HG3  GLN  11           2HG      GLN  11   7.478  -1.783  -4.413
   42   HE21  GLN  11          1HE2      GLN  11   9.981   0.402  -5.806
   43   HE22  GLN  11          2HE2      GLN  11  11.251  -0.829  -5.746
   44    H    MET  12           H        MET  12   5.547   0.583  -3.760
   45    HA   MET  12           HA       MET  12   6.209   3.411  -4.388
   46    HB3  MET  12           2HB      MET  12   3.853   3.514  -4.249
   47    HG3  MET  12           2HG      MET  12   2.705   2.814  -2.032
   48    HE1  MET  12           3HE      MET  12   0.883   1.454  -5.184
   49    HE2  MET  12           1HE      MET  12   1.135   2.830  -4.102
   50    HE3  MET  12           2HE      MET  12   2.299   2.475  -5.400
   51    H    GLN  13           H        GLN  13   6.902   4.638  -2.597
   52    HA   GLN  13           HA       GLN  13   8.458   3.053  -0.627
   53    HB3  GLN  13           2HB      GLN  13   8.601   5.946  -1.611
   54    HG3  GLN  13           2HG      GLN  13  10.555   4.508   0.232
   55   HE21  GLN  13          1HE2      GLN  13  11.826   6.476   1.395
   56   HE22  GLN  13          2HE2      GLN  13  12.610   7.545   0.229
   57    H    VAL  14           H        VAL  14   7.829   3.079   1.547
   58    HA   VAL  14           HA       VAL  14   5.641   4.964   2.328
   59    HB   VAL  14           HB       VAL  14   4.480   3.014   2.222
   60   HG11  VAL  14          1HG1      VAL  14   6.288   1.427   1.709
   61   HG12  VAL  14          2HG1      VAL  14   6.709   1.377   3.443
   62   HG13  VAL  14          3HG1      VAL  14   5.128   0.803   2.854
   63   HG21  VAL  14          3HG2      VAL  14   3.933   2.253   4.445
   64   HG22  VAL  14          1HG2      VAL  14   5.450   2.903   5.094
   65   HG23  VAL  14          2HG2      VAL  14   4.202   3.995   4.466
   66    H    GLY  15           H        GLY  15   5.945   6.145   4.001
   67    HA2  GLY  15           2HA      GLY  15   8.538   6.082   5.424
   68    HA3  GLY  15           3HA      GLY  15   7.295   7.351   5.473
   69    H    GLY  16           H        GLY  16   8.670   4.810   7.113
   70    HA2  GLY  16           2HA      GLY  16   8.555   4.596   9.399
   71    HA3  GLY  16           3HA      GLY  16   6.972   5.400   9.427
   72    H    MET  17           H        MET  17   6.380   2.893   7.256
   73    HA   MET  17           HA       MET  17   5.056   1.413   9.350
   74    HB3  MET  17           2HB      MET  17   4.294   1.562   6.923
   75    HG3  MET  17           2HG      MET  17   6.314  -0.722   6.672
   76    HE1  MET  17           3HE      MET  17   6.431  -2.415   4.772
   77    HE2  MET  17           1HE      MET  17   5.491  -2.229   3.274
   78    HE3  MET  17           2HE      MET  17   6.656  -0.986   3.748
   79    H    ARG  18           H        ARG  18   8.303   1.195   8.326
   80    HA   ARG  18           HA       ARG  18   8.824  -1.525   8.399
   81    HB3  ARG  18           2HB      ARG  18  10.271   0.100   7.343
   82    HG3  ARG  18           2HG      ARG  18  11.007   0.947  10.184
   83    HD3  ARG  18           2HD      ARG  18  12.281   1.725   7.528
   84    HE   ARG  18           HE       ARG  18  11.963   3.334   9.710
   85   HH11  ARG  18          1HH1      ARG  18  15.003   1.806   8.566
   86   HH12  ARG  18          2HH1      ARG  18  15.930   3.082   9.349
   87   HH21  ARG  18          1HH2      ARG  18  13.312   4.928  10.466
   88   HH22  ARG  18          2HH2      ARG  18  15.052   4.680  10.362
   89    H    CYS  19           H        CYS  19   7.518  -0.599  11.054
   90    HA   CYS  19           HA       CYS  19   9.343  -1.992  12.959
   91    HB3  CYS  19           2HB      CYS  19   6.629  -0.668  13.331
   92    HG   CYS  19           HG       CYS  19   7.072  -0.976  16.016
   93    H    ALA  20           H        ALA  20   9.009  -4.088  13.542
   94    HA   ALA  20           HA       ALA  20   8.033  -5.825  11.589
   95    HB1  ALA  20           1HB      ALA  20   9.896  -6.253  13.147
   96    HB2  ALA  20           2HB      ALA  20   8.748  -6.398  14.500
   97    HB3  ALA  20           3HB      ALA  20   8.728  -7.576  13.167
   98    H    ALA  21           H        ALA  21   5.961  -4.303  13.751
   99    HA   ALA  21           HA       ALA  21   3.839  -6.389  13.364
  100    HB1  ALA  21           1HB      ALA  21   4.129  -4.341  15.612
  101    HB2  ALA  21           2HB      ALA  21   2.842  -5.560  15.454
  102    HB3  ALA  21           3HB      ALA  21   4.513  -6.073  15.746
  103    H    CYS  22           H        CYS  22   4.825  -3.629  11.950
  104    HA   CYS  22           HA       CYS  22   2.178  -2.248  12.005
  105    HB3  CYS  22           2HB      CYS  22   3.544  -0.176  11.658
  106    HG   CYS  22           HG       CYS  22   2.676  -0.766  14.037
  107    H    ALA  23           H        ALA  23   4.863  -2.932   9.638
  108    HA   ALA  23           HA       ALA  23   3.411  -2.316   7.272
  109    HB1  ALA  23           1HB      ALA  23   5.302  -4.623   7.846
  110    HB2  ALA  23           2HB      ALA  23   4.887  -3.931   6.269
  111    HB3  ALA  23           3HB      ALA  23   5.787  -2.958   7.434
  112    H    SER  24           H        SER  24   3.192  -4.999   9.562
  113    HA   SER  24           HA       SER  24   1.400  -6.760   8.219
  114    HB3  SER  24           2HB      SER  24   0.861  -7.524  10.545
  115    HG   SER  24           HG       SER  24   2.660  -8.377   9.695
  116    H    SER  25           H        SER  25   0.657  -3.665   9.870
  117    HA   SER  25           HA       SER  25  -2.224  -4.136   9.975
  118    HB3  SER  25           2HB      SER  25  -2.379  -1.806  10.526
  119    HG   SER  25           HG       SER  25  -0.303  -1.747  12.019
  120    H    ILE  26           H        ILE  26   0.081  -2.790   7.669
  121    HA   ILE  26           HA       ILE  26  -1.901  -1.693   5.824
  122    HB   ILE  26           HB       ILE  26   1.013  -2.313   5.195
  123   HG13  ILE  26          2HG1      ILE  26   1.677  -0.076   5.940
  124   HG21  ILE  26          1HG2      ILE  26  -0.908  -0.161   4.225
  125   HG22  ILE  26          2HG2      ILE  26   0.784  -0.366   3.718
  126   HG23  ILE  26          3HG2      ILE  26  -0.416  -1.614   3.334
  127   HD11  ILE  26          3HD1      ILE  26   0.407   1.100   7.688
  128   HD12  ILE  26          1HD1      ILE  26  -0.456   1.128   6.145
  129   HD13  ILE  26          2HD1      ILE  26  -0.980   0.028   7.440
  130    H    GLU  27           H        GLU  27   0.099  -4.628   5.990
  131    HA   GLU  27           HA       GLU  27  -0.809  -5.692   3.478
  132    HB3  GLU  27           2HB      GLU  27   0.351  -7.338   5.770
  133    HG3  GLU  27           2HG      GLU  27   0.417  -7.462   2.726
  134    H    ARG  28           H        ARG  28  -1.801  -6.442   6.929
  135    HA   ARG  28           HA       ARG  28  -3.805  -8.324   6.212
  136    HB3  ARG  28           2HB      ARG  28  -3.587  -6.487   8.615
  137    HG3  ARG  28           2HG      ARG  28  -5.865  -7.408   8.623
  138    HD3  ARG  28           2HD      ARG  28  -4.452 -10.034   8.140
  139    HE   ARG  28           HE       ARG  28  -5.824  -9.886  10.383
  140   HH11  ARG  28          1HH1      ARG  28  -7.084 -11.432   7.382
  141   HH12  ARG  28          2HH1      ARG  28  -8.075 -12.480   8.342
  142   HH21  ARG  28          1HH2      ARG  28  -6.962 -11.414  11.433
  143   HH22  ARG  28          2HH2      ARG  28  -7.861 -12.607  10.557
  144    H    ALA  29           H        ALA  29  -4.034  -4.739   6.376
  145    HA   ALA  29           HA       ALA  29  -6.887  -4.642   6.170
  146    HB1  ALA  29           1HB      ALA  29  -5.724  -2.685   6.886
  147    HB2  ALA  29           2HB      ALA  29  -4.719  -2.649   5.427
  148    HB3  ALA  29           3HB      ALA  29  -6.471  -2.309   5.324
  149    H    LEU  30           H        LEU  30  -4.490  -5.217   3.609
  150    HA   LEU  30           HA       LEU  30  -5.821  -4.583   1.269
  151    HB3  LEU  30           2HB      LEU  30  -4.345  -7.158   2.031
  152    HG   LEU  30           HG       LEU  30  -3.557  -7.298  -0.274
  153   HD11  LEU  30          1HD1      LEU  30  -5.294  -8.872   0.576
  154   HD12  LEU  30          2HD1      LEU  30  -5.162  -8.688  -1.178
  155   HD13  LEU  30          3HD1      LEU  30  -6.494  -7.913  -0.330
  156   HD21  LEU  30          3HD2      LEU  30  -4.698  -6.289  -2.115
  157   HD22  LEU  30          1HD2      LEU  30  -4.301  -4.990  -0.972
  158   HD23  LEU  30          2HD2      LEU  30  -5.957  -5.616  -1.056
  159    H    GLU  31           H        GLU  31  -6.423  -7.614   3.146
  160    HA   GLU  31           HA       GLU  31  -8.273  -8.486   1.160
  161    HB3  GLU  31           2HB      GLU  31  -7.119 -10.191   2.407
  162    HG3  GLU  31           2HG      GLU  31  -8.092  -8.738   4.870
  163    H    ARG  32           H        ARG  32  -8.567  -6.270   3.725
  164    HA   ARG  32           HA       ARG  32 -11.441  -6.673   4.180
  165    HB3  ARG  32           2HB      ARG  32 -11.188  -5.104   6.015
  166    HG3  ARG  32           2HG      ARG  32  -9.601  -6.246   7.472
  167    HD3  ARG  32           2HD      ARG  32 -10.820  -8.280   5.548
  168    HE   ARG  32           HE       ARG  32  -9.840  -9.760   6.968
  169   HH11  ARG  32          1HH1      ARG  32 -10.939  -7.051   9.036
  170   HH12  ARG  32          2HH1      ARG  32 -10.736  -8.031  10.484
  171   HH21  ARG  32          1HH2      ARG  32  -9.933 -10.960   8.921
  172   HH22  ARG  32          2HH2      ARG  32 -10.296 -10.105  10.407
  173    H    LEU  33           H        LEU  33  -9.340  -4.652   2.288
  174    HA   LEU  33           HA       LEU  33 -11.351  -2.730   1.404
  175    HB3  LEU  33           2HB      LEU  33  -9.887  -2.377  -0.476
  176    HG   LEU  33           HG       LEU  33  -7.992  -3.179   1.763
  177   HD11  LEU  33          1HD1      LEU  33  -7.583  -1.455  -0.686
  178   HD12  LEU  33          2HD1      LEU  33  -6.838  -3.039  -0.345
  179   HD13  LEU  33          3HD1      LEU  33  -6.441  -1.638   0.652
  180   HD21  LEU  33          3HD2      LEU  33  -7.894  -0.803   2.331
  181   HD22  LEU  33          1HD2      LEU  33  -9.536  -1.433   2.564
  182   HD23  LEU  33          2HD2      LEU  33  -9.153  -0.440   1.131
  183    H    LYS  34           H        LYS  34 -12.032  -2.910  -1.092
  184    HA   LYS  34           HA       LYS  34 -12.438  -5.692  -1.975
  185    HB3  LYS  34           2HB      LYS  34 -14.470  -5.107  -0.699
  186    HG3  LYS  34           2HG      LYS  34 -15.177  -3.278  -3.036
  187    HD3  LYS  34           2HD      LYS  34 -16.603  -3.884  -0.410
  188    HE3  LYS  34           2HE      LYS  34 -17.110  -1.637  -1.492
  189    HZ1  LYS  34           3HZ      LYS  34 -18.618  -1.821  -3.443
  190    HZ2  LYS  34           1HZ      LYS  34 -18.272  -3.413  -3.577
  191    HZ3  LYS  34           2HZ      LYS  34 -17.099  -2.299  -3.821
  192    H    GLY  35           H        GLY  35 -12.329  -6.058  -4.097
  193    HA2  GLY  35           2HA      GLY  35 -12.284  -5.599  -6.410
  194    HA3  GLY  35           3HA      GLY  35 -12.222  -3.851  -6.090
  195    H    VAL  36           H        VAL  36  -9.952  -6.086  -4.499
  196    HA   VAL  36           HA       VAL  36  -7.721  -4.673  -5.942
  197    HB   VAL  36           HB       VAL  36  -7.559  -5.761  -3.110
  198   HG11  VAL  36          1HG1      VAL  36  -5.769  -4.019  -2.915
  199   HG12  VAL  36          2HG1      VAL  36  -5.407  -5.233  -4.143
  200   HG13  VAL  36          3HG1      VAL  36  -5.990  -3.623  -4.627
  201   HG21  VAL  36          3HG2      VAL  36  -7.937  -3.435  -2.290
  202   HG22  VAL  36          1HG2      VAL  36  -8.517  -2.987  -3.903
  203   HG23  VAL  36          2HG2      VAL  36  -9.383  -4.203  -2.925
  204    H    ALA  37           H        ALA  37  -5.803  -5.925  -6.471
  205    HA   ALA  37           HA       ALA  37  -6.435  -8.821  -6.691
  206    HB1  ALA  37           1HB      ALA  37  -6.071  -7.455  -8.740
  207    HB2  ALA  37           2HB      ALA  37  -4.394  -7.198  -8.226
  208    HB3  ALA  37           3HB      ALA  37  -4.967  -8.834  -8.583
  209    H    GLU  38           H        GLU  38  -3.690  -6.760  -5.405
  210    HA   GLU  38           HA       GLU  38  -2.734  -9.026  -3.864
  211    HB3  GLU  38           2HB      GLU  38  -0.448  -8.992  -4.641
  212    HG3  GLU  38           2HG      GLU  38  -2.101  -9.382  -7.160
  213    H    ALA  39           H        ALA  39  -1.255  -8.266  -2.191
  214    HA   ALA  39           HA       ALA  39   0.108  -5.766  -2.606
  215    HB1  ALA  39           1HB      ALA  39  -1.769  -5.804  -0.228
  216    HB2  ALA  39           2HB      ALA  39  -0.753  -4.455  -0.808
  217    HB3  ALA  39           3HB      ALA  39  -2.143  -5.013  -1.778
  218    H    SER  40           H        SER  40   2.095  -5.986  -1.845
  219    HA   SER  40           HA       SER  40   2.675  -8.003   0.299
  220    HB3  SER  40           2HB      SER  40   4.545  -8.723  -1.047
  221    HG   SER  40           HG       SER  40   2.557  -9.632  -1.752
  222    H    VAL  41           H        VAL  41   3.757  -7.138   2.038
  223    HA   VAL  41           HA       VAL  41   5.119  -4.509   1.748
  224    HB   VAL  41           HB       VAL  41   5.334  -4.458   4.165
  225   HG11  VAL  41          1HG1      VAL  41   2.540  -5.161   3.186
  226   HG12  VAL  41          2HG1      VAL  41   2.931  -4.353   4.717
  227   HG13  VAL  41          3HG1      VAL  41   3.324  -3.569   3.201
  228   HG21  VAL  41          3HG2      VAL  41   4.202  -6.188   5.585
  229   HG22  VAL  41          1HG2      VAL  41   4.173  -7.250   4.168
  230   HG23  VAL  41          2HG2      VAL  41   5.710  -6.703   4.826
  231    H    THR  42           H        THR  42   7.225  -4.011   2.214
  232    HA   THR  42           HA       THR  42   9.117  -6.223   2.927
  233    HB   THR  42           HB       THR  42   9.569  -4.031   0.866
  234    HG1  THR  42           1HG      THR  42   8.519  -5.706  -0.071
  235   HG21  THR  42          3HG2      THR  42  11.751  -5.080   0.522
  236   HG22  THR  42          1HG2      THR  42  11.448  -6.241   1.845
  237   HG23  THR  42          2HG2      THR  42  11.645  -4.505   2.181
  238    H    VAL  43           H        VAL  43   9.203  -5.729   5.052
  239    HA   VAL  43           HA       VAL  43   9.404  -3.101   6.170
  240    HB   VAL  43           HB       VAL  43   9.941  -5.891   7.213
  241   HG11  VAL  43          1HG1      VAL  43  11.548  -4.640   8.510
  242   HG12  VAL  43          2HG1      VAL  43  10.414  -3.293   8.696
  243   HG13  VAL  43          3HG1      VAL  43  10.113  -4.829   9.527
  244   HG21  VAL  43          3HG2      VAL  43   7.603  -5.057   6.876
  245   HG22  VAL  43          1HG2      VAL  43   7.964  -5.368   8.584
  246   HG23  VAL  43          2HG2      VAL  43   7.958  -3.701   7.965
  247    H    ALA  44           H        ALA  44  11.948  -5.420   5.102
  248    HA   ALA  44           HA       ALA  44  14.199  -4.071   6.173
  249    HB1  ALA  44           1HB      ALA  44  14.161  -6.401   5.325
  250    HB2  ALA  44           2HB      ALA  44  14.014  -5.776   3.661
  251    HB3  ALA  44           3HB      ALA  44  15.472  -5.451   4.615
  252    H    THR  45           H        THR  45  12.198  -2.880   3.675
  253    HA   THR  45           HA       THR  45  14.272  -0.840   2.947
  254    HB   THR  45           HB       THR  45  13.350  -0.758   0.688
  255    HG1  THR  45           1HG      THR  45  11.940  -2.522   0.076
  256   HG21  THR  45          3HG2      THR  45  14.164  -3.610   1.428
  257   HG22  THR  45          1HG2      THR  45  15.271  -2.266   1.070
  258   HG23  THR  45          2HG2      THR  45  14.197  -2.900  -0.188
  259    H    GLY  46           H        GLY  46  10.936  -1.499   3.817
  260    HA2  GLY  46           2HA      GLY  46   9.275  -0.034   4.527
  261    HA3  GLY  46           3HA      GLY  46  10.356   1.354   4.263
  262    H    ARG  47           H        ARG  47   9.172  -1.304   2.159
  263    HA   ARG  47           HA       ARG  47   7.950   0.656   0.294
  264    HB3  ARG  47           2HB      ARG  47   8.962  -0.432  -1.634
  265    HG3  ARG  47           2HG      ARG  47  11.246   0.254   0.251
  266    HD3  ARG  47           2HD      ARG  47  11.963   1.548  -1.867
  267    HE   ARG  47           HE       ARG  47  12.025  -1.418  -2.289
  268   HH11  ARG  47          1HH1      ARG  47  13.808   1.379  -0.987
  269   HH12  ARG  47          2HH1      ARG  47  15.346   0.694  -1.484
  270   HH21  ARG  47          1HH2      ARG  47  14.080  -2.184  -2.868
  271   HH22  ARG  47          2HH2      ARG  47  15.493  -1.274  -2.409
  272    H    LEU  48           H        LEU  48   6.560  -0.380  -1.278
  273    HA   LEU  48           HA       LEU  48   5.414  -2.986  -0.442
  274    HB3  LEU  48           2HB      LEU  48   3.477  -0.718  -0.908
  275    HG   LEU  48           HG       LEU  48   3.719  -3.033   1.049
  276   HD11  LEU  48          1HD1      LEU  48   1.568  -2.299   2.009
  277   HD12  LEU  48          2HD1      LEU  48   1.628  -0.835   1.004
  278   HD13  LEU  48          3HD1      LEU  48   2.855  -1.105   2.264
  279   HD21  LEU  48          3HD2      LEU  48   1.468  -3.694   0.121
  280   HD22  LEU  48          1HD2      LEU  48   2.739  -3.742  -1.082
  281   HD23  LEU  48          2HD2      LEU  48   1.606  -2.381  -1.072
  282    H    THR  49           H        THR  49   4.412  -4.061  -2.054
  283    HA   THR  49           HA       THR  49   4.312  -2.864  -4.815
  284    HB   THR  49           HB       THR  49   4.852  -5.776  -4.107
  285    HG1  THR  49           1HG      THR  49   6.855  -5.291  -5.114
  286   HG21  THR  49          3HG2      THR  49   4.704  -4.284  -6.776
  287   HG22  THR  49          1HG2      THR  49   3.551  -5.512  -6.196
  288   HG23  THR  49          2HG2      THR  49   5.203  -5.977  -6.575
  289    H    VAL  50           H        VAL  50   2.301  -2.730  -5.544
  290    HA   VAL  50           HA       VAL  50   0.162  -4.474  -4.364
  291    HB   VAL  50           HB       VAL  50   0.126  -2.198  -3.347
  292   HG11  VAL  50          1HG1      VAL  50   0.916  -0.893  -5.300
  293   HG12  VAL  50          2HG1      VAL  50  -0.612  -1.224  -6.143
  294   HG13  VAL  50          3HG1      VAL  50  -0.609  -0.262  -4.657
  295   HG21  VAL  50          3HG2      VAL  50  -2.254  -1.696  -3.653
  296   HG22  VAL  50          1HG2      VAL  50  -2.334  -2.857  -4.992
  297   HG23  VAL  50          2HG2      VAL  50  -1.944  -3.403  -3.350
  298    H    THR  51           H        THR  51  -1.521  -5.068  -5.749
  299    HA   THR  51           HA       THR  51  -1.267  -4.328  -8.636
  300    HB   THR  51           HB       THR  51  -1.889  -7.113  -7.595
  301    HG1  THR  51           1HG      THR  51   0.175  -7.540  -7.927
  302   HG21  THR  51          3HG2      THR  51  -1.714  -7.814  -9.940
  303   HG22  THR  51          1HG2      THR  51  -1.350  -6.161 -10.457
  304   HG23  THR  51          2HG2      THR  51  -2.953  -6.558  -9.844
  305    H    TYR  52           H        TYR  52  -3.104  -3.722  -9.556
  306    HA   TYR  52           HA       TYR  52  -5.744  -4.582  -8.748
  307    HB3  TYR  52           2HB      TYR  52  -5.319  -3.029  -6.885
  308    HD1  TYR  52           2HD      TYR  52  -3.149  -1.812  -6.810
  309    HD2  TYR  52           1HD      TYR  52  -6.408  -0.422  -9.249
  310    HE1  TYR  52           2HE      TYR  52  -2.075   0.430  -6.965
  311    HE2  TYR  52           1HE      TYR  52  -5.303   1.792  -9.473
  312    HH   TYR  52           HH       TYR  52  -2.158   2.511  -7.909
  313    H    ASP  53           H        ASP  53  -7.471  -3.696 -10.066
  314    HA   ASP  53           HA       ASP  53  -6.660  -2.648 -12.688
  315    HB3  ASP  53           2HB      ASP  53  -9.262  -3.610 -11.491
  316    HA   PRO  54           HA       PRO  54  -7.208   1.516 -11.191
  317    HB3  PRO  54           2HB      PRO  54  -5.495   1.951 -12.687
  318    HG3  PRO  54           2HG      PRO  54  -5.556   1.078 -14.945
  319    HD3  PRO  54           2HD      PRO  54  -5.524  -0.699 -13.350
  320    H    LYS  55           H        LYS  55  -9.699  -0.065 -12.292
  321    HA   LYS  55           HA       LYS  55 -11.498   2.306 -12.506
  322    HB3  LYS  55           2HB      LYS  55 -12.919   0.684 -14.050
  323    HG3  LYS  55           2HG      LYS  55 -11.777   1.421 -16.121
  324    HD3  LYS  55           2HD      LYS  55 -12.006   3.694 -14.095
  325    HE3  LYS  55           2HE      LYS  55 -12.343   3.472 -17.105
  326    HZ1  LYS  55           3HZ      LYS  55 -12.926   5.812 -15.365
  327    HZ2  LYS  55           1HZ      LYS  55 -14.049   4.931 -16.184
  328    HZ3  LYS  55           2HZ      LYS  55 -12.931   5.795 -17.003
  329    H    GLN  56           H        GLN  56 -11.047  -1.046 -11.446
  330    HA   GLN  56           HA       GLN  56 -13.429  -0.974  -9.733
  331    HB3  GLN  56           2HB      GLN  56 -12.301  -2.795  -8.500
  332    HG3  GLN  56           2HG      GLN  56 -11.969  -3.420 -11.448
  333   HE21  GLN  56          1HE2      GLN  56 -10.540  -4.967  -9.636
  334   HE22  GLN  56          2HE2      GLN  56 -11.456  -6.405  -9.216
  335    H    VAL  57           H        VAL  57  -9.937  -0.104  -9.279
  336    HA   VAL  57           HA       VAL  57 -10.679   1.620  -7.011
  337    HB   VAL  57           HB       VAL  57  -9.019   0.676  -5.463
  338   HG11  VAL  57          1HG1      VAL  57 -10.267  -1.202  -4.629
  339   HG12  VAL  57          2HG1      VAL  57 -11.383   0.032  -5.227
  340   HG13  VAL  57          3HG1      VAL  57 -11.074  -1.439  -6.187
  341   HG21  VAL  57          3HG2      VAL  57  -7.527  -0.465  -7.005
  342   HG22  VAL  57          1HG2      VAL  57  -8.113  -1.601  -5.790
  343   HG23  VAL  57          2HG2      VAL  57  -8.795  -1.640  -7.429
  344    H    SER  58           H        SER  58  -8.429   2.598  -6.072
  345    HA   SER  58           HA       SER  58  -6.561   3.167  -8.312
  346    HB3  SER  58           2HB      SER  58  -8.558   4.682  -8.537
  347    HG   SER  58           HG       SER  58  -8.386   6.521  -7.066
  348    H    GLU  59           H        GLU  59  -5.276   5.398  -7.191
  349    HA   GLU  59           HA       GLU  59  -3.498   4.493  -5.223
  350    HB3  GLU  59           2HB      GLU  59  -3.043   6.814  -4.767
  351    HG3  GLU  59           2HG      GLU  59  -2.700   5.699  -7.231
  352    H    ILE  60           H        ILE  60  -6.811   5.651  -4.782
  353    HA   ILE  60           HA       ILE  60  -6.870   6.237  -1.993
  354    HB   ILE  60           HB       ILE  60  -8.909   5.215  -3.979
  355   HG13  ILE  60          2HG1      ILE  60  -9.801   7.442  -3.999
  356   HG21  ILE  60          1HG2      ILE  60  -9.774   4.443  -1.927
  357   HG22  ILE  60          2HG2      ILE  60  -9.387   5.971  -1.087
  358   HG23  ILE  60          3HG2      ILE  60 -10.670   5.907  -2.326
  359   HD11  ILE  60          3HD1      ILE  60  -8.647   9.361  -3.008
  360   HD12  ILE  60          1HD1      ILE  60  -9.258   8.291  -1.733
  361   HD13  ILE  60          2HD1      ILE  60  -7.529   8.292  -2.155
  362    H    THR  61           H        THR  61  -6.965   3.075  -3.601
  363    HA   THR  61           HA       THR  61  -7.615   1.486  -1.279
  364    HB   THR  61           HB       THR  61  -7.036   1.123  -4.086
  365    HG1  THR  61           1HG      THR  61  -8.892   0.604  -2.738
  366   HG21  THR  61          3HG2      THR  61  -4.935  -0.006  -3.452
  367   HG22  THR  61          1HG2      THR  61  -6.141  -1.068  -4.186
  368   HG23  THR  61          2HG2      THR  61  -5.887  -1.132  -2.437
  369    H    ILE  62           H        ILE  62  -4.763   3.174  -1.991
  370    HA   ILE  62           HA       ILE  62  -3.467   1.697   0.265
  371    HB   ILE  62           HB       ILE  62  -2.716   0.945  -1.974
  372   HG13  ILE  62          2HG1      ILE  62  -1.385   0.962   0.335
  373   HG21  ILE  62          1HG2      ILE  62  -1.074   2.271  -3.231
  374   HG22  ILE  62          2HG2      ILE  62  -2.652   3.050  -3.203
  375   HG23  ILE  62          3HG2      ILE  62  -1.347   3.661  -2.160
  376   HD11  ILE  62          3HD1      ILE  62  -0.098   0.327  -2.347
  377   HD12  ILE  62          1HD1      ILE  62   0.532  -0.169  -0.774
  378   HD13  ILE  62          2HD1      ILE  62  -1.039  -0.778  -1.313
  379    H    GLN  63           H        GLN  63  -3.910   4.843  -1.225
  380    HA   GLN  63           HA       GLN  63  -2.413   6.447   0.573
  381    HB3  GLN  63           2HB      GLN  63  -4.465   8.050   0.182
  382    HG3  GLN  63           2HG      GLN  63  -2.958   7.106  -2.294
  383   HE21  GLN  63          1HE2      GLN  63  -2.195   9.787  -3.048
  384   HE22  GLN  63          2HE2      GLN  63  -3.660  10.704  -3.367
  385    H    GLU  64           H        GLU  64  -5.981   5.759   0.973
  386    HA   GLU  64           HA       GLU  64  -5.987   6.819   3.617
  387    HB3  GLU  64           2HB      GLU  64  -8.160   5.896   3.893
  388    HG3  GLU  64           2HG      GLU  64  -8.030   6.290   0.881
  389    H    ARG  65           H        ARG  65  -5.243   3.637   2.413
  390    HA   ARG  65           HA       ARG  65  -5.394   2.221   4.911
  391    HB3  ARG  65           2HB      ARG  65  -3.785   1.376   2.482
  392    HG3  ARG  65           2HG      ARG  65  -5.859  -0.435   3.608
  393    HD3  ARG  65           2HD      ARG  65  -4.122  -2.106   3.434
  394    HE   ARG  65           HE       ARG  65  -4.694  -0.511   1.124
  395   HH11  ARG  65          1HH1      ARG  65  -2.513  -3.097   2.203
  396   HH12  ARG  65          2HH1      ARG  65  -2.265  -3.665   0.571
  397   HH21  ARG  65          1HH2      ARG  65  -4.385  -1.254  -0.854
  398   HH22  ARG  65          2HH2      ARG  65  -3.356  -2.628  -1.198
  399    H    ILE  66           H        ILE  66  -2.976   4.298   3.647
  400    HA   ILE  66           HA       ILE  66  -1.006   3.279   5.700
  401    HB   ILE  66           HB       ILE  66  -0.606   4.782   3.082
  402   HG13  ILE  66          2HG1      ILE  66  -0.865   2.257   3.043
  403   HG21  ILE  66          1HG2      ILE  66   1.802   4.878   3.641
  404   HG22  ILE  66          2HG2      ILE  66   0.870   5.787   4.814
  405   HG23  ILE  66          3HG2      ILE  66   1.479   4.162   5.224
  406   HD11  ILE  66          3HD1      ILE  66   1.058   1.667   1.758
  407   HD12  ILE  66          1HD1      ILE  66   0.601   3.325   1.336
  408   HD13  ILE  66          2HD1      ILE  66   2.002   3.022   2.394
  409    H    ALA  67           H        ALA  67  -2.635   6.193   4.430
  410    HA   ALA  67           HA       ALA  67  -1.398   8.036   6.173
  411    HB1  ALA  67           1HB      ALA  67  -4.154   8.149   4.840
  412    HB2  ALA  67           2HB      ALA  67  -3.213   9.532   5.444
  413    HB3  ALA  67           3HB      ALA  67  -2.614   8.582   4.075
  414    H    ALA  68           H        ALA  68  -4.675   6.497   6.510
  415    HA   ALA  68           HA       ALA  68  -5.083   7.693   9.148
  416    HB1  ALA  68           1HB      ALA  68  -6.910   7.327   7.488
  417    HB2  ALA  68           2HB      ALA  68  -6.685   5.569   7.668
  418    HB3  ALA  68           3HB      ALA  68  -7.224   6.543   9.046
  419    H    LEU  69           H        LEU  69  -3.733   4.676   8.011
  420    HA   LEU  69           HA       LEU  69  -3.828   3.269  10.560
  421    HB3  LEU  69           2HB      LEU  69  -1.862   2.014   9.357
  422    HG   LEU  69           HG       LEU  69  -3.343   0.768   7.852
  423   HD11  LEU  69          1HD1      LEU  69  -4.777  -0.207   9.524
  424   HD12  LEU  69          2HD1      LEU  69  -4.685   1.240  10.543
  425   HD13  LEU  69          3HD1      LEU  69  -3.240   0.245  10.280
  426   HD21  LEU  69          3HD2      LEU  69  -4.818   2.702   7.136
  427   HD22  LEU  69          1HD2      LEU  69  -5.639   2.580   8.703
  428   HD23  LEU  69          2HD2      LEU  69  -5.681   1.216   7.572
  429    H    GLY  70           H        GLY  70  -1.833   5.892   9.389
  430    HA2  GLY  70           2HA      GLY  70  -1.009   7.160  11.365
  431    HA3  GLY  70           3HA      GLY  70  -0.194   5.690  11.904
  432    H    TYR  71           H        TYR  71   0.033   6.122   8.497
  433    HA   TYR  71           HA       TYR  71   2.838   7.116   8.804
  434    HB3  TYR  71           2HB      TYR  71   3.435   5.213   7.277
  435    HD1  TYR  71           1HD      TYR  71   4.498   5.754   9.773
  436    HD2  TYR  71           2HD      TYR  71   1.346   2.942   8.910
  437    HE1  TYR  71           1HE      TYR  71   4.980   4.573  11.893
  438    HE2  TYR  71           2HE      TYR  71   1.847   1.733  11.027
  439    HH   TYR  71           HH       TYR  71   4.437   2.828  13.262
  440    H    THR  72           H        THR  72   3.648   6.849   6.130
  441    HA   THR  72           HA       THR  72   1.799   8.486   4.502
  442    HB   THR  72           HB       THR  72   3.188  10.076   5.887
  443    HG1  THR  72           1HG      THR  72   4.017  11.112   3.833
  444   HG21  THR  72          3HG2      THR  72   5.513   9.167   4.127
  445   HG22  THR  72          1HG2      THR  72   5.333   8.732   5.836
  446   HG23  THR  72          2HG2      THR  72   5.515  10.430   5.376
  447    H    LEU  73           H        LEU  73   2.807   8.855   2.249
  448    HA   LEU  73           HA       LEU  73   4.459   6.591   1.351
  449    HB3  LEU  73           2HB      LEU  73   2.169   5.652   1.535
  450    HG   LEU  73           HG       LEU  73   1.460   7.634  -0.686
  451   HD11  LEU  73          1HD1      LEU  73   0.856   5.284  -1.266
  452   HD12  LEU  73          2HD1      LEU  73  -0.551   6.331  -1.052
  453   HD13  LEU  73          3HD1      LEU  73  -0.104   5.190   0.229
  454   HD21  LEU  73          3HD2      LEU  73   0.872   8.593   1.474
  455   HD22  LEU  73          1HD2      LEU  73   0.153   7.057   2.016
  456   HD23  LEU  73          2HD2      LEU  73  -0.604   8.006   0.722
  457    H    ALA  74           H        ALA  74   5.052   6.576  -0.853
  458    HA   ALA  74           HA       ALA  74   4.335   8.860  -2.579
  459    HB1  ALA  74           1HB      ALA  74   7.205   8.114  -1.853
  460    HB2  ALA  74           2HB      ALA  74   6.737   9.249  -3.136
  461    HB3  ALA  74           3HB      ALA  74   6.373   9.631  -1.443
  462    H    GLU  75           H        GLU  75   3.777   8.092  -4.499
  463    HA   GLU  75           HA       GLU  75   5.075   5.661  -5.616
  464    HB3  GLU  75           2HB      GLU  75   2.368   6.795  -6.471
  465    HG3  GLU  75           2HG      GLU  75   2.107   4.288  -7.092
  466    HA   PRO  76           HA       PRO  76   7.191   8.812  -7.553
  467    HB3  PRO  76           2HB      PRO  76   8.933   7.471  -8.047
  468    HG3  PRO  76           2HG      PRO  76   8.547   5.174  -8.473
  469    HD3  PRO  76           2HD      PRO  76   7.182   5.655  -6.605
  Start of MODEL    4
    1    H2   PRO   6           2H       PRO   6  -7.848  -7.110 -17.982
    2    HA   PRO   6           HA       PRO   6  -5.404  -7.888 -16.568
    3    HB3  PRO   6           2HB      PRO   6  -4.135  -6.858 -18.305
    4    HG3  PRO   6           2HG      PRO   6  -4.776  -8.813 -19.421
    5    HD3  PRO   6           2HD      PRO   6  -6.423  -9.681 -18.111
    6    H    LEU   7           H        LEU   7  -4.219  -5.901 -15.787
    7    HA   LEU   7           HA       LEU   7  -5.832  -3.620 -14.949
    8    HB3  LEU   7           2HB      LEU   7  -6.697  -5.353 -13.511
    9    HG   LEU   7           HG       LEU   7  -3.995  -5.610 -12.124
   10   HD11  LEU   7          1HD1      LEU   7  -6.722  -6.902 -11.644
   11   HD12  LEU   7          2HD1      LEU   7  -5.993  -5.613 -10.667
   12   HD13  LEU   7          3HD1      LEU   7  -5.248  -7.214 -10.708
   13   HD21  LEU   7          3HD2      LEU   7  -4.154  -8.061 -12.630
   14   HD22  LEU   7          1HD2      LEU   7  -3.824  -7.079 -14.048
   15   HD23  LEU   7          2HD2      LEU   7  -5.467  -7.709 -13.776
   16    H    LYS   8           H        LYS   8  -3.923  -3.410 -12.520
   17    HA   LYS   8           HA       LYS   8  -1.359  -2.839 -13.918
   18    HB3  LYS   8           2HB      LYS   8  -1.212  -0.757 -12.421
   19    HG3  LYS   8           2HG      LYS   8  -3.420  -0.550 -14.498
   20    HD3  LYS   8           2HD      LYS   8  -2.342   1.641 -14.953
   21    HE3  LYS   8           2HE      LYS   8  -3.175   1.216 -12.049
   22    HZ1  LYS   8           3HZ      LYS   8  -3.501   3.628 -12.042
   23    HZ2  LYS   8           1HZ      LYS   8  -2.774   3.760 -13.504
   24    HZ3  LYS   8           2HZ      LYS   8  -1.902   3.250 -12.203
   25    H    THR   9           H        THR   9   0.481  -2.785 -12.609
   26    HA   THR   9           HA       THR   9   0.268  -3.498  -9.764
   27    HB   THR   9           HB       THR   9   0.574  -5.662 -10.992
   28    HG1  THR   9           1HG      THR   9   1.160  -5.728  -8.993
   29   HG21  THR   9          3HG2      THR   9   3.385  -4.622 -11.559
   30   HG22  THR   9          1HG2      THR   9   2.127  -4.928 -12.778
   31   HG23  THR   9          2HG2      THR   9   2.777  -6.269 -11.824
   32    H    GLN  10           H        GLN  10   2.130  -2.823  -8.497
   33    HA   GLN  10           HA       GLN  10   3.956  -0.905  -9.757
   34    HB3  GLN  10           2HB      GLN  10   1.681   0.059  -7.970
   35    HG3  GLN  10           2HG      GLN  10   3.734   1.560  -8.186
   36   HE21  GLN  10          1HE2      GLN  10   3.824   3.805  -9.650
   37   HE22  GLN  10          2HE2      GLN  10   4.285   3.467 -11.315
   38    H    GLN  11           H        GLN  11   5.537  -0.186  -8.319
   39    HA   GLN  11           HA       GLN  11   5.425  -1.182  -5.514
   40    HB3  GLN  11           2HB      GLN  11   7.864  -1.263  -5.547
   41    HG3  GLN  11           2HG      GLN  11   6.865  -2.723  -8.029
   42   HE21  GLN  11          1HE2      GLN  11   7.813  -4.874  -5.694
   43   HE22  GLN  11          2HE2      GLN  11   9.427  -5.183  -6.344
   44    H    MET  12           H        MET  12   6.411   0.228  -3.910
   45    HA   MET  12           HA       MET  12   7.231   2.894  -4.628
   46    HB3  MET  12           2HB      MET  12   4.826   3.275  -4.779
   47    HG3  MET  12           2HG      MET  12   4.262   3.222  -1.902
   48    HE1  MET  12           3HE      MET  12   3.203   0.320  -4.368
   49    HE2  MET  12           1HE      MET  12   1.834   1.062  -5.232
   50    HE3  MET  12           2HE      MET  12   3.473   1.654  -5.513
   51    H    GLN  13           H        GLN  13   8.141   4.092  -2.925
   52    HA   GLN  13           HA       GLN  13   8.685   2.627  -0.420
   53    HB3  GLN  13           2HB      GLN  13   9.667   5.255  -0.136
   54    HG3  GLN  13           2HG      GLN  13  11.885   4.281  -0.637
   55   HE21  GLN  13          1HE2      GLN  13  12.813   2.100   0.606
   56   HE22  GLN  13          2HE2      GLN  13  11.951   1.742   2.092
   57    H    VAL  14           H        VAL  14   8.524   4.088   1.585
   58    HA   VAL  14           HA       VAL  14   5.937   5.517   1.809
   59    HB   VAL  14           HB       VAL  14   5.561   3.028   2.061
   60   HG11  VAL  14          1HG1      VAL  14   6.297   1.884   4.074
   61   HG12  VAL  14          2HG1      VAL  14   7.726   2.485   3.223
   62   HG13  VAL  14          3HG1      VAL  14   7.128   3.324   4.672
   63   HG21  VAL  14          3HG2      VAL  14   4.954   4.643   4.569
   64   HG22  VAL  14          1HG2      VAL  14   4.011   4.622   3.059
   65   HG23  VAL  14          2HG2      VAL  14   4.147   3.158   4.036
   66    H    GLY  15           H        GLY  15   5.791   6.739   3.784
   67    HA2  GLY  15           2HA      GLY  15   8.429   7.422   5.043
   68    HA3  GLY  15           3HA      GLY  15   7.009   8.475   4.912
   69    H    GLY  16           H        GLY  16   8.452   5.798   6.635
   70    HA2  GLY  16           2HA      GLY  16   8.516   6.138   9.027
   71    HA3  GLY  16           3HA      GLY  16   6.790   6.503   9.030
   72    H    MET  17           H        MET  17   6.674   3.965   7.058
   73    HA   MET  17           HA       MET  17   6.295   2.003   9.244
   74    HB3  MET  17           2HB      MET  17   5.713   1.881   6.268
   75    HG3  MET  17           2HG      MET  17   5.177  -0.145   8.471
   76    HE1  MET  17           3HE      MET  17   3.463  -0.656   4.212
   77    HE2  MET  17           1HE      MET  17   4.313   0.835   4.653
   78    HE3  MET  17           2HE      MET  17   5.185  -0.713   4.637
   79    H    ARG  18           H        ARG  18   7.751   0.590   9.832
   80    HA   ARG  18           HA       ARG  18   9.844  -0.472   8.017
   81    HB3  ARG  18           2HB      ARG  18  11.510  -0.000   9.971
   82    HG3  ARG  18           2HG      ARG  18  11.939   2.363   9.330
   83    HD3  ARG  18           2HD      ARG  18  12.312   2.074   6.906
   84    HE   ARG  18           HE       ARG  18  13.983   1.087   8.363
   85   HH11  ARG  18          1HH1      ARG  18  11.678  -1.382   7.317
   86   HH12  ARG  18          2HH1      ARG  18  12.824  -2.656   7.559
   87   HH21  ARG  18          1HH2      ARG  18  15.470  -0.578   8.377
   88   HH22  ARG  18          2HH2      ARG  18  14.923  -2.225   8.209
   89    H    CYS  19           H        CYS  19   7.868  -1.000  10.905
   90    HA   CYS  19           HA       CYS  19   9.363  -3.526  11.420
   91    HB3  CYS  19           2HB      CYS  19   9.064  -1.789  13.213
   92    HG   CYS  19           HG       CYS  19   6.804  -1.977  14.742
   93    H    ALA  20           H        ALA  20   8.225  -5.400  12.139
   94    HA   ALA  20           HA       ALA  20   6.448  -6.468  10.220
   95    HB1  ALA  20           1HB      ALA  20   8.056  -7.709  11.691
   96    HB2  ALA  20           2HB      ALA  20   7.002  -7.398  13.080
   97    HB3  ALA  20           3HB      ALA  20   6.418  -8.389  11.726
   98    H    ALA  21           H        ALA  21   5.717  -5.202  13.522
   99    HA   ALA  21           HA       ALA  21   2.935  -5.755  13.520
  100    HB1  ALA  21           1HB      ALA  21   2.813  -3.973  15.223
  101    HB2  ALA  21           2HB      ALA  21   4.198  -5.043  15.510
  102    HB3  ALA  21           3HB      ALA  21   4.449  -3.430  14.805
  103    H    CYS  22           H        CYS  22   4.588  -2.746  12.347
  104    HA   CYS  22           HA       CYS  22   2.095  -1.588  11.457
  105    HB3  CYS  22           2HB      CYS  22   3.687   0.003  10.218
  106    HG   CYS  22           HG       CYS  22   4.104  -0.686  13.460
  107    H    ALA  23           H        ALA  23   4.606  -3.408   9.645
  108    HA   ALA  23           HA       ALA  23   3.338  -3.341   7.106
  109    HB1  ALA  23           1HB      ALA  23   5.598  -4.252   7.569
  110    HB2  ALA  23           2HB      ALA  23   4.886  -5.581   8.508
  111    HB3  ALA  23           3HB      ALA  23   4.579  -5.471   6.769
  112    H    SER  24           H        SER  24   2.502  -5.142  10.055
  113    HA   SER  24           HA       SER  24   0.538  -6.876   8.692
  114    HB3  SER  24           2HB      SER  24  -0.013  -7.672  10.909
  115    HG   SER  24           HG       SER  24   2.812  -7.300  10.786
  116    H    SER  25           H        SER  25   0.448  -3.882  10.647
  117    HA   SER  25           HA       SER  25  -2.379  -3.556  10.670
  118    HB3  SER  25           2HB      SER  25  -1.955  -1.299  11.370
  119    HG   SER  25           HG       SER  25  -0.130  -1.624  12.902
  120    H    ILE  26           H        ILE  26  -0.087  -2.902   8.149
  121    HA   ILE  26           HA       ILE  26  -2.186  -1.863   6.323
  122    HB   ILE  26           HB       ILE  26   0.686  -2.794   5.803
  123   HG13  ILE  26          2HG1      ILE  26   1.129  -0.369   5.403
  124   HG21  ILE  26          1HG2      ILE  26  -0.630  -3.075   3.766
  125   HG22  ILE  26          2HG2      ILE  26  -1.314  -1.444   3.930
  126   HG23  ILE  26          3HG2      ILE  26   0.418  -1.671   3.594
  127   HD11  ILE  26          3HD1      ILE  26  -1.429   0.085   6.992
  128   HD12  ILE  26          1HD1      ILE  26  -0.214   1.296   6.525
  129   HD13  ILE  26          2HD1      ILE  26  -1.193   0.522   5.270
  130    H    GLU  27           H        GLU  27  -0.286  -4.918   6.522
  131    HA   GLU  27           HA       GLU  27  -1.600  -5.976   4.242
  132    HB3  GLU  27           2HB      GLU  27  -0.614  -8.206   5.173
  133    HG3  GLU  27           2HG      GLU  27   1.315  -5.931   4.593
  134    H    ARG  28           H        ARG  28  -2.524  -6.282   7.664
  135    HA   ARG  28           HA       ARG  28  -4.433  -8.395   7.301
  136    HB3  ARG  28           2HB      ARG  28  -4.278  -6.157   9.363
  137    HG3  ARG  28           2HG      ARG  28  -5.800  -8.778   9.328
  138    HD3  ARG  28           2HD      ARG  28  -4.604  -8.749  11.453
  139    HE   ARG  28           HE       ARG  28  -5.944  -6.382  12.539
  140   HH11  ARG  28          1HH1      ARG  28  -2.797  -7.594  11.317
  141   HH12  ARG  28          2HH1      ARG  28  -1.989  -6.280  12.165
  142   HH21  ARG  28          1HH2      ARG  28  -4.736  -4.910  13.572
  143   HH22  ARG  28          2HH2      ARG  28  -2.973  -4.889  13.368
  144    H    ALA  29           H        ALA  29  -4.689  -4.893   6.812
  145    HA   ALA  29           HA       ALA  29  -7.612  -5.027   6.310
  146    HB1  ALA  29           1HB      ALA  29  -6.662  -3.084   7.508
  147    HB2  ALA  29           2HB      ALA  29  -5.604  -2.746   6.115
  148    HB3  ALA  29           3HB      ALA  29  -7.371  -2.603   5.948
  149    H    LEU  30           H        LEU  30  -4.553  -4.715   4.480
  150    HA   LEU  30           HA       LEU  30  -5.730  -3.977   2.020
  151    HB3  LEU  30           2HB      LEU  30  -3.074  -5.359   2.568
  152    HG   LEU  30           HG       LEU  30  -3.327  -5.168   0.154
  153   HD11  LEU  30          1HD1      LEU  30  -4.005  -2.224   0.627
  154   HD12  LEU  30          2HD1      LEU  30  -5.095  -3.461  -0.046
  155   HD13  LEU  30          3HD1      LEU  30  -3.672  -2.967  -0.955
  156   HD21  LEU  30          3HD2      LEU  30  -1.427  -3.656  -0.307
  157   HD22  LEU  30          1HD2      LEU  30  -1.137  -4.627   1.148
  158   HD23  LEU  30          2HD2      LEU  30  -1.612  -2.919   1.293
  159    H    GLU  31           H        GLU  31  -5.805  -7.111   3.442
  160    HA   GLU  31           HA       GLU  31  -6.511  -8.391   0.867
  161    HB3  GLU  31           2HB      GLU  31  -5.301  -9.760   2.437
  162    HG3  GLU  31           2HG      GLU  31  -7.555  -9.139   4.385
  163    H    ARG  32           H        ARG  32  -8.181  -6.435   3.147
  164    HA   ARG  32           HA       ARG  32 -10.824  -7.672   2.536
  165    HB3  ARG  32           2HB      ARG  32 -11.670  -6.238   4.356
  166    HG3  ARG  32           2HG      ARG  32  -9.265  -7.815   5.337
  167    HD3  ARG  32           2HD      ARG  32 -12.055  -7.354   6.474
  168    HE   ARG  32           HE       ARG  32 -10.085  -9.310   7.158
  169   HH11  ARG  32          1HH1      ARG  32 -12.199  -6.951   8.783
  170   HH12  ARG  32          2HH1      ARG  32 -12.145  -7.848  10.284
  171   HH21  ARG  32          1HH2      ARG  32 -10.148 -10.418   9.093
  172   HH22  ARG  32          2HH2      ARG  32 -10.825  -9.648  10.512
  173    H    LEU  33           H        LEU  33  -8.979  -4.704   1.973
  174    HA   LEU  33           HA       LEU  33 -11.055  -2.946   1.159
  175    HB3  LEU  33           2HB      LEU  33  -9.378  -1.773  -0.130
  176    HG   LEU  33           HG       LEU  33  -7.843  -2.931   2.209
  177   HD11  LEU  33          1HD1      LEU  33  -7.647  -0.200   0.908
  178   HD12  LEU  33          2HD1      LEU  33  -6.563  -1.564   0.567
  179   HD13  LEU  33          3HD1      LEU  33  -6.614  -0.855   2.191
  180   HD21  LEU  33          3HD2      LEU  33  -9.797  -0.595   2.242
  181   HD22  LEU  33          1HD2      LEU  33  -8.688  -1.033   3.561
  182   HD23  LEU  33          2HD2      LEU  33  -9.985  -2.140   3.105
  183    H    LYS  34           H        LYS  34 -11.740  -2.254  -0.918
  184    HA   LYS  34           HA       LYS  34 -12.552  -4.457  -2.674
  185    HB3  LYS  34           2HB      LYS  34 -13.597  -2.487  -3.937
  186    HG3  LYS  34           2HG      LYS  34 -14.258  -2.791  -0.973
  187    HD3  LYS  34           2HD      LYS  34 -16.030  -1.913  -3.303
  188    HE3  LYS  34           2HE      LYS  34 -17.559  -1.288  -1.369
  189    HZ1  LYS  34           3HZ      LYS  34 -18.301  -3.561  -0.949
  190    HZ2  LYS  34           1HZ      LYS  34 -16.948  -4.182  -1.611
  191    HZ3  LYS  34           2HZ      LYS  34 -17.999  -3.331  -2.556
  192    H    GLY  35           H        GLY  35 -12.088  -4.714  -4.851
  193    HA2  GLY  35           2HA      GLY  35 -10.991  -4.596  -6.861
  194    HA3  GLY  35           3HA      GLY  35 -10.639  -2.911  -6.441
  195    H    VAL  36           H        VAL  36  -9.181  -5.271  -4.343
  196    HA   VAL  36           HA       VAL  36  -6.526  -4.724  -5.635
  197    HB   VAL  36           HB       VAL  36  -5.557  -5.305  -3.367
  198   HG11  VAL  36          1HG1      VAL  36  -5.815  -3.017  -2.521
  199   HG12  VAL  36          2HG1      VAL  36  -5.571  -3.027  -4.274
  200   HG13  VAL  36          3HG1      VAL  36  -7.196  -2.749  -3.607
  201   HG21  VAL  36          3HG2      VAL  36  -6.923  -4.816  -1.380
  202   HG22  VAL  36          1HG2      VAL  36  -8.371  -4.682  -2.373
  203   HG23  VAL  36          2HG2      VAL  36  -7.530  -6.247  -2.223
  204    H    ALA  37           H        ALA  37  -5.354  -6.348  -6.341
  205    HA   ALA  37           HA       ALA  37  -6.564  -9.063  -6.263
  206    HB1  ALA  37           1HB      ALA  37  -6.142  -7.998  -8.425
  207    HB2  ALA  37           2HB      ALA  37  -4.420  -7.809  -8.030
  208    HB3  ALA  37           3HB      ALA  37  -5.118  -9.429  -8.221
  209    H    GLU  38           H        GLU  38  -3.239  -7.673  -5.978
  210    HA   GLU  38           HA       GLU  38  -2.454  -9.772  -4.067
  211    HB3  GLU  38           2HB      GLU  38  -0.409 -10.244  -5.547
  212    HG3  GLU  38           2HG      GLU  38  -3.106 -11.260  -6.517
  213    H    ALA  39           H        ALA  39  -1.042  -8.966  -2.575
  214    HA   ALA  39           HA       ALA  39   0.733  -6.706  -3.287
  215    HB1  ALA  39           1HB      ALA  39  -0.230  -5.209  -1.630
  216    HB2  ALA  39           2HB      ALA  39  -1.504  -5.717  -2.755
  217    HB3  ALA  39           3HB      ALA  39  -1.413  -6.448  -1.137
  218    H    SER  40           H        SER  40   2.218  -6.060  -1.609
  219    HA   SER  40           HA       SER  40   2.556  -7.676   0.803
  220    HB3  SER  40           2HB      SER  40   3.390  -9.320  -0.725
  221    HG   SER  40           HG       SER  40   3.934  -8.188  -2.561
  222    H    VAL  41           H        VAL  41   3.649  -6.600   2.350
  223    HA   VAL  41           HA       VAL  41   5.266  -4.180   1.702
  224    HB   VAL  41           HB       VAL  41   4.642  -5.470   4.405
  225   HG11  VAL  41          1HG1      VAL  41   5.525  -3.285   5.311
  226   HG12  VAL  41          2HG1      VAL  41   6.767  -4.276   4.545
  227   HG13  VAL  41          3HG1      VAL  41   6.088  -2.881   3.680
  228   HG21  VAL  41          3HG2      VAL  41   3.151  -3.612   4.813
  229   HG22  VAL  41          1HG2      VAL  41   3.572  -2.865   3.267
  230   HG23  VAL  41          2HG2      VAL  41   2.645  -4.384   3.307
  231    H    THR  42           H        THR  42   7.418  -4.339   1.414
  232    HA   THR  42           HA       THR  42   8.872  -6.858   2.092
  233    HB   THR  42           HB       THR  42   9.748  -4.420   0.517
  234    HG1  THR  42           1HG      THR  42   8.851  -7.029  -0.154
  235   HG21  THR  42          3HG2      THR  42  11.697  -5.571   1.473
  236   HG22  THR  42          1HG2      THR  42  11.583  -5.922  -0.255
  237   HG23  THR  42          2HG2      THR  42  11.067  -7.143   0.932
  238    H    VAL  43           H        VAL  43   9.011  -6.793   4.238
  239    HA   VAL  43           HA       VAL  43   9.168  -4.486   5.841
  240    HB   VAL  43           HB       VAL  43   9.905  -7.367   6.481
  241   HG11  VAL  43          1HG1      VAL  43   9.490  -5.039   8.418
  242   HG12  VAL  43          2HG1      VAL  43   9.465  -6.748   8.892
  243   HG13  VAL  43          3HG1      VAL  43  10.947  -6.051   8.246
  244   HG21  VAL  43          3HG2      VAL  43   7.407  -5.697   7.049
  245   HG22  VAL  43          1HG2      VAL  43   7.532  -6.935   5.789
  246   HG23  VAL  43          2HG2      VAL  43   7.644  -7.399   7.489
  247    H    ALA  44           H        ALA  44  11.859  -6.271   4.348
  248    HA   ALA  44           HA       ALA  44  14.040  -5.371   5.846
  249    HB1  ALA  44           1HB      ALA  44  15.313  -5.741   3.768
  250    HB2  ALA  44           2HB      ALA  44  14.122  -7.028   4.026
  251    HB3  ALA  44           3HB      ALA  44  13.808  -5.751   2.827
  252    H    THR  45           H        THR  45  12.110  -3.384   3.601
  253    HA   THR  45           HA       THR  45  13.672  -0.997   4.515
  254    HB   THR  45           HB       THR  45  13.623  -0.021   2.304
  255    HG1  THR  45           1HG      THR  45  13.021  -1.301   0.559
  256   HG21  THR  45          3HG2      THR  45  14.831  -2.816   2.119
  257   HG22  THR  45          1HG2      THR  45  15.576  -1.424   2.943
  258   HG23  THR  45          2HG2      THR  45  15.308  -1.380   1.205
  259    H    GLY  46           H        GLY  46  10.658  -2.390   4.325
  260    HA2  GLY  46           2HA      GLY  46   8.610  -1.550   5.031
  261    HA3  GLY  46           3HA      GLY  46   9.243   0.116   4.937
  262    H    ARG  47           H        ARG  47  10.034  -1.230   2.001
  263    HA   ARG  47           HA       ARG  47   8.109   0.468   0.705
  264    HB3  ARG  47           2HB      ARG  47  10.473   0.077  -0.041
  265    HG3  ARG  47           2HG      ARG  47  10.300  -2.507  -0.141
  266    HD3  ARG  47           2HD      ARG  47   9.149  -1.742  -2.886
  267    HE   ARG  47           HE       ARG  47   9.503  -4.560  -2.129
  268   HH11  ARG  47          1HH1      ARG  47  10.904  -1.882  -4.025
  269   HH12  ARG  47          2HH1      ARG  47  11.758  -2.996  -5.065
  270   HH21  ARG  47          1HH2      ARG  47  10.563  -5.874  -3.570
  271   HH22  ARG  47          2HH2      ARG  47  11.735  -5.200  -4.676
  272    H    LEU  48           H        LEU  48   6.589  -0.120  -0.922
  273    HA   LEU  48           HA       LEU  48   5.167  -2.687  -0.347
  274    HB3  LEU  48           2HB      LEU  48   3.239  -0.988  -1.387
  275    HG   LEU  48           HG       LEU  48   4.205  -1.269   1.485
  276   HD11  LEU  48          1HD1      LEU  48   2.020  -0.259   2.087
  277   HD12  LEU  48          2HD1      LEU  48   1.678   0.026   0.357
  278   HD13  LEU  48          3HD1      LEU  48   3.011   0.890   1.167
  279   HD21  LEU  48          3HD2      LEU  48   3.233  -3.338   0.555
  280   HD22  LEU  48          1HD2      LEU  48   1.877  -2.450  -0.161
  281   HD23  LEU  48          2HD2      LEU  48   2.004  -2.610   1.593
  282    H    THR  49           H        THR  49   4.000  -3.640  -1.904
  283    HA   THR  49           HA       THR  49   4.336  -3.048  -4.809
  284    HB   THR  49           HB       THR  49   4.725  -5.803  -3.542
  285    HG1  THR  49           1HG      THR  49   6.574  -4.731  -3.332
  286   HG21  THR  49          3HG2      THR  49   3.598  -5.996  -5.701
  287   HG22  THR  49          1HG2      THR  49   5.291  -6.472  -5.883
  288   HG23  THR  49          2HG2      THR  49   4.755  -4.874  -6.454
  289    H    VAL  50           H        VAL  50   2.381  -3.099  -5.703
  290    HA   VAL  50           HA       VAL  50   0.183  -4.672  -4.478
  291    HB   VAL  50           HB       VAL  50   0.151  -2.555  -3.241
  292   HG11  VAL  50          1HG1      VAL  50  -0.364  -1.120  -5.879
  293   HG12  VAL  50          2HG1      VAL  50  -0.320  -0.414  -4.256
  294   HG13  VAL  50          3HG1      VAL  50   1.158  -1.076  -4.968
  295   HG21  VAL  50          3HG2      VAL  50  -2.194  -1.946  -3.593
  296   HG22  VAL  50          1HG2      VAL  50  -2.205  -2.743  -5.173
  297   HG23  VAL  50          2HG2      VAL  50  -1.998  -3.701  -3.696
  298    H    THR  51           H        THR  51  -1.168  -5.470  -5.865
  299    HA   THR  51           HA       THR  51  -1.376  -4.453  -8.670
  300    HB   THR  51           HB       THR  51  -1.918  -7.255  -7.570
  301    HG1  THR  51           1HG      THR  51   0.035  -7.723  -8.565
  302   HG21  THR  51          3HG2      THR  51  -1.680  -6.254 -10.479
  303   HG22  THR  51          1HG2      THR  51  -3.216  -6.597  -9.684
  304   HG23  THR  51          2HG2      THR  51  -2.052  -7.903  -9.947
  305    H    TYR  52           H        TYR  52  -3.248  -3.552  -9.172
  306    HA   TYR  52           HA       TYR  52  -5.733  -4.173  -7.700
  307    HB3  TYR  52           2HB      TYR  52  -4.623  -2.392  -6.387
  308    HD1  TYR  52           1HD      TYR  52  -6.273  -0.291  -8.982
  309    HD2  TYR  52           2HD      TYR  52  -2.583  -1.207  -6.960
  310    HE1  TYR  52           1HE      TYR  52  -5.244   1.775  -9.920
  311    HE2  TYR  52           2HE      TYR  52  -1.574   0.894  -7.828
  312    HH   TYR  52           HH       TYR  52  -1.918   2.824  -9.109
  313    H    ASP  53           H        ASP  53  -7.668  -3.359  -8.727
  314    HA   ASP  53           HA       ASP  53  -7.383  -3.174 -11.651
  315    HB3  ASP  53           2HB      ASP  53  -9.804  -3.610  -9.915
  316    HA   PRO  54           HA       PRO  54  -7.552   1.249 -10.856
  317    HB3  PRO  54           2HB      PRO  54  -5.768   1.351 -12.258
  318    HG3  PRO  54           2HG      PRO  54  -5.652   0.026 -14.249
  319    HD3  PRO  54           2HD      PRO  54  -5.888  -1.426 -12.437
  320    H    LYS  55           H        LYS  55  -9.991  -0.461 -11.862
  321    HA   LYS  55           HA       LYS  55 -11.675   1.804 -12.888
  322    HB3  LYS  55           2HB      LYS  55 -13.003   0.253 -14.139
  323    HG3  LYS  55           2HG      LYS  55 -10.070  -0.454 -14.655
  324    HD3  LYS  55           2HD      LYS  55 -12.442  -0.650 -16.545
  325    HE3  LYS  55           2HE      LYS  55  -9.487  -1.392 -16.824
  326    HZ1  LYS  55           3HZ      LYS  55 -10.111  -1.814 -19.144
  327    HZ2  LYS  55           1HZ      LYS  55 -11.697  -1.547 -18.793
  328    HZ3  LYS  55           2HZ      LYS  55 -10.885  -2.835 -18.142
  329    H    GLN  56           H        GLN  56 -11.644  -1.268 -11.036
  330    HA   GLN  56           HA       GLN  56 -13.883  -0.646  -9.332
  331    HB3  GLN  56           2HB      GLN  56 -12.800  -2.438  -7.859
  332    HG3  GLN  56           2HG      GLN  56 -13.468  -2.891 -10.771
  333   HE21  GLN  56          1HE2      GLN  56 -13.249  -4.862 -11.764
  334   HE22  GLN  56          2HE2      GLN  56 -12.747  -6.337 -10.931
  335    H    VAL  57           H        VAL  57 -10.354   0.109  -8.938
  336    HA   VAL  57           HA       VAL  57 -11.068   2.225  -7.027
  337    HB   VAL  57           HB       VAL  57  -9.502   1.569  -5.267
  338   HG11  VAL  57          1HG1      VAL  57 -10.804  -0.031  -4.087
  339   HG12  VAL  57          2HG1      VAL  57 -11.902   0.999  -5.009
  340   HG13  VAL  57          3HG1      VAL  57 -11.540  -0.655  -5.572
  341   HG21  VAL  57          3HG2      VAL  57  -9.261  -1.116  -6.708
  342   HG22  VAL  57          1HG2      VAL  57  -7.973   0.087  -6.526
  343   HG23  VAL  57          2HG2      VAL  57  -8.609  -0.737  -5.100
  344    H    SER  58           H        SER  58  -8.558   2.991  -6.120
  345    HA   SER  58           HA       SER  58  -6.541   2.648  -8.211
  346    HB3  SER  58           2HB      SER  58  -7.436   5.446  -7.419
  347    HG   SER  58           HG       SER  58  -5.470   5.803  -8.121
  348    H    GLU  59           H        GLU  59  -4.478   4.035  -7.388
  349    HA   GLU  59           HA       GLU  59  -3.473   3.036  -4.985
  350    HB3  GLU  59           2HB      GLU  59  -1.840   3.827  -6.299
  351    HG3  GLU  59           2HG      GLU  59  -2.909   5.191  -7.950
  352    H    ILE  60           H        ILE  60  -5.487   5.912  -5.339
  353    HA   ILE  60           HA       ILE  60  -5.538   7.112  -2.830
  354    HB   ILE  60           HB       ILE  60  -7.636   6.350  -4.872
  355   HG13  ILE  60          2HG1      ILE  60  -5.918   8.216  -5.159
  356   HG21  ILE  60          1HG2      ILE  60  -8.272   7.694  -2.223
  357   HG22  ILE  60          2HG2      ILE  60  -9.340   7.720  -3.646
  358   HG23  ILE  60          3HG2      ILE  60  -8.964   6.185  -2.888
  359   HD11  ILE  60          3HD1      ILE  60  -7.402   9.832  -6.124
  360   HD12  ILE  60          1HD1      ILE  60  -8.050   8.216  -6.464
  361   HD13  ILE  60          2HD1      ILE  60  -8.784   9.232  -5.197
  362    H    THR  61           H        THR  61  -7.116   3.974  -3.573
  363    HA   THR  61           HA       THR  61  -8.377   3.704  -1.000
  364    HB   THR  61           HB       THR  61  -7.817   1.884  -3.343
  365    HG1  THR  61           1HG      THR  61  -9.527   3.251  -3.518
  366   HG21  THR  61          3HG2      THR  61  -9.078   1.017  -0.701
  367   HG22  THR  61          1HG2      THR  61  -7.671   0.289  -1.514
  368   HG23  THR  61          2HG2      THR  61  -9.270   0.157  -2.246
  369    H    ILE  62           H        ILE  62  -5.215   2.563  -2.164
  370    HA   ILE  62           HA       ILE  62  -4.664   1.303   0.462
  371    HB   ILE  62           HB       ILE  62  -3.850   0.157  -1.478
  372   HG13  ILE  62          2HG1      ILE  62  -2.564   0.106   0.673
  373   HG21  ILE  62          1HG2      ILE  62  -3.558   1.984  -3.058
  374   HG22  ILE  62          2HG2      ILE  62  -2.172   2.616  -2.132
  375   HG23  ILE  62          3HG2      ILE  62  -2.082   1.048  -2.961
  376   HD11  ILE  62          3HD1      ILE  62  -1.894  -1.384  -1.260
  377   HD12  ILE  62          1HD1      ILE  62  -0.672  -0.169  -1.700
  378   HD13  ILE  62          2HD1      ILE  62  -0.586  -0.983  -0.132
  379    H    GLN  63           H        GLN  63  -3.931   4.371  -1.174
  380    HA   GLN  63           HA       GLN  63  -2.035   5.348   0.696
  381    HB3  GLN  63           2HB      GLN  63  -4.145   7.082  -0.631
  382    HG3  GLN  63           2HG      GLN  63  -1.145   7.507  -0.321
  383   HE21  GLN  63          1HE2      GLN  63  -3.916   9.673   0.353
  384   HE22  GLN  63          2HE2      GLN  63  -3.585  10.769  -0.989
  385    H    GLU  64           H        GLU  64  -5.650   5.502   0.835
  386    HA   GLU  64           HA       GLU  64  -5.771   6.858   3.374
  387    HB3  GLU  64           2HB      GLU  64  -8.062   5.683   3.478
  388    HG3  GLU  64           2HG      GLU  64  -8.997   6.965   1.546
  389    H    ARG  65           H        ARG  65  -5.096   3.421   2.716
  390    HA   ARG  65           HA       ARG  65  -5.413   2.759   5.572
  391    HB3  ARG  65           2HB      ARG  65  -4.363   1.198   3.175
  392    HG3  ARG  65           2HG      ARG  65  -3.409   0.001   4.965
  393    HD3  ARG  65           2HD      ARG  65  -4.379   0.865   6.995
  394    HE   ARG  65           HE       ARG  65  -6.936   0.562   5.846
  395   HH11  ARG  65          1HH1      ARG  65  -5.375  -0.168   8.951
  396   HH12  ARG  65          2HH1      ARG  65  -6.852   0.132   9.829
  397   HH21  ARG  65          1HH2      ARG  65  -8.728   0.925   7.026
  398   HH22  ARG  65          2HH2      ARG  65  -8.728   0.801   8.772
  399    H    ILE  66           H        ILE  66  -2.629   3.573   3.454
  400    HA   ILE  66           HA       ILE  66  -0.761   3.271   5.726
  401    HB   ILE  66           HB       ILE  66  -0.479   4.654   3.031
  402   HG13  ILE  66          2HG1      ILE  66   0.687   2.140   4.339
  403   HG21  ILE  66          1HG2      ILE  66   1.872   5.077   3.621
  404   HG22  ILE  66          2HG2      ILE  66   0.805   5.979   4.678
  405   HG23  ILE  66          3HG2      ILE  66   1.576   4.481   5.272
  406   HD11  ILE  66          3HD1      ILE  66  -0.503   2.667   1.585
  407   HD12  ILE  66          1HD1      ILE  66   0.243   1.146   2.078
  408   HD13  ILE  66          2HD1      ILE  66  -1.242   1.674   2.877
  409    H    ALA  67           H        ALA  67  -2.594   6.066   4.425
  410    HA   ALA  67           HA       ALA  67  -1.552   7.949   6.261
  411    HB1  ALA  67           1HB      ALA  67  -4.278   7.870   4.898
  412    HB2  ALA  67           2HB      ALA  67  -3.479   9.303   5.580
  413    HB3  ALA  67           3HB      ALA  67  -2.758   8.472   4.188
  414    H    ALA  68           H        ALA  68  -4.372   5.724   6.598
  415    HA   ALA  68           HA       ALA  68  -5.329   6.837   9.047
  416    HB1  ALA  68           1HB      ALA  68  -6.700   4.770   9.115
  417    HB2  ALA  68           2HB      ALA  68  -6.707   5.548   7.521
  418    HB3  ALA  68           3HB      ALA  68  -5.724   4.089   7.789
  419    H    LEU  69           H        LEU  69  -2.707   4.532   8.509
  420    HA   LEU  69           HA       LEU  69  -2.371   3.916  11.371
  421    HB3  LEU  69           2HB      LEU  69  -0.094   3.286  10.769
  422    HG   LEU  69           HG       LEU  69  -1.724   2.148   8.504
  423   HD11  LEU  69          1HD1      LEU  69   0.681   1.586   8.727
  424   HD12  LEU  69          2HD1      LEU  69  -0.334   0.165   9.025
  425   HD13  LEU  69          3HD1      LEU  69   0.404   1.022  10.388
  426   HD21  LEU  69          3HD2      LEU  69  -2.598   0.408  10.008
  427   HD22  LEU  69          1HD2      LEU  69  -3.249   1.986  10.432
  428   HD23  LEU  69          2HD2      LEU  69  -1.946   1.280  11.418
  429    H    GLY  70           H        GLY  70  -1.907   6.813   9.567
  430    HA2  GLY  70           2HA      GLY  70  -1.187   8.867  10.370
  431    HA3  GLY  70           3HA      GLY  70  -0.337   8.098  11.732
  432    H    TYR  71           H        TYR  71   0.318   6.581   8.717
  433    HA   TYR  71           HA       TYR  71   2.932   8.003   8.455
  434    HB3  TYR  71           2HB      TYR  71   3.587   6.014   7.104
  435    HD1  TYR  71           1HD      TYR  71   4.549   7.070   9.632
  436    HD2  TYR  71           2HD      TYR  71   2.273   3.487   8.860
  437    HE1  TYR  71           1HE      TYR  71   5.449   6.059  11.706
  438    HE2  TYR  71           2HE      TYR  71   3.181   2.474  10.934
  439    HH   TYR  71           HH       TYR  71   5.428   4.236  13.119
  440    H    THR  72           H        THR  72   3.463   7.475   5.763
  441    HA   THR  72           HA       THR  72   1.314   8.769   4.180
  442    HB   THR  72           HB       THR  72   4.145   9.930   4.218
  443    HG1  THR  72           1HG      THR  72   3.435  10.409   6.198
  444   HG21  THR  72          3HG2      THR  72   1.477  11.091   3.299
  445   HG22  THR  72          1HG2      THR  72   2.749  10.468   2.226
  446   HG23  THR  72          2HG2      THR  72   3.054  11.895   3.222
  447    H    LEU  73           H        LEU  73   1.542   8.249   1.936
  448    HA   LEU  73           HA       LEU  73   3.488   6.094   1.329
  449    HB3  LEU  73           2HB      LEU  73   1.213   7.131  -0.387
  450    HG   LEU  73           HG       LEU  73   2.554   5.365  -1.506
  451   HD11  LEU  73          1HD1      LEU  73   2.381   3.016  -0.533
  452   HD12  LEU  73          2HD1      LEU  73   1.792   3.744   0.963
  453   HD13  LEU  73          3HD1      LEU  73   3.436   4.095   0.387
  454   HD21  LEU  73          3HD2      LEU  73   0.605   3.903  -1.997
  455   HD22  LEU  73          1HD2      LEU  73   0.112   5.597  -1.894
  456   HD23  LEU  73          2HD2      LEU  73  -0.213   4.487  -0.543
  457    H    ALA  74           H        ALA  74   4.842   6.066  -0.565
  458    HA   ALA  74           HA       ALA  74   5.308   8.718  -1.868
  459    HB1  ALA  74           1HB      ALA  74   7.395   6.608  -1.210
  460    HB2  ALA  74           2HB      ALA  74   7.669   8.218  -1.862
  461    HB3  ALA  74           3HB      ALA  74   7.055   8.039  -0.212
  462    H    GLU  75           H        GLU  75   3.411   7.132  -3.010
  463    HA   GLU  75           HA       GLU  75   4.591   5.980  -5.477
  464    HB3  GLU  75           2HB      GLU  75   1.660   6.592  -5.339
  465    HG3  GLU  75           2HG      GLU  75   1.421   4.278  -6.134
  466    HA   PRO  76           HA       PRO  76   5.036  10.302  -5.961
  467    HB3  PRO  76           2HB      PRO  76   7.141   9.795  -6.735
  468    HG3  PRO  76           2HG      PRO  76   7.504   8.002  -8.274
  469    HD3  PRO  76           2HD      PRO  76   6.362   7.134  -6.405
  Start of MODEL    5
    1    H2   PRO   6           2H       PRO   6  -6.469  -3.608 -17.463
    2    HA   PRO   6           HA       PRO   6  -8.559  -5.113 -16.079
    3    HB3  PRO   6           2HB      PRO   6  -7.730  -7.137 -16.701
    4    HG3  PRO   6           2HG      PRO   6  -7.615  -6.873 -19.021
    5    HD3  PRO   6           2HD      PRO   6  -8.819  -4.878 -18.699
    6    H    LEU   7           H        LEU   7  -6.969  -6.435 -14.250
    7    HA   LEU   7           HA       LEU   7  -5.918  -4.384 -12.543
    8    HB3  LEU   7           2HB      LEU   7  -7.007  -6.456 -11.721
    9    HG   LEU   7           HG       LEU   7  -4.378  -7.857 -12.411
   10   HD11  LEU   7          1HD1      LEU   7  -5.245  -8.364 -10.184
   11   HD12  LEU   7          2HD1      LEU   7  -5.363  -9.773 -11.236
   12   HD13  LEU   7          3HD1      LEU   7  -6.821  -8.820 -10.867
   13   HD21  LEU   7          3HD2      LEU   7  -7.206  -8.407 -13.427
   14   HD22  LEU   7          1HD2      LEU   7  -5.851  -9.544 -13.575
   15   HD23  LEU   7          2HD2      LEU   7  -5.769  -7.998 -14.406
   16    H    LYS   8           H        LYS   8  -3.815  -4.013 -11.859
   17    HA   LYS   8           HA       LYS   8  -1.537  -5.000 -13.456
   18    HB3  LYS   8           2HB      LYS   8  -2.363  -3.415 -14.962
   19    HG3  LYS   8           2HG      LYS   8  -3.799  -2.051 -13.243
   20    HD3  LYS   8           2HD      LYS   8  -1.389  -0.206 -13.473
   21    HE3  LYS   8           2HE      LYS   8  -3.933  -0.071 -11.789
   22    HZ1  LYS   8           3HZ      LYS   8  -2.001   2.057 -12.480
   23    HZ2  LYS   8           1HZ      LYS   8  -1.970   1.256 -11.045
   24    HZ3  LYS   8           2HZ      LYS   8  -3.260   2.210 -11.465
   25    H    THR   9           H        THR   9   0.487  -4.596 -12.616
   26    HA   THR   9           HA       THR   9   0.537  -4.130  -9.724
   27    HB   THR   9           HB       THR   9   1.614  -6.077 -10.915
   28    HG1  THR   9           1HG      THR   9   3.183  -6.105  -9.369
   29   HG21  THR   9          3HG2      THR   9   3.922  -4.137 -11.345
   30   HG22  THR   9          1HG2      THR   9   2.826  -4.634 -12.656
   31   HG23  THR   9          2HG2      THR   9   3.807  -5.846 -11.816
   32    H    GLN  10           H        GLN  10   2.391  -3.018  -8.729
   33    HA   GLN  10           HA       GLN  10   4.019  -1.123  -9.917
   34    HB3  GLN  10           2HB      GLN  10   2.200   0.355 -10.428
   35    HG3  GLN  10           2HG      GLN  10   1.025   1.431  -8.327
   36   HE21  GLN  10          1HE2      GLN  10  -0.128  -1.891  -8.302
   37   HE22  GLN  10          2HE2      GLN  10  -1.350  -1.642  -9.538
   38    H    GLN  11           H        GLN  11   5.293   0.066  -8.361
   39    HA   GLN  11           HA       GLN  11   5.132  -0.964  -5.561
   40    HB3  GLN  11           2HB      GLN  11   7.613  -0.583  -5.529
   41    HG3  GLN  11           2HG      GLN  11   6.305  -2.836  -6.389
   42   HE21  GLN  11          1HE2      GLN  11   9.484  -2.082  -7.954
   43   HE22  GLN  11          2HE2      GLN  11   9.019  -2.792  -9.500
   44    H    MET  12           H        MET  12   6.165   0.447  -3.941
   45    HA   MET  12           HA       MET  12   6.523   3.271  -4.551
   46    HB3  MET  12           2HB      MET  12   4.068   3.145  -4.286
   47    HG3  MET  12           2HG      MET  12   4.626   2.396  -1.384
   48    HE1  MET  12           3HE      MET  12   1.955   2.250  -4.270
   49    HE2  MET  12           1HE      MET  12   1.621   0.844  -3.237
   50    HE3  MET  12           2HE      MET  12   0.454   2.182  -3.328
   51    H    GLN  13           H        GLN  13   7.680   4.385  -2.988
   52    HA   GLN  13           HA       GLN  13   8.817   2.859  -0.699
   53    HB3  GLN  13           2HB      GLN  13  10.219   4.887  -0.416
   54    HG3  GLN  13           2HG      GLN  13  11.480   4.898  -2.576
   55   HE21  GLN  13          1HE2      GLN  13  12.535   3.959  -0.542
   56   HE22  GLN  13          2HE2      GLN  13  12.884   2.234  -0.583
   57    H    VAL  14           H        VAL  14   8.411   3.454   1.454
   58    HA   VAL  14           HA       VAL  14   6.206   5.399   1.991
   59    HB   VAL  14           HB       VAL  14   6.197   2.430   2.311
   60   HG11  VAL  14          1HG1      VAL  14   5.983   3.089   4.663
   61   HG12  VAL  14          2HG1      VAL  14   4.678   4.220   4.261
   62   HG13  VAL  14          3HG1      VAL  14   4.442   2.484   4.039
   63   HG21  VAL  14          3HG2      VAL  14   3.866   2.655   1.672
   64   HG22  VAL  14          1HG2      VAL  14   3.962   4.418   1.803
   65   HG23  VAL  14          2HG2      VAL  14   4.880   3.566   0.544
   66    H    GLY  15           H        GLY  15   6.163   6.301   3.973
   67    HA2  GLY  15           2HA      GLY  15   8.778   6.225   5.466
   68    HA3  GLY  15           3HA      GLY  15   7.764   7.656   5.220
   69    H    GLY  16           H        GLY  16   8.613   5.307   7.396
   70    HA2  GLY  16           2HA      GLY  16   8.019   5.359   9.667
   71    HA3  GLY  16           3HA      GLY  16   6.412   6.011   9.267
   72    H    MET  17           H        MET  17   7.342   3.278   7.331
   73    HA   MET  17           HA       MET  17   5.569   1.541   9.021
   74    HB3  MET  17           2HB      MET  17   5.728   1.271   6.029
   75    HG3  MET  17           2HG      MET  17   3.523   0.907   8.093
   76    HE1  MET  17           3HE      MET  17   3.038  -0.435   3.708
   77    HE2  MET  17           1HE      MET  17   4.578   0.207   4.303
   78    HE3  MET  17           2HE      MET  17   3.933  -1.303   4.971
   79    H    ARG  18           H        ARG  18   8.742   1.754   8.197
   80    HA   ARG  18           HA       ARG  18   9.334  -0.979   7.497
   81    HB3  ARG  18           2HB      ARG  18  10.735   0.812   6.788
   82    HG3  ARG  18           2HG      ARG  18  11.845   1.180   9.593
   83    HD3  ARG  18           2HD      ARG  18  12.863   3.186   8.520
   84    HE   ARG  18           HE       ARG  18  13.894   0.725   8.296
   85   HH11  ARG  18          1HH1      ARG  18  13.775   3.251   5.771
   86   HH12  ARG  18          2HH1      ARG  18  15.298   2.717   5.097
   87   HH21  ARG  18          1HH2      ARG  18  15.817   0.161   7.366
   88   HH22  ARG  18          2HH2      ARG  18  16.450   1.056   6.022
   89    H    CYS  19           H        CYS  19   7.736  -1.543   9.316
   90    HA   CYS  19           HA       CYS  19   9.208  -2.792  11.536
   91    HB3  CYS  19           2HB      CYS  19   6.960  -0.767  11.954
   92    HG   CYS  19           HG       CYS  19   7.462  -0.920  14.584
   93    H    ALA  20           H        ALA  20   8.414  -4.787  11.857
   94    HA   ALA  20           HA       ALA  20   6.490  -5.974  10.204
   95    HB1  ALA  20           1HB      ALA  20   6.752  -7.922  11.703
   96    HB2  ALA  20           2HB      ALA  20   8.319  -7.161  11.371
   97    HB3  ALA  20           3HB      ALA  20   7.515  -6.890  12.930
   98    H    ALA  21           H        ALA  21   5.971  -4.589  13.459
   99    HA   ALA  21           HA       ALA  21   3.282  -5.446  13.860
  100    HB1  ALA  21           1HB      ALA  21   4.697  -4.409  15.603
  101    HB2  ALA  21           2HB      ALA  21   4.679  -2.864  14.723
  102    HB3  ALA  21           3HB      ALA  21   3.180  -3.519  15.407
  103    H    CYS  22           H        CYS  22   4.564  -2.597  12.096
  104    HA   CYS  22           HA       CYS  22   1.933  -1.581  11.450
  105    HB3  CYS  22           2HB      CYS  22   3.208   0.122  10.199
  106    HG   CYS  22           HG       CYS  22   3.054   0.324  12.863
  107    H    ALA  23           H        ALA  23   4.394  -3.362   9.568
  108    HA   ALA  23           HA       ALA  23   2.936  -3.702   7.162
  109    HB1  ALA  23           1HB      ALA  23   5.294  -4.403   7.574
  110    HB2  ALA  23           2HB      ALA  23   4.711  -5.703   8.639
  111    HB3  ALA  23           3HB      ALA  23   4.307  -5.727   6.915
  112    H    SER  24           H        SER  24   2.480  -5.235  10.348
  113    HA   SER  24           HA       SER  24   0.712  -7.331   9.328
  114    HB3  SER  24           2HB      SER  24   0.251  -7.822  11.687
  115    HG   SER  24           HG       SER  24   3.010  -7.234  11.230
  116    H    SER  25           H        SER  25   0.212  -4.005  10.334
  117    HA   SER  25           HA       SER  25  -2.688  -4.213  10.630
  118    HB3  SER  25           2HB      SER  25  -2.644  -1.921  11.142
  119    HG   SER  25           HG       SER  25  -0.582  -1.631  12.361
  120    H    ILE  26           H        ILE  26  -0.415  -2.955   8.157
  121    HA   ILE  26           HA       ILE  26  -2.583  -2.274   6.303
  122    HB   ILE  26           HB       ILE  26   0.420  -2.364   6.135
  123   HG13  ILE  26          2HG1      ILE  26  -1.660  -0.246   5.466
  124   HG21  ILE  26          1HG2      ILE  26  -1.396  -2.153   3.693
  125   HG22  ILE  26          2HG2      ILE  26   0.339  -1.774   3.714
  126   HG23  ILE  26          3HG2      ILE  26  -0.187  -3.423   4.004
  127   HD11  ILE  26          3HD1      ILE  26  -1.281  -0.322   7.893
  128   HD12  ILE  26          1HD1      ILE  26   0.479  -0.312   7.637
  129   HD13  ILE  26          2HD1      ILE  26  -0.485   1.108   7.191
  130    H    GLU  27           H        GLU  27  -0.369  -5.154   6.509
  131    HA   GLU  27           HA       GLU  27  -1.480  -6.192   4.072
  132    HB3  GLU  27           2HB      GLU  27  -0.312  -8.322   4.686
  133    HG3  GLU  27           2HG      GLU  27   1.437  -5.845   4.935
  134    H    ARG  28           H        ARG  28  -2.564  -6.621   7.438
  135    HA   ARG  28           HA       ARG  28  -4.344  -8.829   6.781
  136    HB3  ARG  28           2HB      ARG  28  -4.639  -6.855   9.071
  137    HG3  ARG  28           2HG      ARG  28  -6.484  -8.632   8.649
  138    HD3  ARG  28           2HD      ARG  28  -4.363 -10.487   9.824
  139    HE   ARG  28           HE       ARG  28  -6.688 -11.659   8.567
  140   HH11  ARG  28          1HH1      ARG  28  -5.563 -10.472  11.753
  141   HH12  ARG  28          2HH1      ARG  28  -6.674 -11.566  12.559
  142   HH21  ARG  28          1HH2      ARG  28  -8.216 -12.794   9.766
  143   HH22  ARG  28          2HH2      ARG  28  -8.122 -12.757  11.510
  144    H    ALA  29           H        ALA  29  -4.683  -5.272   6.693
  145    HA   ALA  29           HA       ALA  29  -7.550  -5.375   6.060
  146    HB1  ALA  29           1HB      ALA  29  -7.247  -2.937   5.783
  147    HB2  ALA  29           2HB      ALA  29  -6.596  -3.520   7.325
  148    HB3  ALA  29           3HB      ALA  29  -5.488  -3.124   5.987
  149    H    LEU  30           H        LEU  30  -4.512  -5.019   4.216
  150    HA   LEU  30           HA       LEU  30  -5.713  -4.197   1.793
  151    HB3  LEU  30           2HB      LEU  30  -3.022  -5.511   2.347
  152    HG   LEU  30           HG       LEU  30  -3.242  -5.244  -0.085
  153   HD11  LEU  30          1HD1      LEU  30  -3.938  -2.332   0.540
  154   HD12  LEU  30          2HD1      LEU  30  -5.005  -3.531  -0.228
  155   HD13  LEU  30          3HD1      LEU  30  -3.561  -2.972  -1.075
  156   HD21  LEU  30          3HD2      LEU  30  -1.563  -3.068   1.258
  157   HD22  LEU  30          1HD2      LEU  30  -1.329  -3.661  -0.393
  158   HD23  LEU  30          2HD2      LEU  30  -1.075  -4.752   0.986
  159    H    GLU  31           H        GLU  31  -5.558  -7.416   3.075
  160    HA   GLU  31           HA       GLU  31  -6.274  -8.679   0.512
  161    HB3  GLU  31           2HB      GLU  31  -4.993 -10.022   2.074
  162    HG3  GLU  31           2HG      GLU  31  -7.260  -9.463   4.026
  163    H    ARG  32           H        ARG  32  -7.957  -6.770   2.731
  164    HA   ARG  32           HA       ARG  32 -10.575  -8.061   2.156
  165    HB3  ARG  32           2HB      ARG  32 -11.422  -6.573   3.988
  166    HG3  ARG  32           2HG      ARG  32  -9.205  -8.570   4.570
  167    HD3  ARG  32           2HD      ARG  32 -11.038  -7.232   6.585
  168    HE   ARG  32           HE       ARG  32  -9.960  -9.776   6.729
  169   HH11  ARG  32          1HH1      ARG  32  -9.271  -6.801   8.543
  170   HH12  ARG  32          2HH1      ARG  32  -8.802  -7.689   9.977
  171   HH21  ARG  32          1HH2      ARG  32  -9.518 -10.823   8.668
  172   HH22  ARG  32          2HH2      ARG  32  -9.167  -9.905  10.097
  173    H    LEU  33           H        LEU  33  -8.883  -4.876   1.957
  174    HA   LEU  33           HA       LEU  33 -10.873  -3.252   0.877
  175    HB3  LEU  33           2HB      LEU  33  -9.139  -2.005  -0.290
  176    HG   LEU  33           HG       LEU  33  -7.705  -3.075   2.154
  177   HD11  LEU  33          1HD1      LEU  33  -7.523  -0.365   0.803
  178   HD12  LEU  33          2HD1      LEU  33  -6.384  -1.699   0.539
  179   HD13  LEU  33          3HD1      LEU  33  -6.532  -0.965   2.146
  180   HD21  LEU  33          3HD2      LEU  33  -8.649  -1.156   3.398
  181   HD22  LEU  33          1HD2      LEU  33  -9.894  -2.320   2.921
  182   HD23  LEU  33          2HD2      LEU  33  -9.709  -0.792   2.019
  183    H    LYS  34           H        LYS  34 -11.981  -2.993  -1.046
  184    HA   LYS  34           HA       LYS  34 -12.023  -5.215  -2.852
  185    HB3  LYS  34           2HB      LYS  34 -13.963  -3.737  -2.320
  186    HG3  LYS  34           2HG      LYS  34 -12.474  -1.794  -4.134
  187    HD3  LYS  34           2HD      LYS  34 -15.465  -1.874  -3.619
  188    HE3  LYS  34           2HE      LYS  34 -13.664   0.003  -5.224
  189    HZ1  LYS  34           3HZ      LYS  34 -15.758   1.084  -5.811
  190    HZ2  LYS  34           1HZ      LYS  34 -16.614  -0.062  -5.028
  191    HZ3  LYS  34           2HZ      LYS  34 -15.739  -0.463  -6.377
  192    H    GLY  35           H        GLY  35 -11.802  -5.087  -5.260
  193    HA2  GLY  35           2HA      GLY  35 -10.770  -4.554  -7.251
  194    HA3  GLY  35           3HA      GLY  35 -10.250  -3.021  -6.520
  195    H    VAL  36           H        VAL  36  -8.602  -4.097  -4.471
  196    HA   VAL  36           HA       VAL  36  -6.122  -4.758  -5.736
  197    HB   VAL  36           HB       VAL  36  -7.019  -5.123  -2.852
  198   HG11  VAL  36          1HG1      VAL  36  -4.580  -5.088  -2.284
  199   HG12  VAL  36          2HG1      VAL  36  -5.029  -6.518  -3.204
  200   HG13  VAL  36          3HG1      VAL  36  -4.194  -5.173  -4.013
  201   HG21  VAL  36          3HG2      VAL  36  -7.108  -2.768  -3.601
  202   HG22  VAL  36          1HG2      VAL  36  -5.847  -3.031  -2.401
  203   HG23  VAL  36          2HG2      VAL  36  -5.408  -2.871  -4.113
  204    H    ALA  37           H        ALA  37  -5.134  -6.659  -6.161
  205    HA   ALA  37           HA       ALA  37  -6.600  -9.236  -5.610
  206    HB1  ALA  37           1HB      ALA  37  -4.855  -8.461  -7.975
  207    HB2  ALA  37           2HB      ALA  37  -5.757  -9.976  -7.785
  208    HB3  ALA  37           3HB      ALA  37  -6.640  -8.448  -7.980
  209    H    GLU  38           H        GLU  38  -3.406  -7.667  -5.482
  210    HA   GLU  38           HA       GLU  38  -2.376  -9.790  -3.851
  211    HB3  GLU  38           2HB      GLU  38  -1.091  -9.449  -6.585
  212    HG3  GLU  38           2HG      GLU  38  -0.347 -11.105  -4.140
  213    H    ALA  39           H        ALA  39  -0.720  -9.016  -2.500
  214    HA   ALA  39           HA       ALA  39   0.839  -6.664  -3.266
  215    HB1  ALA  39           1HB      ALA  39  -1.086  -6.531  -0.901
  216    HB2  ALA  39           2HB      ALA  39   0.033  -5.257  -1.450
  217    HB3  ALA  39           3HB      ALA  39  -1.349  -5.722  -2.457
  218    H    SER  40           H        SER  40   2.480  -6.088  -1.668
  219    HA   SER  40           HA       SER  40   2.981  -7.898   0.605
  220    HB3  SER  40           2HB      SER  40   3.877  -9.358  -0.954
  221    HG   SER  40           HG       SER  40   5.586  -8.424  -2.461
  222    H    VAL  41           H        VAL  41   3.791  -6.771   2.235
  223    HA   VAL  41           HA       VAL  41   5.250  -4.205   1.777
  224    HB   VAL  41           HB       VAL  41   4.306  -5.506   4.373
  225   HG11  VAL  41          1HG1      VAL  41   5.665  -2.815   3.890
  226   HG12  VAL  41          2HG1      VAL  41   4.888  -3.308   5.410
  227   HG13  VAL  41          3HG1      VAL  41   6.310  -4.173   4.838
  228   HG21  VAL  41          3HG2      VAL  41   2.457  -4.572   2.953
  229   HG22  VAL  41          1HG2      VAL  41   2.671  -3.706   4.482
  230   HG23  VAL  41          2HG2      VAL  41   3.281  -3.001   2.977
  231    H    THR  42           H        THR  42   7.402  -4.151   1.747
  232    HA   THR  42           HA       THR  42   9.020  -6.494   2.604
  233    HB   THR  42           HB       THR  42  10.013  -3.986   1.223
  234    HG1  THR  42           1HG      THR  42   8.943  -6.333   0.028
  235   HG21  THR  42          3HG2      THR  42  11.672  -5.580   0.293
  236   HG22  THR  42          1HG2      THR  42  10.948  -6.894   1.242
  237   HG23  THR  42          2HG2      THR  42  11.741  -5.527   2.063
  238    H    VAL  43           H        VAL  43   9.384  -6.435   4.750
  239    HA   VAL  43           HA       VAL  43   8.871  -4.087   6.250
  240    HB   VAL  43           HB       VAL  43  10.128  -6.704   7.163
  241   HG11  VAL  43          1HG1      VAL  43   8.871  -4.465   8.818
  242   HG12  VAL  43          2HG1      VAL  43   9.256  -6.090   9.428
  243   HG13  VAL  43          3HG1      VAL  43  10.555  -5.025   8.909
  244   HG21  VAL  43          3HG2      VAL  43   7.880  -6.978   6.169
  245   HG22  VAL  43          1HG2      VAL  43   7.779  -7.173   7.921
  246   HG23  VAL  43          2HG2      VAL  43   7.260  -5.652   7.167
  247    H    ALA  44           H        ALA  44  12.030  -5.393   5.244
  248    HA   ALA  44           HA       ALA  44  13.763  -4.098   6.984
  249    HB1  ALA  44           1HB      ALA  44  15.407  -4.253   5.125
  250    HB2  ALA  44           2HB      ALA  44  14.464  -5.741   5.302
  251    HB3  ALA  44           3HB      ALA  44  14.087  -4.600   3.989
  252    H    THR  45           H        THR  45  12.252  -2.623   4.111
  253    HA   THR  45           HA       THR  45  13.188   0.076   5.004
  254    HB   THR  45           HB       THR  45  13.190   0.627   2.517
  255    HG1  THR  45           1HG      THR  45  13.652  -1.476   1.357
  256   HG21  THR  45          3HG2      THR  45  15.162  -1.537   3.390
  257   HG22  THR  45          1HG2      THR  45  15.255   0.165   3.885
  258   HG23  THR  45          2HG2      THR  45  15.417  -0.262   2.181
  259    H    GLY  46           H        GLY  46  10.448  -1.783   4.658
  260    HA2  GLY  46           2HA      GLY  46   8.285  -1.206   5.166
  261    HA3  GLY  46           3HA      GLY  46   8.732   0.518   5.162
  262    H    ARG  47           H        ARG  47   9.691  -1.003   2.299
  263    HA   ARG  47           HA       ARG  47   7.854   0.638   0.761
  264    HB3  ARG  47           2HB      ARG  47  10.239   0.489   0.198
  265    HG3  ARG  47           2HG      ARG  47   9.636  -2.373  -0.669
  266    HD3  ARG  47           2HD      ARG  47  12.194  -0.721  -0.811
  267    HE   ARG  47           HE       ARG  47  12.997  -2.910  -0.842
  268   HH11  ARG  47          1HH1      ARG  47  10.189  -2.810  -3.048
  269   HH12  ARG  47          2HH1      ARG  47  10.693  -4.279  -3.839
  270   HH21  ARG  47          1HH2      ARG  47  13.399  -4.849  -1.731
  271   HH22  ARG  47          2HH2      ARG  47  12.393  -5.487  -3.022
  272    H    LEU  48           H        LEU  48   6.733  -0.185  -1.144
  273    HA   LEU  48           HA       LEU  48   5.291  -2.736  -0.514
  274    HB3  LEU  48           2HB      LEU  48   3.437  -0.903  -1.637
  275    HG   LEU  48           HG       LEU  48   4.012  -1.660   1.252
  276   HD11  LEU  48          1HD1      LEU  48   2.897   0.521   1.234
  277   HD12  LEU  48          2HD1      LEU  48   1.727  -0.717   1.724
  278   HD13  LEU  48          3HD1      LEU  48   1.691  -0.065   0.070
  279   HD21  LEU  48          3HD2      LEU  48   1.913  -3.024   0.949
  280   HD22  LEU  48          1HD2      LEU  48   3.157  -3.507  -0.208
  281   HD23  LEU  48          2HD2      LEU  48   1.812  -2.487  -0.736
  282    H    THR  49           H        THR  49   4.164  -3.722  -2.075
  283    HA   THR  49           HA       THR  49   4.385  -3.032  -4.967
  284    HB   THR  49           HB       THR  49   4.802  -5.836  -3.832
  285    HG1  THR  49           1HG      THR  49   6.630  -4.659  -3.499
  286   HG21  THR  49          3HG2      THR  49   3.724  -5.840  -6.055
  287   HG22  THR  49          1HG2      THR  49   5.397  -6.389  -6.181
  288   HG23  THR  49          2HG2      THR  49   4.965  -4.739  -6.685
  289    H    VAL  50           H        VAL  50   2.403  -3.259  -5.885
  290    HA   VAL  50           HA       VAL  50   0.298  -4.877  -4.584
  291    HB   VAL  50           HB       VAL  50   0.203  -2.791  -3.322
  292   HG11  VAL  50          1HG1      VAL  50   1.113  -1.203  -5.001
  293   HG12  VAL  50          2HG1      VAL  50  -0.393  -1.339  -5.935
  294   HG13  VAL  50          3HG1      VAL  50  -0.413  -0.649  -4.304
  295   HG21  VAL  50          3HG2      VAL  50  -2.199  -2.966  -5.185
  296   HG22  VAL  50          1HG2      VAL  50  -1.910  -4.023  -3.795
  297   HG23  VAL  50          2HG2      VAL  50  -2.153  -2.287  -3.549
  298    H    THR  51           H        THR  51  -1.306  -5.508  -5.892
  299    HA   THR  51           HA       THR  51  -1.431  -4.622  -8.749
  300    HB   THR  51           HB       THR  51  -1.895  -7.384  -7.502
  301    HG1  THR  51           1HG      THR  51   0.244  -6.973  -7.970
  302   HG21  THR  51          3HG2      THR  51  -2.368  -8.117  -9.838
  303   HG22  THR  51          1HG2      THR  51  -2.277  -6.437 -10.410
  304   HG23  THR  51          2HG2      THR  51  -3.579  -6.944  -9.325
  305    H    TYR  52           H        TYR  52  -3.324  -3.669  -9.263
  306    HA   TYR  52           HA       TYR  52  -5.847  -4.497  -8.013
  307    HB3  TYR  52           2HB      TYR  52  -4.911  -2.821  -6.438
  308    HD1  TYR  52           2HD      TYR  52  -6.531  -0.606  -8.963
  309    HD2  TYR  52           1HD      TYR  52  -2.977  -1.390  -6.668
  310    HE1  TYR  52           2HE      TYR  52  -5.595   1.577  -9.677
  311    HE2  TYR  52           1HE      TYR  52  -2.080   0.846  -7.296
  312    HH   TYR  52           HH       TYR  52  -2.421   2.786  -8.562
  313    H    ASP  53           H        ASP  53  -7.793  -3.406  -8.986
  314    HA   ASP  53           HA       ASP  53  -7.484  -3.043 -11.876
  315    HB3  ASP  53           2HB      ASP  53  -9.874  -3.390 -10.052
  316    HA   PRO  54           HA       PRO  54  -7.387   1.349 -11.043
  317    HB3  PRO  54           2HB      PRO  54  -5.826   1.403 -12.734
  318    HG3  PRO  54           2HG      PRO  54  -6.085   0.095 -14.727
  319    HD3  PRO  54           2HD      PRO  54  -6.182  -1.407 -12.910
  320    H    LYS  55           H        LYS  55 -10.123  -0.142 -11.827
  321    HA   LYS  55           HA       LYS  55 -11.671   2.357 -12.539
  322    HB3  LYS  55           2HB      LYS  55 -13.264   0.871 -13.704
  323    HG3  LYS  55           2HG      LYS  55 -10.416   0.591 -14.761
  324    HD3  LYS  55           2HD      LYS  55 -13.114   0.222 -16.130
  325    HE3  LYS  55           2HE      LYS  55 -11.531   1.200 -17.737
  326    HZ1  LYS  55           3HZ      LYS  55  -9.565  -0.370 -18.267
  327    HZ2  LYS  55           1HZ      LYS  55  -9.759  -0.957 -16.764
  328    HZ3  LYS  55           2HZ      LYS  55  -9.398   0.638 -16.993
  329    H    GLN  56           H        GLN  56 -11.821  -0.821 -10.855
  330    HA   GLN  56           HA       GLN  56 -13.968  -0.038  -9.055
  331    HB3  GLN  56           2HB      GLN  56 -12.789  -1.854  -7.566
  332    HG3  GLN  56           2HG      GLN  56 -13.517  -3.733  -9.081
  333   HE21  GLN  56          1HE2      GLN  56 -16.004  -3.827  -9.948
  334   HE22  GLN  56          2HE2      GLN  56 -17.146  -3.127  -8.801
  335    H    VAL  57           H        VAL  57 -10.387   0.479  -8.941
  336    HA   VAL  57           HA       VAL  57 -10.800   2.475  -6.823
  337    HB   VAL  57           HB       VAL  57  -9.111   1.588  -5.311
  338   HG11  VAL  57          1HG1      VAL  57 -11.264  -0.522  -5.688
  339   HG12  VAL  57          2HG1      VAL  57 -10.345  -0.182  -4.221
  340   HG13  VAL  57          3HG1      VAL  57 -11.474   1.031  -4.834
  341   HG21  VAL  57          3HG2      VAL  57  -7.765   0.195  -6.841
  342   HG22  VAL  57          1HG2      VAL  57  -8.302  -0.755  -5.455
  343   HG23  VAL  57          2HG2      VAL  57  -9.112  -0.949  -7.023
  344    H    SER  58           H        SER  58  -8.476   3.348  -6.155
  345    HA   SER  58           HA       SER  58  -6.402   2.974  -8.181
  346    HB3  SER  58           2HB      SER  58  -7.738   4.934  -8.984
  347    HG   SER  58           HG       SER  58  -6.511   6.603  -7.136
  348    H    GLU  59           H        GLU  59  -4.449   4.624  -7.294
  349    HA   GLU  59           HA       GLU  59  -3.364   3.588  -4.963
  350    HB3  GLU  59           2HB      GLU  59  -1.831   4.727  -6.137
  351    HG3  GLU  59           2HG      GLU  59  -3.127   5.949  -7.767
  352    H    ILE  60           H        ILE  60  -5.662   6.275  -5.135
  353    HA   ILE  60           HA       ILE  60  -5.771   7.286  -2.554
  354    HB   ILE  60           HB       ILE  60  -7.839   6.537  -4.627
  355   HG13  ILE  60          2HG1      ILE  60  -8.140   8.881  -4.934
  356   HG21  ILE  60          1HG2      ILE  60  -9.166   6.128  -2.732
  357   HG22  ILE  60          2HG2      ILE  60  -8.562   7.578  -1.884
  358   HG23  ILE  60          3HG2      ILE  60  -9.615   7.727  -3.320
  359   HD11  ILE  60          3HD1      ILE  60  -7.908   9.788  -2.634
  360   HD12  ILE  60          1HD1      ILE  60  -6.167   9.422  -2.667
  361   HD13  ILE  60          2HD1      ILE  60  -6.848  10.611  -3.784
  362    H    THR  61           H        THR  61  -7.058   4.097  -3.531
  363    HA   THR  61           HA       THR  61  -8.381   3.570  -1.042
  364    HB   THR  61           HB       THR  61  -7.520   1.895  -3.406
  365    HG1  THR  61           1HG      THR  61  -9.314   3.173  -3.642
  366   HG21  THR  61          3HG2      THR  61  -8.928   0.875  -0.891
  367   HG22  THR  61          1HG2      THR  61  -7.399   0.275  -1.579
  368   HG23  THR  61          2HG2      THR  61  -8.908   0.034  -2.455
  369    H    ILE  62           H        ILE  62  -5.047   2.895  -2.060
  370    HA   ILE  62           HA       ILE  62  -4.541   1.565   0.570
  371    HB   ILE  62           HB       ILE  62  -3.691   0.545  -1.544
  372   HG13  ILE  62          2HG1      ILE  62  -2.877  -0.036   0.677
  373   HG21  ILE  62          1HG2      ILE  62  -2.974   2.573  -2.741
  374   HG22  ILE  62          2HG2      ILE  62  -1.672   2.829  -1.551
  375   HG23  ILE  62          3HG2      ILE  62  -1.678   1.407  -2.616
  376   HD11  ILE  62          3HD1      ILE  62  -0.736  -1.007   0.153
  377   HD12  ILE  62          1HD1      ILE  62  -1.762  -1.132  -1.291
  378   HD13  ILE  62          2HD1      ILE  62  -0.480   0.102  -1.198
  379    H    GLN  63           H        GLN  63  -3.879   4.632  -1.080
  380    HA   GLN  63           HA       GLN  63  -2.112   5.781   0.800
  381    HB3  GLN  63           2HB      GLN  63  -4.449   7.211  -0.550
  382    HG3  GLN  63           2HG      GLN  63  -1.857   8.512  -0.593
  383   HE21  GLN  63          1HE2      GLN  63  -3.576   9.676  -1.913
  384   HE22  GLN  63          2HE2      GLN  63  -4.390  10.970  -1.027
  385    H    GLU  64           H        GLU  64  -5.713   5.865   0.795
  386    HA   GLU  64           HA       GLU  64  -5.993   7.218   3.268
  387    HB3  GLU  64           2HB      GLU  64  -8.366   6.212   3.131
  388    HG3  GLU  64           2HG      GLU  64  -8.818   7.222   0.780
  389    H    ARG  65           H        ARG  65  -5.166   3.904   2.723
  390    HA   ARG  65           HA       ARG  65  -5.862   3.025   5.457
  391    HB3  ARG  65           2HB      ARG  65  -4.433   1.646   3.144
  392    HG3  ARG  65           2HG      ARG  65  -3.704   0.517   5.131
  393    HD3  ARG  65           2HD      ARG  65  -5.241   1.094   6.868
  394    HE   ARG  65           HE       ARG  65  -7.323   0.961   5.199
  395   HH11  ARG  65          1HH1      ARG  65  -6.827  -1.036   8.129
  396   HH12  ARG  65          2HH1      ARG  65  -8.555  -1.151   8.345
  397   HH21  ARG  65          1HH2      ARG  65  -9.384   0.682   5.530
  398   HH22  ARG  65          2HH2      ARG  65  -9.998  -0.327   6.829
  399    H    ILE  66           H        ILE  66  -2.872   3.658   3.513
  400    HA   ILE  66           HA       ILE  66  -1.041   3.166   5.717
  401    HB   ILE  66           HB       ILE  66  -0.689   4.810   3.173
  402   HG13  ILE  66          2HG1      ILE  66  -1.184   2.186   3.061
  403   HG21  ILE  66          1HG2      ILE  66   1.375   3.698   5.136
  404   HG22  ILE  66          2HG2      ILE  66   1.784   4.444   3.577
  405   HG23  ILE  66          3HG2      ILE  66   1.038   5.422   4.831
  406   HD11  ILE  66          3HD1      ILE  66  -0.500   3.418   1.087
  407   HD12  ILE  66          1HD1      ILE  66   1.199   3.437   1.629
  408   HD13  ILE  66          2HD1      ILE  66   0.416   1.910   1.204
  409    H    ALA  67           H        ALA  67  -2.508   6.204   4.499
  410    HA   ALA  67           HA       ALA  67  -1.105   7.933   6.247
  411    HB1  ALA  67           1HB      ALA  67  -2.822   9.572   5.557
  412    HB2  ALA  67           2HB      ALA  67  -2.231   8.634   4.175
  413    HB3  ALA  67           3HB      ALA  67  -3.819   8.264   4.885
  414    H    ALA  68           H        ALA  68  -4.173   6.152   6.750
  415    HA   ALA  68           HA       ALA  68  -4.979   7.655   9.105
  416    HB1  ALA  68           1HB      ALA  68  -6.776   5.943   9.185
  417    HB2  ALA  68           2HB      ALA  68  -6.596   6.617   7.558
  418    HB3  ALA  68           3HB      ALA  68  -5.950   5.003   7.922
  419    H    LEU  69           H        LEU  69  -3.373   4.547   8.518
  420    HA   LEU  69           HA       LEU  69  -3.115   3.702  11.280
  421    HB3  LEU  69           2HB      LEU  69  -1.187   2.365  10.092
  422    HG   LEU  69           HG       LEU  69  -2.888   0.792   9.087
  423   HD11  LEU  69          1HD1      LEU  69  -3.386   1.667  11.961
  424   HD12  LEU  69          2HD1      LEU  69  -2.078   0.602  11.406
  425   HD13  LEU  69          3HD1      LEU  69  -3.771   0.089  11.257
  426   HD21  LEU  69          3HD2      LEU  69  -4.723   2.457   8.586
  427   HD22  LEU  69          1HD2      LEU  69  -5.008   2.599  10.327
  428   HD23  LEU  69          2HD2      LEU  69  -5.244   1.046   9.512
  429    H    GLY  70           H        GLY  70  -1.433   6.115   9.393
  430    HA2  GLY  70           2HA      GLY  70  -0.691   7.942  10.800
  431    HA3  GLY  70           3HA      GLY  70   0.144   6.792  11.861
  432    H    TYR  71           H        TYR  71   0.455   6.237   8.443
  433    HA   TYR  71           HA       TYR  71   3.283   7.230   8.526
  434    HB3  TYR  71           2HB      TYR  71   3.917   5.252   7.393
  435    HD1  TYR  71           1HD      TYR  71   3.741   5.590  10.290
  436    HD2  TYR  71           2HD      TYR  71   1.556   2.884   7.743
  437    HE1  TYR  71           1HE      TYR  71   3.143   4.227  12.267
  438    HE2  TYR  71           2HE      TYR  71   1.012   1.471   9.718
  439    HH   TYR  71           HH       TYR  71   1.780   2.568  13.037
  440    H    THR  72           H        THR  72   3.967   6.982   5.822
  441    HA   THR  72           HA       THR  72   1.877   8.270   4.204
  442    HB   THR  72           HB       THR  72   2.943  10.148   5.487
  443    HG1  THR  72           1HG      THR  72   3.516  11.136   3.221
  444   HG21  THR  72          3HG2      THR  72   5.376   9.650   3.709
  445   HG22  THR  72          1HG2      THR  72   5.314   9.296   5.450
  446   HG23  THR  72          2HG2      THR  72   5.130  10.959   4.886
  447    H    LEU  73           H        LEU  73   2.914   8.854   1.938
  448    HA   LEU  73           HA       LEU  73   4.669   6.620   1.062
  449    HB3  LEU  73           2HB      LEU  73   2.179   5.998   1.055
  450    HG   LEU  73           HG       LEU  73   2.156   7.675  -1.502
  451   HD11  LEU  73          1HD1      LEU  73  -0.139   6.808  -1.750
  452   HD12  LEU  73          2HD1      LEU  73   0.067   5.824  -0.282
  453   HD13  LEU  73          3HD1      LEU  73   1.053   5.502  -1.725
  454   HD21  LEU  73          3HD2      LEU  73   1.691   9.156   0.455
  455   HD22  LEU  73          1HD2      LEU  73   0.409   8.042   0.976
  456   HD23  LEU  73          2HD2      LEU  73   0.292   8.933  -0.566
  457    H    ALA  74           H        ALA  74   5.448   6.707  -1.086
  458    HA   ALA  74           HA       ALA  74   4.925   9.152  -2.693
  459    HB1  ALA  74           1HB      ALA  74   7.323   9.227  -3.337
  460    HB2  ALA  74           2HB      ALA  74   7.100   9.538  -1.604
  461    HB3  ALA  74           3HB      ALA  74   7.683   7.952  -2.154
  462    H    GLU  75           H        GLU  75   3.739   8.254  -4.277
  463    HA   GLU  75           HA       GLU  75   4.714   5.780  -5.668
  464    HB3  GLU  75           2HB      GLU  75   1.837   6.588  -5.094
  465    HG3  GLU  75           2HG      GLU  75   1.480   4.114  -5.603
  466    HA   PRO  76           HA       PRO  76   4.866   9.593  -8.168
  467    HB3  PRO  76           2HB      PRO  76   7.130   9.506  -7.637
  468    HG3  PRO  76           2HG      PRO  76   8.383   7.449  -7.799
  469    HD3  PRO  76           2HD      PRO  76   6.669   7.173  -6.217
  Start of MODEL    6
    1    H2   PRO   6           2H       PRO   6  -8.255  -2.195 -16.591
    2    HA   PRO   6           HA       PRO   6  -8.284  -4.901 -15.464
    3    HB3  PRO   6           2HB      PRO   6  -6.902  -5.671 -17.185
    4    HG3  PRO   6           2HG      PRO   6  -8.743  -5.398 -18.594
    5    HD3  PRO   6           2HD      PRO   6 -10.154  -4.382 -17.113
    6    H    LEU   7           H        LEU   7  -6.870  -5.308 -13.946
    7    HA   LEU   7           HA       LEU   7  -5.562  -3.167 -12.585
    8    HB3  LEU   7           2HB      LEU   7  -6.852  -4.958 -11.504
    9    HG   LEU   7           HG       LEU   7  -4.439  -6.780 -11.869
   10   HD11  LEU   7          1HD1      LEU   7  -5.726  -6.808  -9.696
   11   HD12  LEU   7          2HD1      LEU   7  -5.753  -8.356 -10.567
   12   HD13  LEU   7          3HD1      LEU   7  -7.169  -7.283 -10.603
   13   HD21  LEU   7          3HD2      LEU   7  -7.190  -7.096 -13.142
   14   HD22  LEU   7          1HD2      LEU   7  -5.984  -8.394 -13.001
   15   HD23  LEU   7          2HD2      LEU   7  -5.622  -6.977 -13.983
   16    H    LYS   8           H        LYS   8  -3.469  -2.918 -11.881
   17    HA   LYS   8           HA       LYS   8  -1.326  -4.241 -13.491
   18    HB3  LYS   8           2HB      LYS   8  -1.314  -2.267 -14.561
   19    HG3  LYS   8           2HG      LYS   8  -3.026  -0.958 -13.437
   20    HD3  LYS   8           2HD      LYS   8  -2.331  -1.010 -11.061
   21    HE3  LYS   8           2HE      LYS   8   0.197  -0.582 -11.463
   22    HZ1  LYS   8           3HZ      LYS   8   0.483   1.945 -10.972
   23    HZ2  LYS   8           1HZ      LYS   8  -0.898   2.138 -11.833
   24    HZ3  LYS   8           2HZ      LYS   8   0.425   1.449 -12.537
   25    H    THR   9           H        THR   9   0.363  -5.051 -12.448
   26    HA   THR   9           HA       THR   9   0.601  -4.858  -9.507
   27    HB   THR   9           HB       THR   9   2.332  -6.325 -11.536
   28    HG1  THR   9           1HG      THR   9   0.246  -7.295  -9.889
   29   HG21  THR   9          3HG2      THR   9   2.838  -7.775  -9.529
   30   HG22  THR   9          1HG2      THR   9   2.082  -6.541  -8.503
   31   HG23  THR   9          2HG2      THR   9   3.535  -6.151  -9.452
   32    H    GLN  10           H        GLN  10   2.274  -3.733  -8.390
   33    HA   GLN  10           HA       GLN  10   4.425  -2.489  -9.859
   34    HB3  GLN  10           2HB      GLN  10   2.244  -0.693  -8.655
   35    HG3  GLN  10           2HG      GLN  10   4.356   0.517  -8.821
   36   HE21  GLN  10          1HE2      GLN  10   3.612   0.027 -12.299
   37   HE22  GLN  10          2HE2      GLN  10   5.202  -0.585 -12.713
   38    H    GLN  11           H        GLN  11   5.975  -1.471  -8.543
   39    HA   GLN  11           HA       GLN  11   5.937  -2.090  -5.645
   40    HB3  GLN  11           2HB      GLN  11   8.269  -1.018  -5.833
   41    HG3  GLN  11           2HG      GLN  11   7.801  -3.572  -7.401
   42   HE21  GLN  11          1HE2      GLN  11   9.608  -2.555  -8.820
   43   HE22  GLN  11          2HE2      GLN  11  11.258  -2.759  -8.222
   44    H    MET  12           H        MET  12   5.980  -0.554  -4.064
   45    HA   MET  12           HA       MET  12   5.361   2.292  -4.720
   46    HB3  MET  12           2HB      MET  12   3.865   0.162  -3.171
   47    HG3  MET  12           2HG      MET  12   3.556   3.149  -2.726
   48    HE1  MET  12           3HE      MET  12   1.179   3.610  -3.503
   49    HE2  MET  12           1HE      MET  12   1.170   2.023  -4.318
   50    HE3  MET  12           2HE      MET  12  -0.194   2.512  -3.304
   51    H    GLN  13           H        GLN  13   6.630   3.642  -3.628
   52    HA   GLN  13           HA       GLN  13   8.264   2.804  -1.338
   53    HB3  GLN  13           2HB      GLN  13   8.865   5.297  -1.388
   54    HG3  GLN  13           2HG      GLN  13  10.024   5.307  -3.609
   55   HE21  GLN  13          1HE2      GLN  13  11.344   5.293  -1.468
   56   HE22  GLN  13          2HE2      GLN  13  12.090   3.769  -1.020
   57    H    VAL  14           H        VAL  14   7.848   3.328   0.827
   58    HA   VAL  14           HA       VAL  14   5.411   4.868   1.535
   59    HB   VAL  14           HB       VAL  14   5.823   1.924   2.016
   60   HG11  VAL  14          1HG1      VAL  14   4.240   3.628   3.991
   61   HG12  VAL  14          2HG1      VAL  14   4.236   1.861   3.890
   62   HG13  VAL  14          3HG1      VAL  14   5.712   2.706   4.351
   63   HG21  VAL  14          3HG2      VAL  14   3.298   3.578   1.638
   64   HG22  VAL  14          1HG2      VAL  14   4.208   2.806   0.334
   65   HG23  VAL  14          2HG2      VAL  14   3.444   1.811   1.580
   66    H    GLY  15           H        GLY  15   5.526   5.880   3.470
   67    HA2  GLY  15           2HA      GLY  15   8.166   5.804   4.924
   68    HA3  GLY  15           3HA      GLY  15   7.192   7.262   4.682
   69    H    GLY  16           H        GLY  16   8.119   5.455   7.049
   70    HA2  GLY  16           2HA      GLY  16   7.379   5.708   9.278
   71    HA3  GLY  16           3HA      GLY  16   5.715   5.973   8.713
   72    H    MET  17           H        MET  17   6.174   3.377   6.998
   73    HA   MET  17           HA       MET  17   5.062   1.518   8.969
   74    HB3  MET  17           2HB      MET  17   5.931   0.974   6.102
   75    HG3  MET  17           2HG      MET  17   3.808  -0.261   7.906
   76    HE1  MET  17           3HE      MET  17   4.612  -1.811   3.618
   77    HE2  MET  17           1HE      MET  17   5.493  -0.403   4.233
   78    HE3  MET  17           2HE      MET  17   5.697  -1.997   5.007
   79    H    ARG  18           H        ARG  18   8.210   2.240   7.772
   80    HA   ARG  18           HA       ARG  18   9.664  -0.101   8.554
   81    HB3  ARG  18           2HB      ARG  18  10.572   2.801   8.321
   82    HG3  ARG  18           2HG      ARG  18  12.098   0.203   7.819
   83    HD3  ARG  18           2HD      ARG  18  13.012   3.118   7.717
   84    HE   ARG  18           HE       ARG  18  14.686   1.066   8.007
   85   HH11  ARG  18          1HH1      ARG  18  14.001   2.976   5.109
   86   HH12  ARG  18          2HH1      ARG  18  15.480   2.506   4.315
   87   HH21  ARG  18          1HH2      ARG  18  16.676   0.667   7.013
   88   HH22  ARG  18          2HH2      ARG  18  16.934   1.138   5.348
   89    H    CYS  19           H        CYS  19   9.047  -0.760  10.576
   90    HA   CYS  19           HA       CYS  19  10.099   0.167  13.035
   91    HB3  CYS  19           2HB      CYS  19   7.168   0.924  12.588
   92    HG   CYS  19           HG       CYS  19   7.102   2.152  14.847
   93    H    ALA  20           H        ALA  20   9.477  -1.329  14.784
   94    HA   ALA  20           HA       ALA  20   9.242  -3.936  13.859
   95    HB1  ALA  20           1HB      ALA  20   9.023  -4.568  16.237
   96    HB2  ALA  20           2HB      ALA  20  10.264  -3.332  15.966
   97    HB3  ALA  20           3HB      ALA  20   8.684  -2.870  16.649
   98    H    ALA  21           H        ALA  21   7.739  -5.120  13.112
   99    HA   ALA  21           HA       ALA  21   5.851  -6.259  12.693
  100    HB1  ALA  21           1HB      ALA  21   4.626  -4.982  15.171
  101    HB2  ALA  21           2HB      ALA  21   4.074  -6.424  14.315
  102    HB3  ALA  21           3HB      ALA  21   5.634  -6.454  15.163
  103    H    CYS  22           H        CYS  22   5.969  -2.931  12.399
  104    HA   CYS  22           HA       CYS  22   3.223  -2.267  12.315
  105    HB3  CYS  22           2HB      CYS  22   4.195  -0.140  11.194
  106    HG   CYS  22           HG       CYS  22   5.534  -1.469  13.966
  107    H    ALA  23           H        ALA  23   5.111  -3.597   9.655
  108    HA   ALA  23           HA       ALA  23   3.272  -2.913   7.582
  109    HB1  ALA  23           1HB      ALA  23   5.080  -5.352   7.860
  110    HB2  ALA  23           2HB      ALA  23   4.412  -4.663   6.366
  111    HB3  ALA  23           3HB      ALA  23   5.611  -3.752   7.285
  112    H    SER  24           H        SER  24   2.927  -5.333  10.190
  113    HA   SER  24           HA       SER  24   0.976  -6.929   8.717
  114    HB3  SER  24           2HB      SER  24   2.337  -7.790  10.620
  115    HG   SER  24           HG       SER  24   1.662  -7.406  12.675
  116    H    SER  25           H        SER  25   0.793  -3.912  10.318
  117    HA   SER  25           HA       SER  25  -2.090  -3.861  10.773
  118    HB3  SER  25           2HB      SER  25  -1.760  -1.685  11.592
  119    HG   SER  25           HG       SER  25   0.420  -1.706  12.626
  120    H    ILE  26           H        ILE  26  -0.049  -3.440   8.067
  121    HA   ILE  26           HA       ILE  26  -2.255  -2.223   6.425
  122    HB   ILE  26           HB       ILE  26   0.741  -2.468   6.090
  123   HG13  ILE  26          2HG1      ILE  26  -1.212  -0.264   5.287
  124   HG21  ILE  26          1HG2      ILE  26  -1.172  -2.262   3.729
  125   HG22  ILE  26          2HG2      ILE  26   0.580  -1.964   3.685
  126   HG23  ILE  26          3HG2      ILE  26  -0.009  -3.574   4.046
  127   HD11  ILE  26          3HD1      ILE  26  -1.102  -0.236   7.719
  128   HD12  ILE  26          1HD1      ILE  26   0.677  -0.376   7.676
  129   HD13  ILE  26          2HD1      ILE  26  -0.125   1.090   7.067
  130    H    GLU  27           H        GLU  27  -0.083  -5.098   6.596
  131    HA   GLU  27           HA       GLU  27  -1.275  -6.124   4.237
  132    HB3  GLU  27           2HB      GLU  27   0.280  -7.974   6.032
  133    HG3  GLU  27           2HG      GLU  27   0.358  -7.259   3.054
  134    H    ARG  28           H        ARG  28  -2.212  -6.722   7.643
  135    HA   ARG  28           HA       ARG  28  -3.704  -9.125   7.033
  136    HB3  ARG  28           2HB      ARG  28  -4.184  -7.105   9.257
  137    HG3  ARG  28           2HG      ARG  28  -5.075 -10.010   8.929
  138    HD3  ARG  28           2HD      ARG  28  -5.483  -8.049  11.223
  139    HE   ARG  28           HE       ARG  28  -7.029 -10.366  10.453
  140   HH11  ARG  28          1HH1      ARG  28  -5.837  -8.780  13.428
  141   HH12  ARG  28          2HH1      ARG  28  -7.222  -9.403  14.321
  142   HH21  ARG  28          1HH2      ARG  28  -8.682 -11.060  11.726
  143   HH22  ARG  28          2HH2      ARG  28  -8.679 -10.706  13.450
  144    H    ALA  29           H        ALA  29  -4.672  -5.672   6.956
  145    HA   ALA  29           HA       ALA  29  -7.385  -6.161   6.082
  146    HB1  ALA  29           1HB      ALA  29  -5.590  -3.697   5.878
  147    HB2  ALA  29           2HB      ALA  29  -7.361  -3.721   5.675
  148    HB3  ALA  29           3HB      ALA  29  -6.646  -4.110   7.251
  149    H    LEU  30           H        LEU  30  -4.328  -5.783   4.341
  150    HA   LEU  30           HA       LEU  30  -5.301  -4.844   1.910
  151    HB3  LEU  30           2HB      LEU  30  -2.841  -6.561   2.438
  152    HG   LEU  30           HG       LEU  30  -2.916  -6.067   0.056
  153   HD11  LEU  30          1HD1      LEU  30  -2.914  -3.711  -0.778
  154   HD12  LEU  30          2HD1      LEU  30  -3.312  -3.149   0.860
  155   HD13  LEU  30          3HD1      LEU  30  -4.456  -4.162  -0.055
  156   HD21  LEU  30          3HD2      LEU  30  -0.743  -5.930   1.174
  157   HD22  LEU  30          1HD2      LEU  30  -1.048  -4.246   1.657
  158   HD23  LEU  30          2HD2      LEU  30  -0.822  -4.644  -0.046
  159    H    GLU  31           H        GLU  31  -5.570  -8.127   3.009
  160    HA   GLU  31           HA       GLU  31  -6.134  -9.224   0.338
  161    HB3  GLU  31           2HB      GLU  31  -5.101 -10.731   1.791
  162    HG3  GLU  31           2HG      GLU  31  -7.278 -10.149   3.833
  163    H    ARG  32           H        ARG  32  -7.892  -7.310   2.493
  164    HA   ARG  32           HA       ARG  32 -10.498  -8.263   1.410
  165    HB3  ARG  32           2HB      ARG  32 -11.416  -7.178   3.560
  166    HG3  ARG  32           2HG      ARG  32  -9.646  -9.651   3.791
  167    HD3  ARG  32           2HD      ARG  32 -11.868  -8.539   5.546
  168    HE   ARG  32           HE       ARG  32 -10.558 -11.242   5.619
  169   HH11  ARG  32          1HH1      ARG  32 -13.440  -9.305   6.381
  170   HH12  ARG  32          2HH1      ARG  32 -14.147 -10.587   7.324
  171   HH21  ARG  32          1HH2      ARG  32 -11.565 -12.856   6.757
  172   HH22  ARG  32          2HH2      ARG  32 -13.202 -12.637   7.320
  173    H    LEU  33           H        LEU  33  -8.358  -5.554   1.402
  174    HA   LEU  33           HA       LEU  33 -10.256  -3.416   1.178
  175    HB3  LEU  33           2HB      LEU  33  -8.393  -2.199   0.034
  176    HG   LEU  33           HG       LEU  33  -7.236  -3.676   2.407
  177   HD11  LEU  33          1HD1      LEU  33  -5.678  -2.301   1.055
  178   HD12  LEU  33          2HD1      LEU  33  -5.899  -1.652   2.689
  179   HD13  LEU  33          3HD1      LEU  33  -6.718  -0.887   1.309
  180   HD21  LEU  33          3HD2      LEU  33  -9.382  -2.806   3.164
  181   HD22  LEU  33          1HD2      LEU  33  -9.029  -1.216   2.438
  182   HD23  LEU  33          2HD2      LEU  33  -8.076  -1.815   3.814
  183    H    LYS  34           H        LYS  34 -10.747  -2.117  -0.702
  184    HA   LYS  34           HA       LYS  34 -11.980  -3.786  -2.746
  185    HB3  LYS  34           2HB      LYS  34 -13.264  -2.059  -1.637
  186    HG3  LYS  34           2HG      LYS  34 -11.305  -0.051  -2.836
  187    HD3  LYS  34           2HD      LYS  34 -12.679   1.682  -1.787
  188    HE3  LYS  34           2HE      LYS  34 -14.422   0.114  -3.728
  189    HZ1  LYS  34           3HZ      LYS  34 -13.821   3.023  -3.487
  190    HZ2  LYS  34           1HZ      LYS  34 -15.186   2.317  -2.969
  191    HZ3  LYS  34           2HZ      LYS  34 -14.829   2.330  -4.585
  192    H    GLY  35           H        GLY  35 -11.650  -3.907  -4.880
  193    HA2  GLY  35           2HA      GLY  35 -10.744  -3.674  -6.963
  194    HA3  GLY  35           3HA      GLY  35 -10.261  -2.033  -6.512
  195    H    VAL  36           H        VAL  36  -9.001  -4.856  -4.816
  196    HA   VAL  36           HA       VAL  36  -6.345  -4.543  -6.085
  197    HB   VAL  36           HB       VAL  36  -6.223  -2.868  -4.392
  198   HG11  VAL  36          1HG1      VAL  36  -6.446  -3.221  -2.021
  199   HG12  VAL  36          2HG1      VAL  36  -7.966  -3.655  -2.806
  200   HG13  VAL  36          3HG1      VAL  36  -6.861  -4.926  -2.241
  201   HG21  VAL  36          3HG2      VAL  36  -4.173  -4.165  -4.752
  202   HG22  VAL  36          1HG2      VAL  36  -4.296  -3.612  -3.079
  203   HG23  VAL  36          2HG2      VAL  36  -4.641  -5.307  -3.472
  204    H    ALA  37           H        ALA  37  -5.573  -6.422  -6.529
  205    HA   ALA  37           HA       ALA  37  -6.957  -8.810  -5.410
  206    HB1  ALA  37           1HB      ALA  37  -7.183  -8.186  -7.807
  207    HB2  ALA  37           2HB      ALA  37  -5.419  -8.377  -8.002
  208    HB3  ALA  37           3HB      ALA  37  -6.422  -9.774  -7.595
  209    H    GLU  38           H        GLU  38  -3.631  -7.604  -5.712
  210    HA   GLU  38           HA       GLU  38  -2.586 -10.004  -4.407
  211    HB3  GLU  38           2HB      GLU  38  -1.423  -9.559  -7.147
  212    HG3  GLU  38           2HG      GLU  38  -1.310 -12.038  -7.098
  213    H    ALA  39           H        ALA  39  -1.330  -9.065  -2.901
  214    HA   ALA  39           HA       ALA  39   0.746  -7.070  -3.696
  215    HB1  ALA  39           1HB      ALA  39  -0.102  -5.577  -1.954
  216    HB2  ALA  39           2HB      ALA  39  -1.422  -5.964  -3.072
  217    HB3  ALA  39           3HB      ALA  39  -1.340  -6.773  -1.495
  218    H    SER  40           H        SER  40   2.254  -6.529  -1.906
  219    HA   SER  40           HA       SER  40   2.562  -8.472   0.277
  220    HB3  SER  40           2HB      SER  40   4.708  -8.387  -1.867
  221    HG   SER  40           HG       SER  40   5.734  -9.358  -0.290
  222    H    VAL  41           H        VAL  41   3.458  -7.491   2.018
  223    HA   VAL  41           HA       VAL  41   4.786  -4.861   1.724
  224    HB   VAL  41           HB       VAL  41   4.970  -4.812   4.142
  225   HG11  VAL  41          1HG1      VAL  41   2.872  -4.106   3.076
  226   HG12  VAL  41          2HG1      VAL  41   2.211  -5.741   3.256
  227   HG13  VAL  41          3HG1      VAL  41   2.595  -4.767   4.690
  228   HG21  VAL  41          3HG2      VAL  41   3.883  -6.706   5.494
  229   HG22  VAL  41          1HG2      VAL  41   4.064  -7.710   4.051
  230   HG23  VAL  41          2HG2      VAL  41   5.491  -7.016   4.824
  231    H    THR  42           H        THR  42   6.930  -4.358   2.545
  232    HA   THR  42           HA       THR  42   8.834  -6.678   2.761
  233    HB   THR  42           HB       THR  42   9.484  -3.986   1.548
  234    HG1  THR  42           1HG      THR  42   9.263  -6.311   0.008
  235   HG21  THR  42          3HG2      THR  42  11.456  -5.223   0.665
  236   HG22  THR  42          1HG2      THR  42  10.927  -6.680   1.532
  237   HG23  THR  42          2HG2      THR  42  11.425  -5.230   2.428
  238    H    VAL  43           H        VAL  43   9.273  -6.745   4.866
  239    HA   VAL  43           HA       VAL  43   8.876  -4.524   6.600
  240    HB   VAL  43           HB       VAL  43  10.115  -7.256   7.055
  241   HG11  VAL  43          1HG1      VAL  43  11.034  -5.842   8.838
  242   HG12  VAL  43          2HG1      VAL  43   9.421  -5.169   9.167
  243   HG13  VAL  43          3HG1      VAL  43   9.769  -6.881   9.490
  244   HG21  VAL  43          3HG2      VAL  43   7.926  -7.684   8.159
  245   HG22  VAL  43          1HG2      VAL  43   7.416  -6.023   7.777
  246   HG23  VAL  43          2HG2      VAL  43   7.687  -7.187   6.479
  247    H    ALA  44           H        ALA  44  11.998  -5.884   5.397
  248    HA   ALA  44           HA       ALA  44  13.712  -4.672   7.156
  249    HB1  ALA  44           1HB      ALA  44  14.435  -6.315   5.535
  250    HB2  ALA  44           2HB      ALA  44  14.135  -5.192   4.183
  251    HB3  ALA  44           3HB      ALA  44  15.429  -4.872   5.354
  252    H    THR  45           H        THR  45  12.397  -3.044   4.264
  253    HA   THR  45           HA       THR  45  13.453  -0.441   5.294
  254    HB   THR  45           HB       THR  45  13.427   0.351   2.946
  255    HG1  THR  45           1HG      THR  45  13.394  -1.287   1.352
  256   HG21  THR  45          3HG2      THR  45  15.140  -2.151   3.279
  257   HG22  THR  45          1HG2      THR  45  15.502  -0.585   4.034
  258   HG23  THR  45          2HG2      THR  45  15.467  -0.728   2.271
  259    H    GLY  46           H        GLY  46  10.569  -2.152   4.941
  260    HA2  GLY  46           2HA      GLY  46   8.447  -1.484   5.479
  261    HA3  GLY  46           3HA      GLY  46   9.064   0.150   5.807
  262    H    ARG  47           H        ARG  47   9.013  -1.789   2.822
  263    HA   ARG  47           HA       ARG  47   7.456   0.348   1.414
  264    HB3  ARG  47           2HB      ARG  47   9.791   0.332   0.716
  265    HG3  ARG  47           2HG      ARG  47   9.276  -2.514  -0.254
  266    HD3  ARG  47           2HD      ARG  47  11.715  -0.718  -0.459
  267    HE   ARG  47           HE       ARG  47  12.813  -2.706  -0.704
  268   HH11  ARG  47          1HH1      ARG  47   9.731  -3.118  -2.442
  269   HH12  ARG  47          2HH1      ARG  47  10.117  -4.772  -2.856
  270   HH21  ARG  47          1HH2      ARG  47  13.288  -4.722  -1.445
  271   HH22  ARG  47          2HH2      ARG  47  12.154  -5.591  -2.462
  272    H    LEU  48           H        LEU  48   6.619  -0.717  -0.836
  273    HA   LEU  48           HA       LEU  48   5.106  -3.201  -0.149
  274    HB3  LEU  48           2HB      LEU  48   3.345  -1.261  -1.376
  275    HG   LEU  48           HG       LEU  48   3.466  -2.331   1.471
  276   HD11  LEU  48          1HD1      LEU  48   1.411  -0.574   0.068
  277   HD12  LEU  48          2HD1      LEU  48   2.339  -0.197   1.536
  278   HD13  LEU  48          3HD1      LEU  48   1.089  -1.449   1.575
  279   HD21  LEU  48          3HD2      LEU  48   2.916  -4.047  -0.241
  280   HD22  LEU  48          1HD2      LEU  48   1.626  -3.010  -0.879
  281   HD23  LEU  48          2HD2      LEU  48   1.515  -3.682   0.763
  282    H    THR  49           H        THR  49   4.038  -4.232  -1.836
  283    HA   THR  49           HA       THR  49   4.363  -3.334  -4.663
  284    HB   THR  49           HB       THR  49   4.731  -6.209  -3.711
  285    HG1  THR  49           1HG      THR  49   6.557  -5.028  -3.273
  286   HG21  THR  49          3HG2      THR  49   5.360  -6.611  -6.081
  287   HG22  THR  49          1HG2      THR  49   4.987  -4.926  -6.480
  288   HG23  THR  49          2HG2      THR  49   3.697  -6.043  -5.969
  289    H    VAL  50           H        VAL  50   2.464  -3.492  -5.725
  290    HA   VAL  50           HA       VAL  50   0.150  -4.879  -4.469
  291    HB   VAL  50           HB       VAL  50   0.359  -2.770  -3.263
  292   HG11  VAL  50          1HG1      VAL  50   0.047  -1.324  -5.926
  293   HG12  VAL  50          2HG1      VAL  50   0.042  -0.581  -4.317
  294   HG13  VAL  50          3HG1      VAL  50   1.509  -1.360  -4.919
  295   HG21  VAL  50          3HG2      VAL  50  -1.902  -1.898  -3.576
  296   HG22  VAL  50          1HG2      VAL  50  -2.044  -2.729  -5.127
  297   HG23  VAL  50          2HG2      VAL  50  -1.879  -3.669  -3.628
  298    H    THR  51           H        THR  51  -1.503  -5.386  -5.790
  299    HA   THR  51           HA       THR  51  -1.408  -4.526  -8.655
  300    HB   THR  51           HB       THR  51  -2.467  -7.163  -7.563
  301    HG1  THR  51           1HG      THR  51  -0.383  -7.275  -7.339
  302   HG21  THR  51          3HG2      THR  51  -2.415  -7.847  -9.921
  303   HG22  THR  51          1HG2      THR  51  -1.856  -6.232 -10.409
  304   HG23  THR  51          2HG2      THR  51  -3.471  -6.442  -9.712
  305    H    TYR  52           H        TYR  52  -2.939  -3.059  -8.979
  306    HA   TYR  52           HA       TYR  52  -5.694  -3.472  -7.953
  307    HB3  TYR  52           2HB      TYR  52  -4.412  -2.130  -6.281
  308    HD1  TYR  52           2HD      TYR  52  -2.051  -1.500  -7.079
  309    HD2  TYR  52           1HD      TYR  52  -5.552   0.771  -8.140
  310    HE1  TYR  52           2HE      TYR  52  -0.605   0.430  -7.672
  311    HE2  TYR  52           1HE      TYR  52  -4.105   2.673  -8.816
  312    HH   TYR  52           HH       TYR  52  -0.538   2.560  -8.768
  313    H    ASP  53           H        ASP  53  -7.304  -1.797  -8.966
  314    HA   ASP  53           HA       ASP  53  -6.586  -1.581 -11.806
  315    HB3  ASP  53           2HB      ASP  53  -8.611  -2.820 -11.172
  316    HA   PRO  54           HA       PRO  54  -6.355   2.825 -11.422
  317    HB3  PRO  54           2HB      PRO  54  -4.739   2.450 -13.093
  318    HG3  PRO  54           2HG      PRO  54  -5.195   1.107 -15.003
  319    HD3  PRO  54           2HD      PRO  54  -5.607  -0.349 -13.255
  320    H    LYS  55           H        LYS  55  -9.218   1.462 -12.124
  321    HA   LYS  55           HA       LYS  55 -10.415   3.905 -13.469
  322    HB3  LYS  55           2HB      LYS  55 -11.921   2.116 -14.606
  323    HG3  LYS  55           2HG      LYS  55 -10.320   1.599 -16.406
  324    HD3  LYS  55           2HD      LYS  55  -9.997   4.485 -15.529
  325    HE3  LYS  55           2HE      LYS  55 -10.194   3.202 -18.288
  326    HZ1  LYS  55           3HZ      LYS  55  -9.429   5.482 -18.910
  327    HZ2  LYS  55           1HZ      LYS  55  -9.715   5.984 -17.380
  328    HZ3  LYS  55           2HZ      LYS  55 -10.964   5.430 -18.328
  329    H    GLN  56           H        GLN  56 -11.269   1.043 -11.519
  330    HA   GLN  56           HA       GLN  56 -13.741   2.421 -10.555
  331    HB3  GLN  56           2HB      GLN  56 -14.324   0.271  -9.618
  332    HG3  GLN  56           2HG      GLN  56 -14.267   0.705 -12.362
  333   HE21  GLN  56          1HE2      GLN  56 -13.672  -2.666 -11.175
  334   HE22  GLN  56          2HE2      GLN  56 -12.626  -3.084 -12.501
  335    H    VAL  57           H        VAL  57 -10.472   1.449  -9.552
  336    HA   VAL  57           HA       VAL  57 -10.863   3.303  -7.248
  337    HB   VAL  57           HB       VAL  57  -9.465   2.038  -5.793
  338   HG11  VAL  57          1HG1      VAL  57 -11.894   1.650  -5.758
  339   HG12  VAL  57          2HG1      VAL  57 -11.689   0.232  -6.814
  340   HG13  VAL  57          3HG1      VAL  57 -10.973   0.243  -5.196
  341   HG21  VAL  57          3HG2      VAL  57  -8.750  -0.275  -6.199
  342   HG22  VAL  57          1HG2      VAL  57  -9.383  -0.208  -7.855
  343   HG23  VAL  57          2HG2      VAL  57  -8.004   0.797  -7.376
  344    H    SER  58           H        SER  58  -8.101   3.066  -6.427
  345    HA   SER  58           HA       SER  58  -6.181   3.657  -8.401
  346    HB3  SER  58           2HB      SER  58  -7.555   5.728  -8.732
  347    HG   SER  58           HG       SER  58  -8.296   6.726  -7.071
  348    H    GLU  59           H        GLU  59  -4.346   5.111  -6.963
  349    HA   GLU  59           HA       GLU  59  -3.552   3.616  -4.736
  350    HB3  GLU  59           2HB      GLU  59  -2.129   5.130  -6.046
  351    HG3  GLU  59           2HG      GLU  59  -2.994   7.452  -4.304
  352    H    ILE  60           H        ILE  60  -6.126   5.916  -4.804
  353    HA   ILE  60           HA       ILE  60  -6.397   6.668  -2.064
  354    HB   ILE  60           HB       ILE  60  -8.417   6.113  -4.267
  355   HG13  ILE  60          2HG1      ILE  60  -8.555   8.512  -4.542
  356   HG21  ILE  60          1HG2      ILE  60  -9.994   7.533  -2.876
  357   HG22  ILE  60          2HG2      ILE  60  -9.705   5.890  -2.316
  358   HG23  ILE  60          3HG2      ILE  60  -8.891   7.247  -1.505
  359   HD11  ILE  60          3HD1      ILE  60  -7.999   9.341  -2.252
  360   HD12  ILE  60          1HD1      ILE  60  -6.309   8.837  -2.501
  361   HD13  ILE  60          2HD1      ILE  60  -7.022  10.096  -3.519
  362    H    THR  61           H        THR  61  -7.093   3.529  -3.596
  363    HA   THR  61           HA       THR  61  -8.652   2.326  -1.506
  364    HB   THR  61           HB       THR  61  -6.914   1.322  -3.736
  365    HG1  THR  61           1HG      THR  61  -9.065   0.103  -3.732
  366   HG21  THR  61          3HG2      THR  61  -7.335  -1.005  -3.144
  367   HG22  THR  61          1HG2      THR  61  -8.033  -0.520  -1.578
  368   HG23  THR  61          2HG2      THR  61  -6.301  -0.280  -1.930
  369    H    ILE  62           H        ILE  62  -5.153   2.599  -1.858
  370    HA   ILE  62           HA       ILE  62  -4.816   1.169   0.739
  371    HB   ILE  62           HB       ILE  62  -3.808   0.413  -1.475
  372   HG13  ILE  62          2HG1      ILE  62  -3.258  -0.544   0.682
  373   HG21  ILE  62          1HG2      ILE  62  -1.711   2.529  -0.910
  374   HG22  ILE  62          2HG2      ILE  62  -1.759   1.361  -2.246
  375   HG23  ILE  62          3HG2      ILE  62  -2.944   2.651  -2.186
  376   HD11  ILE  62          3HD1      ILE  62  -2.039  -1.338  -1.354
  377   HD12  ILE  62          1HD1      ILE  62  -0.726  -0.205  -0.991
  378   HD13  ILE  62          2HD1      ILE  62  -1.104  -1.515   0.141
  379    H    GLN  63           H        GLN  63  -4.249   4.340  -0.717
  380    HA   GLN  63           HA       GLN  63  -2.771   5.571   1.352
  381    HB3  GLN  63           2HB      GLN  63  -5.088   6.736  -0.253
  382    HG3  GLN  63           2HG      GLN  63  -2.681   8.095   1.055
  383   HE21  GLN  63          1HE2      GLN  63  -4.403  10.547   1.288
  384   HE22  GLN  63          2HE2      GLN  63  -4.630  11.146  -0.350
  385    H    GLU  64           H        GLU  64  -6.374   5.113   1.173
  386    HA   GLU  64           HA       GLU  64  -6.824   6.470   3.647
  387    HB3  GLU  64           2HB      GLU  64  -9.129   5.350   3.426
  388    HG3  GLU  64           2HG      GLU  64  -9.692   6.521   1.268
  389    H    ARG  65           H        ARG  65  -5.442   3.417   3.289
  390    HA   ARG  65           HA       ARG  65  -6.000   2.662   6.144
  391    HB3  ARG  65           2HB      ARG  65  -4.686   1.164   3.850
  392    HG3  ARG  65           2HG      ARG  65  -3.794   0.687   6.375
  393    HD3  ARG  65           2HD      ARG  65  -4.788  -1.488   7.060
  394    HE   ARG  65           HE       ARG  65  -6.821   0.693   7.354
  395   HH11  ARG  65          1HH1      ARG  65  -4.630  -1.582   9.025
  396   HH12  ARG  65          2HH1      ARG  65  -5.516  -1.454  10.507
  397   HH21  ARG  65          1HH2      ARG  65  -7.753   0.956   9.337
  398   HH22  ARG  65          2HH2      ARG  65  -7.358  -0.157  10.624
  399    H    ILE  66           H        ILE  66  -3.264   3.192   3.834
  400    HA   ILE  66           HA       ILE  66  -1.221   3.068   5.843
  401    HB   ILE  66           HB       ILE  66  -1.295   4.398   3.102
  402   HG13  ILE  66          2HG1      ILE  66  -1.544   1.826   3.317
  403   HG21  ILE  66          1HG2      ILE  66   1.171   4.477   3.200
  404   HG22  ILE  66          2HG2      ILE  66   0.496   5.425   4.508
  405   HG23  ILE  66          3HG2      ILE  66   1.146   3.797   4.834
  406   HD11  ILE  66          3HD1      ILE  66   0.063   1.268   1.583
  407   HD12  ILE  66          1HD1      ILE  66  -0.727   2.813   1.214
  408   HD13  ILE  66          2HD1      ILE  66   0.944   2.771   1.833
  409    H    ALA  67           H        ALA  67  -2.922   5.987   4.571
  410    HA   ALA  67           HA       ALA  67  -1.464   7.786   6.260
  411    HB1  ALA  67           1HB      ALA  67  -3.153   9.417   5.526
  412    HB2  ALA  67           2HB      ALA  67  -2.573   8.453   4.158
  413    HB3  ALA  67           3HB      ALA  67  -4.166   8.114   4.876
  414    H    ALA  68           H        ALA  68  -4.160   5.645   6.925
  415    HA   ALA  68           HA       ALA  68  -5.126   7.117   9.305
  416    HB1  ALA  68           1HB      ALA  68  -6.778   5.302   9.413
  417    HB2  ALA  68           2HB      ALA  68  -6.732   5.995   7.782
  418    HB3  ALA  68           3HB      ALA  68  -5.953   4.429   8.109
  419    H    LEU  69           H        LEU  69  -2.931   4.479   8.533
  420    HA   LEU  69           HA       LEU  69  -2.305   3.912  11.348
  421    HB3  LEU  69           2HB      LEU  69  -0.073   3.212   9.963
  422    HG   LEU  69           HG       LEU  69  -0.861   0.975   9.745
  423   HD11  LEU  69          1HD1      LEU  69  -2.043   2.091  12.318
  424   HD12  LEU  69          2HD1      LEU  69  -0.306   1.870  12.006
  425   HD13  LEU  69          3HD1      LEU  69  -1.400   0.479  12.030
  426   HD21  LEU  69          3HD2      LEU  69  -3.676   1.969  10.360
  427   HD22  LEU  69          1HD2      LEU  69  -3.162   0.282  10.169
  428   HD23  LEU  69          2HD2      LEU  69  -3.098   1.386   8.782
  429    H    GLY  70           H        GLY  70  -1.900   6.706   9.496
  430    HA2  GLY  70           2HA      GLY  70  -0.824   8.689  10.086
  431    HA3  GLY  70           3HA      GLY  70   0.102   7.829  11.347
  432    H    TYR  71           H        TYR  71   0.317   6.106   8.487
  433    HA   TYR  71           HA       TYR  71   3.091   6.995   7.944
  434    HB3  TYR  71           2HB      TYR  71   3.144   4.880   6.639
  435    HD1  TYR  71           1HD      TYR  71   3.294   5.812   9.859
  436    HD2  TYR  71           2HD      TYR  71   1.932   2.401   7.589
  437    HE1  TYR  71           1HE      TYR  71   3.492   4.406  11.868
  438    HE2  TYR  71           2HE      TYR  71   2.150   0.973   9.622
  439    HH   TYR  71           HH       TYR  71   3.214   2.336  12.762
  440    H    THR  72           H        THR  72   3.360   6.501   5.238
  441    HA   THR  72           HA       THR  72   1.195   7.730   3.723
  442    HB   THR  72           HB       THR  72   2.359   9.706   4.683
  443    HG1  THR  72           1HG      THR  72   2.651  10.660   2.536
  444   HG21  THR  72          3HG2      THR  72   4.702   8.758   4.621
  445   HG22  THR  72          1HG2      THR  72   4.544  10.373   3.936
  446   HG23  THR  72          2HG2      THR  72   4.687   8.968   2.856
  447    H    LEU  73           H        LEU  73   2.161   8.098   1.303
  448    HA   LEU  73           HA       LEU  73   3.732   5.712   0.501
  449    HB3  LEU  73           2HB      LEU  73   1.284   5.102   0.880
  450    HG   LEU  73           HG       LEU  73   0.859   6.536  -1.788
  451   HD11  LEU  73          1HD1      LEU  73  -0.224   4.329  -1.572
  452   HD12  LEU  73          2HD1      LEU  73  -1.406   5.639  -1.648
  453   HD13  LEU  73          3HD1      LEU  73  -1.032   4.868  -0.088
  454   HD21  LEU  73          3HD2      LEU  73   0.647   8.236  -0.039
  455   HD22  LEU  73          1HD2      LEU  73  -0.385   7.156   0.930
  456   HD23  LEU  73          2HD2      LEU  73  -0.950   7.800  -0.631
  457    H    ALA  74           H        ALA  74   3.955   5.524  -1.905
  458    HA   ALA  74           HA       ALA  74   3.121   7.772  -3.569
  459    HB1  ALA  74           1HB      ALA  74   5.410   8.138  -4.517
  460    HB2  ALA  74           2HB      ALA  74   5.288   8.623  -2.824
  461    HB3  ALA  74           3HB      ALA  74   6.080   7.089  -3.249
  462    H    GLU  75           H        GLU  75   2.816   7.197  -5.683
  463    HA   GLU  75           HA       GLU  75   3.999   4.827  -6.887
  464    HB3  GLU  75           2HB      GLU  75   0.969   4.731  -6.858
  465    HG3  GLU  75           2HG      GLU  75   1.446   2.268  -6.886
  466    HA   PRO  76           HA       PRO  76   3.031   8.633  -9.242
  467    HB3  PRO  76           2HB      PRO  76   4.997   9.481  -8.349
  468    HG3  PRO  76           2HG      PRO  76   6.994   8.152  -8.224
  469    HD3  PRO  76           2HD      PRO  76   5.348   7.059  -6.961
  Start of MODEL    7
    1    H2   PRO   6           2H       PRO   6  -7.777  -3.078 -15.989
    2    HA   PRO   6           HA       PRO   6  -8.269  -5.898 -15.344
    3    HB3  PRO   6           2HB      PRO   6  -6.695  -6.527 -16.966
    4    HG3  PRO   6           2HG      PRO   6  -8.114  -5.714 -18.648
    5    HD3  PRO   6           2HD      PRO   6  -9.728  -4.940 -17.163
    6    H    LEU   7           H        LEU   7  -6.876  -6.718 -13.697
    7    HA   LEU   7           HA       LEU   7  -5.660  -4.589 -12.066
    8    HB3  LEU   7           2HB      LEU   7  -6.990  -5.873 -10.686
    9    HG   LEU   7           HG       LEU   7  -5.896  -8.344 -12.053
   10   HD11  LEU   7          1HD1      LEU   7  -6.675  -9.688 -10.094
   11   HD12  LEU   7          2HD1      LEU   7  -6.909  -8.186  -9.178
   12   HD13  LEU   7          3HD1      LEU   7  -5.281  -8.672  -9.706
   13   HD21  LEU   7          3HD2      LEU   7  -8.245  -9.081 -11.838
   14   HD22  LEU   7          1HD2      LEU   7  -8.180  -7.515 -12.654
   15   HD23  LEU   7          2HD2      LEU   7  -8.645  -7.593 -10.950
   16    H    LYS   8           H        LYS   8  -3.661  -4.287 -11.675
   17    HA   LYS   8           HA       LYS   8  -1.541  -6.012 -12.888
   18    HB3  LYS   8           2HB      LYS   8  -1.918  -4.254 -14.503
   19    HG3  LYS   8           2HG      LYS   8  -1.943  -2.376 -12.113
   20    HD3  LYS   8           2HD      LYS   8  -1.793  -0.490 -13.743
   21    HE3  LYS   8           2HE      LYS   8   0.775  -2.126 -13.521
   22    HZ1  LYS   8           3HZ      LYS   8   0.936  -0.047 -14.797
   23    HZ2  LYS   8           1HZ      LYS   8   1.774   0.051 -13.375
   24    HZ3  LYS   8           2HZ      LYS   8   0.336   0.808 -13.520
   25    H    THR   9           H        THR   9   0.543  -5.823 -11.944
   26    HA   THR   9           HA       THR   9   0.602  -5.003  -9.113
   27    HB   THR   9           HB       THR   9   1.688  -7.105 -10.062
   28    HG1  THR   9           1HG      THR   9   3.060  -6.988  -8.408
   29   HG21  THR   9          3HG2      THR   9   3.934  -5.136 -10.747
   30   HG22  THR   9          1HG2      THR   9   2.971  -6.035 -11.940
   31   HG23  THR   9          2HG2      THR   9   4.021  -6.893 -10.798
   32    H    GLN  10           H        GLN  10   2.271  -3.621  -8.256
   33    HA   GLN  10           HA       GLN  10   3.645  -1.639  -9.866
   34    HB3  GLN  10           2HB      GLN  10   1.314  -0.682  -8.154
   35    HG3  GLN  10           2HG      GLN  10   3.200   0.975  -8.759
   36   HE21  GLN  10          1HE2      GLN  10   2.765   3.009 -10.601
   37   HE22  GLN  10          2HE2      GLN  10   3.144   2.402 -12.219
   38    H    GLN  11           H        GLN  11   5.262  -0.670  -8.601
   39    HA   GLN  11           HA       GLN  11   5.424  -1.436  -5.728
   40    HB3  GLN  11           2HB      GLN  11   7.535  -0.373  -7.642
   41    HG3  GLN  11           2HG      GLN  11   7.704  -1.384  -4.769
   42   HE21  GLN  11          1HE2      GLN  11  10.005   0.198  -7.076
   43   HE22  GLN  11          2HE2      GLN  11  11.285  -0.976  -6.728
   44    H    MET  12           H        MET  12   5.742   0.051  -4.079
   45    HA   MET  12           HA       MET  12   4.980   2.887  -4.598
   46    HB3  MET  12           2HB      MET  12   3.619   0.760  -2.904
   47    HG3  MET  12           2HG      MET  12   3.067   3.754  -2.889
   48    HE1  MET  12           3HE      MET  12   0.810   2.654  -4.309
   49    HE2  MET  12           1HE      MET  12  -0.615   2.960  -3.301
   50    HE3  MET  12           2HE      MET  12   0.639   4.197  -3.425
   51    H    GLN  13           H        GLN  13   5.466   4.296  -2.897
   52    HA   GLN  13           HA       GLN  13   7.670   3.457  -1.084
   53    HB3  GLN  13           2HB      GLN  13   8.058   5.963  -0.964
   54    HG3  GLN  13           2HG      GLN  13   8.101   4.737  -3.752
   55   HE21  GLN  13          1HE2      GLN  13   9.751   5.672  -5.205
   56   HE22  GLN  13          2HE2      GLN  13  10.007   7.414  -5.132
   57    H    VAL  14           H        VAL  14   7.553   4.113   1.130
   58    HA   VAL  14           HA       VAL  14   5.099   5.308   2.188
   59    HB   VAL  14           HB       VAL  14   4.228   3.109   2.078
   60   HG11  VAL  14          1HG1      VAL  14   6.712   2.030   3.469
   61   HG12  VAL  14          2HG1      VAL  14   5.240   1.119   3.085
   62   HG13  VAL  14          3HG1      VAL  14   6.234   1.757   1.776
   63   HG21  VAL  14          3HG2      VAL  14   5.142   3.519   4.951
   64   HG22  VAL  14          1HG2      VAL  14   3.750   4.305   4.180
   65   HG23  VAL  14          2HG2      VAL  14   3.763   2.553   4.395
   66    H    GLY  15           H        GLY  15   5.511   6.475   3.897
   67    HA2  GLY  15           2HA      GLY  15   8.206   6.314   5.233
   68    HA3  GLY  15           3HA      GLY  15   7.275   7.804   5.026
   69    H    GLY  16           H        GLY  16   7.982   5.330   7.096
   70    HA2  GLY  16           2HA      GLY  16   7.296   5.747   9.472
   71    HA3  GLY  16           3HA      GLY  16   5.620   5.830   8.892
   72    H    MET  17           H        MET  17   6.039   3.589   6.948
   73    HA   MET  17           HA       MET  17   6.075   1.262   8.784
   74    HB3  MET  17           2HB      MET  17   5.839   1.247   5.756
   75    HG3  MET  17           2HG      MET  17   4.735  -0.708   7.802
   76    HE1  MET  17           3HE      MET  17   6.571  -0.540   4.286
   77    HE2  MET  17           1HE      MET  17   6.912  -2.122   5.026
   78    HE3  MET  17           2HE      MET  17   5.919  -2.026   3.561
   79    H    ARG  18           H        ARG  18   7.938   0.528   9.386
   80    HA   ARG  18           HA       ARG  18   9.898  -0.623   7.839
   81    HB3  ARG  18           2HB      ARG  18  10.800   1.476   7.106
   82    HG3  ARG  18           2HG      ARG  18  11.110   2.263  10.035
   83    HD3  ARG  18           2HD      ARG  18  11.791   3.757   7.465
   84    HE   ARG  18           HE       ARG  18  12.699   4.732  10.086
   85   HH11  ARG  18          1HH1      ARG  18  10.179   5.175   7.595
   86   HH12  ARG  18          2HH1      ARG  18   9.818   6.782   8.237
   87   HH21  ARG  18          1HH2      ARG  18  12.107   6.790  10.736
   88   HH22  ARG  18          2HH2      ARG  18  10.782   7.607   9.892
   89    H    CYS  19           H        CYS  19  10.950  -2.041   9.099
   90    HA   CYS  19           HA       CYS  19  11.331  -3.408  10.890
   91    HB3  CYS  19           2HB      CYS  19  11.904  -2.227  13.117
   92    HG   CYS  19           HG       CYS  19  14.208  -1.085  12.196
   93    H    ALA  20           H        ALA  20  10.508  -4.226  12.996
   94    HA   ALA  20           HA       ALA  20   8.822  -5.101  14.225
   95    HB1  ALA  20           1HB      ALA  20   7.553  -2.337  14.058
   96    HB2  ALA  20           2HB      ALA  20   7.329  -3.552  15.334
   97    HB3  ALA  20           3HB      ALA  20   8.901  -2.776  15.128
   98    H    ALA  21           H        ALA  21   6.122  -4.960  14.401
   99    HA   ALA  21           HA       ALA  21   5.461  -6.695  12.186
  100    HB1  ALA  21           1HB      ALA  21   5.039  -7.150  14.606
  101    HB2  ALA  21           2HB      ALA  21   3.830  -5.845  14.621
  102    HB3  ALA  21           3HB      ALA  21   3.575  -7.283  13.616
  103    H    CYS  22           H        CYS  22   4.916  -3.364  12.426
  104    HA   CYS  22           HA       CYS  22   2.226  -2.969  12.079
  105    HB3  CYS  22           2HB      CYS  22   2.866  -0.720  11.305
  106    HG   CYS  22           HG       CYS  22   2.895  -1.318  13.876
  107    H    ALA  23           H        ALA  23   4.445  -3.666   9.339
  108    HA   ALA  23           HA       ALA  23   2.876  -3.248   7.110
  109    HB1  ALA  23           1HB      ALA  23   5.114  -4.102   7.079
  110    HB2  ALA  23           2HB      ALA  23   4.610  -5.626   7.854
  111    HB3  ALA  23           3HB      ALA  23   4.048  -5.220   6.220
  112    H    SER  24           H        SER  24   2.280  -5.732   9.616
  113    HA   SER  24           HA       SER  24   0.433  -7.382   8.204
  114    HB3  SER  24           2HB      SER  24  -0.169  -8.262  10.328
  115    HG   SER  24           HG       SER  24   2.356  -7.343  11.060
  116    H    SER  25           H        SER  25  -0.116  -4.267   9.845
  117    HA   SER  25           HA       SER  25  -3.043  -4.456   9.643
  118    HB3  SER  25           2HB      SER  25  -3.035  -2.200  10.541
  119    HG   SER  25           HG       SER  25  -2.760  -3.723  12.107
  120    H    ILE  26           H        ILE  26  -0.558  -3.737   7.445
  121    HA   ILE  26           HA       ILE  26  -2.473  -2.458   5.530
  122    HB   ILE  26           HB       ILE  26   0.487  -3.156   5.269
  123   HG13  ILE  26          2HG1      ILE  26  -1.049  -0.568   5.511
  124   HG21  ILE  26          1HG2      ILE  26  -1.381  -2.110   3.113
  125   HG22  ILE  26          2HG2      ILE  26   0.391  -2.267   2.993
  126   HG23  ILE  26          3HG2      ILE  26  -0.593  -3.710   3.146
  127   HD11  ILE  26          3HD1      ILE  26   0.966   0.170   6.724
  128   HD12  ILE  26          1HD1      ILE  26   0.363  -1.334   7.458
  129   HD13  ILE  26          2HD1      ILE  26   1.770  -1.367   6.379
  130    H    GLU  27           H        GLU  27  -0.464  -5.447   5.840
  131    HA   GLU  27           HA       GLU  27  -1.483  -6.730   3.586
  132    HB3  GLU  27           2HB      GLU  27  -0.813  -8.888   4.707
  133    HG3  GLU  27           2HG      GLU  27   1.287  -6.729   5.047
  134    H    ARG  28           H        ARG  28  -2.839  -6.990   6.943
  135    HA   ARG  28           HA       ARG  28  -4.771  -8.980   6.128
  136    HB3  ARG  28           2HB      ARG  28  -4.687  -7.195   8.589
  137    HG3  ARG  28           2HG      ARG  28  -6.914  -8.184   8.411
  138    HD3  ARG  28           2HD      ARG  28  -5.536 -10.907   8.297
  139    HE   ARG  28           HE       ARG  28  -8.151 -10.119   9.182
  140   HH11  ARG  28          1HH1      ARG  28  -6.784 -12.690   7.105
  141   HH12  ARG  28          2HH1      ARG  28  -8.210 -13.679   7.338
  142   HH21  ARG  28          1HH2      ARG  28  -9.720 -11.583   9.652
  143   HH22  ARG  28          2HH2      ARG  28  -9.709 -13.163   8.902
  144    H    ALA  29           H        ALA  29  -4.902  -5.433   6.197
  145    HA   ALA  29           HA       ALA  29  -7.781  -5.303   5.667
  146    HB1  ALA  29           1HB      ALA  29  -5.544  -3.243   5.332
  147    HB2  ALA  29           2HB      ALA  29  -7.286  -2.940   5.138
  148    HB3  ALA  29           3HB      ALA  29  -6.644  -3.398   6.721
  149    H    LEU  30           H        LEU  30  -4.807  -5.006   3.699
  150    HA   LEU  30           HA       LEU  30  -5.717  -3.800   1.502
  151    HB3  LEU  30           2HB      LEU  30  -3.756  -6.159   1.558
  152    HG   LEU  30           HG       LEU  30  -2.494  -5.042  -0.158
  153   HD11  LEU  30          1HD1      LEU  30  -3.544  -5.664  -2.145
  154   HD12  LEU  30          2HD1      LEU  30  -5.159  -5.559  -1.452
  155   HD13  LEU  30          3HD1      LEU  30  -4.034  -6.829  -0.905
  156   HD21  LEU  30          3HD2      LEU  30  -3.274  -2.741   0.193
  157   HD22  LEU  30          1HD2      LEU  30  -4.843  -3.151  -0.525
  158   HD23  LEU  30          2HD2      LEU  30  -3.379  -3.194  -1.517
  159    H    GLU  31           H        GLU  31  -5.787  -7.392   1.696
  160    HA   GLU  31           HA       GLU  31  -6.825  -7.562  -0.952
  161    HB3  GLU  31           2HB      GLU  31  -5.451  -9.333  -0.113
  162    HG3  GLU  31           2HG      GLU  31  -7.639 -10.011   1.894
  163    H    ARG  32           H        ARG  32  -8.350  -6.709   1.903
  164    HA   ARG  32           HA       ARG  32 -10.984  -7.824   1.222
  165    HB3  ARG  32           2HB      ARG  32 -11.549  -7.588   3.550
  166    HG3  ARG  32           2HG      ARG  32  -8.666  -8.586   3.456
  167    HD3  ARG  32           2HD      ARG  32  -9.609  -8.403   5.738
  168    HE   ARG  32           HE       ARG  32 -11.830  -9.002   5.880
  169   HH11  ARG  32          1HH1      ARG  32 -10.213 -11.663   4.072
  170   HH12  ARG  32          2HH1      ARG  32 -11.681 -12.616   4.140
  171   HH21  ARG  32          1HH2      ARG  32 -13.557 -10.466   6.011
  172   HH22  ARG  32          2HH2      ARG  32 -13.465 -11.965   5.109
  173    H    LEU  33           H        LEU  33  -9.278  -4.810   1.175
  174    HA   LEU  33           HA       LEU  33 -11.449  -2.973   1.601
  175    HB3  LEU  33           2HB      LEU  33  -9.978  -1.337   0.488
  176    HG   LEU  33           HG       LEU  33  -8.185  -3.171   2.107
  177   HD11  LEU  33          1HD1      LEU  33  -7.866  -0.235   1.406
  178   HD12  LEU  33          2HD1      LEU  33  -6.947  -1.574   0.684
  179   HD13  LEU  33          3HD1      LEU  33  -6.768  -1.208   2.405
  180   HD21  LEU  33          3HD2      LEU  33  -8.604  -1.537   3.949
  181   HD22  LEU  33          1HD2      LEU  33 -10.058  -2.449   3.502
  182   HD23  LEU  33          2HD2      LEU  33  -9.849  -0.763   2.955
  183    H    LYS  34           H        LYS  34 -10.891  -4.973  -1.115
  184    HA   LYS  34           HA       LYS  34 -11.839  -5.272  -3.126
  185    HB3  LYS  34           2HB      LYS  34 -13.818  -3.813  -3.860
  186    HG3  LYS  34           2HG      LYS  34 -13.998  -5.517  -1.341
  187    HD3  LYS  34           2HD      LYS  34 -16.149  -4.505  -3.269
  188    HE3  LYS  34           2HE      LYS  34 -17.671  -5.702  -1.578
  189    HZ1  LYS  34           3HZ      LYS  34 -17.464  -6.652  -3.733
  190    HZ2  LYS  34           1HZ      LYS  34 -17.364  -7.865  -2.621
  191    HZ3  LYS  34           2HZ      LYS  34 -16.013  -7.381  -3.385
  192    H    GLY  35           H        GLY  35 -11.760  -4.568  -5.307
  193    HA2  GLY  35           2HA      GLY  35 -10.869  -3.465  -7.126
  194    HA3  GLY  35           3HA      GLY  35 -10.660  -2.020  -6.117
  195    H    VAL  36           H        VAL  36  -8.917  -2.827  -4.233
  196    HA   VAL  36           HA       VAL  36  -6.359  -3.632  -5.486
  197    HB   VAL  36           HB       VAL  36  -5.620  -3.817  -3.038
  198   HG11  VAL  36          1HG1      VAL  36  -6.521  -1.114  -4.112
  199   HG12  VAL  36          2HG1      VAL  36  -5.467  -1.339  -2.700
  200   HG13  VAL  36          3HG1      VAL  36  -4.924  -1.883  -4.282
  201   HG21  VAL  36          3HG2      VAL  36  -8.153  -2.216  -2.489
  202   HG22  VAL  36          1HG2      VAL  36  -7.996  -3.945  -2.118
  203   HG23  VAL  36          2HG2      VAL  36  -6.938  -2.760  -1.332
  204    H    ALA  37           H        ALA  37  -5.299  -5.633  -4.991
  205    HA   ALA  37           HA       ALA  37  -7.169  -7.873  -4.246
  206    HB1  ALA  37           1HB      ALA  37  -7.031  -7.514  -6.683
  207    HB2  ALA  37           2HB      ALA  37  -5.265  -7.696  -6.616
  208    HB3  ALA  37           3HB      ALA  37  -6.316  -9.070  -6.214
  209    H    GLU  38           H        GLU  38  -3.610  -7.128  -4.548
  210    HA   GLU  38           HA       GLU  38  -2.952  -9.232  -2.626
  211    HB3  GLU  38           2HB      GLU  38  -1.387 -10.318  -4.284
  212    HG3  GLU  38           2HG      GLU  38  -4.335 -10.650  -4.933
  213    H    ALA  39           H        ALA  39  -0.728  -9.006  -1.847
  214    HA   ALA  39           HA       ALA  39   0.909  -6.840  -3.008
  215    HB1  ALA  39           1HB      ALA  39  -0.813  -5.658  -1.746
  216    HB2  ALA  39           2HB      ALA  39  -0.422  -6.599  -0.283
  217    HB3  ALA  39           3HB      ALA  39   0.768  -5.463  -0.963
  218    H    SER  40           H        SER  40   2.971  -6.593  -2.213
  219    HA   SER  40           HA       SER  40   4.040  -8.766  -0.427
  220    HB3  SER  40           2HB      SER  40   6.123  -8.739  -1.630
  221    HG   SER  40           HG       SER  40   4.115  -8.955  -3.649
  222    H    VAL  41           H        VAL  41   4.689  -7.857   1.466
  223    HA   VAL  41           HA       VAL  41   5.594  -5.033   1.557
  224    HB   VAL  41           HB       VAL  41   5.394  -5.098   3.926
  225   HG11  VAL  41          1HG1      VAL  41   3.064  -5.563   4.197
  226   HG12  VAL  41          2HG1      VAL  41   3.276  -5.042   2.527
  227   HG13  VAL  41          3HG1      VAL  41   3.068  -6.757   2.881
  228   HG21  VAL  41          3HG2      VAL  41   5.141  -8.127   3.758
  229   HG22  VAL  41          1HG2      VAL  41   6.380  -7.181   4.594
  230   HG23  VAL  41          2HG2      VAL  41   4.720  -7.170   5.184
  231    H    THR  42           H        THR  42   7.600  -4.313   2.036
  232    HA   THR  42           HA       THR  42   9.749  -6.276   2.829
  233    HB   THR  42           HB       THR  42  10.039  -3.774   1.153
  234    HG1  THR  42           1HG      THR  42   9.265  -5.391  -0.085
  235   HG21  THR  42          3HG2      THR  42  12.022  -4.193   2.621
  236   HG22  THR  42          1HG2      THR  42  12.388  -4.487   0.919
  237   HG23  THR  42          2HG2      THR  42  12.101  -5.858   2.002
  238    H    VAL  43           H        VAL  43   9.766  -6.030   4.968
  239    HA   VAL  43           HA       VAL  43   8.954  -3.538   6.253
  240    HB   VAL  43           HB       VAL  43   9.870  -6.234   7.284
  241   HG11  VAL  43          1HG1      VAL  43   9.073  -3.807   8.965
  242   HG12  VAL  43          2HG1      VAL  43   9.197  -5.472   9.565
  243   HG13  VAL  43          3HG1      VAL  43  10.642  -4.651   9.000
  244   HG21  VAL  43          3HG2      VAL  43   7.595  -6.013   6.297
  245   HG22  VAL  43          1HG2      VAL  43   7.488  -6.282   8.047
  246   HG23  VAL  43          2HG2      VAL  43   7.271  -4.645   7.377
  247    H    ALA  44           H        ALA  44  12.149  -5.152   5.717
  248    HA   ALA  44           HA       ALA  44  13.595  -3.560   7.630
  249    HB1  ALA  44           1HB      ALA  44  14.552  -5.043   5.127
  250    HB2  ALA  44           2HB      ALA  44  15.576  -4.465   6.459
  251    HB3  ALA  44           3HB      ALA  44  14.375  -5.731   6.755
  252    H    THR  45           H        THR  45  13.453  -3.280   4.080
  253    HA   THR  45           HA       THR  45  14.632  -0.613   4.039
  254    HB   THR  45           HB       THR  45  13.371  -2.062   1.688
  255    HG1  THR  45           1HG      THR  45  15.281  -3.207   1.501
  256   HG21  THR  45          3HG2      THR  45  14.300   0.160   1.165
  257   HG22  THR  45          1HG2      THR  45  15.350  -1.087   0.491
  258   HG23  THR  45          2HG2      THR  45  15.820  -0.252   1.987
  259    H    GLY  46           H        GLY  46  11.503  -1.648   4.660
  260    HA2  GLY  46           2HA      GLY  46   9.449  -0.692   4.746
  261    HA3  GLY  46           3HA      GLY  46  10.300   0.836   4.874
  262    H    ARG  47           H        ARG  47   9.029  -1.525   2.544
  263    HA   ARG  47           HA       ARG  47   7.894   0.612   0.905
  264    HB3  ARG  47           2HB      ARG  47  10.130   0.455  -0.108
  265    HG3  ARG  47           2HG      ARG  47   9.335  -2.455  -0.541
  266    HD3  ARG  47           2HD      ARG  47  11.632  -1.046  -1.921
  267    HE   ARG  47           HE       ARG  47  10.468  -3.720  -2.539
  268   HH11  ARG  47          1HH1      ARG  47  13.391  -1.974  -1.507
  269   HH12  ARG  47          2HH1      ARG  47  14.219  -3.451  -1.103
  270   HH21  ARG  47          1HH2      ARG  47  11.688  -5.569  -2.225
  271   HH22  ARG  47          2HH2      ARG  47  13.346  -5.441  -1.674
  272    H    LEU  48           H        LEU  48   6.662  -0.361  -1.025
  273    HA   LEU  48           HA       LEU  48   5.394  -2.979  -0.313
  274    HB3  LEU  48           2HB      LEU  48   3.211  -1.802  -1.031
  275    HG   LEU  48           HG       LEU  48   4.449  -0.610   1.486
  276   HD11  LEU  48          1HD1      LEU  48   2.452   0.561   0.597
  277   HD12  LEU  48          2HD1      LEU  48   2.056  -0.322   2.089
  278   HD13  LEU  48          3HD1      LEU  48   1.592  -0.994   0.501
  279   HD21  LEU  48          3HD2      LEU  48   2.800  -3.147   1.040
  280   HD22  LEU  48          1HD2      LEU  48   3.132  -2.424   2.634
  281   HD23  LEU  48          2HD2      LEU  48   4.465  -3.059   1.671
  282    H    THR  49           H        THR  49   4.428  -4.073  -1.907
  283    HA   THR  49           HA       THR  49   4.445  -3.085  -4.726
  284    HB   THR  49           HB       THR  49   4.785  -6.014  -3.984
  285    HG1  THR  49           1HG      THR  49   6.900  -5.826  -4.565
  286   HG21  THR  49          3HG2      THR  49   3.723  -5.597  -6.169
  287   HG22  THR  49          1HG2      THR  49   5.354  -6.240  -6.390
  288   HG23  THR  49          2HG2      THR  49   5.049  -4.504  -6.626
  289    H    VAL  50           H        VAL  50   2.380  -3.207  -5.549
  290    HA   VAL  50           HA       VAL  50   0.324  -4.790  -4.094
  291    HB   VAL  50           HB       VAL  50   0.348  -2.690  -2.915
  292   HG11  VAL  50          1HG1      VAL  50   1.327  -1.176  -4.600
  293   HG12  VAL  50          2HG1      VAL  50  -0.160  -1.268  -5.568
  294   HG13  VAL  50          3HG1      VAL  50  -0.186  -0.531  -3.957
  295   HG21  VAL  50          3HG2      VAL  50  -1.996  -2.039  -3.161
  296   HG22  VAL  50          1HG2      VAL  50  -2.091  -2.785  -4.751
  297   HG23  VAL  50          2HG2      VAL  50  -1.838  -3.799  -3.314
  298    H    THR  51           H        THR  51  -1.350  -5.455  -5.224
  299    HA   THR  51           HA       THR  51  -1.469  -4.939  -8.145
  300    HB   THR  51           HB       THR  51  -2.458  -7.290  -6.472
  301    HG1  THR  51           1HG      THR  51  -0.886  -8.294  -7.936
  302   HG21  THR  51          3HG2      THR  51  -3.981  -6.893  -8.430
  303   HG22  THR  51          1HG2      THR  51  -3.000  -8.338  -8.661
  304   HG23  THR  51          2HG2      THR  51  -2.578  -6.833  -9.509
  305    H    TYR  52           H        TYR  52  -3.112  -3.819  -8.933
  306    HA   TYR  52           HA       TYR  52  -5.785  -3.894  -7.742
  307    HB3  TYR  52           2HB      TYR  52  -4.623  -2.197  -6.399
  308    HD1  TYR  52           2HD      TYR  52  -5.583  -0.075  -9.297
  309    HD2  TYR  52           1HD      TYR  52  -2.403  -1.312  -6.674
  310    HE1  TYR  52           2HE      TYR  52  -4.154   1.778 -10.152
  311    HE2  TYR  52           1HE      TYR  52  -1.002   0.582  -7.460
  312    HH   TYR  52           HH       TYR  52  -0.935   2.544  -8.845
  313    H    ASP  53           H        ASP  53  -7.447  -2.786  -9.045
  314    HA   ASP  53           HA       ASP  53  -6.801  -2.719 -11.935
  315    HB3  ASP  53           2HB      ASP  53  -9.410  -2.858 -10.409
  316    HA   PRO  54           HA       PRO  54  -6.371   1.625 -11.057
  317    HB3  PRO  54           2HB      PRO  54  -4.541   1.427 -12.486
  318    HG3  PRO  54           2HG      PRO  54  -4.703   0.237 -14.558
  319    HD3  PRO  54           2HD      PRO  54  -5.267  -1.282 -12.841
  320    H    LYS  55           H        LYS  55  -9.065   0.439 -12.361
  321    HA   LYS  55           HA       LYS  55 -10.253   3.149 -12.812
  322    HB3  LYS  55           2HB      LYS  55 -11.654   2.201 -14.663
  323    HG3  LYS  55           2HG      LYS  55  -8.652   2.121 -15.205
  324    HD3  LYS  55           2HD      LYS  55 -10.968   2.956 -16.994
  325    HE3  LYS  55           2HE      LYS  55  -7.946   2.778 -17.423
  326    HZ1  LYS  55           3HZ      LYS  55  -9.247   2.209 -19.428
  327    HZ2  LYS  55           1HZ      LYS  55  -8.393   3.601 -19.613
  328    HZ3  LYS  55           2HZ      LYS  55  -9.999   3.677 -19.367
  329    H    GLN  56           H        GLN  56 -10.688  -0.136 -11.595
  330    HA   GLN  56           HA       GLN  56 -13.168   0.561 -10.160
  331    HB3  GLN  56           2HB      GLN  56 -12.348  -1.293  -8.606
  332    HG3  GLN  56           2HG      GLN  56 -12.659  -1.967 -11.552
  333   HE21  GLN  56          1HE2      GLN  56 -13.316  -3.434  -8.243
  334   HE22  GLN  56          2HE2      GLN  56 -12.865  -5.051  -8.794
  335    H    VAL  57           H        VAL  57  -9.614   0.823  -9.489
  336    HA   VAL  57           HA       VAL  57 -10.148   2.893  -7.453
  337    HB   VAL  57           HB       VAL  57  -8.771   1.804  -5.749
  338   HG11  VAL  57          1HG1      VAL  57 -11.169   0.074  -6.442
  339   HG12  VAL  57          2HG1      VAL  57 -10.376   0.206  -4.869
  340   HG13  VAL  57          3HG1      VAL  57 -11.210   1.612  -5.552
  341   HG21  VAL  57          3HG2      VAL  57  -7.483   0.242  -7.212
  342   HG22  VAL  57          1HG2      VAL  57  -8.216  -0.565  -5.825
  343   HG23  VAL  57          2HG2      VAL  57  -8.948  -0.731  -7.439
  344    H    SER  58           H        SER  58  -7.420   2.770  -6.380
  345    HA   SER  58           HA       SER  58  -5.395   3.043  -8.371
  346    HB3  SER  58           2HB      SER  58  -6.810   5.031  -8.990
  347    HG   SER  58           HG       SER  58  -7.522   6.314  -7.474
  348    H    GLU  59           H        GLU  59  -3.730   4.893  -7.011
  349    HA   GLU  59           HA       GLU  59  -2.882   3.778  -4.582
  350    HB3  GLU  59           2HB      GLU  59  -1.554   5.382  -5.825
  351    HG3  GLU  59           2HG      GLU  59  -3.434   7.586  -4.856
  352    H    ILE  60           H        ILE  60  -5.801   5.609  -5.072
  353    HA   ILE  60           HA       ILE  60  -6.041   6.978  -2.574
  354    HB   ILE  60           HB       ILE  60  -8.052   5.908  -4.597
  355   HG13  ILE  60          2HG1      ILE  60  -8.246   8.169  -5.373
  356   HG21  ILE  60          1HG2      ILE  60  -9.338   6.015  -2.620
  357   HG22  ILE  60          2HG2      ILE  60  -8.639   7.583  -2.140
  358   HG23  ILE  60          3HG2      ILE  60  -9.726   7.460  -3.550
  359   HD11  ILE  60          3HD1      ILE  60  -7.860   9.540  -3.392
  360   HD12  ILE  60          1HD1      ILE  60  -6.162   9.003  -3.313
  361   HD13  ILE  60          2HD1      ILE  60  -6.721   9.964  -4.684
  362    H    THR  61           H        THR  61  -7.242   3.716  -3.455
  363    HA   THR  61           HA       THR  61  -8.672   3.325  -1.038
  364    HB   THR  61           HB       THR  61  -7.460   1.297  -2.958
  365    HG1  THR  61           1HG      THR  61  -9.916   2.737  -2.857
  366   HG21  THR  61          3HG2      THR  61  -9.796   1.070  -0.990
  367   HG22  THR  61          1HG2      THR  61  -8.291   0.120  -0.974
  368   HG23  THR  61          2HG2      THR  61  -9.455  -0.094  -2.289
  369    H    ILE  62           H        ILE  62  -5.322   2.608  -1.824
  370    HA   ILE  62           HA       ILE  62  -4.826   1.383   0.840
  371    HB   ILE  62           HB       ILE  62  -3.946   0.437  -1.317
  372   HG13  ILE  62          2HG1      ILE  62  -3.133  -0.313   0.780
  373   HG21  ILE  62          1HG2      ILE  62  -3.297   2.547  -2.416
  374   HG22  ILE  62          2HG2      ILE  62  -1.979   2.757  -1.234
  375   HG23  ILE  62          3HG2      ILE  62  -1.987   1.386  -2.369
  376   HD11  ILE  62          3HD1      ILE  62  -0.624   0.294  -0.857
  377   HD12  ILE  62          1HD1      ILE  62  -0.870  -1.012   0.323
  378   HD13  ILE  62          2HD1      ILE  62  -1.756  -1.025  -1.210
  379    H    GLN  63           H        GLN  63  -4.191   4.494  -0.801
  380    HA   GLN  63           HA       GLN  63  -2.619   5.748   1.189
  381    HB3  GLN  63           2HB      GLN  63  -4.908   6.848  -0.501
  382    HG3  GLN  63           2HG      GLN  63  -2.637   8.597   0.383
  383   HE21  GLN  63          1HE2      GLN  63  -3.289   9.289  -1.937
  384   HE22  GLN  63          2HE2      GLN  63  -4.638  10.416  -2.036
  385    H    GLU  64           H        GLU  64  -6.198   5.546   0.970
  386    HA   GLU  64           HA       GLU  64  -6.733   6.924   3.372
  387    HB3  GLU  64           2HB      GLU  64  -8.974   5.671   3.193
  388    HG3  GLU  64           2HG      GLU  64  -9.450   6.479   0.782
  389    H    ARG  65           H        ARG  65  -5.642   3.647   3.015
  390    HA   ARG  65           HA       ARG  65  -6.223   2.953   5.823
  391    HB3  ARG  65           2HB      ARG  65  -4.448   1.254   4.081
  392    HG3  ARG  65           2HG      ARG  65  -5.816  -0.582   4.930
  393    HD3  ARG  65           2HD      ARG  65  -5.083   1.288   7.219
  394    HE   ARG  65           HE       ARG  65  -5.034  -1.576   7.688
  395   HH11  ARG  65          1HH1      ARG  65  -7.273   1.223   7.970
  396   HH12  ARG  65          2HH1      ARG  65  -7.852   0.661   9.496
  397   HH21  ARG  65          1HH2      ARG  65  -6.240  -2.377   9.400
  398   HH22  ARG  65          2HH2      ARG  65  -7.247  -1.261  10.314
  399    H    ILE  66           H        ILE  66  -3.293   3.486   3.775
  400    HA   ILE  66           HA       ILE  66  -1.456   3.124   5.990
  401    HB   ILE  66           HB       ILE  66  -1.135   4.295   3.202
  402   HG13  ILE  66          2HG1      ILE  66  -1.704   1.812   3.519
  403   HG21  ILE  66          1HG2      ILE  66   1.316   4.093   3.525
  404   HG22  ILE  66          2HG2      ILE  66   0.653   5.235   4.674
  405   HG23  ILE  66          3HG2      ILE  66   1.066   3.581   5.202
  406   HD11  ILE  66          3HD1      ILE  66  -0.051   0.906   2.036
  407   HD12  ILE  66          1HD1      ILE  66  -0.486   2.530   1.490
  408   HD13  ILE  66          2HD1      ILE  66   1.066   2.244   2.328
  409    H    ALA  67           H        ALA  67  -2.871   6.118   4.621
  410    HA   ALA  67           HA       ALA  67  -1.393   7.959   6.213
  411    HB1  ALA  67           1HB      ALA  67  -4.250   8.087   5.117
  412    HB2  ALA  67           2HB      ALA  67  -3.297   9.472   5.682
  413    HB3  ALA  67           3HB      ALA  67  -2.771   8.563   4.252
  414    H    ALA  68           H        ALA  68  -4.214   5.967   6.961
  415    HA   ALA  68           HA       ALA  68  -4.900   7.336   9.460
  416    HB1  ALA  68           1HB      ALA  68  -6.807   5.821   9.388
  417    HB2  ALA  68           2HB      ALA  68  -6.560   6.536   7.778
  418    HB3  ALA  68           3HB      ALA  68  -6.055   4.863   8.095
  419    H    LEU  69           H        LEU  69  -3.250   4.294   8.557
  420    HA   LEU  69           HA       LEU  69  -2.878   3.300  11.245
  421    HB3  LEU  69           2HB      LEU  69  -0.803   2.282  10.297
  422    HG   LEU  69           HG       LEU  69  -3.292   1.911   8.582
  423   HD11  LEU  69          1HD1      LEU  69  -1.244   1.104   7.488
  424   HD12  LEU  69          2HD1      LEU  69  -2.276  -0.249   7.980
  425   HD13  LEU  69          3HD1      LEU  69  -0.837   0.153   8.939
  426   HD21  LEU  69          3HD2      LEU  69  -2.346   0.385  11.044
  427   HD22  LEU  69          1HD2      LEU  69  -3.686  -0.099   9.977
  428   HD23  LEU  69          2HD2      LEU  69  -3.815   1.384  10.914
  429    H    GLY  70           H        GLY  70  -1.534   6.049   9.584
  430    HA2  GLY  70           2HA      GLY  70  -0.936   7.906  11.093
  431    HA3  GLY  70           3HA      GLY  70   0.101   6.787  11.999
  432    H    TYR  71           H        TYR  71   0.225   6.272   8.595
  433    HA   TYR  71           HA       TYR  71   2.978   7.409   8.558
  434    HB3  TYR  71           2HB      TYR  71   3.420   5.613   6.997
  435    HD1  TYR  71           1HD      TYR  71   3.504   5.757  10.082
  436    HD2  TYR  71           2HD      TYR  71   1.539   3.042   7.364
  437    HE1  TYR  71           1HE      TYR  71   3.370   4.058  11.875
  438    HE2  TYR  71           2HE      TYR  71   1.440   1.327   9.158
  439    HH   TYR  71           HH       TYR  71   2.445   2.016  12.517
  440    H    THR  72           H        THR  72   3.548   7.476   5.934
  441    HA   THR  72           HA       THR  72   1.518   8.953   4.356
  442    HB   THR  72           HB       THR  72   3.534  10.396   3.497
  443    HG1  THR  72           1HG      THR  72   5.228   9.669   4.517
  444   HG21  THR  72          3HG2      THR  72   3.189  12.127   5.198
  445   HG22  THR  72          1HG2      THR  72   2.311  10.964   6.218
  446   HG23  THR  72          2HG2      THR  72   1.669  11.431   4.625
  447    H    LEU  73           H        LEU  73   2.366   9.063   1.981
  448    HA   LEU  73           HA       LEU  73   4.089   6.843   1.163
  449    HB3  LEU  73           2HB      LEU  73   2.056   5.629   1.891
  450    HG   LEU  73           HG       LEU  73   0.652   7.433  -0.131
  451   HD11  LEU  73          1HD1      LEU  73  -0.280   4.654   0.650
  452   HD12  LEU  73          2HD1      LEU  73   0.437   5.093  -0.917
  453   HD13  LEU  73          3HD1      LEU  73  -1.091   5.810  -0.436
  454   HD21  LEU  73          3HD2      LEU  73   0.289   8.016   2.239
  455   HD22  LEU  73          1HD2      LEU  73  -0.170   6.345   2.602
  456   HD23  LEU  73          2HD2      LEU  73  -1.179   7.355   1.556
  457    H    ALA  74           H        ALA  74   4.102   6.443  -1.169
  458    HA   ALA  74           HA       ALA  74   2.887   8.439  -2.924
  459    HB1  ALA  74           1HB      ALA  74   5.002   9.255  -3.878
  460    HB2  ALA  74           2HB      ALA  74   4.900   9.644  -2.154
  461    HB3  ALA  74           3HB      ALA  74   5.922   8.298  -2.700
  462    H    GLU  75           H        GLU  75   2.684   7.804  -5.040
  463    HA   GLU  75           HA       GLU  75   4.205   5.448  -6.034
  464    HB3  GLU  75           2HB      GLU  75   1.174   5.687  -6.324
  465    HG3  GLU  75           2HG      GLU  75   1.540   3.117  -6.581
  466    HA   PRO  76           HA       PRO  76   3.982   8.936  -9.083
  467    HB3  PRO  76           2HB      PRO  76   5.526  10.168  -7.848
  468    HG3  PRO  76           2HG      PRO  76   7.319   9.129  -6.679
  469    HD3  PRO  76           2HD      PRO  76   5.470   8.043  -5.806
  Start of MODEL    8
    1    H2   PRO   6           2H       PRO   6  -7.546  -8.083 -15.422
    2    HA   PRO   6           HA       PRO   6  -4.752  -8.504 -15.918
    3    HB3  PRO   6           2HB      PRO   6  -4.718  -8.253 -18.267
    4    HG3  PRO   6           2HG      PRO   6  -5.511 -10.456 -17.598
    5    HD3  PRO   6           2HD      PRO   6  -7.516 -10.652 -16.321
    6    H    LEU   7           H        LEU   7  -3.922  -6.831 -14.872
    7    HA   LEU   7           HA       LEU   7  -4.633  -4.092 -15.280
    8    HB3  LEU   7           2HB      LEU   7  -6.649  -4.850 -13.980
    9    HG   LEU   7           HG       LEU   7  -4.754  -5.010 -11.633
   10   HD11  LEU   7          1HD1      LEU   7  -6.770  -5.557 -10.334
   11   HD12  LEU   7          2HD1      LEU   7  -7.765  -5.418 -11.802
   12   HD13  LEU   7          3HD1      LEU   7  -6.922  -4.002 -11.137
   13   HD21  LEU   7          3HD2      LEU   7  -5.596  -7.383 -11.320
   14   HD22  LEU   7          1HD2      LEU   7  -4.547  -7.181 -12.714
   15   HD23  LEU   7          2HD2      LEU   7  -6.314  -7.288 -12.937
   16    H    LYS   8           H        LYS   8  -3.447  -2.634 -13.819
   17    HA   LYS   8           HA       LYS   8  -0.717  -3.547 -14.056
   18    HB3  LYS   8           2HB      LYS   8  -0.140  -1.204 -13.468
   19    HG3  LYS   8           2HG      LYS   8  -2.462  -1.314 -15.439
   20    HD3  LYS   8           2HD      LYS   8  -1.359   0.450 -16.627
   21    HE3  LYS   8           2HE      LYS   8  -1.293   1.324 -13.707
   22    HZ1  LYS   8           3HZ      LYS   8  -1.980   3.415 -14.619
   23    HZ2  LYS   8           1HZ      LYS   8  -2.161   2.785 -16.128
   24    HZ3  LYS   8           2HZ      LYS   8  -0.658   2.949 -15.474
   25    H    THR   9           H        THR   9   0.716  -4.201 -12.604
   26    HA   THR   9           HA       THR   9   0.241  -3.724  -9.701
   27    HB   THR   9           HB       THR   9   0.762  -6.069 -10.378
   28    HG1  THR   9           1HG      THR   9   1.868  -6.253  -8.505
   29   HG21  THR   9          3HG2      THR   9   2.577  -5.692 -12.026
   30   HG22  THR   9          1HG2      THR   9   3.101  -6.697 -10.671
   31   HG23  THR   9          2HG2      THR   9   3.593  -4.995 -10.740
   32    H    GLN  10           H        GLN  10   2.223  -3.132  -8.489
   33    HA   GLN  10           HA       GLN  10   4.299  -1.642  -9.690
   34    HB3  GLN  10           2HB      GLN  10   2.813   0.149 -10.206
   35    HG3  GLN  10           2HG      GLN  10   1.689   1.318  -8.076
   36   HE21  GLN  10          1HE2      GLN  10  -0.179  -1.587  -8.556
   37   HE22  GLN  10          2HE2      GLN  10  -1.143  -0.974  -9.888
   38    H    GLN  11           H        GLN  11   5.883  -1.175  -8.292
   39    HA   GLN  11           HA       GLN  11   5.680  -2.014  -5.493
   40    HB3  GLN  11           2HB      GLN  11   8.029  -0.685  -6.906
   41    HG3  GLN  11           2HG      GLN  11   7.863  -2.765  -4.680
   42   HE21  GLN  11          1HE2      GLN  11   9.474  -3.475  -6.803
   43   HE22  GLN  11          2HE2      GLN  11  11.147  -3.084  -6.461
   44    H    MET  12           H        MET  12   5.743  -0.654  -3.755
   45    HA   MET  12           HA       MET  12   5.260   2.261  -4.181
   46    HB3  MET  12           2HB      MET  12   3.678   0.203  -2.586
   47    HG3  MET  12           2HG      MET  12   3.216   3.203  -2.762
   48    HE1  MET  12           3HE      MET  12  -0.455   2.272  -3.355
   49    HE2  MET  12           1HE      MET  12   0.862   3.396  -3.710
   50    HE3  MET  12           2HE      MET  12   0.985   1.690  -4.205
   51    H    GLN  13           H        GLN  13   5.896   3.559  -2.502
   52    HA   GLN  13           HA       GLN  13   7.710   2.378  -0.441
   53    HB3  GLN  13           2HB      GLN  13   8.643   4.801  -0.476
   54    HG3  GLN  13           2HG      GLN  13   8.994   2.882  -2.796
   55   HE21  GLN  13          1HE2      GLN  13   9.141   4.033  -4.727
   56   HE22  GLN  13          2HE2      GLN  13  10.111   5.503  -4.895
   57    H    VAL  14           H        VAL  14   7.754   3.725   1.574
   58    HA   VAL  14           HA       VAL  14   5.382   5.343   2.189
   59    HB   VAL  14           HB       VAL  14   4.447   3.129   2.490
   60   HG11  VAL  14          1HG1      VAL  14   6.472   1.811   2.910
   61   HG12  VAL  14          2HG1      VAL  14   6.609   2.559   4.519
   62   HG13  VAL  14          3HG1      VAL  14   5.226   1.521   4.127
   63   HG21  VAL  14          3HG2      VAL  14   3.547   3.303   4.686
   64   HG22  VAL  14          1HG2      VAL  14   4.904   4.295   5.250
   65   HG23  VAL  14          2HG2      VAL  14   3.753   4.942   4.056
   66    H    GLY  15           H        GLY  15   5.519   6.613   3.926
   67    HA2  GLY  15           2HA      GLY  15   8.137   7.524   4.564
   68    HA3  GLY  15           3HA      GLY  15   6.608   8.203   5.142
   69    H    GLY  16           H        GLY  16   8.485   5.234   5.677
   70    HA2  GLY  16           2HA      GLY  16   9.973   4.989   7.507
   71    HA3  GLY  16           3HA      GLY  16   8.946   6.012   8.523
   72    H    MET  17           H        MET  17   7.750   3.169   6.648
   73    HA   MET  17           HA       MET  17   6.253   2.380   8.954
   74    HB3  MET  17           2HB      MET  17   6.733   0.821   6.388
   75    HG3  MET  17           2HG      MET  17   4.637   0.680   8.577
   76    HE1  MET  17           3HE      MET  17   1.863   1.782   6.254
   77    HE2  MET  17           1HE      MET  17   2.297   1.530   7.959
   78    HE3  MET  17           2HE      MET  17   3.341   2.511   6.906
   79    H    ARG  18           H        ARG  18   9.576   1.554   8.327
   80    HA   ARG  18           HA       ARG  18   9.463  -1.024   9.689
   81    HB3  ARG  18           2HB      ARG  18  11.937  -0.866   9.772
   82    HG3  ARG  18           2HG      ARG  18  10.799  -0.221   7.022
   83    HD3  ARG  18           2HD      ARG  18  12.733  -1.943   6.490
   84    HE   ARG  18           HE       ARG  18  12.708   0.801   6.247
   85   HH11  ARG  18          1HH1      ARG  18  15.386  -1.487   6.932
   86   HH12  ARG  18          2HH1      ARG  18  16.489  -0.538   5.979
   87   HH21  ARG  18          1HH2      ARG  18  14.132   1.876   5.120
   88   HH22  ARG  18          2HH2      ARG  18  15.813   1.397   4.984
   89    H    CYS  19           H        CYS  19   9.168   2.098  10.987
   90    HA   CYS  19           HA       CYS  19  10.623   2.075  13.364
   91    HB3  CYS  19           2HB      CYS  19   8.679   3.473  14.237
   92    HG   CYS  19           HG       CYS  19   9.521   4.225  11.120
   93    H    ALA  20           H        ALA  20   7.941  -0.022  12.689
   94    HA   ALA  20           HA       ALA  20   8.483  -1.670  14.954
   95    HB1  ALA  20           1HB      ALA  20   7.057   0.016  16.108
   96    HB2  ALA  20           2HB      ALA  20   5.761  -0.270  14.935
   97    HB3  ALA  20           3HB      ALA  20   6.268  -1.558  16.053
   98    H    ALA  21           H        ALA  21   6.084  -3.224  14.850
   99    HA   ALA  21           HA       ALA  21   6.492  -4.708  12.428
  100    HB1  ALA  21           1HB      ALA  21   5.984  -5.695  14.645
  101    HB2  ALA  21           2HB      ALA  21   4.364  -4.959  14.606
  102    HB3  ALA  21           3HB      ALA  21   4.804  -6.212  13.432
  103    H    CYS  22           H        CYS  22   5.127  -1.897  12.259
  104    HA   CYS  22           HA       CYS  22   2.422  -2.045  11.816
  105    HB3  CYS  22           2HB      CYS  22   2.757   0.197  10.713
  106    HG   CYS  22           HG       CYS  22   2.502  -0.370  13.387
  107    H    ALA  23           H        ALA  23   4.771  -2.872   9.260
  108    HA   ALA  23           HA       ALA  23   3.189  -2.815   6.963
  109    HB1  ALA  23           1HB      ALA  23   4.555  -4.738   6.315
  110    HB2  ALA  23           2HB      ALA  23   5.541  -3.520   7.136
  111    HB3  ALA  23           3HB      ALA  23   5.038  -4.992   8.003
  112    H    SER  24           H        SER  24   2.967  -5.107   9.752
  113    HA   SER  24           HA       SER  24   1.102  -6.910   8.491
  114    HB3  SER  24           2HB      SER  24   0.748  -7.769  10.748
  115    HG   SER  24           HG       SER  24   2.814  -8.407  11.103
  116    H    SER  25           H        SER  25   0.556  -3.898  10.364
  117    HA   SER  25           HA       SER  25  -2.350  -4.350  10.506
  118    HB3  SER  25           2HB      SER  25  -2.464  -2.076  11.400
  119    HG   SER  25           HG       SER  25  -1.949  -3.729  12.829
  120    H    ILE  26           H        ILE  26  -0.247  -3.301   8.070
  121    HA   ILE  26           HA       ILE  26  -2.503  -2.084   6.523
  122    HB   ILE  26           HB       ILE  26   0.380  -2.591   5.726
  123   HG13  ILE  26          2HG1      ILE  26   0.702  -0.154   5.849
  124   HG21  ILE  26          1HG2      ILE  26  -0.119  -1.052   3.844
  125   HG22  ILE  26          2HG2      ILE  26  -1.049  -2.551   3.772
  126   HG23  ILE  26          3HG2      ILE  26  -1.833  -1.051   4.316
  127   HD11  ILE  26          3HD1      ILE  26  -0.666   1.188   7.362
  128   HD12  ILE  26          1HD1      ILE  26  -1.623   0.686   5.961
  129   HD13  ILE  26          2HD1      ILE  26  -1.838  -0.132   7.536
  130    H    GLU  27           H        GLU  27  -0.219  -4.872   6.283
  131    HA   GLU  27           HA       GLU  27  -1.454  -6.024   4.061
  132    HB3  GLU  27           2HB      GLU  27   0.005  -7.622   6.194
  133    HG3  GLU  27           2HG      GLU  27  -0.284  -7.764   3.158
  134    H    ARG  28           H        ARG  28  -2.097  -6.720   7.529
  135    HA   ARG  28           HA       ARG  28  -3.892  -8.878   7.164
  136    HB3  ARG  28           2HB      ARG  28  -3.693  -6.823   9.402
  137    HG3  ARG  28           2HG      ARG  28  -4.978  -9.579   9.327
  138    HD3  ARG  28           2HD      ARG  28  -4.071  -7.923  11.722
  139    HE   ARG  28           HE       ARG  28  -6.020  -8.945  12.533
  140   HH11  ARG  28          1HH1      ARG  28  -4.093 -11.485  10.927
  141   HH12  ARG  28          2HH1      ARG  28  -4.959 -12.731  11.791
  142   HH21  ARG  28          1HH2      ARG  28  -7.122 -10.558  13.415
  143   HH22  ARG  28          2HH2      ARG  28  -6.697 -12.233  13.145
  144    H    ALA  29           H        ALA  29  -4.452  -5.489   6.634
  145    HA   ALA  29           HA       ALA  29  -7.407  -5.878   6.376
  146    HB1  ALA  29           1HB      ALA  29  -5.674  -3.368   6.227
  147    HB2  ALA  29           2HB      ALA  29  -7.452  -3.432   6.149
  148    HB3  ALA  29           3HB      ALA  29  -6.614  -3.903   7.640
  149    H    LEU  30           H        LEU  30  -4.484  -5.001   4.487
  150    HA   LEU  30           HA       LEU  30  -5.740  -4.442   2.019
  151    HB3  LEU  30           2HB      LEU  30  -2.969  -5.519   2.643
  152    HG   LEU  30           HG       LEU  30  -3.261  -5.499   0.206
  153   HD11  LEU  30          1HD1      LEU  30  -5.039  -3.816  -0.052
  154   HD12  LEU  30          2HD1      LEU  30  -3.622  -3.355  -0.997
  155   HD13  LEU  30          3HD1      LEU  30  -3.949  -2.542   0.548
  156   HD21  LEU  30          3HD2      LEU  30  -1.076  -4.918   1.162
  157   HD22  LEU  30          1HD2      LEU  30  -1.559  -3.214   1.313
  158   HD23  LEU  30          2HD2      LEU  30  -1.365  -3.941  -0.290
  159    H    GLU  31           H        GLU  31  -4.936  -7.579   3.432
  160    HA   GLU  31           HA       GLU  31  -5.392  -9.159   1.061
  161    HB3  GLU  31           2HB      GLU  31  -4.157 -10.070   2.953
  162    HG3  GLU  31           2HG      GLU  31  -6.504  -9.206   4.551
  163    H    ARG  32           H        ARG  32  -7.551  -7.343   3.018
  164    HA   ARG  32           HA       ARG  32  -9.859  -8.930   2.080
  165    HB3  ARG  32           2HB      ARG  32 -11.150  -8.032   3.909
  166    HG3  ARG  32           2HG      ARG  32  -8.614  -8.876   5.278
  167    HD3  ARG  32           2HD      ARG  32 -11.470  -9.900   5.427
  168    HE   ARG  32           HE       ARG  32  -8.956 -10.983   6.388
  169   HH11  ARG  32          1HH1      ARG  32 -12.482 -11.085   6.985
  170   HH12  ARG  32          2HH1      ARG  32 -12.357 -12.666   7.707
  171   HH21  ARG  32          1HH2      ARG  32  -8.901 -12.824   7.571
  172   HH22  ARG  32          2HH2      ARG  32 -10.370 -13.709   7.918
  173    H    LEU  33           H        LEU  33  -8.596  -5.600   2.256
  174    HA   LEU  33           HA       LEU  33 -10.681  -4.019   1.419
  175    HB3  LEU  33           2HB      LEU  33  -9.015  -2.648   0.135
  176    HG   LEU  33           HG       LEU  33  -7.751  -3.561   2.738
  177   HD11  LEU  33          1HD1      LEU  33  -6.273  -2.259   1.234
  178   HD12  LEU  33          2HD1      LEU  33  -6.673  -1.368   2.710
  179   HD13  LEU  33          3HD1      LEU  33  -7.483  -0.967   1.180
  180   HD21  LEU  33          3HD2      LEU  33 -10.034  -2.811   3.212
  181   HD22  LEU  33          1HD2      LEU  33  -9.747  -1.335   2.252
  182   HD23  LEU  33          2HD2      LEU  33  -8.860  -1.608   3.766
  183    H    LYS  34           H        LYS  34 -11.919  -3.565  -0.291
  184    HA   LYS  34           HA       LYS  34 -12.066  -5.518  -2.428
  185    HB3  LYS  34           2HB      LYS  34 -13.940  -4.044  -3.208
  186    HG3  LYS  34           2HG      LYS  34 -14.199  -4.536  -0.225
  187    HD3  LYS  34           2HD      LYS  34 -16.039  -5.106  -2.589
  188    HE3  LYS  34           2HE      LYS  34 -16.644  -5.191   0.399
  189    HZ1  LYS  34           3HZ      LYS  34 -18.571  -6.443  -0.415
  190    HZ2  LYS  34           1HZ      LYS  34 -18.135  -6.196  -1.960
  191    HZ3  LYS  34           2HZ      LYS  34 -18.589  -4.909  -1.021
  192    H    GLY  35           H        GLY  35 -12.139  -5.074  -4.720
  193    HA2  GLY  35           2HA      GLY  35 -11.540  -4.093  -6.720
  194    HA3  GLY  35           3HA      GLY  35 -10.948  -2.667  -5.841
  195    H    VAL  36           H        VAL  36  -8.962  -3.873  -4.278
  196    HA   VAL  36           HA       VAL  36  -6.755  -4.207  -6.113
  197    HB   VAL  36           HB       VAL  36  -6.172  -3.215  -4.087
  198   HG11  VAL  36          1HG1      VAL  36  -7.428  -5.536  -2.604
  199   HG12  VAL  36          2HG1      VAL  36  -6.475  -4.250  -1.842
  200   HG13  VAL  36          3HG1      VAL  36  -7.995  -3.850  -2.632
  201   HG21  VAL  36          3HG2      VAL  36  -4.425  -4.847  -4.793
  202   HG22  VAL  36          1HG2      VAL  36  -4.458  -4.617  -3.047
  203   HG23  VAL  36          2HG2      VAL  36  -5.159  -6.081  -3.749
  204    H    ALA  37           H        ALA  37  -5.785  -5.953  -6.923
  205    HA   ALA  37           HA       ALA  37  -7.257  -8.550  -6.663
  206    HB1  ALA  37           1HB      ALA  37  -7.277  -7.302  -8.820
  207    HB2  ALA  37           2HB      ALA  37  -5.498  -7.461  -8.891
  208    HB3  ALA  37           3HB      ALA  37  -6.530  -8.900  -8.962
  209    H    GLU  38           H        GLU  38  -4.189  -7.339  -5.805
  210    HA   GLU  38           HA       GLU  38  -3.081  -9.778  -4.909
  211    HB3  GLU  38           2HB      GLU  38  -2.069  -8.811  -7.610
  212    HG3  GLU  38           2HG      GLU  38  -0.805 -10.823  -5.717
  213    H    ALA  39           H        ALA  39  -1.426  -9.255  -3.434
  214    HA   ALA  39           HA       ALA  39   0.187  -6.878  -3.654
  215    HB1  ALA  39           1HB      ALA  39  -1.963  -5.786  -3.003
  216    HB2  ALA  39           2HB      ALA  39  -2.038  -6.821  -1.561
  217    HB3  ALA  39           3HB      ALA  39  -0.733  -5.625  -1.747
  218    H    SER  40           H        SER  40   1.744  -6.623  -1.931
  219    HA   SER  40           HA       SER  40   1.780  -8.458   0.354
  220    HB3  SER  40           2HB      SER  40   3.968  -8.794  -1.723
  221    HG   SER  40           HG       SER  40   4.727 -10.300  -0.371
  222    H    VAL  41           H        VAL  41   3.045  -7.650   2.020
  223    HA   VAL  41           HA       VAL  41   4.444  -5.076   1.559
  224    HB   VAL  41           HB       VAL  41   4.845  -4.960   3.948
  225   HG11  VAL  41          1HG1      VAL  41   1.997  -5.786   3.288
  226   HG12  VAL  41          2HG1      VAL  41   2.531  -4.855   4.705
  227   HG13  VAL  41          3HG1      VAL  41   2.722  -4.179   3.092
  228   HG21  VAL  41          3HG2      VAL  41   3.773  -6.782   5.432
  229   HG22  VAL  41          1HG2      VAL  41   3.935  -7.842   4.019
  230   HG23  VAL  41          2HG2      VAL  41   5.357  -7.086   4.718
  231    H    THR  42           H        THR  42   6.647  -4.679   2.277
  232    HA   THR  42           HA       THR  42   8.529  -7.003   2.089
  233    HB   THR  42           HB       THR  42   8.851  -4.356   0.629
  234    HG1  THR  42           1HG      THR  42   8.087  -5.271  -1.083
  235   HG21  THR  42          3HG2      THR  42  10.616  -5.579  -0.606
  236   HG22  THR  42          1HG2      THR  42  10.348  -7.013   0.411
  237   HG23  THR  42          2HG2      THR  42  10.994  -5.515   1.118
  238    H    VAL  43           H        VAL  43   8.458  -6.758   4.403
  239    HA   VAL  43           HA       VAL  43   9.015  -4.348   5.805
  240    HB   VAL  43           HB       VAL  43   9.379  -7.254   6.624
  241   HG11  VAL  43          1HG1      VAL  43  10.859  -5.961   8.117
  242   HG12  VAL  43          2HG1      VAL  43   9.585  -4.750   8.375
  243   HG13  VAL  43          3HG1      VAL  43   9.396  -6.402   8.997
  244   HG21  VAL  43          3HG2      VAL  43   7.042  -6.421   6.187
  245   HG22  VAL  43          1HG2      VAL  43   7.309  -6.872   7.878
  246   HG23  VAL  43          2HG2      VAL  43   7.316  -5.161   7.404
  247    H    ALA  44           H        ALA  44  11.266  -6.841   4.514
  248    HA   ALA  44           HA       ALA  44  13.611  -6.116   5.794
  249    HB1  ALA  44           1HB      ALA  44  14.742  -7.211   3.840
  250    HB2  ALA  44           2HB      ALA  44  13.386  -8.141   4.478
  251    HB3  ALA  44           3HB      ALA  44  13.193  -7.206   2.974
  252    H    THR  45           H        THR  45  12.132  -4.272   3.178
  253    HA   THR  45           HA       THR  45  14.292  -2.229   3.517
  254    HB   THR  45           HB       THR  45  13.920  -1.563   1.120
  255    HG1  THR  45           1HG      THR  45  13.130  -3.354  -0.180
  256   HG21  THR  45          3HG2      THR  45  15.445  -3.194   0.227
  257   HG22  THR  45          1HG2      THR  45  14.980  -4.401   1.445
  258   HG23  THR  45          2HG2      THR  45  15.877  -2.938   1.918
  259    H    GLY  46           H        GLY  46  11.045  -2.893   3.953
  260    HA2  GLY  46           2HA      GLY  46   9.485  -1.507   4.943
  261    HA3  GLY  46           3HA      GLY  46  10.565  -0.106   4.689
  262    H    ARG  47           H        ARG  47   9.267  -2.371   2.242
  263    HA   ARG  47           HA       ARG  47   7.857  -0.077   0.897
  264    HB3  ARG  47           2HB      ARG  47   8.535  -1.170  -1.266
  265    HG3  ARG  47           2HG      ARG  47  10.948  -0.419   0.418
  266    HD3  ARG  47           2HD      ARG  47  10.260  -0.243  -2.538
  267    HE   ARG  47           HE       ARG  47  12.399   1.123  -1.010
  268   HH11  ARG  47          1HH1      ARG  47  11.356   0.145  -4.296
  269   HH12  ARG  47          2HH1      ARG  47  12.182   1.515  -5.013
  270   HH21  ARG  47          1HH2      ARG  47  13.474   2.816  -2.124
  271   HH22  ARG  47          2HH2      ARG  47  13.348   2.879  -3.875
  272    H    LEU  48           H        LEU  48   6.495  -1.119  -0.997
  273    HA   LEU  48           HA       LEU  48   4.906  -3.494  -0.138
  274    HB3  LEU  48           2HB      LEU  48   3.111  -1.552  -1.255
  275    HG   LEU  48           HG       LEU  48   3.554  -2.425   1.617
  276   HD11  LEU  48          1HD1      LEU  48   1.373  -0.651   0.430
  277   HD12  LEU  48          2HD1      LEU  48   2.605  -0.155   1.612
  278   HD13  LEU  48          3HD1      LEU  48   1.363  -1.333   2.072
  279   HD21  LEU  48          3HD2      LEU  48   1.393  -3.630   1.209
  280   HD22  LEU  48          1HD2      LEU  48   2.644  -4.159   0.080
  281   HD23  LEU  48          2HD2      LEU  48   1.380  -3.044  -0.463
  282    H    THR  49           H        THR  49   3.573  -4.347  -1.874
  283    HA   THR  49           HA       THR  49   3.983  -3.322  -4.641
  284    HB   THR  49           HB       THR  49   3.973  -6.295  -4.007
  285    HG1  THR  49           1HG      THR  49   5.968  -5.888  -3.577
  286   HG21  THR  49          3HG2      THR  49   4.580  -6.519  -6.386
  287   HG22  THR  49          1HG2      THR  49   4.499  -4.755  -6.597
  288   HG23  THR  49          2HG2      THR  49   3.034  -5.697  -6.228
  289    H    VAL  50           H        VAL  50   2.060  -3.229  -5.693
  290    HA   VAL  50           HA       VAL  50  -0.310  -4.648  -4.623
  291    HB   VAL  50           HB       VAL  50  -0.160  -2.674  -3.194
  292   HG11  VAL  50          1HG1      VAL  50   1.006  -1.092  -4.710
  293   HG12  VAL  50          2HG1      VAL  50  -0.470  -0.950  -5.690
  294   HG13  VAL  50          3HG1      VAL  50  -0.461  -0.401  -4.007
  295   HG21  VAL  50          3HG2      VAL  50  -2.502  -2.415  -5.123
  296   HG22  VAL  50          1HG2      VAL  50  -2.382  -3.576  -3.784
  297   HG23  VAL  50          2HG2      VAL  50  -2.424  -1.840  -3.449
  298    H    THR  51           H        THR  51  -1.847  -5.074  -6.055
  299    HA   THR  51           HA       THR  51  -1.665  -4.020  -8.854
  300    HB   THR  51           HB       THR  51  -2.888  -6.600  -7.776
  301    HG1  THR  51           1HG      THR  51  -0.599  -6.458  -7.799
  302   HG21  THR  51          3HG2      THR  51  -2.997  -7.182 -10.226
  303   HG22  THR  51          1HG2      THR  51  -2.537  -5.504 -10.625
  304   HG23  THR  51          2HG2      THR  51  -4.055  -5.855  -9.774
  305    H    TYR  52           H        TYR  52  -3.189  -2.605  -9.442
  306    HA   TYR  52           HA       TYR  52  -5.954  -2.942  -8.530
  307    HB3  TYR  52           2HB      TYR  52  -4.921  -1.550  -6.758
  308    HD1  TYR  52           1HD      TYR  52  -5.871   1.106  -9.191
  309    HD2  TYR  52           2HD      TYR  52  -2.710  -0.538  -6.770
  310    HE1  TYR  52           1HE      TYR  52  -4.526   3.173  -9.543
  311    HE2  TYR  52           2HE      TYR  52  -1.383   1.546  -7.079
  312    HH   TYR  52           HH       TYR  52  -1.316   3.699  -8.046
  313    H    ASP  53           H        ASP  53  -7.523  -1.633  -9.692
  314    HA   ASP  53           HA       ASP  53  -6.689  -1.152 -12.486
  315    HB3  ASP  53           2HB      ASP  53  -9.412  -1.547 -11.203
  316    HA   PRO  54           HA       PRO  54  -6.687   3.100 -11.063
  317    HB3  PRO  54           2HB      PRO  54  -4.759   3.222 -12.368
  318    HG3  PRO  54           2HG      PRO  54  -4.692   2.284 -14.584
  319    HD3  PRO  54           2HD      PRO  54  -5.188   0.539 -13.062
  320    H    LYS  55           H        LYS  55  -9.185   1.849 -12.611
  321    HA   LYS  55           HA       LYS  55 -10.583   4.465 -12.962
  322    HB3  LYS  55           2HB      LYS  55 -11.840   3.395 -14.887
  323    HG3  LYS  55           2HG      LYS  55 -10.016   3.506 -16.603
  324    HD3  LYS  55           2HD      LYS  55 -10.146   5.764 -14.566
  325    HE3  LYS  55           2HE      LYS  55  -9.092   5.827 -17.416
  326    HZ1  LYS  55           3HZ      LYS  55  -9.085   7.936 -15.329
  327    HZ2  LYS  55           1HZ      LYS  55 -10.197   7.859 -16.552
  328    HZ3  LYS  55           2HZ      LYS  55  -8.600   8.092 -16.884
  329    H    GLN  56           H        GLN  56 -10.906   0.996 -12.163
  330    HA   GLN  56           HA       GLN  56 -13.514   1.345 -10.875
  331    HB3  GLN  56           2HB      GLN  56 -12.823  -0.726  -9.600
  332    HG3  GLN  56           2HG      GLN  56 -12.482  -2.269 -11.551
  333   HE21  GLN  56          1HE2      GLN  56 -14.215  -2.219 -13.600
  334   HE22  GLN  56          2HE2      GLN  56 -15.849  -1.977 -12.981
  335    H    VAL  57           H        VAL  57 -10.099   1.691  -9.801
  336    HA   VAL  57           HA       VAL  57 -10.956   3.261  -7.458
  337    HB   VAL  57           HB       VAL  57  -9.523   2.040  -5.891
  338   HG11  VAL  57          1HG1      VAL  57 -10.903   0.104  -5.456
  339   HG12  VAL  57          2HG1      VAL  57 -11.909   1.487  -5.921
  340   HG13  VAL  57          3HG1      VAL  57 -11.600   0.165  -7.079
  341   HG21  VAL  57          3HG2      VAL  57  -9.273  -0.133  -8.044
  342   HG22  VAL  57          1HG2      VAL  57  -7.959   0.935  -7.517
  343   HG23  VAL  57          2HG2      VAL  57  -8.661  -0.220  -6.382
  344    H    SER  58           H        SER  58  -8.310   3.351  -6.296
  345    HA   SER  58           HA       SER  58  -6.345   4.096  -8.293
  346    HB3  SER  58           2HB      SER  58  -7.959   6.035  -8.315
  347    HG   SER  58           HG       SER  58  -8.650   6.692  -6.469
  348    H    GLU  59           H        GLU  59  -4.659   5.615  -6.748
  349    HA   GLU  59           HA       GLU  59  -3.578   4.248  -4.581
  350    HB3  GLU  59           2HB      GLU  59  -2.611   6.244  -5.666
  351    HG3  GLU  59           2HG      GLU  59  -4.647   7.860  -4.061
  352    H    ILE  60           H        ILE  60  -6.629   6.022  -4.619
  353    HA   ILE  60           HA       ILE  60  -6.826   6.853  -1.932
  354    HB   ILE  60           HB       ILE  60  -8.860   6.130  -4.042
  355   HG13  ILE  60          2HG1      ILE  60  -9.179   8.493  -4.276
  356   HG21  ILE  60          1HG2      ILE  60 -10.601   7.192  -2.661
  357   HG22  ILE  60          2HG2      ILE  60 -10.020   5.651  -2.048
  358   HG23  ILE  60          3HG2      ILE  60  -9.482   7.152  -1.267
  359   HD11  ILE  60          3HD1      ILE  60  -7.191   8.995  -2.018
  360   HD12  ILE  60          1HD1      ILE  60  -7.879  10.206  -3.106
  361   HD13  ILE  60          2HD1      ILE  60  -8.936   9.353  -1.976
  362    H    THR  61           H        THR  61  -7.915   3.681  -3.243
  363    HA   THR  61           HA       THR  61  -9.071   2.671  -0.888
  364    HB   THR  61           HB       THR  61  -7.598   1.288  -3.159
  365    HG1  THR  61           1HG      THR  61 -10.247   0.880  -2.973
  366   HG21  THR  61          3HG2      THR  61  -8.857  -0.771  -2.527
  367   HG22  THR  61          1HG2      THR  61  -9.369   0.017  -1.013
  368   HG23  THR  61          2HG2      THR  61  -7.653  -0.341  -1.315
  369    H    ILE  62           H        ILE  62  -5.642   2.965  -1.620
  370    HA   ILE  62           HA       ILE  62  -4.933   1.485   0.900
  371    HB   ILE  62           HB       ILE  62  -4.195   0.526  -1.234
  372   HG13  ILE  62          2HG1      ILE  62  -3.119   0.100   0.942
  373   HG21  ILE  62          1HG2      ILE  62  -2.399   2.969  -1.483
  374   HG22  ILE  62          2HG2      ILE  62  -2.344   1.505  -2.492
  375   HG23  ILE  62          3HG2      ILE  62  -3.756   2.534  -2.551
  376   HD11  ILE  62          3HD1      ILE  62  -1.026   0.134  -1.272
  377   HD12  ILE  62          1HD1      ILE  62  -1.070  -0.891   0.168
  378   HD13  ILE  62          2HD1      ILE  62  -2.290  -1.108  -1.101
  379    H    GLN  63           H        GLN  63  -4.643   4.666  -0.619
  380    HA   GLN  63           HA       GLN  63  -3.109   5.986   1.422
  381    HB3  GLN  63           2HB      GLN  63  -4.675   7.940   0.897
  382    HG3  GLN  63           2HG      GLN  63  -4.195   8.170  -1.577
  383   HE21  GLN  63          1HE2      GLN  63  -1.910   8.836  -2.385
  384   HE22  GLN  63          2HE2      GLN  63  -0.778   9.291  -1.106
  385    H    GLU  64           H        GLU  64  -6.622   5.228   1.219
  386    HA   GLU  64           HA       GLU  64  -7.572   6.169   3.672
  387    HB3  GLU  64           2HB      GLU  64  -9.109   4.060   3.434
  388    HG3  GLU  64           2HG      GLU  64  -8.955   6.100   1.184
  389    H    ARG  65           H        ARG  65  -5.625   3.271   3.173
  390    HA   ARG  65           HA       ARG  65  -6.027   2.401   5.977
  391    HB3  ARG  65           2HB      ARG  65  -4.538   1.133   3.629
  392    HG3  ARG  65           2HG      ARG  65  -3.753   0.029   5.613
  393    HD3  ARG  65           2HD      ARG  65  -5.272   0.562   7.369
  394    HE   ARG  65           HE       ARG  65  -7.388   0.362   5.705
  395   HH11  ARG  65          1HH1      ARG  65  -6.795  -1.491   8.709
  396   HH12  ARG  65          2HH1      ARG  65  -8.494  -1.550   9.036
  397   HH21  ARG  65          1HH2      ARG  65  -9.462   0.143   6.172
  398   HH22  ARG  65          2HH2      ARG  65  -9.991  -0.797   7.564
  399    H    ILE  66           H        ILE  66  -3.307   3.404   3.822
  400    HA   ILE  66           HA       ILE  66  -1.339   3.097   5.959
  401    HB   ILE  66           HB       ILE  66  -1.209   4.417   3.224
  402   HG13  ILE  66          2HG1      ILE  66  -1.547   1.857   3.476
  403   HG21  ILE  66          1HG2      ILE  66   1.048   3.876   5.216
  404   HG22  ILE  66          2HG2      ILE  66   1.282   4.379   3.533
  405   HG23  ILE  66          3HG2      ILE  66   0.498   5.471   4.662
  406   HD11  ILE  66          3HD1      ILE  66   1.050   2.619   2.106
  407   HD12  ILE  66          1HD1      ILE  66   0.011   1.219   1.796
  408   HD13  ILE  66          2HD1      ILE  66  -0.591   2.842   1.428
  409    H    ALA  67           H        ALA  67  -3.159   5.954   4.773
  410    HA   ALA  67           HA       ALA  67  -1.760   7.765   6.551
  411    HB1  ALA  67           1HB      ALA  67  -3.513   9.350   5.909
  412    HB2  ALA  67           2HB      ALA  67  -2.920   8.494   4.476
  413    HB3  ALA  67           3HB      ALA  67  -4.482   8.045   5.203
  414    H    ALA  68           H        ALA  68  -4.355   5.450   7.068
  415    HA   ALA  68           HA       ALA  68  -5.479   6.756   9.439
  416    HB1  ALA  68           1HB      ALA  68  -6.805   4.661   9.579
  417    HB2  ALA  68           2HB      ALA  68  -6.896   5.390   7.969
  418    HB3  ALA  68           3HB      ALA  68  -5.868   3.971   8.239
  419    H    LEU  69           H        LEU  69  -3.234   4.057   8.767
  420    HA   LEU  69           HA       LEU  69  -2.575   3.543  11.534
  421    HB3  LEU  69           2HB      LEU  69  -0.370   2.702  10.183
  422    HG   LEU  69           HG       LEU  69  -1.360   0.544   9.828
  423   HD11  LEU  69          1HD1      LEU  69  -0.755   1.253  12.143
  424   HD12  LEU  69          2HD1      LEU  69  -2.029   0.021  12.095
  425   HD13  LEU  69          3HD1      LEU  69  -2.455   1.690  12.427
  426   HD21  LEU  69          3HD2      LEU  69  -3.718   0.050  10.189
  427   HD22  LEU  69          1HD2      LEU  69  -3.540   1.220   8.873
  428   HD23  LEU  69          2HD2      LEU  69  -4.080   1.761  10.478
  429    H    GLY  70           H        GLY  70  -1.796   6.234   9.584
  430    HA2  GLY  70           2HA      GLY  70  -1.040   8.208  10.635
  431    HA3  GLY  70           3HA      GLY  70  -0.049   7.264  11.765
  432    H    TYR  71           H        TYR  71   0.513   5.989   8.738
  433    HA   TYR  71           HA       TYR  71   3.011   7.568   8.351
  434    HB3  TYR  71           2HB      TYR  71   3.618   5.721   6.826
  435    HD1  TYR  71           2HD      TYR  71   5.326   5.942   8.638
  436    HD2  TYR  71           1HD      TYR  71   1.683   3.713   9.206
  437    HE1  TYR  71           2HE      TYR  71   6.325   4.814  10.616
  438    HE2  TYR  71           1HE      TYR  71   2.683   2.576  11.178
  439    HH   TYR  71           HH       TYR  71   4.567   2.336  12.500
  440    H    THR  72           H        THR  72   3.405   7.386   5.606
  441    HA   THR  72           HA       THR  72   0.942   8.010   4.152
  442    HB   THR  72           HB       THR  72   3.063  10.154   4.547
  443    HG1  THR  72           1HG      THR  72   0.881   9.684   5.723
  444   HG21  THR  72          3HG2      THR  72   0.874  10.025   2.416
  445   HG22  THR  72          1HG2      THR  72   2.629  10.144   2.135
  446   HG23  THR  72          2HG2      THR  72   1.765  11.494   2.873
  447    H    LEU  73           H        LEU  73   1.101   7.165   2.155
  448    HA   LEU  73           HA       LEU  73   3.515   5.738   1.425
  449    HB3  LEU  73           2HB      LEU  73   1.201   4.879   1.245
  450    HG   LEU  73           HG       LEU  73   0.339   7.003  -0.121
  451   HD11  LEU  73          1HD1      LEU  73   1.422   5.210  -2.334
  452   HD12  LEU  73          2HD1      LEU  73   1.714   6.949  -2.100
  453   HD13  LEU  73          3HD1      LEU  73   0.123   6.395  -2.578
  454   HD21  LEU  73          3HD2      LEU  73  -0.412   4.104  -0.720
  455   HD22  LEU  73          1HD2      LEU  73  -1.434   5.499  -1.090
  456   HD23  LEU  73          2HD2      LEU  73  -1.055   5.111   0.594
  457    H    ALA  74           H        ALA  74   4.342   5.617  -0.771
  458    HA   ALA  74           HA       ALA  74   4.016   8.003  -2.479
  459    HB1  ALA  74           1HB      ALA  74   6.664   6.907  -1.419
  460    HB2  ALA  74           2HB      ALA  74   6.567   7.926  -2.862
  461    HB3  ALA  74           3HB      ALA  74   6.041   8.552  -1.281
  462    H    GLU  75           H        GLU  75   4.170   7.551  -4.683
  463    HA   GLU  75           HA       GLU  75   4.774   4.830  -5.620
  464    HB3  GLU  75           2HB      GLU  75   1.921   5.853  -5.688
  465    HG3  GLU  75           2HG      GLU  75   1.827   3.161  -6.213
  466    HA   PRO  76           HA       PRO  76   5.928   8.186  -8.346
  467    HB3  PRO  76           2HB      PRO  76   8.079   7.457  -7.888
  468    HG3  PRO  76           2HG      PRO  76   8.628   5.121  -7.864
  469    HD3  PRO  76           2HD      PRO  76   6.904   5.443  -6.292
  Start of MODEL    9
    1    H2   PRO   6           2H       PRO   6  -7.149  -3.850 -17.548
    2    HA   PRO   6           HA       PRO   6  -6.242  -6.604 -17.188
    3    HB3  PRO   6           2HB      PRO   6  -4.474  -6.347 -18.599
    4    HG3  PRO   6           2HG      PRO   6  -5.631  -5.640 -20.512
    5    HD3  PRO   6           2HD      PRO   6  -7.623  -6.114 -19.368
    6    H    LEU   7           H        LEU   7  -5.465  -6.888 -15.171
    7    HA   LEU   7           HA       LEU   7  -5.509  -4.861 -13.193
    8    HB3  LEU   7           2HB      LEU   7  -3.826  -6.719 -12.121
    9    HG   LEU   7           HG       LEU   7  -5.938  -6.262 -11.122
   10   HD11  LEU   7          1HD1      LEU   7  -7.312  -7.789 -13.373
   11   HD12  LEU   7          2HD1      LEU   7  -7.418  -6.036 -13.104
   12   HD13  LEU   7          3HD1      LEU   7  -8.078  -7.137 -11.906
   13   HD21  LEU   7          3HD2      LEU   7  -4.862  -8.431 -10.601
   14   HD22  LEU   7          1HD2      LEU   7  -5.817  -9.203 -11.881
   15   HD23  LEU   7          2HD2      LEU   7  -6.628  -8.520 -10.464
   16    H    LYS   8           H        LYS   8  -4.136  -3.497 -12.303
   17    HA   LYS   8           HA       LYS   8  -1.480  -3.051 -13.618
   18    HB3  LYS   8           2HB      LYS   8  -1.751  -0.800 -12.312
   19    HG3  LYS   8           2HG      LYS   8  -3.469  -1.408 -14.744
   20    HD3  LYS   8           2HD      LYS   8  -4.099   0.792 -13.926
   21    HE3  LYS   8           2HE      LYS   8  -1.118   1.385 -13.861
   22    HZ1  LYS   8           3HZ      LYS   8  -1.786   3.592 -13.230
   23    HZ2  LYS   8           1HZ      LYS   8  -3.379   3.250 -13.422
   24    HZ3  LYS   8           2HZ      LYS   8  -2.380   3.256 -14.732
   25    H    THR   9           H        THR   9   0.340  -2.962 -12.462
   26    HA   THR   9           HA       THR   9   0.272  -3.545  -9.530
   27    HB   THR   9           HB       THR   9   2.468  -3.928 -11.598
   28    HG1  THR   9           1HG      THR   9   0.810  -5.525 -11.458
   29   HG21  THR   9          3HG2      THR   9   3.722  -4.989  -9.707
   30   HG22  THR   9          1HG2      THR   9   2.522  -4.344  -8.568
   31   HG23  THR   9          2HG2      THR   9   3.567  -3.249  -9.511
   32    H    GLN  10           H        GLN  10   1.527  -2.154  -8.140
   33    HA   GLN  10           HA       GLN  10   2.956   0.061  -9.325
   34    HB3  GLN  10           2HB      GLN  10   0.655   0.611  -7.388
   35    HG3  GLN  10           2HG      GLN  10   2.468   2.270  -7.023
   36   HE21  GLN  10          1HE2      GLN  10   1.574   4.486  -9.326
   37   HE22  GLN  10          2HE2      GLN  10   2.853   4.236 -10.518
   38    H    GLN  11           H        GLN  11   4.388   1.040  -7.835
   39    HA   GLN  11           HA       GLN  11   4.903  -0.437  -5.299
   40    HB3  GLN  11           2HB      GLN  11   6.998   0.640  -7.240
   41    HG3  GLN  11           2HG      GLN  11   7.184  -1.499  -5.101
   42   HE21  GLN  11          1HE2      GLN  11   9.393  -2.045  -4.469
   43   HE22  GLN  11          2HE2      GLN  11  10.651  -1.965  -5.697
   44    H    MET  12           H        MET  12   5.309   0.939  -3.555
   45    HA   MET  12           HA       MET  12   5.861   3.801  -4.096
   46    HB3  MET  12           2HB      MET  12   3.501   3.849  -3.803
   47    HG3  MET  12           2HG      MET  12   2.558   3.255  -1.477
   48    HE1  MET  12           3HE      MET  12   0.447   1.611  -4.253
   49    HE2  MET  12           1HE      MET  12   0.629   2.958  -3.108
   50    HE3  MET  12           2HE      MET  12   1.656   2.869  -4.557
   51    H    GLN  13           H        GLN  13   6.845   4.928  -2.474
   52    HA   GLN  13           HA       GLN  13   8.469   3.225  -0.626
   53    HB3  GLN  13           2HB      GLN  13  10.122   5.006  -0.717
   54    HG3  GLN  13           2HG      GLN  13  10.748   5.127  -3.109
   55   HE21  GLN  13          1HE2      GLN  13  10.796   2.890  -4.714
   56   HE22  GLN  13          2HE2      GLN  13  11.452   1.593  -3.713
   57    H    VAL  14           H        VAL  14   8.137   3.537   1.565
   58    HA   VAL  14           HA       VAL  14   5.946   5.467   2.256
   59    HB   VAL  14           HB       VAL  14   5.944   2.455   2.329
   60   HG11  VAL  14          1HG1      VAL  14   5.388   3.006   4.667
   61   HG12  VAL  14          2HG1      VAL  14   4.194   4.205   4.125
   62   HG13  VAL  14          3HG1      VAL  14   3.940   2.482   3.802
   63   HG21  VAL  14          3HG2      VAL  14   3.817   4.486   1.607
   64   HG22  VAL  14          1HG2      VAL  14   4.899   3.685   0.447
   65   HG23  VAL  14          2HG2      VAL  14   3.733   2.736   1.377
   66    H    GLY  15           H        GLY  15   6.072   6.405   4.124
   67    HA2  GLY  15           2HA      GLY  15   8.638   6.177   5.545
   68    HA3  GLY  15           3HA      GLY  15   7.468   7.503   5.640
   69    H    GLY  16           H        GLY  16   8.914   5.258   7.393
   70    HA2  GLY  16           2HA      GLY  16   8.731   4.982   9.683
   71    HA3  GLY  16           3HA      GLY  16   7.053   5.562   9.634
   72    H    MET  17           H        MET  17   7.013   3.192   7.371
   73    HA   MET  17           HA       MET  17   5.580   1.486   9.268
   74    HB3  MET  17           2HB      MET  17   5.716   1.109   6.267
   75    HG3  MET  17           2HG      MET  17   3.503   0.802   8.349
   76    HE1  MET  17           3HE      MET  17   3.017  -0.596   3.975
   77    HE2  MET  17           1HE      MET  17   4.507   0.217   4.484
   78    HE3  MET  17           2HE      MET  17   4.061  -1.342   5.206
   79    H    ARG  18           H        ARG  18   8.750   1.359   8.483
   80    HA   ARG  18           HA       ARG  18   9.323  -1.290   7.702
   81    HB3  ARG  18           2HB      ARG  18  10.877   0.487   9.628
   82    HG3  ARG  18           2HG      ARG  18  11.844  -1.620   7.644
   83    HD3  ARG  18           2HD      ARG  18  13.345   0.187   9.595
   84    HE   ARG  18           HE       ARG  18  14.764  -1.495   7.636
   85   HH11  ARG  18          1HH1      ARG  18  13.671  -1.414  11.038
   86   HH12  ARG  18          2HH1      ARG  18  14.851  -2.655  11.452
   87   HH21  ARG  18          1HH2      ARG  18  16.428  -2.813   8.433
   88   HH22  ARG  18          2HH2      ARG  18  16.269  -3.425  10.072
   89    H    CYS  19           H        CYS  19   9.511  -3.164   8.705
   90    HA   CYS  19           HA       CYS  19   9.633  -4.831  10.234
   91    HB3  CYS  19           2HB      CYS  19   9.363  -4.555  12.638
   92    HG   CYS  19           HG       CYS  19  11.707  -4.657  11.526
   93    H    ALA  20           H        ALA  20   8.267  -6.339  11.236
   94    HA   ALA  20           HA       ALA  20   6.065  -6.558   9.508
   95    HB1  ALA  20           1HB      ALA  20   7.576  -8.371  10.288
   96    HB2  ALA  20           2HB      ALA  20   6.803  -8.297  11.893
   97    HB3  ALA  20           3HB      ALA  20   5.871  -8.781  10.460
   98    H    ALA  21           H        ALA  21   5.992  -5.863  13.037
   99    HA   ALA  21           HA       ALA  21   3.144  -6.172  13.337
  100    HB1  ALA  21           1HB      ALA  21   5.136  -4.479  14.918
  101    HB2  ALA  21           2HB      ALA  21   3.512  -4.958  15.455
  102    HB3  ALA  21           3HB      ALA  21   4.761  -6.192  15.211
  103    H    CYS  22           H        CYS  22   5.077  -3.595  12.002
  104    HA   CYS  22           HA       CYS  22   2.863  -1.646  12.026
  105    HB3  CYS  22           2HB      CYS  22   4.654  -0.129  11.105
  106    HG   CYS  22           HG       CYS  22   6.491  -0.103  13.088
  107    H    ALA  23           H        ALA  23   4.894  -3.306   9.578
  108    HA   ALA  23           HA       ALA  23   3.421  -2.765   7.250
  109    HB1  ALA  23           1HB      ALA  23   5.518  -4.113   7.406
  110    HB2  ALA  23           2HB      ALA  23   4.624  -5.399   8.248
  111    HB3  ALA  23           3HB      ALA  23   4.232  -5.023   6.574
  112    H    SER  24           H        SER  24   2.525  -4.916   9.960
  113    HA   SER  24           HA       SER  24   0.404  -6.286   8.543
  114    HB3  SER  24           2HB      SER  24  -0.345  -6.944  10.847
  115    HG   SER  24           HG       SER  24   2.463  -7.247  10.496
  116    H    SER  25           H        SER  25   0.430  -3.222  10.296
  117    HA   SER  25           HA       SER  25  -2.389  -2.980  10.689
  118    HB3  SER  25           2HB      SER  25  -1.928  -0.712  11.279
  119    HG   SER  25           HG       SER  25   0.037  -0.916  12.548
  120    H    ILE  26           H        ILE  26  -0.310  -2.356   7.976
  121    HA   ILE  26           HA       ILE  26  -2.582  -1.398   6.282
  122    HB   ILE  26           HB       ILE  26   0.418  -1.512   6.000
  123   HG13  ILE  26          2HG1      ILE  26  -1.625   0.585   5.134
  124   HG21  ILE  26          1HG2      ILE  26  -1.496  -1.497   3.632
  125   HG22  ILE  26          2HG2      ILE  26   0.211  -1.013   3.578
  126   HG23  ILE  26          3HG2      ILE  26  -0.191  -2.671   3.976
  127   HD11  ILE  26          3HD1      ILE  26   0.126   0.540   7.625
  128   HD12  ILE  26          1HD1      ILE  26  -0.644   1.992   6.961
  129   HD13  ILE  26          2HD1      ILE  26  -1.652   0.663   7.555
  130    H    GLU  27           H        GLU  27  -0.287  -4.154   6.450
  131    HA   GLU  27           HA       GLU  27  -1.265  -5.209   4.026
  132    HB3  GLU  27           2HB      GLU  27   0.284  -6.821   6.076
  133    HG3  GLU  27           2HG      GLU  27   0.459  -6.696   3.024
  134    H    ARG  28           H        ARG  28  -2.101  -6.159   7.401
  135    HA   ARG  28           HA       ARG  28  -3.505  -8.530   6.622
  136    HB3  ARG  28           2HB      ARG  28  -3.933  -6.859   9.130
  137    HG3  ARG  28           2HG      ARG  28  -4.492  -9.763   8.418
  138    HD3  ARG  28           2HD      ARG  28  -3.365  -9.718  10.605
  139    HE   ARG  28           HE       ARG  28  -3.777  -7.886  11.933
  140   HH11  ARG  28          1HH1      ARG  28  -7.003  -9.040  10.867
  141   HH12  ARG  28          2HH1      ARG  28  -7.769  -7.765  11.787
  142   HH21  ARG  28          1HH2      ARG  28  -4.997  -6.565  13.330
  143   HH22  ARG  28          2HH2      ARG  28  -6.734  -6.512  13.096
  144    H    ALA  29           H        ALA  29  -4.558  -5.161   6.729
  145    HA   ALA  29           HA       ALA  29  -7.320  -5.817   5.912
  146    HB1  ALA  29           1HB      ALA  29  -7.569  -3.351   5.859
  147    HB2  ALA  29           2HB      ALA  29  -6.931  -3.910   7.416
  148    HB3  ALA  29           3HB      ALA  29  -5.841  -3.164   6.224
  149    H    LEU  30           H        LEU  30  -4.273  -4.812   4.336
  150    HA   LEU  30           HA       LEU  30  -5.315  -3.643   2.036
  151    HB3  LEU  30           2HB      LEU  30  -2.767  -5.273   2.373
  152    HG   LEU  30           HG       LEU  30  -3.002  -4.864  -0.001
  153   HD11  LEU  30          1HD1      LEU  30  -4.660  -3.091  -0.079
  154   HD12  LEU  30          2HD1      LEU  30  -3.209  -2.533  -0.901
  155   HD13  LEU  30          3HD1      LEU  30  -3.567  -1.963   0.750
  156   HD21  LEU  30          3HD2      LEU  30  -1.023  -3.425  -0.363
  157   HD22  LEU  30          1HD2      LEU  30  -0.775  -4.513   1.018
  158   HD23  LEU  30          2HD2      LEU  30  -1.162  -2.799   1.290
  159    H    GLU  31           H        GLU  31  -4.631  -7.140   2.504
  160    HA   GLU  31           HA       GLU  31  -5.605  -7.790  -0.166
  161    HB3  GLU  31           2HB      GLU  31  -3.940  -9.172   0.793
  162    HG3  GLU  31           2HG      GLU  31  -5.946  -9.956   2.949
  163    H    ARG  32           H        ARG  32  -7.260  -6.773   2.529
  164    HA   ARG  32           HA       ARG  32  -9.689  -8.304   1.862
  165    HB3  ARG  32           2HB      ARG  32 -10.608  -7.462   3.988
  166    HG3  ARG  32           2HG      ARG  32  -8.955  -8.371   5.656
  167    HD3  ARG  32           2HD      ARG  32  -8.825 -10.710   4.667
  168    HE   ARG  32           HE       ARG  32 -11.059  -9.426   5.666
  169   HH11  ARG  32          1HH1      ARG  32 -10.444 -12.212   3.526
  170   HH12  ARG  32          2HH1      ARG  32 -11.962 -12.959   4.015
  171   HH21  ARG  32          1HH2      ARG  32 -13.006 -10.531   6.153
  172   HH22  ARG  32          2HH2      ARG  32 -13.297 -12.073   5.365
  173    H    LEU  33           H        LEU  33  -8.260  -5.126   1.465
  174    HA   LEU  33           HA       LEU  33 -10.598  -3.526   1.141
  175    HB3  LEU  33           2HB      LEU  33  -9.170  -2.103  -0.322
  176    HG   LEU  33           HG       LEU  33  -7.536  -3.027   2.065
  177   HD11  LEU  33          1HD1      LEU  33  -6.345  -1.638   0.343
  178   HD12  LEU  33          2HD1      LEU  33  -6.457  -0.867   1.934
  179   HD13  LEU  33          3HD1      LEU  33  -7.532  -0.353   0.620
  180   HD21  LEU  33          3HD2      LEU  33  -8.533  -1.094   3.268
  181   HD22  LEU  33          1HD2      LEU  33  -9.749  -2.318   2.870
  182   HD23  LEU  33          2HD2      LEU  33  -9.635  -0.823   1.904
  183    H    LYS  34           H        LYS  34 -12.245  -3.629  -0.241
  184    HA   LYS  34           HA       LYS  34 -12.307  -5.544  -2.365
  185    HB3  LYS  34           2HB      LYS  34 -14.154  -3.216  -1.686
  186    HG3  LYS  34           2HG      LYS  34 -14.649  -3.877  -3.985
  187    HD3  LYS  34           2HD      LYS  34 -14.879  -6.724  -2.898
  188    HE3  LYS  34           2HE      LYS  34 -15.482  -5.482  -5.619
  189    HZ1  LYS  34           3HZ      LYS  34 -15.296  -8.336  -4.845
  190    HZ2  LYS  34           1HZ      LYS  34 -14.291  -7.545  -5.880
  191    HZ3  LYS  34           2HZ      LYS  34 -15.870  -7.782  -6.286
  192    H    GLY  35           H        GLY  35 -11.372  -5.444  -4.283
  193    HA2  GLY  35           2HA      GLY  35 -11.168  -4.305  -6.454
  194    HA3  GLY  35           3HA      GLY  35 -10.780  -2.806  -5.589
  195    H    VAL  36           H        VAL  36  -9.083  -4.541  -3.640
  196    HA   VAL  36           HA       VAL  36  -6.590  -4.442  -5.211
  197    HB   VAL  36           HB       VAL  36  -7.113  -5.122  -2.294
  198   HG11  VAL  36          1HG1      VAL  36  -4.475  -4.818  -3.797
  199   HG12  VAL  36          2HG1      VAL  36  -4.621  -4.839  -2.028
  200   HG13  VAL  36          3HG1      VAL  36  -5.059  -6.272  -2.958
  201   HG21  VAL  36          3HG2      VAL  36  -5.946  -2.642  -3.657
  202   HG22  VAL  36          1HG2      VAL  36  -7.528  -2.745  -2.852
  203   HG23  VAL  36          2HG2      VAL  36  -6.048  -2.892  -1.904
  204    H    ALA  37           H        ALA  37  -5.370  -6.171  -5.830
  205    HA   ALA  37           HA       ALA  37  -6.834  -8.775  -5.984
  206    HB1  ALA  37           1HB      ALA  37  -5.696  -8.957  -8.167
  207    HB2  ALA  37           2HB      ALA  37  -6.647  -7.465  -8.055
  208    HB3  ALA  37           3HB      ALA  37  -4.880  -7.412  -7.882
  209    H    GLU  38           H        GLU  38  -3.485  -7.469  -5.521
  210    HA   GLU  38           HA       GLU  38  -2.752  -9.694  -3.893
  211    HB3  GLU  38           2HB      GLU  38  -0.746 -10.004  -5.884
  212    HG3  GLU  38           2HG      GLU  38  -3.012 -11.963  -5.391
  213    H    ALA  39           H        ALA  39  -1.213  -8.968  -2.439
  214    HA   ALA  39           HA       ALA  39   0.645  -6.781  -3.300
  215    HB1  ALA  39           1HB      ALA  39  -1.514  -5.808  -2.477
  216    HB2  ALA  39           2HB      ALA  39  -1.252  -6.622  -0.919
  217    HB3  ALA  39           3HB      ALA  39  -0.118  -5.367  -1.479
  218    H    SER  40           H        SER  40   2.216  -6.147  -1.563
  219    HA   SER  40           HA       SER  40   2.524  -7.782   0.792
  220    HB3  SER  40           2HB      SER  40   4.689  -8.152  -1.306
  221    HG   SER  40           HG       SER  40   4.302  -9.513   1.178
  222    H    VAL  41           H        VAL  41   3.623  -6.682   2.355
  223    HA   VAL  41           HA       VAL  41   5.173  -4.236   1.644
  224    HB   VAL  41           HB       VAL  41   4.730  -5.473   4.392
  225   HG11  VAL  41          1HG1      VAL  41   5.843  -2.764   3.517
  226   HG12  VAL  41          2HG1      VAL  41   5.448  -3.198   5.188
  227   HG13  VAL  41          3HG1      VAL  41   6.735  -4.058   4.349
  228   HG21  VAL  41          3HG2      VAL  41   3.087  -3.714   4.793
  229   HG22  VAL  41          1HG2      VAL  41   3.326  -3.068   3.166
  230   HG23  VAL  41          2HG2      VAL  41   2.577  -4.663   3.395
  231    H    THR  42           H        THR  42   7.355  -4.243   1.430
  232    HA   THR  42           HA       THR  42   8.946  -6.700   1.969
  233    HB   THR  42           HB       THR  42   9.696  -4.060   0.677
  234    HG1  THR  42           1HG      THR  42   9.469  -6.584  -0.566
  235   HG21  THR  42          3HG2      THR  42  11.692  -5.150   1.608
  236   HG22  THR  42          1HG2      THR  42  11.682  -5.325  -0.147
  237   HG23  THR  42          2HG2      THR  42  11.222  -6.703   0.884
  238    H    VAL  43           H        VAL  43   9.388  -6.917   4.048
  239    HA   VAL  43           HA       VAL  43   8.770  -4.829   5.830
  240    HB   VAL  43           HB       VAL  43  10.000  -7.567   6.313
  241   HG11  VAL  43          1HG1      VAL  43   9.187  -7.354   8.666
  242   HG12  VAL  43          2HG1      VAL  43  10.492  -6.220   8.326
  243   HG13  VAL  43          3HG1      VAL  43   8.802  -5.649   8.345
  244   HG21  VAL  43          3HG2      VAL  43   7.658  -8.096   7.022
  245   HG22  VAL  43          1HG2      VAL  43   7.160  -6.455   6.583
  246   HG23  VAL  43          2HG2      VAL  43   7.728  -7.580   5.333
  247    H    ALA  44           H        ALA  44  12.008  -5.904   4.834
  248    HA   ALA  44           HA       ALA  44  13.539  -4.632   6.839
  249    HB1  ALA  44           1HB      ALA  44  15.364  -4.900   5.137
  250    HB2  ALA  44           2HB      ALA  44  14.395  -6.367   5.373
  251    HB3  ALA  44           3HB      ALA  44  14.128  -5.346   3.944
  252    H    THR  45           H        THR  45  11.824  -3.048   4.285
  253    HA   THR  45           HA       THR  45  13.081  -0.442   5.110
  254    HB   THR  45           HB       THR  45  12.321   0.336   2.746
  255    HG1  THR  45           1HG      THR  45  12.923  -2.331   2.061
  256   HG21  THR  45          3HG2      THR  45  14.654   0.323   3.409
  257   HG22  THR  45          1HG2      THR  45  14.495  -0.303   1.759
  258   HG23  THR  45          2HG2      THR  45  14.773  -1.423   3.113
  259    H    GLY  46           H        GLY  46  10.131  -2.225   4.392
  260    HA2  GLY  46           2HA      GLY  46   7.980  -1.711   5.188
  261    HA3  GLY  46           3HA      GLY  46   8.477  -0.033   5.524
  262    H    ARG  47           H        ARG  47   9.505  -1.080   2.441
  263    HA   ARG  47           HA       ARG  47   7.617   0.699   1.093
  264    HB3  ARG  47           2HB      ARG  47  10.019   0.589   0.485
  265    HG3  ARG  47           2HG      ARG  47   9.334  -2.046  -0.864
  266    HD3  ARG  47           2HD      ARG  47  11.990  -0.622  -0.491
  267    HE   ARG  47           HE       ARG  47  11.182  -3.075  -2.011
  268   HH11  ARG  47          1HH1      ARG  47  13.912  -1.014  -0.976
  269   HH12  ARG  47          2HH1      ARG  47  15.050  -2.269  -1.359
  270   HH21  ARG  47          1HH2      ARG  47  12.732  -4.510  -2.595
  271   HH22  ARG  47          2HH2      ARG  47  14.419  -4.153  -2.302
  272    H    LEU  48           H        LEU  48   6.340   0.039  -0.772
  273    HA   LEU  48           HA       LEU  48   5.032  -2.627  -0.281
  274    HB3  LEU  48           2HB      LEU  48   3.089  -0.965  -1.344
  275    HG   LEU  48           HG       LEU  48   3.818  -1.376   1.573
  276   HD11  LEU  48          1HD1      LEU  48   1.456   0.052   0.278
  277   HD12  LEU  48          2HD1      LEU  48   2.664   0.758   1.370
  278   HD13  LEU  48          3HD1      LEU  48   1.517  -0.432   1.986
  279   HD21  LEU  48          3HD2      LEU  48   2.998  -3.400   0.391
  280   HD22  LEU  48          1HD2      LEU  48   1.622  -2.494  -0.269
  281   HD23  LEU  48          2HD2      LEU  48   1.729  -2.806   1.471
  282    H    THR  49           H        THR  49   3.872  -3.573  -1.911
  283    HA   THR  49           HA       THR  49   3.990  -2.600  -4.696
  284    HB   THR  49           HB       THR  49   4.598  -5.527  -4.077
  285    HG1  THR  49           1HG      THR  49   6.413  -4.538  -3.562
  286   HG21  THR  49          3HG2      THR  49   4.667  -3.833  -6.629
  287   HG22  THR  49          1HG2      THR  49   3.535  -5.159  -6.260
  288   HG23  THR  49          2HG2      THR  49   5.248  -5.506  -6.498
  289    H    VAL  50           H        VAL  50   2.035  -2.806  -5.557
  290    HA   VAL  50           HA       VAL  50   0.051  -4.705  -4.389
  291    HB   VAL  50           HB       VAL  50  -0.218  -2.662  -3.123
  292   HG11  VAL  50          1HG1      VAL  50   0.669  -0.979  -4.716
  293   HG12  VAL  50          2HG1      VAL  50  -0.792  -1.155  -5.711
  294   HG13  VAL  50          3HG1      VAL  50  -0.908  -0.528  -4.064
  295   HG21  VAL  50          3HG2      VAL  50  -2.233  -3.976  -3.662
  296   HG22  VAL  50          1HG2      VAL  50  -2.594  -2.253  -3.468
  297   HG23  VAL  50          2HG2      VAL  50  -2.523  -2.964  -5.089
  298    H    THR  51           H        THR  51  -1.098  -5.716  -5.822
  299    HA   THR  51           HA       THR  51  -1.469  -4.715  -8.608
  300    HB   THR  51           HB       THR  51  -2.118  -7.471  -7.467
  301    HG1  THR  51           1HG      THR  51   0.160  -7.025  -7.625
  302   HG21  THR  51          3HG2      THR  51  -1.898  -6.441 -10.344
  303   HG22  THR  51          1HG2      THR  51  -3.423  -6.808  -9.525
  304   HG23  THR  51          2HG2      THR  51  -2.270  -8.108  -9.854
  305    H    TYR  52           H        TYR  52  -3.465  -4.002  -9.188
  306    HA   TYR  52           HA       TYR  52  -5.869  -4.674  -7.588
  307    HB3  TYR  52           2HB      TYR  52  -5.000  -2.719  -6.470
  308    HD1  TYR  52           1HD      TYR  52  -6.387  -0.944  -9.441
  309    HD2  TYR  52           2HD      TYR  52  -2.918  -1.599  -6.979
  310    HE1  TYR  52           1HE      TYR  52  -5.249   0.979 -10.534
  311    HE2  TYR  52           2HE      TYR  52  -1.806   0.364  -8.001
  312    HH   TYR  52           HH       TYR  52  -2.016   2.136  -9.556
  313    H    ASP  53           H        ASP  53  -7.917  -3.890  -8.597
  314    HA   ASP  53           HA       ASP  53  -7.881  -4.203 -11.524
  315    HB3  ASP  53           2HB      ASP  53 -10.113  -4.060  -9.478
  316    HA   PRO  54           HA       PRO  54  -7.452   0.279 -11.303
  317    HB3  PRO  54           2HB      PRO  54  -5.717  -0.111 -12.752
  318    HG3  PRO  54           2HG      PRO  54  -5.929  -1.593 -14.617
  319    HD3  PRO  54           2HD      PRO  54  -6.284  -2.801 -12.663
  320    H    LYS  55           H        LYS  55 -10.155  -1.142 -11.986
  321    HA   LYS  55           HA       LYS  55 -11.524   1.313 -13.039
  322    HB3  LYS  55           2HB      LYS  55 -12.402  -1.547 -13.596
  323    HG3  LYS  55           2HG      LYS  55 -13.161   1.107 -14.898
  324    HD3  LYS  55           2HD      LYS  55 -14.966  -0.238 -15.949
  325    HE3  LYS  55           2HE      LYS  55 -12.182  -1.318 -16.572
  326    HZ1  LYS  55           3HZ      LYS  55 -13.865  -2.559 -17.735
  327    HZ2  LYS  55           1HZ      LYS  55 -13.125  -1.572 -18.812
  328    HZ3  LYS  55           2HZ      LYS  55 -14.620  -1.187 -18.243
  329    H    GLN  56           H        GLN  56 -11.682  -1.604 -10.977
  330    HA   GLN  56           HA       GLN  56 -13.851  -0.588  -9.295
  331    HB3  GLN  56           2HB      GLN  56 -12.877  -2.200  -7.603
  332    HG3  GLN  56           2HG      GLN  56 -13.077  -4.312  -9.007
  333   HE21  GLN  56          1HE2      GLN  56 -15.168  -5.320  -9.103
  334   HE22  GLN  56          2HE2      GLN  56 -16.601  -4.439  -8.588
  335    H    VAL  57           H        VAL  57 -10.213  -0.271  -9.119
  336    HA   VAL  57           HA       VAL  57 -10.571   2.062  -7.342
  337    HB   VAL  57           HB       VAL  57  -9.110   1.228  -5.570
  338   HG11  VAL  57          1HG1      VAL  57 -11.479  -0.643  -5.862
  339   HG12  VAL  57          2HG1      VAL  57 -10.606  -0.223  -4.381
  340   HG13  VAL  57          3HG1      VAL  57 -11.526   1.024  -5.235
  341   HG21  VAL  57          3HG2      VAL  57  -7.811  -0.469  -6.778
  342   HG22  VAL  57          1HG2      VAL  57  -8.568  -1.184  -5.352
  343   HG23  VAL  57          2HG2      VAL  57  -9.255  -1.487  -6.962
  344    H    SER  58           H        SER  58  -8.243   2.758  -6.527
  345    HA   SER  58           HA       SER  58  -6.070   2.165  -8.412
  346    HB3  SER  58           2HB      SER  58  -7.432   4.023  -9.449
  347    HG   SER  58           HG       SER  58  -6.323   6.000  -8.042
  348    H    GLU  59           H        GLU  59  -4.245   4.059  -7.712
  349    HA   GLU  59           HA       GLU  59  -3.137   3.487  -5.228
  350    HB3  GLU  59           2HB      GLU  59  -2.003   4.592  -7.069
  351    HG3  GLU  59           2HG      GLU  59  -2.050   7.081  -7.233
  352    H    ILE  60           H        ILE  60  -5.841   5.658  -5.799
  353    HA   ILE  60           HA       ILE  60  -5.946   7.160  -3.376
  354    HB   ILE  60           HB       ILE  60  -7.993   5.984  -5.292
  355   HG13  ILE  60          2HG1      ILE  60  -8.376   8.249  -6.006
  356   HG21  ILE  60          1HG2      ILE  60  -9.265   5.944  -3.327
  357   HG22  ILE  60          2HG2      ILE  60  -8.665   7.537  -2.788
  358   HG23  ILE  60          3HG2      ILE  60  -9.753   7.397  -4.194
  359   HD11  ILE  60          3HD1      ILE  60  -7.922   9.547  -3.913
  360   HD12  ILE  60          1HD1      ILE  60  -6.185   9.196  -4.099
  361   HD13  ILE  60          2HD1      ILE  60  -7.034  10.154  -5.318
  362    H    THR  61           H        THR  61  -7.019   3.820  -3.987
  363    HA   THR  61           HA       THR  61  -8.388   3.555  -1.456
  364    HB   THR  61           HB       THR  61  -7.636   1.738  -3.744
  365    HG1  THR  61           1HG      THR  61  -9.485   2.820  -4.039
  366   HG21  THR  61          3HG2      THR  61  -8.887  -0.117  -2.643
  367   HG22  THR  61          1HG2      THR  61  -8.792   0.770  -1.103
  368   HG23  THR  61          2HG2      THR  61  -7.313   0.197  -1.906
  369    H    ILE  62           H        ILE  62  -5.059   2.852  -2.390
  370    HA   ILE  62           HA       ILE  62  -4.554   1.659   0.294
  371    HB   ILE  62           HB       ILE  62  -3.608   0.709  -1.809
  372   HG13  ILE  62          2HG1      ILE  62  -2.770   0.176   0.423
  373   HG21  ILE  62          1HG2      ILE  62  -1.707   3.086  -1.770
  374   HG22  ILE  62          2HG2      ILE  62  -1.666   1.693  -2.874
  375   HG23  ILE  62          3HG2      ILE  62  -3.007   2.814  -2.957
  376   HD11  ILE  62          3HD1      ILE  62  -1.674  -0.821  -1.651
  377   HD12  ILE  62          1HD1      ILE  62  -0.396   0.400  -1.471
  378   HD13  ILE  62          2HD1      ILE  62  -0.672  -0.792  -0.188
  379    H    GLN  63           H        GLN  63  -4.113   4.755  -1.321
  380    HA   GLN  63           HA       GLN  63  -2.256   5.978   0.368
  381    HB3  GLN  63           2HB      GLN  63  -4.724   7.214  -0.948
  382    HG3  GLN  63           2HG      GLN  63  -2.072   8.451  -0.126
  383   HE21  GLN  63          1HE2      GLN  63  -1.781   8.786  -2.580
  384   HE22  GLN  63          2HE2      GLN  63  -2.597  10.167  -3.260
  385    H    GLU  64           H        GLU  64  -5.852   6.005   0.822
  386    HA   GLU  64           HA       GLU  64  -5.722   7.637   3.180
  387    HB3  GLU  64           2HB      GLU  64  -8.043   7.050   3.533
  388    HG3  GLU  64           2HG      GLU  64  -7.612   7.287   0.524
  389    H    ARG  65           H        ARG  65  -5.872   4.078   2.876
  390    HA   ARG  65           HA       ARG  65  -5.817   3.491   5.675
  391    HB3  ARG  65           2HB      ARG  65  -5.152   2.003   3.131
  392    HG3  ARG  65           2HG      ARG  65  -3.739   0.834   4.644
  393    HD3  ARG  65           2HD      ARG  65  -4.639   1.390   6.889
  394    HE   ARG  65           HE       ARG  65  -7.115   0.908   6.247
  395   HH11  ARG  65          1HH1      ARG  65  -5.089  -1.021   8.468
  396   HH12  ARG  65          2HH1      ARG  65  -6.496  -1.398   9.423
  397   HH21  ARG  65          1HH2      ARG  65  -8.812  -0.014   7.264
  398   HH22  ARG  65          2HH2      ARG  65  -8.549  -1.131   8.586
  399    H    ILE  66           H        ILE  66  -3.084   4.129   3.384
  400    HA   ILE  66           HA       ILE  66  -1.046   3.534   5.399
  401    HB   ILE  66           HB       ILE  66  -0.944   5.216   2.867
  402   HG13  ILE  66          2HG1      ILE  66  -1.234   2.580   2.832
  403   HG21  ILE  66          1HG2      ILE  66   0.795   6.038   4.406
  404   HG22  ILE  66          2HG2      ILE  66   1.297   4.370   4.769
  405   HG23  ILE  66          3HG2      ILE  66   1.569   5.066   3.164
  406   HD11  ILE  66          3HD1      ILE  66   0.374   2.309   0.975
  407   HD12  ILE  66          1HD1      ILE  66  -0.637   3.752   0.797
  408   HD13  ILE  66          2HD1      ILE  66   1.064   3.897   1.322
  409    H    ALA  67           H        ALA  67  -2.588   6.639   4.418
  410    HA   ALA  67           HA       ALA  67  -1.146   8.208   6.309
  411    HB1  ALA  67           1HB      ALA  67  -2.257   9.127   4.341
  412    HB2  ALA  67           2HB      ALA  67  -3.851   8.642   4.956
  413    HB3  ALA  67           3HB      ALA  67  -2.915   9.896   5.799
  414    H    ALA  68           H        ALA  68  -4.219   6.392   6.646
  415    HA   ALA  68           HA       ALA  68  -5.175   7.651   9.025
  416    HB1  ALA  68           1HB      ALA  68  -5.800   4.952   7.727
  417    HB2  ALA  68           2HB      ALA  68  -6.781   5.742   8.979
  418    HB3  ALA  68           3HB      ALA  68  -6.611   6.488   7.384
  419    H    LEU  69           H        LEU  69  -3.023   4.898   8.553
  420    HA   LEU  69           HA       LEU  69  -3.085   4.178  11.434
  421    HB3  LEU  69           2HB      LEU  69  -1.389   2.405  10.438
  422    HG   LEU  69           HG       LEU  69  -3.193   0.947   9.647
  423   HD11  LEU  69          1HD1      LEU  69  -4.057   2.397  12.182
  424   HD12  LEU  69          2HD1      LEU  69  -2.694   1.264  12.104
  425   HD13  LEU  69          3HD1      LEU  69  -4.342   0.705  11.746
  426   HD21  LEU  69          3HD2      LEU  69  -5.519   1.554   9.628
  427   HD22  LEU  69          1HD2      LEU  69  -4.675   2.718   8.591
  428   HD23  LEU  69          2HD2      LEU  69  -5.184   3.183  10.220
  429    H    GLY  70           H        GLY  70  -1.712   6.665  10.008
  430    HA2  GLY  70           2HA      GLY  70  -0.201   8.131  10.950
  431    HA3  GLY  70           3HA      GLY  70   0.269   6.898  12.146
  432    H    TYR  71           H        TYR  71   0.332   6.489   8.618
  433    HA   TYR  71           HA       TYR  71   3.298   6.811   8.575
  434    HB3  TYR  71           2HB      TYR  71   3.411   4.981   6.950
  435    HD1  TYR  71           1HD      TYR  71   4.629   4.994   9.380
  436    HD2  TYR  71           2HD      TYR  71   0.899   3.041   8.486
  437    HE1  TYR  71           1HE      TYR  71   4.887   3.589  11.405
  438    HE2  TYR  71           2HE      TYR  71   1.172   1.596  10.496
  439    HH   TYR  71           HH       TYR  71   3.994   1.957  12.707
  440    H    THR  72           H        THR  72   3.890   6.949   6.003
  441    HA   THR  72           HA       THR  72   2.066   8.820   4.614
  442    HB   THR  72           HB       THR  72   4.035  10.424   4.289
  443    HG1  THR  72           1HG      THR  72   5.670  10.366   5.712
  444   HG21  THR  72          3HG2      THR  72   3.678  11.670   6.326
  445   HG22  THR  72          1HG2      THR  72   3.073  10.234   7.170
  446   HG23  THR  72          2HG2      THR  72   2.151  10.946   5.826
  447    H    LEU  73           H        LEU  73   3.221   9.433   2.354
  448    HA   LEU  73           HA       LEU  73   4.907   7.204   1.402
  449    HB3  LEU  73           2HB      LEU  73   2.497   6.417   1.498
  450    HG   LEU  73           HG       LEU  73   2.180   8.040  -1.066
  451   HD11  LEU  73          1HD1      LEU  73  -0.041   7.007  -1.126
  452   HD12  LEU  73          2HD1      LEU  73   0.303   6.115   0.367
  453   HD13  LEU  73          3HD1      LEU  73   1.221   5.763  -1.117
  454   HD21  LEU  73          3HD2      LEU  73   0.213   9.093   0.045
  455   HD22  LEU  73          1HD2      LEU  73   1.736   9.563   0.787
  456   HD23  LEU  73          2HD2      LEU  73   0.701   8.354   1.587
  457    H    ALA  74           H        ALA  74   5.664   7.209  -0.670
  458    HA   ALA  74           HA       ALA  74   5.013   9.503  -2.468
  459    HB1  ALA  74           1HB      ALA  74   7.704   8.071  -2.188
  460    HB2  ALA  74           2HB      ALA  74   7.307   9.330  -3.378
  461    HB3  ALA  74           3HB      ALA  74   7.362   9.724  -1.648
  462    H    GLU  75           H        GLU  75   3.899   8.764  -4.149
  463    HA   GLU  75           HA       GLU  75   4.364   6.031  -5.252
  464    HB3  GLU  75           2HB      GLU  75   1.757   7.561  -4.860
  465    HG3  GLU  75           2HG      GLU  75   0.787   5.210  -5.415
  466    HA   PRO  76           HA       PRO  76   6.168   8.350  -8.115
  467    HB3  PRO  76           2HB      PRO  76   7.216   6.479  -8.851
  468    HG3  PRO  76           2HG      PRO  76   5.989   4.455  -9.173
  469    HD3  PRO  76           2HD      PRO  76   5.495   5.265  -6.995
  Start of MODEL   10
    1    H2   PRO   6           2H       PRO   6  -7.394  -1.887 -15.648
    2    HA   PRO   6           HA       PRO   6  -8.767  -4.209 -14.541
    3    HB3  PRO   6           2HB      PRO   6  -7.925  -5.616 -16.281
    4    HG3  PRO   6           2HG      PRO   6  -9.851  -4.489 -17.060
    5    HD3  PRO   6           2HD      PRO   6 -10.156  -2.380 -16.313
    6    H    LEU   7           H        LEU   7  -7.457  -5.587 -13.263
    7    HA   LEU   7           HA       LEU   7  -5.601  -4.277 -11.675
    8    HB3  LEU   7           2HB      LEU   7  -7.004  -6.272 -11.064
    9    HG   LEU   7           HG       LEU   7  -4.684  -7.849 -12.294
   10   HD11  LEU   7          1HD1      LEU   7  -5.694  -9.813 -11.183
   11   HD12  LEU   7          2HD1      LEU   7  -6.845  -8.746 -10.349
   12   HD13  LEU   7          3HD1      LEU   7  -5.101  -8.621 -10.024
   13   HD21  LEU   7          3HD2      LEU   7  -6.567  -7.496 -13.886
   14   HD22  LEU   7          1HD2      LEU   7  -7.694  -8.151 -12.687
   15   HD23  LEU   7          2HD2      LEU   7  -6.432  -9.183 -13.391
   16    H    LYS   8           H        LYS   8  -3.503  -4.223 -11.367
   17    HA   LYS   8           HA       LYS   8  -1.529  -5.666 -12.955
   18    HB3  LYS   8           2HB      LYS   8  -2.171  -3.804 -14.495
   19    HG3  LYS   8           2HG      LYS   8  -1.071  -2.000 -12.303
   20    HD3  LYS   8           2HD      LYS   8  -2.297  -1.177 -14.946
   21    HE3  LYS   8           2HE      LYS   8  -0.772   0.279 -12.721
   22    HZ1  LYS   8           3HZ      LYS   8  -0.422   1.283 -14.875
   23    HZ2  LYS   8           1HZ      LYS   8  -1.373   2.269 -13.968
   24    HZ3  LYS   8           2HZ      LYS   8  -2.030   1.352 -15.176
   25    H    THR   9           H        THR   9   0.570  -5.502 -12.055
   26    HA   THR   9           HA       THR   9   0.673  -4.929  -9.209
   27    HB   THR   9           HB       THR   9   1.942  -6.752 -10.347
   28    HG1  THR   9           1HG      THR   9   3.419  -6.628  -8.842
   29   HG21  THR   9          3HG2      THR   9   4.116  -6.293 -11.307
   30   HG22  THR   9          1HG2      THR   9   3.924  -4.545 -11.055
   31   HG23  THR   9          2HG2      THR   9   2.913  -5.392 -12.241
   32    H    GLN  10           H        GLN  10   2.008  -3.492  -8.165
   33    HA   GLN  10           HA       GLN  10   2.993  -1.067  -9.469
   34    HB3  GLN  10           2HB      GLN  10   0.625  -1.080  -7.541
   35    HG3  GLN  10           2HG      GLN  10   2.043   0.894  -7.108
   36   HE21  GLN  10          1HE2      GLN  10   3.792   2.052  -8.024
   37   HE22  GLN  10          2HE2      GLN  10   3.757   2.673  -9.670
   38    H    GLN  11           H        GLN  11   4.603  -0.225  -8.290
   39    HA   GLN  11           HA       GLN  11   5.066  -1.167  -5.487
   40    HB3  GLN  11           2HB      GLN  11   7.486  -0.521  -6.082
   41    HG3  GLN  11           2HG      GLN  11   6.839  -2.882  -5.891
   42   HE21  GLN  11          1HE2      GLN  11   5.547  -4.554  -6.585
   43   HE22  GLN  11          2HE2      GLN  11   4.886  -4.680  -8.219
   44    H    MET  12           H        MET  12   5.663   0.363  -3.951
   45    HA   MET  12           HA       MET  12   6.042   3.165  -4.712
   46    HB3  MET  12           2HB      MET  12   3.621   3.118  -4.543
   47    HG3  MET  12           2HG      MET  12   2.797   2.900  -2.007
   48    HE1  MET  12           3HE      MET  12   0.496   2.505  -3.046
   49    HE2  MET  12           1HE      MET  12   1.349   2.761  -4.580
   50    HE3  MET  12           2HE      MET  12   0.236   1.410  -4.416
   51    H    GLN  13           H        GLN  13   6.618   4.528  -2.929
   52    HA   GLN  13           HA       GLN  13   8.057   3.114  -0.740
   53    HB3  GLN  13           2HB      GLN  13   8.857   5.534  -0.256
   54    HG3  GLN  13           2HG      GLN  13   9.639   4.054  -2.790
   55   HE21  GLN  13          1HE2      GLN  13  11.062   5.019  -4.196
   56   HE22  GLN  13          2HE2      GLN  13  11.745   6.598  -3.936
   57    H    VAL  14           H        VAL  14   7.784   3.927   1.403
   58    HA   VAL  14           HA       VAL  14   5.119   5.054   2.106
   59    HB   VAL  14           HB       VAL  14   4.872   2.619   2.145
   60   HG11  VAL  14          1HG1      VAL  14   7.190   1.882   2.536
   61   HG12  VAL  14          2HG1      VAL  14   7.125   2.516   4.198
   62   HG13  VAL  14          3HG1      VAL  14   6.079   1.172   3.707
   63   HG21  VAL  14          3HG2      VAL  14   3.716   4.027   3.869
   64   HG22  VAL  14          1HG2      VAL  14   3.967   2.341   4.350
   65   HG23  VAL  14          2HG2      VAL  14   5.004   3.614   5.019
   66    H    GLY  15           H        GLY  15   5.081   6.171   4.031
   67    HA2  GLY  15           2HA      GLY  15   7.431   7.539   4.806
   68    HA3  GLY  15           3HA      GLY  15   5.847   7.674   5.585
   69    H    GLY  16           H        GLY  16   7.843   4.781   5.463
   70    HA2  GLY  16           2HA      GLY  16   9.381   3.871   6.916
   71    HA3  GLY  16           3HA      GLY  16   9.187   5.273   7.988
   72    H    MET  17           H        MET  17   7.124   2.540   6.885
   73    HA   MET  17           HA       MET  17   5.725   2.329   9.372
   74    HB3  MET  17           2HB      MET  17   5.071   1.659   6.909
   75    HG3  MET  17           2HG      MET  17   5.083  -0.725   6.469
   76    HE1  MET  17           3HE      MET  17   7.174  -2.712   6.092
   77    HE2  MET  17           1HE      MET  17   8.878  -2.258   6.199
   78    HE3  MET  17           2HE      MET  17   7.888  -2.293   7.665
   79    H    ARG  18           H        ARG  18   8.849   1.263   8.736
   80    HA   ARG  18           HA       ARG  18   8.960  -1.304   9.864
   81    HB3  ARG  18           2HB      ARG  18  11.428  -0.650  10.300
   82    HG3  ARG  18           2HG      ARG  18  10.161  -0.473   7.540
   83    HD3  ARG  18           2HD      ARG  18  12.307   0.451   7.183
   84    HE   ARG  18           HE       ARG  18  13.844   0.133   8.812
   85   HH11  ARG  18          1HH1      ARG  18  12.775  -3.140   7.896
   86   HH12  ARG  18          2HH1      ARG  18  13.790  -3.869   9.117
   87   HH21  ARG  18          1HH2      ARG  18  15.307  -0.920  10.128
   88   HH22  ARG  18          2HH2      ARG  18  15.382  -2.675  10.108
   89    H    CYS  19           H        CYS  19   9.370  -2.146  11.767
   90    HA   CYS  19           HA       CYS  19   9.565  -2.546  13.967
   91    HB3  CYS  19           2HB      CYS  19  10.749  -0.932  15.397
   92    HG   CYS  19           HG       CYS  19  12.259  -2.450  13.970
   93    H    ALA  20           H        ALA  20   7.062  -0.946  12.853
   94    HA   ALA  20           HA       ALA  20   5.724  -0.495  15.496
   95    HB1  ALA  20           1HB      ALA  20   5.342   0.916  12.814
   96    HB2  ALA  20           2HB      ALA  20   4.489   1.297  14.328
   97    HB3  ALA  20           3HB      ALA  20   6.226   1.561  14.214
   98    H    ALA  21           H        ALA  21   5.737  -2.974  13.560
   99    HA   ALA  21           HA       ALA  21   4.364  -4.661  13.000
  100    HB1  ALA  21           1HB      ALA  21   3.475  -4.196  15.319
  101    HB2  ALA  21           2HB      ALA  21   2.152  -3.280  14.568
  102    HB3  ALA  21           3HB      ALA  21   2.336  -5.006  14.221
  103    H    CYS  22           H        CYS  22   3.684  -1.589  11.910
  104    HA   CYS  22           HA       CYS  22   1.218  -1.873  10.625
  105    HB3  CYS  22           2HB      CYS  22   2.064   0.180   9.339
  106    HG   CYS  22           HG       CYS  22   2.380  -0.212  12.655
  107    H    ALA  23           H        ALA  23   4.288  -3.129   9.447
  108    HA   ALA  23           HA       ALA  23   3.594  -3.555   6.722
  109    HB1  ALA  23           1HB      ALA  23   5.218  -5.425   6.904
  110    HB2  ALA  23           2HB      ALA  23   5.830  -3.960   7.700
  111    HB3  ALA  23           3HB      ALA  23   5.178  -5.291   8.672
  112    H    SER  24           H        SER  24   2.443  -5.308   9.658
  113    HA   SER  24           HA       SER  24   0.906  -7.201   7.918
  114    HB3  SER  24           2HB      SER  24   1.881  -8.382   9.653
  115    HG   SER  24           HG       SER  24   2.484  -7.446  11.392
  116    H    SER  25           H        SER  25   0.357  -4.516  10.247
  117    HA   SER  25           HA       SER  25  -2.466  -4.627  10.144
  118    HB3  SER  25           2HB      SER  25  -2.485  -2.404  11.090
  119    HG   SER  25           HG       SER  25  -1.360  -2.905  12.876
  120    H    ILE  26           H        ILE  26  -0.274  -3.126   7.791
  121    HA   ILE  26           HA       ILE  26  -2.492  -2.165   6.084
  122    HB   ILE  26           HB       ILE  26   0.496  -2.476   5.744
  123   HG13  ILE  26          2HG1      ILE  26  -1.399  -0.150   5.220
  124   HG21  ILE  26          1HG2      ILE  26   0.333  -1.795   3.346
  125   HG22  ILE  26          2HG2      ILE  26  -0.282  -3.403   3.620
  126   HG23  ILE  26          3HG2      ILE  26  -1.426  -2.051   3.419
  127   HD11  ILE  26          3HD1      ILE  26  -0.170   1.069   6.892
  128   HD12  ILE  26          1HD1      ILE  26  -0.694  -0.464   7.636
  129   HD13  ILE  26          2HD1      ILE  26   0.988  -0.251   7.095
  130    H    GLU  27           H        GLU  27  -0.273  -5.027   5.937
  131    HA   GLU  27           HA       GLU  27  -1.427  -5.863   3.508
  132    HB3  GLU  27           2HB      GLU  27   0.123  -7.646   5.407
  133    HG3  GLU  27           2HG      GLU  27   0.102  -7.389   2.357
  134    H    ARG  28           H        ARG  28  -2.261  -6.804   6.829
  135    HA   ARG  28           HA       ARG  28  -3.945  -9.026   6.276
  136    HB3  ARG  28           2HB      ARG  28  -4.065  -6.894   8.444
  137    HG3  ARG  28           2HG      ARG  28  -5.236  -9.716   8.398
  138    HD3  ARG  28           2HD      ARG  28  -4.986  -7.603  10.572
  139    HE   ARG  28           HE       ARG  28  -7.013  -9.661  10.242
  140   HH11  ARG  28          1HH1      ARG  28  -5.250  -7.826  12.748
  141   HH12  ARG  28          2HH1      ARG  28  -6.668  -7.810  13.760
  142   HH21  ARG  28          1HH2      ARG  28  -8.613  -9.757  11.679
  143   HH22  ARG  28          2HH2      ARG  28  -8.460  -9.083  13.290
  144    H    ALA  29           H        ALA  29  -4.596  -5.541   5.974
  145    HA   ALA  29           HA       ALA  29  -7.424  -5.994   5.181
  146    HB1  ALA  29           1HB      ALA  29  -6.810  -4.034   6.575
  147    HB2  ALA  29           2HB      ALA  29  -5.720  -3.459   5.297
  148    HB3  ALA  29           3HB      ALA  29  -7.472  -3.549   5.005
  149    H    LEU  30           H        LEU  30  -4.282  -5.070   3.720
  150    HA   LEU  30           HA       LEU  30  -5.308  -4.178   1.292
  151    HB3  LEU  30           2HB      LEU  30  -2.575  -5.427   1.732
  152    HG   LEU  30           HG       LEU  30  -2.851  -4.702  -0.589
  153   HD11  LEU  30          1HD1      LEU  30  -3.230  -2.231  -1.058
  154   HD12  LEU  30          2HD1      LEU  30  -3.765  -2.067   0.632
  155   HD13  LEU  30          3HD1      LEU  30  -4.648  -3.111  -0.503
  156   HD21  LEU  30          3HD2      LEU  30  -0.689  -4.316   0.623
  157   HD22  LEU  30          1HD2      LEU  30  -1.231  -2.673   1.015
  158   HD23  LEU  30          2HD2      LEU  30  -0.966  -3.144  -0.675
  159    H    GLU  31           H        GLU  31  -4.706  -7.558   2.145
  160    HA   GLU  31           HA       GLU  31  -4.833  -8.510  -0.595
  161    HB3  GLU  31           2HB      GLU  31  -3.780  -9.842   1.204
  162    HG3  GLU  31           2HG      GLU  31  -6.636 -10.085   2.274
  163    H    ARG  32           H        ARG  32  -7.221  -7.231   1.468
  164    HA   ARG  32           HA       ARG  32  -9.383  -8.638   0.040
  165    HB3  ARG  32           2HB      ARG  32  -9.096  -9.715   2.133
  166    HG3  ARG  32           2HG      ARG  32  -9.811  -7.129   3.584
  167    HD3  ARG  32           2HD      ARG  32  -8.966  -8.469   5.547
  168    HE   ARG  32           HE       ARG  32 -11.533  -8.757   4.484
  169   HH11  ARG  32          1HH1      ARG  32  -9.348 -10.779   6.453
  170   HH12  ARG  32          2HH1      ARG  32 -10.673 -11.631   7.206
  171   HH21  ARG  32          1HH2      ARG  32 -13.171  -9.785   5.632
  172   HH22  ARG  32          2HH2      ARG  32 -12.813 -11.165   6.635
  173    H    LEU  33           H        LEU  33  -8.215  -5.520   0.739
  174    HA   LEU  33           HA       LEU  33 -10.586  -3.939   0.754
  175    HB3  LEU  33           2HB      LEU  33  -9.219  -2.253  -0.500
  176    HG   LEU  33           HG       LEU  33  -7.484  -3.462   1.673
  177   HD11  LEU  33          1HD1      LEU  33  -6.416  -1.787   0.145
  178   HD12  LEU  33          2HD1      LEU  33  -6.505  -1.252   1.833
  179   HD13  LEU  33          3HD1      LEU  33  -7.647  -0.614   0.636
  180   HD21  LEU  33          3HD2      LEU  33  -8.497  -1.759   3.178
  181   HD22  LEU  33          1HD2      LEU  33  -9.668  -2.986   2.669
  182   HD23  LEU  33          2HD2      LEU  33  -9.683  -1.369   1.918
  183    H    LYS  34           H        LYS  34 -12.124  -3.437  -0.689
  184    HA   LYS  34           HA       LYS  34 -12.488  -4.988  -3.078
  185    HB3  LYS  34           2HB      LYS  34 -14.266  -3.232  -3.536
  186    HG3  LYS  34           2HG      LYS  34 -14.373  -4.429  -0.734
  187    HD3  LYS  34           2HD      LYS  34 -16.522  -3.833  -2.820
  188    HE3  LYS  34           2HE      LYS  34 -17.162  -5.741  -1.368
  189    HZ1  LYS  34           3HZ      LYS  34 -16.679  -3.789   0.808
  190    HZ2  LYS  34           1HZ      LYS  34 -16.065  -5.317   0.666
  191    HZ3  LYS  34           2HZ      LYS  34 -17.655  -5.078   1.012
  192    H    GLY  35           H        GLY  35 -11.843  -4.734  -5.105
  193    HA2  GLY  35           2HA      GLY  35 -10.942  -3.742  -7.032
  194    HA3  GLY  35           3HA      GLY  35 -10.637  -2.235  -6.137
  195    H    VAL  36           H        VAL  36  -9.304  -4.590  -4.201
  196    HA   VAL  36           HA       VAL  36  -6.658  -4.516  -5.605
  197    HB   VAL  36           HB       VAL  36  -7.079  -4.860  -2.616
  198   HG11  VAL  36          1HG1      VAL  36  -4.612  -4.242  -4.311
  199   HG12  VAL  36          2HG1      VAL  36  -4.642  -4.307  -2.544
  200   HG13  VAL  36          3HG1      VAL  36  -4.945  -5.774  -3.472
  201   HG21  VAL  36          3HG2      VAL  36  -7.823  -2.590  -3.155
  202   HG22  VAL  36          1HG2      VAL  36  -6.236  -2.514  -2.391
  203   HG23  VAL  36          2HG2      VAL  36  -6.377  -2.314  -4.147
  204    H    ALA  37           H        ALA  37  -5.637  -6.422  -5.970
  205    HA   ALA  37           HA       ALA  37  -7.233  -8.913  -5.534
  206    HB1  ALA  37           1HB      ALA  37  -5.085  -8.214  -7.577
  207    HB2  ALA  37           2HB      ALA  37  -6.066  -9.695  -7.537
  208    HB3  ALA  37           3HB      ALA  37  -6.841  -8.129  -7.843
  209    H    GLU  38           H        GLU  38  -3.766  -7.836  -5.428
  210    HA   GLU  38           HA       GLU  38  -3.176  -9.804  -3.395
  211    HB3  GLU  38           2HB      GLU  38  -3.025 -11.319  -5.259
  212    HG3  GLU  38           2HG      GLU  38  -1.026  -9.394  -6.493
  213    H    ALA  39           H        ALA  39  -1.200  -9.400  -2.254
  214    HA   ALA  39           HA       ALA  39   0.521  -7.176  -3.066
  215    HB1  ALA  39           1HB      ALA  39  -0.216  -5.622  -1.353
  216    HB2  ALA  39           2HB      ALA  39  -1.599  -6.032  -2.379
  217    HB3  ALA  39           3HB      ALA  39  -1.444  -6.777  -0.775
  218    H    SER  40           H        SER  40   2.190  -6.632  -1.580
  219    HA   SER  40           HA       SER  40   2.462  -8.124   0.905
  220    HB3  SER  40           2HB      SER  40   4.565  -8.581  -1.225
  221    HG   SER  40           HG       SER  40   5.644  -9.537   0.354
  222    H    VAL  41           H        VAL  41   3.684  -7.046   2.385
  223    HA   VAL  41           HA       VAL  41   5.106  -4.548   1.534
  224    HB   VAL  41           HB       VAL  41   4.536  -5.530   4.371
  225   HG11  VAL  41          1HG1      VAL  41   6.477  -4.017   4.252
  226   HG12  VAL  41          2HG1      VAL  41   5.542  -2.857   3.282
  227   HG13  VAL  41          3HG1      VAL  41   5.099  -3.176   4.970
  228   HG21  VAL  41          3HG2      VAL  41   3.083  -3.414   2.724
  229   HG22  VAL  41          1HG2      VAL  41   2.411  -4.977   3.223
  230   HG23  VAL  41          2HG2      VAL  41   2.811  -3.761   4.438
  231    H    THR  42           H        THR  42   7.255  -4.568   1.256
  232    HA   THR  42           HA       THR  42   8.939  -6.854   2.075
  233    HB   THR  42           HB       THR  42   9.688  -4.267   0.660
  234    HG1  THR  42           1HG      THR  42   8.342  -5.725  -0.532
  235   HG21  THR  42          3HG2      THR  42  11.229  -6.864   1.145
  236   HG22  THR  42          1HG2      THR  42  11.639  -5.265   1.805
  237   HG23  THR  42          2HG2      THR  42  11.754  -5.554   0.069
  238    H    VAL  43           H        VAL  43   9.411  -6.887   4.189
  239    HA   VAL  43           HA       VAL  43   9.482  -4.504   5.835
  240    HB   VAL  43           HB       VAL  43  10.218  -7.395   6.400
  241   HG11  VAL  43          1HG1      VAL  43  10.070  -5.059   8.359
  242   HG12  VAL  43          2HG1      VAL  43  10.093  -6.774   8.823
  243   HG13  VAL  43          3HG1      VAL  43  11.493  -6.072   8.020
  244   HG21  VAL  43          3HG2      VAL  43   7.843  -5.629   7.159
  245   HG22  VAL  43          1HG2      VAL  43   7.818  -6.929   5.950
  246   HG23  VAL  43          2HG2      VAL  43   8.060  -7.324   7.657
  247    H    ALA  44           H        ALA  44  12.129  -6.574   4.498
  248    HA   ALA  44           HA       ALA  44  14.187  -5.548   6.106
  249    HB1  ALA  44           1HB      ALA  44  14.336  -7.617   4.794
  250    HB2  ALA  44           2HB      ALA  44  14.354  -6.686   3.277
  251    HB3  ALA  44           3HB      ALA  44  15.695  -6.545   4.433
  252    H    THR  45           H        THR  45  13.334  -4.422   2.787
  253    HA   THR  45           HA       THR  45  14.971  -1.968   3.155
  254    HB   THR  45           HB       THR  45  14.353  -1.588   0.732
  255    HG1  THR  45           1HG      THR  45  13.747  -3.652  -0.291
  256   HG21  THR  45          3HG2      THR  45  16.531  -2.563   1.472
  257   HG22  THR  45          1HG2      THR  45  16.003  -3.175  -0.097
  258   HG23  THR  45          2HG2      THR  45  15.827  -4.190   1.353
  259    H    GLY  46           H        GLY  46  11.689  -2.912   3.571
  260    HA2  GLY  46           2HA      GLY  46   9.989  -1.692   4.481
  261    HA3  GLY  46           3HA      GLY  46  11.086  -0.309   4.627
  262    H    ARG  47           H        ARG  47   9.298  -2.153   2.143
  263    HA   ARG  47           HA       ARG  47   8.167   0.259   0.904
  264    HB3  ARG  47           2HB      ARG  47  10.364   0.281  -0.089
  265    HG3  ARG  47           2HG      ARG  47   9.774  -2.541  -1.104
  266    HD3  ARG  47           2HD      ARG  47  11.025  -1.181  -2.750
  267    HE   ARG  47           HE       ARG  47  12.291   0.114  -0.721
  268   HH11  ARG  47          1HH1      ARG  47  13.678  -2.005  -3.235
  269   HH12  ARG  47          2HH1      ARG  47  15.231  -1.224  -3.084
  270   HH21  ARG  47          1HH2      ARG  47  14.208   1.083  -0.715
  271   HH22  ARG  47          2HH2      ARG  47  15.525   0.523  -1.736
  272    H    LEU  48           H        LEU  48   6.882  -0.440  -1.186
  273    HA   LEU  48           HA       LEU  48   5.321  -2.855  -0.325
  274    HB3  LEU  48           2HB      LEU  48   3.699  -0.837  -1.618
  275    HG   LEU  48           HG       LEU  48   3.869  -1.729   1.285
  276   HD11  LEU  48          1HD1      LEU  48   2.956   0.543   1.135
  277   HD12  LEU  48          2HD1      LEU  48   1.663  -0.605   1.526
  278   HD13  LEU  48          3HD1      LEU  48   1.824   0.025  -0.131
  279   HD21  LEU  48          3HD2      LEU  48   1.918  -2.437  -0.967
  280   HD22  LEU  48          1HD2      LEU  48   1.715  -2.902   0.734
  281   HD23  LEU  48          2HD2      LEU  48   3.079  -3.534  -0.188
  282    H    THR  49           H        THR  49   4.163  -4.017  -1.736
  283    HA   THR  49           HA       THR  49   4.220  -3.488  -4.656
  284    HB   THR  49           HB       THR  49   4.959  -6.060  -3.232
  285    HG1  THR  49           1HG      THR  49   6.702  -5.808  -4.394
  286   HG21  THR  49          3HG2      THR  49   3.796  -5.809  -6.039
  287   HG22  THR  49          1HG2      THR  49   3.270  -6.872  -4.720
  288   HG23  THR  49          2HG2      THR  49   4.817  -7.169  -5.514
  289    H    VAL  50           H        VAL  50   2.184  -3.413  -5.349
  290    HA   VAL  50           HA       VAL  50   0.036  -4.987  -4.019
  291    HB   VAL  50           HB       VAL  50   0.077  -2.834  -2.855
  292   HG11  VAL  50          1HG1      VAL  50   1.063  -1.393  -4.618
  293   HG12  VAL  50          2HG1      VAL  50  -0.458  -1.480  -5.528
  294   HG13  VAL  50          3HG1      VAL  50  -0.422  -0.716  -3.933
  295   HG21  VAL  50          3HG2      VAL  50  -2.255  -2.119  -3.203
  296   HG22  VAL  50          1HG2      VAL  50  -2.338  -3.052  -4.701
  297   HG23  VAL  50          2HG2      VAL  50  -2.110  -3.887  -3.150
  298    H    THR  51           H        THR  51  -1.535  -5.677  -5.369
  299    HA   THR  51           HA       THR  51  -1.490  -4.807  -8.235
  300    HB   THR  51           HB       THR  51  -2.324  -7.462  -6.987
  301    HG1  THR  51           1HG      THR  51  -0.087  -7.194  -7.214
  302   HG21  THR  51          3HG2      THR  51  -3.737  -6.873  -8.985
  303   HG22  THR  51          1HG2      THR  51  -2.636  -8.210  -9.323
  304   HG23  THR  51          2HG2      THR  51  -2.271  -6.583  -9.928
  305    H    TYR  52           H        TYR  52  -2.974  -3.254  -8.382
  306    HA   TYR  52           HA       TYR  52  -5.753  -3.861  -7.504
  307    HB3  TYR  52           2HB      TYR  52  -4.720  -2.296  -5.892
  308    HD1  TYR  52           2HD      TYR  52  -5.839   0.045  -8.607
  309    HD2  TYR  52           1HD      TYR  52  -2.693  -1.046  -5.879
  310    HE1  TYR  52           2HE      TYR  52  -4.696   2.199  -9.068
  311    HE2  TYR  52           1HE      TYR  52  -1.552   1.124  -6.321
  312    HH   TYR  52           HH       TYR  52  -1.645   3.146  -7.404
  313    H    ASP  53           H        ASP  53  -7.434  -2.693  -8.658
  314    HA   ASP  53           HA       ASP  53  -6.858  -2.457 -11.541
  315    HB3  ASP  53           2HB      ASP  53  -9.333  -2.796  -9.846
  316    HA   PRO  54           HA       PRO  54  -6.739   2.059 -10.867
  317    HB3  PRO  54           2HB      PRO  54  -5.695   2.947 -12.750
  318    HG3  PRO  54           2HG      PRO  54  -4.367   1.056 -12.131
  319    HD3  PRO  54           2HD      PRO  54  -5.302  -1.110 -12.091
  320    H    LYS  55           H        LYS  55  -9.240   0.215 -12.139
  321    HA   LYS  55           HA       LYS  55 -10.857   2.540 -13.165
  322    HB3  LYS  55           2HB      LYS  55 -12.131   0.919 -14.443
  323    HG3  LYS  55           2HG      LYS  55 -10.493  -0.126 -15.942
  324    HD3  LYS  55           2HD      LYS  55  -9.584   2.678 -15.176
  325    HE3  LYS  55           2HE      LYS  55  -9.258   1.000 -17.710
  326    HZ1  LYS  55           3HZ      LYS  55  -8.444   3.807 -17.186
  327    HZ2  LYS  55           1HZ      LYS  55  -9.622   3.315 -18.224
  328    HZ3  LYS  55           2HZ      LYS  55  -8.083   2.941 -18.553
  329    H    GLN  56           H        GLN  56 -11.015  -0.394 -11.070
  330    HA   GLN  56           HA       GLN  56 -13.368   0.604  -9.637
  331    HB3  GLN  56           2HB      GLN  56 -12.407  -1.021  -7.830
  332    HG3  GLN  56           2HG      GLN  56 -12.975  -3.071  -9.197
  333   HE21  GLN  56          1HE2      GLN  56 -15.134  -3.847  -9.090
  334   HE22  GLN  56          2HE2      GLN  56 -16.371  -2.863  -8.319
  335    H    VAL  57           H        VAL  57  -9.783   1.111  -9.247
  336    HA   VAL  57           HA       VAL  57 -10.406   3.083  -7.093
  337    HB   VAL  57           HB       VAL  57  -8.887   2.079  -5.500
  338   HG11  VAL  57          1HG1      VAL  57 -11.001   0.037  -6.284
  339   HG12  VAL  57          2HG1      VAL  57 -10.193   0.183  -4.730
  340   HG13  VAL  57          3HG1      VAL  57 -11.260   1.487  -5.284
  341   HG21  VAL  57          3HG2      VAL  57  -8.009  -0.197  -5.696
  342   HG22  VAL  57          1HG2      VAL  57  -8.705  -0.366  -7.318
  343   HG23  VAL  57          2HG2      VAL  57  -7.396   0.801  -7.016
  344    H    SER  58           H        SER  58  -8.255   3.975  -6.121
  345    HA   SER  58           HA       SER  58  -5.998   3.962  -8.052
  346    HB3  SER  58           2HB      SER  58  -7.498   6.054  -8.363
  347    HG   SER  58           HG       SER  58  -6.682   7.735  -6.838
  348    H    GLU  59           H        GLU  59  -4.175   5.522  -6.781
  349    HA   GLU  59           HA       GLU  59  -3.226   4.284  -4.481
  350    HB3  GLU  59           2HB      GLU  59  -1.885   5.854  -5.772
  351    HG3  GLU  59           2HG      GLU  59  -3.752   7.993  -4.662
  352    H    ILE  60           H        ILE  60  -5.983   6.410  -4.651
  353    HA   ILE  60           HA       ILE  60  -6.216   7.323  -1.946
  354    HB   ILE  60           HB       ILE  60  -8.161   6.672  -4.179
  355   HG13  ILE  60          2HG1      ILE  60  -6.654   8.706  -4.234
  356   HG21  ILE  60          1HG2      ILE  60 -10.005   7.651  -2.817
  357   HG22  ILE  60          2HG2      ILE  60  -9.438   6.113  -2.203
  358   HG23  ILE  60          3HG2      ILE  60  -8.935   7.623  -1.393
  359   HD11  ILE  60          3HD1      ILE  60  -8.877   8.715  -5.404
  360   HD12  ILE  60          1HD1      ILE  60  -9.567   9.530  -3.977
  361   HD13  ILE  60          2HD1      ILE  60  -8.280  10.310  -4.908
  362    H    THR  61           H        THR  61  -7.257   4.191  -3.379
  363    HA   THR  61           HA       THR  61  -8.631   3.270  -1.045
  364    HB   THR  61           HB       THR  61  -7.509   1.952  -3.520
  365    HG1  THR  61           1HG      THR  61  -9.458   3.036  -3.605
  366   HG21  THR  61          3HG2      THR  61  -8.611  -0.169  -2.875
  367   HG22  THR  61          1HG2      THR  61  -8.847   0.453  -1.224
  368   HG23  THR  61          2HG2      THR  61  -7.208   0.163  -1.861
  369    H    ILE  62           H        ILE  62  -5.223   3.089  -1.878
  370    HA   ILE  62           HA       ILE  62  -4.665   1.530   0.608
  371    HB   ILE  62           HB       ILE  62  -3.749   0.795  -1.578
  372   HG13  ILE  62          2HG1      ILE  62  -2.846   0.003   0.482
  373   HG21  ILE  62          1HG2      ILE  62  -1.878   1.897  -2.620
  374   HG22  ILE  62          2HG2      ILE  62  -3.242   2.996  -2.568
  375   HG23  ILE  62          3HG2      ILE  62  -1.908   3.207  -1.409
  376   HD11  ILE  62          3HD1      ILE  62  -1.510  -0.574  -1.588
  377   HD12  ILE  62          1HD1      ILE  62  -0.424   0.780  -1.199
  378   HD13  ILE  62          2HD1      ILE  62  -0.578  -0.579  -0.079
  379    H    GLN  63           H        GLN  63  -4.322   4.861  -0.605
  380    HA   GLN  63           HA       GLN  63  -2.794   5.849   1.605
  381    HB3  GLN  63           2HB      GLN  63  -5.080   7.285   0.184
  382    HG3  GLN  63           2HG      GLN  63  -2.550   8.286   1.575
  383   HE21  GLN  63          1HE2      GLN  63  -5.727   9.882   1.005
  384   HE22  GLN  63          2HE2      GLN  63  -5.027  11.209   0.096
  385    H    GLU  64           H        GLU  64  -6.335   5.342   1.230
  386    HA   GLU  64           HA       GLU  64  -7.080   6.022   3.899
  387    HB3  GLU  64           2HB      GLU  64  -9.160   4.643   3.270
  388    HG3  GLU  64           2HG      GLU  64  -9.928   6.114   1.469
  389    H    ARG  65           H        ARG  65  -4.955   3.692   3.276
  390    HA   ARG  65           HA       ARG  65  -5.661   2.288   5.806
  391    HB3  ARG  65           2HB      ARG  65  -4.112   1.053   3.486
  392    HG3  ARG  65           2HG      ARG  65  -3.542   0.003   5.620
  393    HD3  ARG  65           2HD      ARG  65  -5.345   0.450   7.114
  394    HE   ARG  65           HE       ARG  65  -7.157   0.127   5.139
  395   HH11  ARG  65          1HH1      ARG  65  -6.920  -1.583   8.246
  396   HH12  ARG  65          2HH1      ARG  65  -8.620  -1.967   8.200
  397   HH21  ARG  65          1HH2      ARG  65  -9.226  -0.353   5.201
  398   HH22  ARG  65          2HH2      ARG  65  -9.895  -1.408   6.442
  399    H    ILE  66           H        ILE  66  -2.959   3.321   3.638
  400    HA   ILE  66           HA       ILE  66  -0.916   3.020   5.673
  401    HB   ILE  66           HB       ILE  66  -0.974   4.607   3.075
  402   HG13  ILE  66          2HG1      ILE  66  -1.160   1.988   3.070
  403   HG21  ILE  66          1HG2      ILE  66   0.761   5.563   4.529
  404   HG22  ILE  66          2HG2      ILE  66   1.364   3.934   4.923
  405   HG23  ILE  66          3HG2      ILE  66   1.534   4.604   3.284
  406   HD11  ILE  66          3HD1      ILE  66   1.177   3.236   1.568
  407   HD12  ILE  66          1HD1      ILE  66   0.347   1.725   1.195
  408   HD13  ILE  66          2HD1      ILE  66  -0.540   3.253   1.061
  409    H    ALA  67           H        ALA  67  -2.764   5.940   4.638
  410    HA   ALA  67           HA       ALA  67  -1.365   7.666   6.499
  411    HB1  ALA  67           1HB      ALA  67  -2.460   8.485   4.429
  412    HB2  ALA  67           2HB      ALA  67  -4.050   8.034   5.096
  413    HB3  ALA  67           3HB      ALA  67  -3.078   9.292   5.880
  414    H    ALA  68           H        ALA  68  -4.120   5.499   6.691
  415    HA   ALA  68           HA       ALA  68  -5.207   6.452   9.201
  416    HB1  ALA  68           1HB      ALA  68  -6.525   5.252   7.451
  417    HB2  ALA  68           2HB      ALA  68  -5.574   3.780   7.761
  418    HB3  ALA  68           3HB      ALA  68  -6.602   4.450   9.028
  419    H    LEU  69           H        LEU  69  -2.746   3.970   8.367
  420    HA   LEU  69           HA       LEU  69  -2.309   3.298  11.201
  421    HB3  LEU  69           2HB      LEU  69  -0.077   2.419  10.097
  422    HG   LEU  69           HG       LEU  69  -0.902   0.307   9.688
  423   HD11  LEU  69          1HD1      LEU  69  -2.127  -0.267  11.632
  424   HD12  LEU  69          2HD1      LEU  69  -2.890   1.312  11.725
  425   HD13  LEU  69          3HD1      LEU  69  -1.148   1.142  12.064
  426   HD21  LEU  69          3HD2      LEU  69  -3.713   1.430   9.361
  427   HD22  LEU  69          1HD2      LEU  69  -3.259  -0.287   9.330
  428   HD23  LEU  69          2HD2      LEU  69  -2.678   0.798   8.064
  429    H    GLY  70           H        GLY  70  -1.528   6.017   9.307
  430    HA2  GLY  70           2HA      GLY  70  -1.062   7.927  10.683
  431    HA3  GLY  70           3HA      GLY  70   0.172   7.004  11.557
  432    H    TYR  71           H        TYR  71   0.496   6.461   8.215
  433    HA   TYR  71           HA       TYR  71   2.853   8.308   8.147
  434    HB3  TYR  71           2HB      TYR  71   3.881   6.677   6.728
  435    HD1  TYR  71           1HD      TYR  71   4.938   6.702   9.070
  436    HD2  TYR  71           2HD      TYR  71   1.680   4.102   7.971
  437    HE1  TYR  71           1HE      TYR  71   5.411   5.270  11.057
  438    HE2  TYR  71           2HE      TYR  71   2.148   2.683   9.944
  439    HH   TYR  71           HH       TYR  71   3.397   2.422  11.855
  440    H    THR  72           H        THR  72   3.338   7.934   5.351
  441    HA   THR  72           HA       THR  72   0.917   8.598   3.841
  442    HB   THR  72           HB       THR  72   1.994  10.331   2.479
  443    HG1  THR  72           1HG      THR  72   4.017  11.157   3.190
  444   HG21  THR  72          3HG2      THR  72   0.769  11.100   4.507
  445   HG22  THR  72          1HG2      THR  72   2.058  12.198   3.996
  446   HG23  THR  72          2HG2      THR  72   2.309  11.133   5.395
  447    H    LEU  73           H        LEU  73   1.988   8.697   1.326
  448    HA   LEU  73           HA       LEU  73   4.015   6.590   1.005
  449    HB3  LEU  73           2HB      LEU  73   1.814   5.407   0.955
  450    HG   LEU  73           HG       LEU  73   1.297   7.152  -1.501
  451   HD11  LEU  73          1HD1      LEU  73  -0.380   5.470  -2.205
  452   HD12  LEU  73          2HD1      LEU  73   0.202   4.370  -0.936
  453   HD13  LEU  73          3HD1      LEU  73   1.271   4.842  -2.274
  454   HD21  LEU  73          3HD2      LEU  73   0.110   7.865   0.541
  455   HD22  LEU  73          1HD2      LEU  73  -0.508   6.214   0.779
  456   HD23  LEU  73          2HD2      LEU  73  -1.023   7.181  -0.621
  457    H    ALA  74           H        ALA  74   4.653   6.339  -1.320
  458    HA   ALA  74           HA       ALA  74   4.173   8.726  -3.040
  459    HB1  ALA  74           1HB      ALA  74   6.583   8.988  -3.434
  460    HB2  ALA  74           2HB      ALA  74   6.194   9.237  -1.722
  461    HB3  ALA  74           3HB      ALA  74   6.938   7.723  -2.248
  462    H    GLU  75           H        GLU  75   3.167   7.754  -4.668
  463    HA   GLU  75           HA       GLU  75   4.395   5.421  -6.078
  464    HB3  GLU  75           2HB      GLU  75   1.477   6.301  -6.024
  465    HG3  GLU  75           2HG      GLU  75   2.369   3.468  -6.483
  466    HA   PRO  76           HA       PRO  76   4.469   9.307  -8.730
  467    HB3  PRO  76           2HB      PRO  76   6.554   9.912  -8.026
  468    HG3  PRO  76           2HG      PRO  76   8.153   8.275  -7.357
  469    HD3  PRO  76           2HD      PRO  76   6.245   7.812  -6.084
  Start of MODEL   11
    1    H2   PRO   6           2H       PRO   6  -5.748  -2.999 -18.047
    2    HA   PRO   6           HA       PRO   6  -7.517  -5.001 -16.824
    3    HB3  PRO   6           2HB      PRO   6  -6.047  -6.703 -17.528
    4    HG3  PRO   6           2HG      PRO   6  -6.795  -6.239 -19.700
    5    HD3  PRO   6           2HD      PRO   6  -8.059  -4.380 -19.233
    6    H    LEU   7           H        LEU   7  -6.545  -5.954 -14.813
    7    HA   LEU   7           HA       LEU   7  -5.190  -4.010 -13.169
    8    HB3  LEU   7           2HB      LEU   7  -6.884  -5.700 -12.360
    9    HG   LEU   7           HG       LEU   7  -4.512  -7.620 -12.279
   10   HD11  LEU   7          1HD1      LEU   7  -6.028  -7.502 -10.301
   11   HD12  LEU   7          2HD1      LEU   7  -6.065  -9.082 -11.103
   12   HD13  LEU   7          3HD1      LEU   7  -7.397  -7.930 -11.340
   13   HD21  LEU   7          3HD2      LEU   7  -5.897  -9.201 -13.593
   14   HD22  LEU   7          1HD2      LEU   7  -5.477  -7.780 -14.544
   15   HD23  LEU   7          2HD2      LEU   7  -7.106  -7.928 -13.851
   16    H    LYS   8           H        LYS   8  -3.166  -4.195 -12.182
   17    HA   LYS   8           HA       LYS   8  -1.141  -6.018 -13.261
   18    HB3  LYS   8           2HB      LYS   8  -1.364  -4.391 -15.105
   19    HG3  LYS   8           2HG      LYS   8  -0.482  -2.310 -13.045
   20    HD3  LYS   8           2HD      LYS   8  -0.968  -2.029 -16.032
   21    HE3  LYS   8           2HE      LYS   8  -0.047  -0.131 -13.827
   22    HZ1  LYS   8           3HZ      LYS   8  -0.069   0.273 -16.759
   23    HZ2  LYS   8           1HZ      LYS   8   1.287   0.175 -15.816
   24    HZ3  LYS   8           2HZ      LYS   8   0.263   1.451 -15.663
   25    H    THR   9           H        THR   9   0.875  -5.925 -12.220
   26    HA   THR   9           HA       THR   9   0.801  -5.014  -9.469
   27    HB   THR   9           HB       THR   9   1.914  -7.116 -10.310
   28    HG1  THR   9           1HG      THR   9   3.173  -7.004  -8.574
   29   HG21  THR   9          3HG2      THR   9   4.286  -5.257 -10.800
   30   HG22  THR   9          1HG2      THR   9   3.354  -6.019 -12.102
   31   HG23  THR   9          2HG2      THR   9   4.241  -7.024 -10.944
   32    H    GLN  10           H        GLN  10   2.177  -3.609  -8.456
   33    HA   GLN  10           HA       GLN  10   3.715  -1.569  -9.868
   34    HB3  GLN  10           2HB      GLN  10   1.061  -1.041  -8.458
   35    HG3  GLN  10           2HG      GLN  10   2.637   0.707  -7.628
   36   HE21  GLN  10          1HE2      GLN  10   2.644   3.331  -8.930
   37   HE22  GLN  10          2HE2      GLN  10   3.950   3.257 -10.098
   38    H    GLN  11           H        GLN  11   5.309  -0.831  -8.488
   39    HA   GLN  11           HA       GLN  11   5.102  -1.551  -5.604
   40    HB3  GLN  11           2HB      GLN  11   7.607  -1.041  -7.256
   41    HG3  GLN  11           2HG      GLN  11   7.175  -1.989  -4.383
   42   HE21  GLN  11          1HE2      GLN  11   8.288  -4.060  -4.904
   43   HE22  GLN  11          2HE2      GLN  11  10.054  -4.006  -4.979
   44    H    MET  12           H        MET  12   5.515  -0.009  -4.085
   45    HA   MET  12           HA       MET  12   5.946   2.825  -4.885
   46    HB3  MET  12           2HB      MET  12   3.516   2.383  -4.461
   47    HG3  MET  12           2HG      MET  12   4.398   1.877  -1.589
   48    HE1  MET  12           3HE      MET  12   1.481  -0.061  -3.118
   49    HE2  MET  12           1HE      MET  12   0.110   1.065  -3.026
   50    HE3  MET  12           2HE      MET  12   1.429   1.366  -4.177
   51    H    GLN  13           H        GLN  13   6.641   4.113  -2.998
   52    HA   GLN  13           HA       GLN  13   8.155   2.582  -0.925
   53    HB3  GLN  13           2HB      GLN  13   9.392   4.685  -0.562
   54    HG3  GLN  13           2HG      GLN  13   9.515   3.694  -3.437
   55   HE21  GLN  13          1HE2      GLN  13  11.869   4.710  -0.855
   56   HE22  GLN  13          2HE2      GLN  13  12.649   5.907  -1.897
   57    H    VAL  14           H        VAL  14   8.138   4.214   1.224
   58    HA   VAL  14           HA       VAL  14   5.612   5.384   1.807
   59    HB   VAL  14           HB       VAL  14   4.554   3.291   1.893
   60   HG11  VAL  14          1HG1      VAL  14   6.447   1.747   1.870
   61   HG12  VAL  14          2HG1      VAL  14   6.817   2.148   3.565
   62   HG13  VAL  14          3HG1      VAL  14   5.300   1.327   3.138
   63   HG21  VAL  14          3HG2      VAL  14   5.232   3.844   4.785
   64   HG22  VAL  14          1HG2      VAL  14   4.038   4.733   3.813
   65   HG23  VAL  14          2HG2      VAL  14   3.809   3.010   4.141
   66    H    GLY  15           H        GLY  15   5.747   6.646   3.452
   67    HA2  GLY  15           2HA      GLY  15   8.293   6.870   4.966
   68    HA3  GLY  15           3HA      GLY  15   6.980   8.070   4.878
   69    H    GLY  16           H        GLY  16   8.433   6.558   7.116
   70    HA2  GLY  16           2HA      GLY  16   7.801   6.187   9.323
   71    HA3  GLY  16           3HA      GLY  16   6.094   6.184   8.840
   72    H    MET  17           H        MET  17   6.016   4.010   6.978
   73    HA   MET  17           HA       MET  17   5.961   1.812   8.856
   74    HB3  MET  17           2HB      MET  17   5.791   1.680   5.829
   75    HG3  MET  17           2HG      MET  17   4.296  -0.059   7.792
   76    HE1  MET  17           3HE      MET  17   5.901  -1.351   3.660
   77    HE2  MET  17           1HE      MET  17   6.632  -0.088   4.668
   78    HE3  MET  17           2HE      MET  17   6.645  -1.775   5.212
   79    H    ARG  18           H        ARG  18   7.753   0.875   9.632
   80    HA   ARG  18           HA       ARG  18   9.727  -0.434   8.081
   81    HB3  ARG  18           2HB      ARG  18  11.233   1.743   9.409
   82    HG3  ARG  18           2HG      ARG  18  11.167   0.528   6.614
   83    HD3  ARG  18           2HD      ARG  18  11.809   2.776   6.193
   84    HE   ARG  18           HE       ARG  18  13.962   2.714   8.247
   85   HH11  ARG  18          1HH1      ARG  18  11.010   4.381   7.090
   86   HH12  ARG  18          2HH1      ARG  18  11.333   5.753   8.122
   87   HH21  ARG  18          1HH2      ARG  18  14.193   4.442   9.576
   88   HH22  ARG  18          2HH2      ARG  18  13.124   5.816   9.448
   89    H    CYS  19           H        CYS  19   8.516   0.358  11.168
   90    HA   CYS  19           HA       CYS  19  10.630  -1.003  12.694
   91    HB3  CYS  19           2HB      CYS  19   8.813  -0.706  14.500
   92    HG   CYS  19           HG       CYS  19   9.810   1.889  12.645
   93    H    ALA  20           H        ALA  20  10.005  -2.878  14.125
   94    HA   ALA  20           HA       ALA  20   9.424  -5.119  12.471
   95    HB1  ALA  20           1HB      ALA  20   9.425  -4.882  15.517
   96    HB2  ALA  20           2HB      ALA  20   9.553  -6.389  14.592
   97    HB3  ALA  20           3HB      ALA  20  10.854  -5.183  14.499
   98    H    ALA  21           H        ALA  21   7.678  -6.465  12.249
   99    HA   ALA  21           HA       ALA  21   5.564  -7.234  12.184
  100    HB1  ALA  21           1HB      ALA  21   5.283  -6.042  14.971
  101    HB2  ALA  21           2HB      ALA  21   4.337  -7.369  14.270
  102    HB3  ALA  21           3HB      ALA  21   6.061  -7.592  14.587
  103    H    CYS  22           H        CYS  22   6.041  -4.207  11.484
  104    HA   CYS  22           HA       CYS  22   3.390  -3.054  11.874
  105    HB3  CYS  22           2HB      CYS  22   4.455  -1.137  10.582
  106    HG   CYS  22           HG       CYS  22   6.092  -2.491  13.147
  107    H    ALA  23           H        ALA  23   4.724  -4.960   9.238
  108    HA   ALA  23           HA       ALA  23   2.997  -3.975   7.165
  109    HB1  ALA  23           1HB      ALA  23   4.017  -6.816   7.658
  110    HB2  ALA  23           2HB      ALA  23   3.356  -6.198   6.143
  111    HB3  ALA  23           3HB      ALA  23   4.890  -5.553   6.762
  112    H    SER  24           H        SER  24   2.369  -6.093   9.954
  113    HA   SER  24           HA       SER  24   0.068  -7.449   9.167
  114    HB3  SER  24           2HB      SER  24  -0.444  -7.628  11.531
  115    HG   SER  24           HG       SER  24   1.266  -8.784  11.832
  116    H    SER  25           H        SER  25   0.265  -4.089  10.369
  117    HA   SER  25           HA       SER  25  -2.588  -3.699  10.599
  118    HB3  SER  25           2HB      SER  25  -2.064  -1.552  11.306
  119    HG   SER  25           HG       SER  25   0.139  -1.723  12.344
  120    H    ILE  26           H        ILE  26  -0.530  -3.821   7.895
  121    HA   ILE  26           HA       ILE  26  -2.562  -2.518   6.110
  122    HB   ILE  26           HB       ILE  26   0.343  -3.330   5.704
  123   HG13  ILE  26          2HG1      ILE  26  -1.229  -0.747   5.432
  124   HG21  ILE  26          1HG2      ILE  26   0.121  -2.895   3.307
  125   HG22  ILE  26          2HG2      ILE  26  -0.826  -4.287   3.775
  126   HG23  ILE  26          3HG2      ILE  26  -1.645  -2.730   3.479
  127   HD11  ILE  26          3HD1      ILE  26   1.546  -1.342   6.564
  128   HD12  ILE  26          1HD1      ILE  26   0.748   0.242   6.527
  129   HD13  ILE  26          2HD1      ILE  26   0.091  -1.063   7.540
  130    H    GLU  27           H        GLU  27  -0.820  -5.643   6.638
  131    HA   GLU  27           HA       GLU  27  -2.275  -6.947   4.562
  132    HB3  GLU  27           2HB      GLU  27  -1.340  -9.054   5.547
  133    HG3  GLU  27           2HG      GLU  27   0.776  -6.874   5.373
  134    H    ARG  28           H        ARG  28  -3.127  -6.568   8.015
  135    HA   ARG  28           HA       ARG  28  -5.418  -8.374   7.749
  136    HB3  ARG  28           2HB      ARG  28  -5.068  -6.310   9.939
  137    HG3  ARG  28           2HG      ARG  28  -6.247  -9.126   9.783
  138    HD3  ARG  28           2HD      ARG  28  -6.201  -7.246  12.170
  139    HE   ARG  28           HE       ARG  28  -7.826  -9.569  11.491
  140   HH11  ARG  28          1HH1      ARG  28  -6.636  -7.711  14.308
  141   HH12  ARG  28          2HH1      ARG  28  -8.002  -8.254  15.253
  142   HH21  ARG  28          1HH2      ARG  28  -9.391 -10.339  12.916
  143   HH22  ARG  28          2HH2      ARG  28  -9.340  -9.783  14.575
  144    H    ALA  29           H        ALA  29  -4.851  -5.325   6.446
  145    HA   ALA  29           HA       ALA  29  -7.781  -4.690   6.289
  146    HB1  ALA  29           1HB      ALA  29  -6.233  -2.914   7.084
  147    HB2  ALA  29           2HB      ALA  29  -5.380  -2.969   5.530
  148    HB3  ALA  29           3HB      ALA  29  -7.089  -2.484   5.592
  149    H    LEU  30           H        LEU  30  -4.886  -5.362   4.267
  150    HA   LEU  30           HA       LEU  30  -5.918  -4.574   1.848
  151    HB3  LEU  30           2HB      LEU  30  -3.906  -6.811   2.332
  152    HG   LEU  30           HG       LEU  30  -4.651  -5.160  -0.072
  153   HD11  LEU  30          1HD1      LEU  30  -2.349  -5.022  -0.898
  154   HD12  LEU  30          2HD1      LEU  30  -1.734  -5.695   0.633
  155   HD13  LEU  30          3HD1      LEU  30  -2.525  -4.103   0.600
  156   HD21  LEU  30          3HD2      LEU  30  -3.131  -7.795   0.230
  157   HD22  LEU  30          1HD2      LEU  30  -3.701  -7.084  -1.293
  158   HD23  LEU  30          2HD2      LEU  30  -4.868  -7.645  -0.091
  159    H    GLU  31           H        GLU  31  -6.589  -7.748   3.288
  160    HA   GLU  31           HA       GLU  31  -7.906  -8.723   0.866
  161    HB3  GLU  31           2HB      GLU  31  -6.863 -10.339   2.247
  162    HG3  GLU  31           2HG      GLU  31  -8.805  -9.600   4.477
  163    H    ARG  32           H        ARG  32  -8.814  -6.517   3.265
  164    HA   ARG  32           HA       ARG  32 -11.701  -6.976   2.877
  165    HB3  ARG  32           2HB      ARG  32 -12.057  -5.439   4.703
  166    HG3  ARG  32           2HG      ARG  32  -9.712  -7.200   5.568
  167    HD3  ARG  32           2HD      ARG  32 -12.070  -5.999   7.076
  168    HE   ARG  32           HE       ARG  32 -10.588  -8.199   7.893
  169   HH11  ARG  32          1HH1      ARG  32 -11.299  -4.967   9.198
  170   HH12  ARG  32          2HH1      ARG  32 -10.833  -5.422  10.804
  171   HH21  ARG  32          1HH2      ARG  32  -9.934  -8.678  10.032
  172   HH22  ARG  32          2HH2      ARG  32 -10.164  -7.464  11.274
  173    H    LEU  33           H        LEU  33  -9.102  -4.754   2.004
  174    HA   LEU  33           HA       LEU  33 -10.612  -2.469   1.165
  175    HB3  LEU  33           2HB      LEU  33  -8.636  -1.948  -0.242
  176    HG   LEU  33           HG       LEU  33  -7.623  -3.069   2.381
  177   HD11  LEU  33          1HD1      LEU  33  -5.828  -1.434   2.117
  178   HD12  LEU  33          2HD1      LEU  33  -6.520  -0.899   0.569
  179   HD13  LEU  33          3HD1      LEU  33  -5.876  -2.540   0.733
  180   HD21  LEU  33          3HD2      LEU  33  -7.887  -0.820   3.326
  181   HD22  LEU  33          1HD2      LEU  33  -9.451  -1.516   2.893
  182   HD23  LEU  33          2HD2      LEU  33  -8.707  -0.282   1.848
  183    H    LYS  34           H        LYS  34 -11.054  -1.718  -1.013
  184    HA   LYS  34           HA       LYS  34 -12.141  -3.852  -2.762
  185    HB3  LYS  34           2HB      LYS  34 -13.516  -1.888  -2.069
  186    HG3  LYS  34           2HG      LYS  34 -11.808  -0.338  -4.052
  187    HD3  LYS  34           2HD      LYS  34 -14.012   0.615  -2.186
  188    HE3  LYS  34           2HE      LYS  34 -12.166   2.005  -4.187
  189    HZ1  LYS  34           3HZ      LYS  34 -13.336   3.986  -3.641
  190    HZ2  LYS  34           1HZ      LYS  34 -14.360   3.193  -2.605
  191    HZ3  LYS  34           2HZ      LYS  34 -14.439   2.897  -4.213
  192    H    GLY  35           H        GLY  35 -11.635  -4.152  -4.935
  193    HA2  GLY  35           2HA      GLY  35 -10.765  -3.779  -7.015
  194    HA3  GLY  35           3HA      GLY  35 -10.001  -2.290  -6.420
  195    H    VAL  36           H        VAL  36  -8.878  -4.836  -4.506
  196    HA   VAL  36           HA       VAL  36  -6.334  -4.893  -6.075
  197    HB   VAL  36           HB       VAL  36  -5.904  -3.631  -4.170
  198   HG11  VAL  36          1HG1      VAL  36  -6.322  -4.272  -1.845
  199   HG12  VAL  36          2HG1      VAL  36  -7.834  -4.120  -2.737
  200   HG13  VAL  36          3HG1      VAL  36  -7.163  -5.732  -2.384
  201   HG21  VAL  36          3HG2      VAL  36  -4.940  -6.434  -3.454
  202   HG22  VAL  36          1HG2      VAL  36  -4.164  -5.334  -4.612
  203   HG23  VAL  36          2HG2      VAL  36  -4.252  -4.900  -2.902
  204    H    ALA  37           H        ALA  37  -5.352  -6.760  -6.505
  205    HA   ALA  37           HA       ALA  37  -6.956  -9.245  -6.010
  206    HB1  ALA  37           1HB      ALA  37  -6.880  -8.387  -8.302
  207    HB2  ALA  37           2HB      ALA  37  -5.098  -8.452  -8.281
  208    HB3  ALA  37           3HB      ALA  37  -6.045  -9.946  -8.191
  209    H    GLU  38           H        GLU  38  -3.637  -8.020  -5.665
  210    HA   GLU  38           HA       GLU  38  -2.889 -10.078  -3.933
  211    HB3  GLU  38           2HB      GLU  38  -2.726 -11.676  -5.662
  212    HG3  GLU  38           2HG      GLU  38  -0.958  -9.773  -7.246
  213    H    ALA  39           H        ALA  39  -0.758  -9.806  -2.985
  214    HA   ALA  39           HA       ALA  39   0.704  -7.334  -3.759
  215    HB1  ALA  39           1HB      ALA  39   0.120  -6.209  -1.650
  216    HB2  ALA  39           2HB      ALA  39  -1.347  -6.598  -2.553
  217    HB3  ALA  39           3HB      ALA  39  -0.873  -7.601  -1.163
  218    H    SER  40           H        SER  40   2.259  -6.744  -1.898
  219    HA   SER  40           HA       SER  40   3.000  -8.597   0.139
  220    HB3  SER  40           2HB      SER  40   5.428  -8.904  -0.694
  221    HG   SER  40           HG       SER  40   3.171 -10.258  -1.729
  222    H    VAL  41           H        VAL  41   3.901  -7.464   1.764
  223    HA   VAL  41           HA       VAL  41   4.671  -4.619   1.328
  224    HB   VAL  41           HB       VAL  41   4.264  -6.169   3.921
  225   HG11  VAL  41          1HG1      VAL  41   3.965  -3.868   4.895
  226   HG12  VAL  41          2HG1      VAL  41   5.591  -4.145   4.274
  227   HG13  VAL  41          3HG1      VAL  41   4.433  -3.183   3.328
  228   HG21  VAL  41          3HG2      VAL  41   2.270  -4.386   2.461
  229   HG22  VAL  41          1HG2      VAL  41   2.118  -6.138   2.712
  230   HG23  VAL  41          2HG2      VAL  41   2.061  -5.043   4.094
  231    H    THR  42           H        THR  42   6.750  -3.822   1.854
  232    HA   THR  42           HA       THR  42   8.794  -5.772   2.856
  233    HB   THR  42           HB       THR  42   9.426  -3.538   0.924
  234    HG1  THR  42           1HG      THR  42   9.651  -5.131  -0.597
  235   HG21  THR  42          3HG2      THR  42  11.519  -4.905   0.677
  236   HG22  THR  42          1HG2      THR  42  10.936  -5.997   1.942
  237   HG23  THR  42          2HG2      THR  42  11.302  -4.296   2.315
  238    H    VAL  43           H        VAL  43   8.334  -5.077   4.958
  239    HA   VAL  43           HA       VAL  43   8.682  -2.382   5.909
  240    HB   VAL  43           HB       VAL  43   8.714  -5.129   7.157
  241   HG11  VAL  43          1HG1      VAL  43   9.156  -2.572   8.740
  242   HG12  VAL  43          2HG1      VAL  43   8.833  -4.189   9.406
  243   HG13  VAL  43          3HG1      VAL  43  10.341  -3.886   8.552
  244   HG21  VAL  43          3HG2      VAL  43   6.566  -4.046   6.504
  245   HG22  VAL  43          1HG2      VAL  43   6.677  -4.214   8.266
  246   HG23  VAL  43          2HG2      VAL  43   6.963  -2.641   7.513
  247    H    ALA  44           H        ALA  44  11.034  -4.929   5.100
  248    HA   ALA  44           HA       ALA  44  13.265  -4.038   6.516
  249    HB1  ALA  44           1HB      ALA  44  13.139  -5.285   3.726
  250    HB2  ALA  44           2HB      ALA  44  14.547  -5.292   4.805
  251    HB3  ALA  44           3HB      ALA  44  13.077  -6.167   5.269
  252    H    THR  45           H        THR  45  11.889  -2.469   3.725
  253    HA   THR  45           HA       THR  45  14.089  -0.428   3.703
  254    HB   THR  45           HB       THR  45  13.671  -0.223   1.244
  255    HG1  THR  45           1HG      THR  45  12.699  -2.353   0.461
  256   HG21  THR  45          3HG2      THR  45  15.541  -1.633   2.219
  257   HG22  THR  45          1HG2      THR  45  15.014  -2.112   0.605
  258   HG23  THR  45          2HG2      THR  45  14.501  -3.052   2.026
  259    H    GLY  46           H        GLY  46  10.642  -1.032   3.721
  260    HA2  GLY  46           2HA      GLY  46   8.945   0.544   4.165
  261    HA3  GLY  46           3HA      GLY  46  10.073   1.887   3.843
  262    H    ARG  47           H        ARG  47   8.739  -0.985   2.183
  263    HA   ARG  47           HA       ARG  47   7.796   0.664  -0.078
  264    HB3  ARG  47           2HB      ARG  47   8.624  -1.016  -1.715
  265    HG3  ARG  47           2HG      ARG  47  10.909   0.238  -0.149
  266    HD3  ARG  47           2HD      ARG  47  10.681  -0.982  -2.925
  267    HE   ARG  47           HE       ARG  47  13.033   0.651  -2.063
  268   HH11  ARG  47          1HH1      ARG  47  10.662   0.085  -4.653
  269   HH12  ARG  47          2HH1      ARG  47  11.009   1.643  -5.375
  270   HH21  ARG  47          1HH2      ARG  47  13.627   2.323  -3.198
  271   HH22  ARG  47          2HH2      ARG  47  12.833   2.824  -4.679
  272    H    LEU  48           H        LEU  48   6.281  -0.510  -1.455
  273    HA   LEU  48           HA       LEU  48   5.014  -2.946  -0.315
  274    HB3  LEU  48           2HB      LEU  48   3.114  -0.819  -1.185
  275    HG   LEU  48           HG       LEU  48   3.202  -2.439   1.382
  276   HD11  LEU  48          1HD1      LEU  48   0.824  -1.681   1.544
  277   HD12  LEU  48          2HD1      LEU  48   1.050  -0.717   0.073
  278   HD13  LEU  48          3HD1      LEU  48   1.960  -0.321   1.551
  279   HD21  LEU  48          3HD2      LEU  48   1.640  -2.918  -1.210
  280   HD22  LEU  48          1HD2      LEU  48   1.257  -3.703   0.336
  281   HD23  LEU  48          2HD2      LEU  48   2.807  -4.015  -0.433
  282    H    THR  49           H        THR  49   3.999  -4.210  -1.916
  283    HA   THR  49           HA       THR  49   4.081  -3.238  -4.745
  284    HB   THR  49           HB       THR  49   4.897  -6.027  -3.846
  285    HG1  THR  49           1HG      THR  49   6.516  -4.646  -3.330
  286   HG21  THR  49          3HG2      THR  49   5.004  -4.627  -6.566
  287   HG22  THR  49          1HG2      THR  49   3.905  -5.952  -6.122
  288   HG23  THR  49          2HG2      THR  49   5.646  -6.245  -6.192
  289    H    VAL  50           H        VAL  50   2.247  -3.609  -5.824
  290    HA   VAL  50           HA       VAL  50   0.113  -5.314  -4.660
  291    HB   VAL  50           HB       VAL  50   0.101  -3.227  -3.364
  292   HG11  VAL  50          1HG1      VAL  50  -0.540  -1.078  -4.303
  293   HG12  VAL  50          2HG1      VAL  50   0.977  -1.623  -5.031
  294   HG13  VAL  50          3HG1      VAL  50  -0.544  -1.739  -5.942
  295   HG21  VAL  50          3HG2      VAL  50  -2.251  -2.675  -3.548
  296   HG22  VAL  50          1HG2      VAL  50  -2.345  -3.421  -5.157
  297   HG23  VAL  50          2HG2      VAL  50  -2.005  -4.425  -3.728
  298    H    THR  51           H        THR  51  -1.294  -6.065  -6.074
  299    HA   THR  51           HA       THR  51  -1.362  -5.087  -8.894
  300    HB   THR  51           HB       THR  51  -2.228  -7.734  -7.624
  301    HG1  THR  51           1HG      THR  51  -0.004  -7.532  -8.081
  302   HG21  THR  51          3HG2      THR  51  -2.368  -6.847 -10.577
  303   HG22  THR  51          1HG2      THR  51  -3.782  -7.026  -9.537
  304   HG23  THR  51          2HG2      THR  51  -2.809  -8.440  -9.922
  305    H    TYR  52           H        TYR  52  -2.913  -3.662  -9.244
  306    HA   TYR  52           HA       TYR  52  -5.641  -4.212  -8.223
  307    HB3  TYR  52           2HB      TYR  52  -4.736  -2.584  -6.678
  308    HD1  TYR  52           1HD      TYR  52  -5.152  -0.574  -9.906
  309    HD2  TYR  52           2HD      TYR  52  -2.937  -1.171  -6.248
  310    HE1  TYR  52           1HE      TYR  52  -3.895   1.491 -10.337
  311    HE2  TYR  52           2HE      TYR  52  -1.666   0.919  -6.695
  312    HH   TYR  52           HH       TYR  52  -1.503   2.853  -8.089
  313    H    ASP  53           H        ASP  53  -7.328  -2.902  -9.390
  314    HA   ASP  53           HA       ASP  53  -6.738  -2.802 -12.283
  315    HB3  ASP  53           2HB      ASP  53  -9.315  -2.800 -10.712
  316    HA   PRO  54           HA       PRO  54  -6.233   1.570 -11.395
  317    HB3  PRO  54           2HB      PRO  54  -4.386   1.354 -12.802
  318    HG3  PRO  54           2HG      PRO  54  -4.523   0.132 -14.865
  319    HD3  PRO  54           2HD      PRO  54  -5.086  -1.363 -13.130
  320    H    LYS  55           H        LYS  55  -8.905   0.326 -12.701
  321    HA   LYS  55           HA       LYS  55 -10.094   2.939 -13.595
  322    HB3  LYS  55           2HB      LYS  55 -10.713   0.141 -14.643
  323    HG3  LYS  55           2HG      LYS  55 -11.578   2.865 -15.711
  324    HD3  LYS  55           2HD      LYS  55 -13.091   1.499 -17.145
  325    HE3  LYS  55           2HE      LYS  55 -10.141   0.808 -17.515
  326    HZ1  LYS  55           3HZ      LYS  55 -12.354   0.899 -19.496
  327    HZ2  LYS  55           1HZ      LYS  55 -11.518  -0.450 -19.000
  328    HZ3  LYS  55           2HZ      LYS  55 -10.766   0.719 -19.852
  329    H    GLN  56           H        GLN  56 -10.607  -0.150 -11.902
  330    HA   GLN  56           HA       GLN  56 -12.985   0.699 -10.444
  331    HB3  GLN  56           2HB      GLN  56 -12.235  -1.048  -8.809
  332    HG3  GLN  56           2HG      GLN  56 -12.097  -2.077 -11.671
  333   HE21  GLN  56          1HE2      GLN  56 -14.511  -3.430  -9.670
  334   HE22  GLN  56          2HE2      GLN  56 -13.637  -4.924  -9.351
  335    H    VAL  57           H        VAL  57  -9.430   0.984  -9.829
  336    HA   VAL  57           HA       VAL  57  -9.999   2.953  -7.667
  337    HB   VAL  57           HB       VAL  57  -8.504   1.754  -6.098
  338   HG11  VAL  57          1HG1      VAL  57 -10.847   0.001  -6.874
  339   HG12  VAL  57          2HG1      VAL  57 -10.020   0.112  -5.311
  340   HG13  VAL  57          3HG1      VAL  57 -10.948   1.496  -5.913
  341   HG21  VAL  57          3HG2      VAL  57  -7.223   0.374  -7.743
  342   HG22  VAL  57          1HG2      VAL  57  -7.882  -0.568  -6.398
  343   HG23  VAL  57          2HG2      VAL  57  -8.670  -0.633  -7.982
  344    H    SER  58           H        SER  58  -7.731   3.456  -6.569
  345    HA   SER  58           HA       SER  58  -5.420   3.465  -8.354
  346    HB3  SER  58           2HB      SER  58  -6.613   5.607  -8.926
  347    HG   SER  58           HG       SER  58  -5.831   6.909  -6.641
  348    H    GLU  59           H        GLU  59  -3.792   5.099  -6.671
  349    HA   GLU  59           HA       GLU  59  -3.314   3.573  -4.338
  350    HB3  GLU  59           2HB      GLU  59  -1.536   4.857  -4.855
  351    HG3  GLU  59           2HG      GLU  59  -2.356   6.447  -6.485
  352    H    ILE  60           H        ILE  60  -5.856   5.953  -4.808
  353    HA   ILE  60           HA       ILE  60  -6.397   6.692  -2.133
  354    HB   ILE  60           HB       ILE  60  -8.017   6.434  -4.645
  355   HG13  ILE  60          2HG1      ILE  60  -8.120   8.783  -4.571
  356   HG21  ILE  60          1HG2      ILE  60  -9.705   5.736  -3.083
  357   HG22  ILE  60          2HG2      ILE  60  -9.297   7.046  -1.957
  358   HG23  ILE  60          3HG2      ILE  60 -10.013   7.413  -3.540
  359   HD11  ILE  60          3HD1      ILE  60  -8.678   9.358  -2.291
  360   HD12  ILE  60          1HD1      ILE  60  -7.150   8.696  -1.677
  361   HD13  ILE  60          2HD1      ILE  60  -7.150  10.149  -2.686
  362    H    THR  61           H        THR  61  -7.088   3.547  -3.625
  363    HA   THR  61           HA       THR  61  -8.872   2.619  -1.583
  364    HB   THR  61           HB       THR  61  -8.232   1.590  -3.882
  365    HG1  THR  61           1HG      THR  61  -9.011  -0.415  -3.004
  366   HG21  THR  61          3HG2      THR  61  -6.402  -0.123  -2.190
  367   HG22  THR  61          1HG2      THR  61  -5.840   1.092  -3.373
  368   HG23  THR  61          2HG2      THR  61  -6.795  -0.298  -3.909
  369    H    ILE  62           H        ILE  62  -5.438   3.005  -1.564
  370    HA   ILE  62           HA       ILE  62  -5.226   1.569   1.081
  371    HB   ILE  62           HB       ILE  62  -4.412   0.464  -1.039
  372   HG13  ILE  62          2HG1      ILE  62  -3.850  -0.282   1.227
  373   HG21  ILE  62          1HG2      ILE  62  -3.296   2.416  -2.079
  374   HG22  ILE  62          2HG2      ILE  62  -2.050   2.366  -0.810
  375   HG23  ILE  62          3HG2      ILE  62  -2.250   1.016  -1.955
  376   HD11  ILE  62          3HD1      ILE  62  -1.324  -0.432  -0.475
  377   HD12  ILE  62          1HD1      ILE  62  -1.823  -1.533   0.827
  378   HD13  ILE  62          2HD1      ILE  62  -2.748  -1.479  -0.688
  379    H    GLN  63           H        GLN  63  -4.606   4.521  -0.536
  380    HA   GLN  63           HA       GLN  63  -2.657   5.770   1.007
  381    HB3  GLN  63           2HB      GLN  63  -5.233   6.927  -0.152
  382    HG3  GLN  63           2HG      GLN  63  -2.581   8.380  -0.061
  383   HE21  GLN  63          1HE2      GLN  63  -3.849   8.875  -2.387
  384   HE22  GLN  63          2HE2      GLN  63  -4.921  10.235  -2.215
  385    H    GLU  64           H        GLU  64  -6.193   5.626   1.761
  386    HA   GLU  64           HA       GLU  64  -5.950   7.420   4.053
  387    HB3  GLU  64           2HB      GLU  64  -8.291   6.912   4.444
  388    HG3  GLU  64           2HG      GLU  64  -7.865   7.097   1.428
  389    H    ARG  65           H        ARG  65  -6.069   3.872   3.648
  390    HA   ARG  65           HA       ARG  65  -5.910   3.224   6.448
  391    HB3  ARG  65           2HB      ARG  65  -5.180   1.812   3.868
  392    HG3  ARG  65           2HG      ARG  65  -3.669   0.758   5.380
  393    HD3  ARG  65           2HD      ARG  65  -4.589   1.360   7.610
  394    HE   ARG  65           HE       ARG  65  -7.038   0.598   7.034
  395   HH11  ARG  65          1HH1      ARG  65  -4.763  -1.404   8.922
  396   HH12  ARG  65          2HH1      ARG  65  -6.013  -1.961   9.970
  397   HH21  ARG  65          1HH2      ARG  65  -8.618  -0.271   8.394
  398   HH22  ARG  65          2HH2      ARG  65  -8.154  -1.422   9.598
  399    H    ILE  66           H        ILE  66  -3.248   3.683   4.009
  400    HA   ILE  66           HA       ILE  66  -1.195   3.304   6.038
  401    HB   ILE  66           HB       ILE  66  -1.060   4.575   3.279
  402   HG13  ILE  66          2HG1      ILE  66  -1.676   2.032   3.620
  403   HG21  ILE  66          1HG2      ILE  66   1.231   3.656   5.095
  404   HG22  ILE  66          2HG2      ILE  66   1.422   4.252   3.444
  405   HG23  ILE  66          3HG2      ILE  66   0.866   5.353   4.688
  406   HD11  ILE  66          3HD1      ILE  66   0.765   2.672   1.929
  407   HD12  ILE  66          1HD1      ILE  66  -0.264   1.238   1.817
  408   HD13  ILE  66          2HD1      ILE  66  -0.949   2.823   1.439
  409    H    ALA  67           H        ALA  67  -2.817   6.282   4.887
  410    HA   ALA  67           HA       ALA  67  -1.212   8.085   6.399
  411    HB1  ALA  67           1HB      ALA  67  -4.109   8.322   5.469
  412    HB2  ALA  67           2HB      ALA  67  -3.073   9.656   6.011
  413    HB3  ALA  67           3HB      ALA  67  -2.667   8.777   4.533
  414    H    ALA  68           H        ALA  68  -4.296   6.466   7.263
  415    HA   ALA  68           HA       ALA  68  -4.601   7.734   9.796
  416    HB1  ALA  68           1HB      ALA  68  -6.363   6.029  10.088
  417    HB2  ALA  68           2HB      ALA  68  -6.399   6.724   8.449
  418    HB3  ALA  68           3HB      ALA  68  -5.702   5.111   8.712
  419    H    LEU  69           H        LEU  69  -2.797   4.808   8.909
  420    HA   LEU  69           HA       LEU  69  -2.220   3.873  11.595
  421    HB3  LEU  69           2HB      LEU  69  -0.309   2.717  10.358
  422    HG   LEU  69           HG       LEU  69  -3.118   2.373   9.232
  423   HD11  LEU  69          1HD1      LEU  69  -1.396   1.539   7.674
  424   HD12  LEU  69          2HD1      LEU  69  -2.251   0.191   8.430
  425   HD13  LEU  69          3HD1      LEU  69  -0.628   0.631   8.995
  426   HD21  LEU  69          3HD2      LEU  69  -1.622   0.841  11.395
  427   HD22  LEU  69          1HD2      LEU  69  -3.195   0.387  10.694
  428   HD23  LEU  69          2HD2      LEU  69  -3.049   1.874  11.625
  429    H    GLY  70           H        GLY  70  -1.185   6.742  10.117
  430    HA2  GLY  70           2HA      GLY  70   0.166   8.377  11.197
  431    HA3  GLY  70           3HA      GLY  70   1.056   7.098  12.057
  432    H    TYR  71           H        TYR  71   0.784   6.058   8.936
  433    HA   TYR  71           HA       TYR  71   3.535   6.898   8.203
  434    HB3  TYR  71           2HB      TYR  71   3.370   4.970   6.672
  435    HD1  TYR  71           2HD      TYR  71   4.184   5.331   9.713
  436    HD2  TYR  71           1HD      TYR  71   1.595   2.576   7.636
  437    HE1  TYR  71           2HE      TYR  71   4.563   3.658  11.475
  438    HE2  TYR  71           1HE      TYR  71   1.982   0.879   9.417
  439    HH   TYR  71           HH       TYR  71   4.132   1.534  12.216
  440    H    THR  72           H        THR  72   3.657   6.977   5.560
  441    HA   THR  72           HA       THR  72   1.279   8.040   4.239
  442    HB   THR  72           HB       THR  72   2.635   9.963   3.207
  443    HG1  THR  72           1HG      THR  72   3.905   9.998   5.736
  444   HG21  THR  72          3HG2      THR  72   1.727  11.571   4.620
  445   HG22  THR  72          1HG2      THR  72   1.801  10.533   6.052
  446   HG23  THR  72          2HG2      THR  72   0.624  10.198   4.764
  447    H    LEU  73           H        LEU  73   1.159   7.013   2.343
  448    HA   LEU  73           HA       LEU  73   3.452   5.568   1.353
  449    HB3  LEU  73           2HB      LEU  73   0.895   4.987   1.287
  450    HG   LEU  73           HG       LEU  73   1.262   5.990  -1.569
  451   HD11  LEU  73          1HD1      LEU  73  -0.989   5.059  -1.885
  452   HD12  LEU  73          2HD1      LEU  73  -1.047   4.552  -0.189
  453   HD13  LEU  73          3HD1      LEU  73   0.107   3.807  -1.307
  454   HD21  LEU  73          3HD2      LEU  73  -0.708   7.401  -1.223
  455   HD22  LEU  73          1HD2      LEU  73   0.556   7.902  -0.098
  456   HD23  LEU  73          2HD2      LEU  73  -0.793   6.914   0.479
  457    H    ALA  74           H        ALA  74   4.303   5.560  -0.843
  458    HA   ALA  74           HA       ALA  74   4.088   8.158  -2.318
  459    HB1  ALA  74           1HB      ALA  74   6.136   8.198  -0.977
  460    HB2  ALA  74           2HB      ALA  74   6.628   6.630  -1.633
  461    HB3  ALA  74           3HB      ALA  74   6.536   8.049  -2.702
  462    H    GLU  75           H        GLU  75   2.483   6.918  -3.478
  463    HA   GLU  75           HA       GLU  75   3.625   5.199  -5.645
  464    HB3  GLU  75           2HB      GLU  75   0.683   5.457  -4.934
  465    HG3  GLU  75           2HG      GLU  75   0.758   3.023  -5.736
  466    HA   PRO  76           HA       PRO  76   3.456   9.436  -6.736
  467    HB3  PRO  76           2HB      PRO  76   5.665   9.211  -7.232
  468    HG3  PRO  76           2HG      PRO  76   6.493   7.307  -8.412
  469    HD3  PRO  76           2HD      PRO  76   5.287   6.505  -6.548
  Start of MODEL   12
    1    H2   PRO   6           2H       PRO   6  -9.171  -4.929 -16.028
    2    HA   PRO   6           HA       PRO   6  -6.951  -6.295 -16.985
    3    HB3  PRO   6           2HB      PRO   6  -5.853  -4.871 -18.462
    4    HG3  PRO   6           2HG      PRO   6  -7.928  -5.468 -19.557
    5    HD3  PRO   6           2HD      PRO   6 -10.032  -4.814 -18.547
    6    H    LEU   7           H        LEU   7  -5.514  -6.407 -15.377
    7    HA   LEU   7           HA       LEU   7  -5.442  -4.275 -13.309
    8    HB3  LEU   7           2HB      LEU   7  -6.833  -5.971 -12.456
    9    HG   LEU   7           HG       LEU   7  -5.772  -7.934 -13.940
   10   HD11  LEU   7          1HD1      LEU   7  -4.384  -8.378 -11.267
   11   HD12  LEU   7          2HD1      LEU   7  -3.542  -7.881 -12.747
   12   HD13  LEU   7          3HD1      LEU   7  -4.362  -9.446 -12.682
   13   HD21  LEU   7          3HD2      LEU   7  -6.841  -9.556 -12.418
   14   HD22  LEU   7          1HD2      LEU   7  -7.831  -8.108 -12.653
   15   HD23  LEU   7          2HD2      LEU   7  -6.910  -8.312 -11.146
   16    H    LYS   8           H        LYS   8  -3.500  -4.031 -12.193
   17    HA   LYS   8           HA       LYS   8  -1.068  -5.168 -13.436
   18    HB3  LYS   8           2HB      LYS   8  -1.645  -3.451 -15.013
   19    HG3  LYS   8           2HG      LYS   8  -1.962  -1.597 -12.622
   20    HD3  LYS   8           2HD      LYS   8  -2.190   0.205 -14.418
   21    HE3  LYS   8           2HE      LYS   8   0.541  -1.048 -13.857
   22    HZ1  LYS   8           3HZ      LYS   8  -0.107   1.729 -14.677
   23    HZ2  LYS   8           1HZ      LYS   8   0.760   0.645 -15.591
   24    HZ3  LYS   8           2HZ      LYS   8   1.344   1.200 -14.169
   25    H    THR   9           H        THR   9   0.851  -4.810 -12.443
   26    HA   THR   9           HA       THR   9   0.721  -4.384  -9.546
   27    HB   THR   9           HB       THR   9   3.059  -5.270 -11.284
   28    HG1  THR   9           1HG      THR   9   1.036  -6.726  -9.919
   29   HG21  THR   9          3HG2      THR   9   3.733  -6.470  -9.177
   30   HG22  THR   9          1HG2      THR   9   2.450  -5.607  -8.303
   31   HG23  THR   9          2HG2      THR   9   3.814  -4.717  -9.022
   32    H    GLN  10           H        GLN  10   2.077  -3.031  -8.350
   33    HA   GLN  10           HA       GLN  10   3.756  -0.968  -9.572
   34    HB3  GLN  10           2HB      GLN  10   1.114  -0.450  -8.135
   35    HG3  GLN  10           2HG      GLN  10   2.809   1.191  -7.285
   36   HE21  GLN  10          1HE2      GLN  10   4.418   2.747  -7.701
   37   HE22  GLN  10          2HE2      GLN  10   4.641   3.567  -9.253
   38    H    GLN  11           H        GLN  11   5.261  -0.252  -8.003
   39    HA   GLN  11           HA       GLN  11   4.847  -1.199  -5.210
   40    HB3  GLN  11           2HB      GLN  11   7.295  -0.660  -4.922
   41    HG3  GLN  11           2HG      GLN  11   7.022  -2.802  -7.045
   42   HE21  GLN  11          1HE2      GLN  11   7.650  -3.832  -3.865
   43   HE22  GLN  11          2HE2      GLN  11   9.404  -3.810  -3.911
   44    H    MET  12           H        MET  12   5.402   0.307  -3.505
   45    HA   MET  12           HA       MET  12   5.555   3.156  -4.267
   46    HB3  MET  12           2HB      MET  12   3.183   2.900  -4.132
   47    HG3  MET  12           2HG      MET  12   3.668   1.713  -1.375
   48    HE1  MET  12           3HE      MET  12   1.053   3.639  -3.680
   49    HE2  MET  12           1HE      MET  12   0.644   1.918  -3.882
   50    HE3  MET  12           2HE      MET  12  -0.459   3.013  -3.026
   51    H    GLN  13           H        GLN  13   6.270   4.520  -2.699
   52    HA   GLN  13           HA       GLN  13   7.883   3.252  -0.549
   53    HB3  GLN  13           2HB      GLN  13   9.222   4.686  -1.891
   54    HG3  GLN  13           2HG      GLN  13   7.191   6.896  -1.449
   55   HE21  GLN  13          1HE2      GLN  13   8.475   8.671  -0.839
   56   HE22  GLN  13          2HE2      GLN  13   9.944   9.137  -1.686
   57    H    VAL  14           H        VAL  14   7.765   4.173   1.570
   58    HA   VAL  14           HA       VAL  14   5.340   5.579   2.406
   59    HB   VAL  14           HB       VAL  14   4.296   3.458   2.120
   60   HG11  VAL  14          1HG1      VAL  14   5.009   1.366   3.152
   61   HG12  VAL  14          2HG1      VAL  14   6.226   1.946   2.015
   62   HG13  VAL  14          3HG1      VAL  14   6.487   2.129   3.762
   63   HG21  VAL  14          3HG2      VAL  14   4.937   3.668   5.089
   64   HG22  VAL  14          1HG2      VAL  14   3.805   4.729   4.227
   65   HG23  VAL  14          2HG2      VAL  14   3.486   2.985   4.333
   66    H    GLY  15           H        GLY  15   5.771   6.736   4.097
   67    HA2  GLY  15           2HA      GLY  15   8.451   6.608   5.237
   68    HA3  GLY  15           3HA      GLY  15   7.246   7.891   5.460
   69    H    GLY  16           H        GLY  16   7.883   4.518   6.407
   70    HA2  GLY  16           2HA      GLY  16   8.587   4.470   8.835
   71    HA3  GLY  16           3HA      GLY  16   7.017   5.151   9.223
   72    H    MET  17           H        MET  17   6.730   2.795   6.724
   73    HA   MET  17           HA       MET  17   5.342   0.913   8.393
   74    HB3  MET  17           2HB      MET  17   6.511   0.490   5.608
   75    HG3  MET  17           2HG      MET  17   4.168  -0.792   7.072
   76    HE1  MET  17           3HE      MET  17   6.281  -2.520   4.376
   77    HE2  MET  17           1HE      MET  17   5.407  -2.201   2.867
   78    HE3  MET  17           2HE      MET  17   6.301  -0.888   3.663
   79    H    ARG  18           H        ARG  18   8.755   1.215   7.698
   80    HA   ARG  18           HA       ARG  18   9.598  -1.450   8.092
   81    HB3  ARG  18           2HB      ARG  18  10.967   0.295   7.032
   82    HG3  ARG  18           2HG      ARG  18  11.241   1.405   9.858
   83    HD3  ARG  18           2HD      ARG  18  12.662   2.215   7.293
   84    HE   ARG  18           HE       ARG  18  13.447   3.487   9.791
   85   HH11  ARG  18          1HH1      ARG  18  11.345   3.967   6.954
   86   HH12  ARG  18          2HH1      ARG  18  10.921   5.585   7.514
   87   HH21  ARG  18          1HH2      ARG  18  12.920   5.544  10.293
   88   HH22  ARG  18          2HH2      ARG  18  11.768   6.431   9.312
   89    H    CYS  19           H        CYS  19   7.934  -0.102  10.444
   90    HA   CYS  19           HA       CYS  19   9.622  -0.694  12.777
   91    HB3  CYS  19           2HB      CYS  19   8.249   1.335  12.559
   92    HG   CYS  19           HG       CYS  19   5.666   1.490  12.678
   93    H    ALA  20           H        ALA  20   7.396  -1.555  14.470
   94    HA   ALA  20           HA       ALA  20   7.854  -4.353  14.248
   95    HB1  ALA  20           1HB      ALA  20   5.917  -2.805  16.017
   96    HB2  ALA  20           2HB      ALA  20   6.396  -4.499  16.230
   97    HB3  ALA  20           3HB      ALA  20   7.604  -3.215  16.385
   98    H    ALA  21           H        ALA  21   4.542  -2.905  14.307
   99    HA   ALA  21           HA       ALA  21   3.607  -5.449  13.097
  100    HB1  ALA  21           1HB      ALA  21   2.847  -4.776  15.360
  101    HB2  ALA  21           2HB      ALA  21   2.141  -3.289  14.676
  102    HB3  ALA  21           3HB      ALA  21   1.496  -4.873  14.211
  103    H    CYS  22           H        CYS  22   4.000  -2.219  11.991
  104    HA   CYS  22           HA       CYS  22   1.564  -1.823  10.624
  105    HB3  CYS  22           2HB      CYS  22   4.339  -0.797   9.843
  106    HG   CYS  22           HG       CYS  22   2.045  -0.644   8.162
  107    H    ALA  23           H        ALA  23   4.389  -3.652   9.469
  108    HA   ALA  23           HA       ALA  23   3.553  -4.228   6.822
  109    HB1  ALA  23           1HB      ALA  23   5.751  -4.795   7.802
  110    HB2  ALA  23           2HB      ALA  23   4.983  -5.937   8.922
  111    HB3  ALA  23           3HB      ALA  23   4.974  -6.262   7.181
  112    H    SER  24           H        SER  24   2.271  -5.456   9.911
  113    HA   SER  24           HA       SER  24   0.554  -7.484   8.595
  114    HB3  SER  24           2HB      SER  24  -0.321  -7.883  10.830
  115    HG   SER  24           HG       SER  24   1.933  -8.214  11.870
  116    H    SER  25           H        SER  25   0.165  -4.302  10.237
  117    HA   SER  25           HA       SER  25  -2.607  -4.094   9.847
  118    HB3  SER  25           2HB      SER  25  -2.432  -1.914  10.694
  119    HG   SER  25           HG       SER  25  -0.777  -2.069  12.313
  120    H    ILE  26           H        ILE  26  -0.102  -3.319   7.528
  121    HA   ILE  26           HA       ILE  26  -2.113  -2.361   5.553
  122    HB   ILE  26           HB       ILE  26   0.852  -3.015   5.399
  123   HG13  ILE  26          2HG1      ILE  26  -0.897  -0.599   4.730
  124   HG21  ILE  26          1HG2      ILE  26  -0.048  -4.120   3.378
  125   HG22  ILE  26          2HG2      ILE  26  -0.960  -2.647   2.968
  126   HG23  ILE  26          3HG2      ILE  26   0.821  -2.671   2.963
  127   HD11  ILE  26          3HD1      ILE  26   0.085  -0.733   7.048
  128   HD12  ILE  26          1HD1      ILE  26   1.695  -0.809   6.310
  129   HD13  ILE  26          2HD1      ILE  26   0.697   0.644   6.101
  130    H    GLU  27           H        GLU  27  -0.188  -5.418   5.908
  131    HA   GLU  27           HA       GLU  27  -1.424  -6.287   3.497
  132    HB3  GLU  27           2HB      GLU  27   0.084  -8.114   5.399
  133    HG3  GLU  27           2HG      GLU  27   1.345  -8.379   3.029
  134    H    ARG  28           H        ARG  28  -2.201  -7.004   6.915
  135    HA   ARG  28           HA       ARG  28  -4.049  -9.164   6.339
  136    HB3  ARG  28           2HB      ARG  28  -2.895  -8.637   8.549
  137    HG3  ARG  28           2HG      ARG  28  -5.406  -7.034   9.182
  138    HD3  ARG  28           2HD      ARG  28  -2.726  -7.531  10.534
  139    HE   ARG  28           HE       ARG  28  -4.458  -5.247  10.942
  140   HH11  ARG  28          1HH1      ARG  28  -2.476  -7.535  12.806
  141   HH12  ARG  28          2HH1      ARG  28  -2.113  -6.321  14.009
  142   HH21  ARG  28          1HH2      ARG  28  -3.940  -3.805  12.463
  143   HH22  ARG  28          2HH2      ARG  28  -2.877  -4.202  13.796
  144    H    ALA  29           H        ALA  29  -4.322  -5.675   6.200
  145    HA   ALA  29           HA       ALA  29  -7.288  -5.731   6.050
  146    HB1  ALA  29           1HB      ALA  29  -7.059  -3.318   6.111
  147    HB2  ALA  29           2HB      ALA  29  -6.051  -4.030   7.378
  148    HB3  ALA  29           3HB      ALA  29  -5.294  -3.425   5.887
  149    H    LEU  30           H        LEU  30  -4.462  -5.290   3.938
  150    HA   LEU  30           HA       LEU  30  -5.941  -4.486   1.630
  151    HB3  LEU  30           2HB      LEU  30  -3.144  -5.678   1.796
  152    HG   LEU  30           HG       LEU  30  -3.641  -5.197  -0.539
  153   HD11  LEU  30          1HD1      LEU  30  -4.253  -2.826  -1.236
  154   HD12  LEU  30          2HD1      LEU  30  -4.634  -2.488   0.462
  155   HD13  LEU  30          3HD1      LEU  30  -5.551  -3.717  -0.444
  156   HD21  LEU  30          3HD2      LEU  30  -2.119  -2.849   0.669
  157   HD22  LEU  30          1HD2      LEU  30  -1.967  -3.469  -0.985
  158   HD23  LEU  30          2HD2      LEU  30  -1.429  -4.466   0.385
  159    H    GLU  31           H        GLU  31  -6.092  -7.503   3.017
  160    HA   GLU  31           HA       GLU  31  -6.881  -8.759   0.433
  161    HB3  GLU  31           2HB      GLU  31  -5.767 -10.315   1.841
  162    HG3  GLU  31           2HG      GLU  31  -7.706  -9.468   3.997
  163    H    ARG  32           H        ARG  32  -8.247  -6.521   2.445
  164    HA   ARG  32           HA       ARG  32 -11.005  -7.408   1.711
  165    HB3  ARG  32           2HB      ARG  32 -11.792  -6.010   3.640
  166    HG3  ARG  32           2HG      ARG  32  -9.903  -8.279   4.394
  167    HD3  ARG  32           2HD      ARG  32 -12.322  -7.154   5.870
  168    HE   ARG  32           HE       ARG  32 -10.375  -9.244   6.788
  169   HH11  ARG  32          1HH1      ARG  32 -13.780  -8.488   6.093
  170   HH12  ARG  32          2HH1      ARG  32 -14.326  -9.945   6.878
  171   HH21  ARG  32          1HH2      ARG  32 -11.162 -11.059   7.787
  172   HH22  ARG  32          2HH2      ARG  32 -12.876 -11.328   7.902
  173    H    LEU  33           H        LEU  33  -9.055  -4.450   2.455
  174    HA   LEU  33           HA       LEU  33 -10.838  -2.797   0.818
  175    HB3  LEU  33           2HB      LEU  33  -9.947  -2.004   2.939
  176    HG   LEU  33           HG       LEU  33  -7.452  -2.905   2.358
  177   HD11  LEU  33          1HD1      LEU  33  -7.037  -1.326   0.496
  178   HD12  LEU  33          2HD1      LEU  33  -5.962  -0.992   1.859
  179   HD13  LEU  33          3HD1      LEU  33  -7.376   0.040   1.577
  180   HD21  LEU  33          3HD2      LEU  33  -8.255  -2.072   4.545
  181   HD22  LEU  33          1HD2      LEU  33  -8.041  -0.402   3.985
  182   HD23  LEU  33          2HD2      LEU  33  -6.630  -1.470   4.169
  183    H    LYS  34           H        LYS  34 -10.455  -1.781  -1.036
  184    HA   LYS  34           HA       LYS  34  -9.679  -1.256  -3.057
  185    HB3  LYS  34           2HB      LYS  34  -6.941  -2.420  -2.451
  186    HG3  LYS  34           2HG      LYS  34  -7.887  -0.039  -4.106
  187    HD3  LYS  34           2HD      LYS  34  -5.051  -1.019  -3.642
  188    HE3  LYS  34           2HE      LYS  34  -6.303   0.776  -5.760
  189    HZ1  LYS  34           3HZ      LYS  34  -4.496   2.027  -4.910
  190    HZ2  LYS  34           1HZ      LYS  34  -4.045   1.470  -6.344
  191    HZ3  LYS  34           2HZ      LYS  34  -3.408   0.784  -5.027
  192    H    GLY  35           H        GLY  35  -9.888  -2.196  -5.075
  193    HA2  GLY  35           2HA      GLY  35 -10.533  -4.970  -5.319
  194    HA3  GLY  35           3HA      GLY  35 -10.345  -3.822  -6.659
  195    H    VAL  36           H        VAL  36  -8.366  -5.553  -4.281
  196    HA   VAL  36           HA       VAL  36  -6.062  -5.576  -6.128
  197    HB   VAL  36           HB       VAL  36  -6.390  -5.833  -3.139
  198   HG11  VAL  36          1HG1      VAL  36  -3.963  -6.093  -2.861
  199   HG12  VAL  36          2HG1      VAL  36  -4.648  -7.521  -3.629
  200   HG13  VAL  36          3HG1      VAL  36  -3.760  -6.333  -4.608
  201   HG21  VAL  36          3HG2      VAL  36  -4.655  -4.023  -4.867
  202   HG22  VAL  36          1HG2      VAL  36  -6.278  -3.600  -4.305
  203   HG23  VAL  36          2HG2      VAL  36  -4.972  -3.855  -3.134
  204    H    ALA  37           H        ALA  37  -5.297  -7.269  -7.083
  205    HA   ALA  37           HA       ALA  37  -6.429  -9.973  -6.584
  206    HB1  ALA  37           1HB      ALA  37  -5.337 -10.501  -8.738
  207    HB2  ALA  37           2HB      ALA  37  -6.360  -9.059  -8.881
  208    HB3  ALA  37           3HB      ALA  37  -4.590  -8.892  -8.772
  209    H    GLU  38           H        GLU  38  -3.448  -8.210  -5.972
  210    HA   GLU  38           HA       GLU  38  -2.259 -10.415  -4.538
  211    HB3  GLU  38           2HB      GLU  38  -0.900  -9.530  -7.103
  212    HG3  GLU  38           2HG      GLU  38  -0.276 -11.788  -5.163
  213    H    ALA  39           H        ALA  39  -1.095  -9.508  -2.839
  214    HA   ALA  39           HA       ALA  39   0.533  -7.107  -3.350
  215    HB1  ALA  39           1HB      ALA  39  -0.508  -5.821  -1.513
  216    HB2  ALA  39           2HB      ALA  39  -1.643  -6.130  -2.834
  217    HB3  ALA  39           3HB      ALA  39  -1.751  -7.086  -1.335
  218    H    SER  40           H        SER  40   2.099  -6.635  -1.852
  219    HA   SER  40           HA       SER  40   2.710  -8.582   0.306
  220    HB3  SER  40           2HB      SER  40   4.772  -9.322  -0.678
  221    HG   SER  40           HG       SER  40   3.024 -10.495  -1.555
  222    H    VAL  41           H        VAL  41   4.258  -7.813   1.790
  223    HA   VAL  41           HA       VAL  41   5.077  -4.932   1.509
  224    HB   VAL  41           HB       VAL  41   5.126  -4.911   4.031
  225   HG11  VAL  41          1HG1      VAL  41   3.306  -3.891   2.717
  226   HG12  VAL  41          2HG1      VAL  41   2.410  -5.425   2.740
  227   HG13  VAL  41          3HG1      VAL  41   2.715  -4.545   4.252
  228   HG21  VAL  41          3HG2      VAL  41   5.124  -7.356   4.508
  229   HG22  VAL  41          1HG2      VAL  41   3.771  -6.525   5.268
  230   HG23  VAL  41          2HG2      VAL  41   3.488  -7.480   3.816
  231    H    THR  42           H        THR  42   7.147  -4.395   1.675
  232    HA   THR  42           HA       THR  42   9.194  -6.496   2.284
  233    HB   THR  42           HB       THR  42   9.404  -3.897   0.716
  234    HG1  THR  42           1HG      THR  42   9.685  -5.391  -1.011
  235   HG21  THR  42          3HG2      THR  42  11.426  -6.124   1.227
  236   HG22  THR  42          1HG2      THR  42  11.556  -4.433   1.753
  237   HG23  THR  42          2HG2      THR  42  11.630  -4.822   0.033
  238    H    VAL  43           H        VAL  43  10.247  -6.272   4.156
  239    HA   VAL  43           HA       VAL  43   9.481  -3.932   5.842
  240    HB   VAL  43           HB       VAL  43  10.464  -6.664   6.739
  241   HG11  VAL  43          1HG1      VAL  43   9.346  -6.055   8.883
  242   HG12  VAL  43          2HG1      VAL  43  10.657  -4.940   8.505
  243   HG13  VAL  43          3HG1      VAL  43   8.973  -4.445   8.229
  244   HG21  VAL  43          3HG2      VAL  43   7.609  -5.655   6.340
  245   HG22  VAL  43          1HG2      VAL  43   8.382  -7.020   5.505
  246   HG23  VAL  43          2HG2      VAL  43   8.037  -7.132   7.230
  247    H    ALA  44           H        ALA  44  12.375  -5.651   4.684
  248    HA   ALA  44           HA       ALA  44  14.302  -4.597   6.482
  249    HB1  ALA  44           1HB      ALA  44  15.904  -5.216   4.706
  250    HB2  ALA  44           2HB      ALA  44  14.689  -6.483   4.950
  251    HB3  ALA  44           3HB      ALA  44  14.571  -5.393   3.547
  252    H    THR  45           H        THR  45  13.048  -3.192   3.471
  253    HA   THR  45           HA       THR  45  14.434  -0.588   3.972
  254    HB   THR  45           HB       THR  45  13.859  -0.215   1.536
  255    HG1  THR  45           1HG      THR  45  13.470  -2.417   0.516
  256   HG21  THR  45          3HG2      THR  45  15.631  -1.633   0.659
  257   HG22  THR  45          1HG2      THR  45  15.549  -2.696   2.083
  258   HG23  THR  45          2HG2      THR  45  16.104  -1.020   2.250
  259    H    GLY  46           H        GLY  46  11.294  -2.071   4.009
  260    HA2  GLY  46           2HA      GLY  46   9.263  -1.210   4.688
  261    HA3  GLY  46           3HA      GLY  46  10.039   0.369   4.939
  262    H    ARG  47           H        ARG  47   8.739  -1.782   2.413
  263    HA   ARG  47           HA       ARG  47   7.506   0.456   0.999
  264    HB3  ARG  47           2HB      ARG  47   9.703   0.678   0.074
  265    HG3  ARG  47           2HG      ARG  47   9.473  -2.220  -0.850
  266    HD3  ARG  47           2HD      ARG  47  10.568  -0.774  -2.512
  267    HE   ARG  47           HE       ARG  47  11.878   0.487  -0.314
  268   HH11  ARG  47          1HH1      ARG  47  12.728  -0.649  -3.575
  269   HH12  ARG  47          2HH1      ARG  47  14.223   0.240  -3.567
  270   HH21  ARG  47          1HH2      ARG  47  13.586   1.783  -0.489
  271   HH22  ARG  47          2HH2      ARG  47  14.534   1.871  -1.962
  272    H    LEU  48           H        LEU  48   6.156  -0.248  -0.828
  273    HA   LEU  48           HA       LEU  48   4.864  -2.866  -0.113
  274    HB3  LEU  48           2HB      LEU  48   3.151  -0.878  -1.421
  275    HG   LEU  48           HG       LEU  48   3.082  -1.939   1.430
  276   HD11  LEU  48          1HD1      LEU  48   1.989   0.242   1.204
  277   HD12  LEU  48          2HD1      LEU  48   0.754  -1.013   1.389
  278   HD13  LEU  48          3HD1      LEU  48   1.081  -0.328  -0.212
  279   HD21  LEU  48          3HD2      LEU  48   1.501  -2.752  -1.063
  280   HD22  LEU  48          1HD2      LEU  48   1.137  -3.291   0.588
  281   HD23  LEU  48          2HD2      LEU  48   2.657  -3.759  -0.165
  282    H    THR  49           H        THR  49   3.835  -4.086  -1.724
  283    HA   THR  49           HA       THR  49   4.112  -3.345  -4.623
  284    HB   THR  49           HB       THR  49   4.317  -6.178  -3.503
  285    HG1  THR  49           1HG      THR  49   6.185  -5.120  -2.959
  286   HG21  THR  49          3HG2      THR  49   3.451  -5.947  -5.845
  287   HG22  THR  49          1HG2      THR  49   5.017  -6.740  -5.781
  288   HG23  THR  49          2HG2      THR  49   4.914  -5.035  -6.278
  289    H    VAL  50           H        VAL  50   2.177  -3.385  -5.599
  290    HA   VAL  50           HA       VAL  50  -0.069  -4.987  -4.492
  291    HB   VAL  50           HB       VAL  50  -0.127  -2.950  -3.193
  292   HG11  VAL  50          1HG1      VAL  50  -0.364  -1.340  -5.765
  293   HG12  VAL  50          2HG1      VAL  50  -0.436  -0.734  -4.098
  294   HG13  VAL  50          3HG1      VAL  50   1.073  -1.398  -4.718
  295   HG21  VAL  50          3HG2      VAL  50  -2.389  -2.159  -3.627
  296   HG22  VAL  50          1HG2      VAL  50  -2.367  -2.870  -5.249
  297   HG23  VAL  50          2HG2      VAL  50  -2.297  -3.921  -3.817
  298    H    THR  51           H        THR  51  -1.435  -5.728  -5.970
  299    HA   THR  51           HA       THR  51  -1.351  -4.697  -8.779
  300    HB   THR  51           HB       THR  51  -1.843  -7.541  -7.764
  301    HG1  THR  51           1HG      THR  51   0.306  -7.135  -7.730
  302   HG21  THR  51          3HG2      THR  51  -1.651  -6.433 -10.631
  303   HG22  THR  51          1HG2      THR  51  -3.138  -7.013  -9.870
  304   HG23  THR  51          2HG2      THR  51  -1.814  -8.134 -10.178
  305    H    TYR  52           H        TYR  52  -3.190  -3.786  -9.460
  306    HA   TYR  52           HA       TYR  52  -5.797  -4.504  -8.215
  307    HB3  TYR  52           2HB      TYR  52  -4.664  -2.847  -6.766
  308    HD1  TYR  52           2HD      TYR  52  -2.451  -1.931  -7.449
  309    HD2  TYR  52           1HD      TYR  52  -6.139  -0.408  -9.102
  310    HE1  TYR  52           2HE      TYR  52  -1.240   0.018  -8.362
  311    HE2  TYR  52           1HE      TYR  52  -4.914   1.512 -10.057
  312    HH   TYR  52           HH       TYR  52  -2.895   2.519 -10.350
  313    H    ASP  53           H        ASP  53  -7.626  -3.077  -9.048
  314    HA   ASP  53           HA       ASP  53  -7.556  -2.880 -11.991
  315    HB3  ASP  53           2HB      ASP  53  -9.794  -3.112  -9.949
  316    HA   PRO  54           HA       PRO  54  -7.375   1.574 -10.919
  317    HB3  PRO  54           2HB      PRO  54  -5.492   1.575 -12.292
  318    HG3  PRO  54           2HG      PRO  54  -5.468   0.371 -14.371
  319    HD3  PRO  54           2HD      PRO  54  -5.856  -1.182 -12.628
  320    H    LYS  55           H        LYS  55  -9.924   0.125 -11.970
  321    HA   LYS  55           HA       LYS  55 -11.343   2.570 -13.036
  322    HB3  LYS  55           2HB      LYS  55 -12.811   0.989 -14.317
  323    HG3  LYS  55           2HG      LYS  55  -9.880   0.953 -15.160
  324    HD3  LYS  55           2HD      LYS  55 -12.465   0.870 -16.785
  325    HE3  LYS  55           2HE      LYS  55  -9.519   0.827 -17.583
  326    HZ1  LYS  55           3HZ      LYS  55 -11.928   0.656 -19.312
  327    HZ2  LYS  55           1HZ      LYS  55 -10.914  -0.580 -18.987
  328    HZ3  LYS  55           2HZ      LYS  55 -10.367   0.730 -19.814
  329    H    GLN  56           H        GLN  56 -11.525  -0.387 -11.114
  330    HA   GLN  56           HA       GLN  56 -13.777   0.562  -9.504
  331    HB3  GLN  56           2HB      GLN  56 -12.625  -0.926  -7.765
  332    HG3  GLN  56           2HG      GLN  56 -13.364  -2.140 -10.460
  333   HE21  GLN  56          1HE2      GLN  56 -13.458  -2.853  -6.897
  334   HE22  GLN  56          2HE2      GLN  56 -13.168  -4.567  -7.109
  335    H    VAL  57           H        VAL  57 -10.143   0.761  -9.003
  336    HA   VAL  57           HA       VAL  57 -10.474   3.220  -7.403
  337    HB   VAL  57           HB       VAL  57  -9.598   2.109  -5.299
  338   HG11  VAL  57          1HG1      VAL  57 -11.963   2.845  -5.506
  339   HG12  VAL  57          2HG1      VAL  57 -12.398   1.186  -5.991
  340   HG13  VAL  57          3HG1      VAL  57 -11.701   1.492  -4.394
  341   HG21  VAL  57          3HG2      VAL  57 -10.002  -0.272  -4.962
  342   HG22  VAL  57          1HG2      VAL  57 -10.569  -0.472  -6.618
  343   HG23  VAL  57          2HG2      VAL  57  -8.873  -0.045  -6.312
  344    H    SER  58           H        SER  58  -8.319   3.712  -6.121
  345    HA   SER  58           HA       SER  58  -5.951   2.952  -7.735
  346    HB3  SER  58           2HB      SER  58  -5.723   5.533  -8.245
  347    HG   SER  58           HG       SER  58  -7.554   4.682  -9.989
  348    H    GLU  59           H        GLU  59  -4.806   5.682  -6.741
  349    HA   GLU  59           HA       GLU  59  -3.420   4.529  -4.590
  350    HB3  GLU  59           2HB      GLU  59  -3.808   7.498  -5.107
  351    HG3  GLU  59           2HG      GLU  59  -1.190   6.163  -4.414
  352    H    ILE  60           H        ILE  60  -6.329   6.566  -4.627
  353    HA   ILE  60           HA       ILE  60  -6.199   7.564  -2.004
  354    HB   ILE  60           HB       ILE  60  -8.237   7.300  -4.142
  355   HG13  ILE  60          2HG1      ILE  60  -8.413   9.644  -3.893
  356   HG21  ILE  60          1HG2      ILE  60 -10.121   8.124  -2.767
  357   HG22  ILE  60          2HG2      ILE  60  -9.697   6.438  -2.476
  358   HG23  ILE  60          3HG2      ILE  60  -9.211   7.689  -1.299
  359   HD11  ILE  60          3HD1      ILE  60  -8.490   9.974  -1.444
  360   HD12  ILE  60          1HD1      ILE  60  -6.786   9.502  -1.308
  361   HD13  ILE  60          2HD1      ILE  60  -7.231  10.971  -2.189
  362    H    THR  61           H        THR  61  -7.817   4.518  -3.015
  363    HA   THR  61           HA       THR  61  -8.803   3.991  -0.373
  364    HB   THR  61           HB       THR  61  -8.198   2.183  -2.732
  365    HG1  THR  61           1HG      THR  61 -10.491   3.472  -1.641
  366   HG21  THR  61          3HG2      THR  61  -8.353   0.755  -0.692
  367   HG22  THR  61          1HG2      THR  61  -9.833   0.597  -1.656
  368   HG23  THR  61          2HG2      THR  61  -9.824   1.600  -0.190
  369    H    ILE  62           H        ILE  62  -5.583   3.479  -1.647
  370    HA   ILE  62           HA       ILE  62  -4.823   1.913   0.797
  371    HB   ILE  62           HB       ILE  62  -4.299   0.943  -1.344
  372   HG13  ILE  62          2HG1      ILE  62  -2.896   0.523   0.687
  373   HG21  ILE  62          1HG2      ILE  62  -2.479   3.318  -1.855
  374   HG22  ILE  62          2HG2      ILE  62  -2.514   1.819  -2.813
  375   HG23  ILE  62          3HG2      ILE  62  -3.931   2.844  -2.776
  376   HD11  ILE  62          3HD1      ILE  62  -1.339   0.169  -1.925
  377   HD12  ILE  62          1HD1      ILE  62  -1.272  -0.826  -0.453
  378   HD13  ILE  62          2HD1      ILE  62  -2.720  -0.840  -1.464
  379    H    GLN  63           H        GLN  63  -4.464   5.085  -0.641
  380    HA   GLN  63           HA       GLN  63  -2.608   6.225   1.193
  381    HB3  GLN  63           2HB      GLN  63  -5.046   7.581  -0.019
  382    HG3  GLN  63           2HG      GLN  63  -2.279   8.762   0.307
  383   HE21  GLN  63          1HE2      GLN  63  -3.232   9.600  -1.972
  384   HE22  GLN  63          2HE2      GLN  63  -4.278  11.006  -1.813
  385    H    GLU  64           H        GLU  64  -6.216   6.007   1.390
  386    HA   GLU  64           HA       GLU  64  -6.558   7.252   3.909
  387    HB3  GLU  64           2HB      GLU  64  -8.639   5.819   4.050
  388    HG3  GLU  64           2HG      GLU  64  -8.335   7.111   1.313
  389    H    ARG  65           H        ARG  65  -5.704   3.875   3.248
  390    HA   ARG  65           HA       ARG  65  -5.753   2.971   5.998
  391    HB3  ARG  65           2HB      ARG  65  -4.505   1.959   3.410
  392    HG3  ARG  65           2HG      ARG  65  -3.086   0.931   5.036
  393    HD3  ARG  65           2HD      ARG  65  -4.204   1.145   7.156
  394    HE   ARG  65           HE       ARG  65  -6.583   0.721   6.154
  395   HH11  ARG  65          1HH1      ARG  65  -4.921  -1.670   8.246
  396   HH12  ARG  65          2HH1      ARG  65  -6.446  -2.086   8.985
  397   HH21  ARG  65          1HH2      ARG  65  -8.331   0.124   7.075
  398   HH22  ARG  65          2HH2      ARG  65  -8.364  -1.015   8.412
  399    H    ILE  66           H        ILE  66  -3.032   3.950   3.840
  400    HA   ILE  66           HA       ILE  66  -1.079   3.563   5.964
  401    HB   ILE  66           HB       ILE  66  -0.951   4.859   3.220
  402   HG13  ILE  66          2HG1      ILE  66  -1.385   2.291   3.578
  403   HG21  ILE  66          1HG2      ILE  66   0.847   5.838   4.595
  404   HG22  ILE  66          2HG2      ILE  66   1.333   4.212   5.141
  405   HG23  ILE  66          3HG2      ILE  66   1.529   4.699   3.443
  406   HD11  ILE  66          3HD1      ILE  66   1.076   3.027   1.961
  407   HD12  ILE  66          1HD1      ILE  66   0.078   1.564   1.829
  408   HD13  ILE  66          2HD1      ILE  66  -0.622   3.128   1.418
  409    H    ALA  67           H        ALA  67  -2.859   6.443   4.907
  410    HA   ALA  67           HA       ALA  67  -1.431   8.319   6.547
  411    HB1  ALA  67           1HB      ALA  67  -4.324   8.296   5.536
  412    HB2  ALA  67           2HB      ALA  67  -3.472   9.705   6.196
  413    HB3  ALA  67           3HB      ALA  67  -2.928   8.968   4.679
  414    H    ALA  68           H        ALA  68  -4.312   6.259   7.144
  415    HA   ALA  68           HA       ALA  68  -4.924   7.330   9.738
  416    HB1  ALA  68           1HB      ALA  68  -6.481   5.404   9.819
  417    HB2  ALA  68           2HB      ALA  68  -6.577   6.266   8.270
  418    HB3  ALA  68           3HB      ALA  68  -5.711   4.716   8.372
  419    H    LEU  69           H        LEU  69  -2.884   4.571   8.734
  420    HA   LEU  69           HA       LEU  69  -2.301   3.653  11.430
  421    HB3  LEU  69           2HB      LEU  69  -0.378   2.515  10.259
  422    HG   LEU  69           HG       LEU  69  -3.145   2.182   9.011
  423   HD11  LEU  69          1HD1      LEU  69  -2.283  -0.053   8.336
  424   HD12  LEU  69          2HD1      LEU  69  -0.674   0.414   8.918
  425   HD13  LEU  69          3HD1      LEU  69  -1.415   1.278   7.548
  426   HD21  LEU  69          3HD2      LEU  69  -1.781   0.647  11.260
  427   HD22  LEU  69          1HD2      LEU  69  -3.331   0.222  10.503
  428   HD23  LEU  69          2HD2      LEU  69  -3.194   1.710  11.430
  429    H    GLY  70           H        GLY  70  -1.365   6.547   9.928
  430    HA2  GLY  70           2HA      GLY  70  -0.436   8.234  11.350
  431    HA3  GLY  70           3HA      GLY  70   0.680   7.043  12.051
  432    H    TYR  71           H        TYR  71   0.549   6.670   8.681
  433    HA   TYR  71           HA       TYR  71   3.181   8.073   8.413
  434    HB3  TYR  71           2HB      TYR  71   3.833   6.222   7.019
  435    HD1  TYR  71           1HD      TYR  71   4.935   6.528   9.427
  436    HD2  TYR  71           2HD      TYR  71   1.620   3.902   8.603
  437    HE1  TYR  71           1HE      TYR  71   5.489   5.206  11.447
  438    HE2  TYR  71           2HE      TYR  71   2.129   2.620  10.674
  439    HH   TYR  71           HH       TYR  71   3.506   2.413  12.523
  440    H    THR  72           H        THR  72   3.388   7.589   5.591
  441    HA   THR  72           HA       THR  72   1.144   8.483   4.056
  442    HB   THR  72           HB       THR  72   3.201  10.578   4.818
  443    HG1  THR  72           1HG      THR  72   1.017  10.287   5.651
  444   HG21  THR  72          3HG2      THR  72   3.349  10.666   2.385
  445   HG22  THR  72          1HG2      THR  72   2.369  12.011   2.958
  446   HG23  THR  72          2HG2      THR  72   1.576  10.597   2.231
  447    H    LEU  73           H        LEU  73   1.545   8.222   1.858
  448    HA   LEU  73           HA       LEU  73   4.004   6.683   1.199
  449    HB3  LEU  73           2HB      LEU  73   1.869   5.497   1.249
  450    HG   LEU  73           HG       LEU  73   0.435   7.494   0.279
  451   HD11  LEU  73          1HD1      LEU  73   1.459   7.896  -1.864
  452   HD12  LEU  73          2HD1      LEU  73  -0.060   7.096  -2.174
  453   HD13  LEU  73          3HD1      LEU  73   1.438   6.159  -2.279
  454   HD21  LEU  73          3HD2      LEU  73  -1.214   5.866  -0.608
  455   HD22  LEU  73          1HD2      LEU  73  -0.500   5.357   0.930
  456   HD23  LEU  73          2HD2      LEU  73   0.032   4.609  -0.592
  457    H    ALA  74           H        ALA  74   4.530   6.574  -1.153
  458    HA   ALA  74           HA       ALA  74   3.326   8.598  -2.849
  459    HB1  ALA  74           1HB      ALA  74   6.363   8.516  -2.791
  460    HB2  ALA  74           2HB      ALA  74   5.345   9.456  -3.889
  461    HB3  ALA  74           3HB      ALA  74   5.354   9.827  -2.158
  462    H    GLU  75           H        GLU  75   2.966   7.897  -4.859
  463    HA   GLU  75           HA       GLU  75   3.687   5.087  -5.550
  464    HB3  GLU  75           2HB      GLU  75   1.249   6.743  -6.310
  465    HG3  GLU  75           2HG      GLU  75   1.669   3.725  -6.370
  466    HA   PRO  76           HA       PRO  76   5.657   7.843  -8.601
  467    HB3  PRO  76           2HB      PRO  76   7.626   7.395  -7.429
  468    HG3  PRO  76           2HG      PRO  76   8.131   5.167  -6.678
  469    HD3  PRO  76           2HD      PRO  76   6.094   5.752  -5.703
  Start of MODEL   13
    1    H2   PRO   6           2H       PRO   6  -7.362  -2.667 -17.346
    2    HA   PRO   6           HA       PRO   6  -7.043  -5.507 -16.878
    3    HB3  PRO   6           2HB      PRO   6  -4.847  -5.600 -17.840
    4    HG3  PRO   6           2HG      PRO   6  -6.664  -5.838 -19.383
    5    HD3  PRO   6           2HD      PRO   6  -8.349  -4.258 -19.471
    6    H    LEU   7           H        LEU   7  -5.737  -6.009 -15.026
    7    HA   LEU   7           HA       LEU   7  -5.334  -3.753 -13.165
    8    HB3  LEU   7           2HB      LEU   7  -6.535  -5.845 -12.438
    9    HG   LEU   7           HG       LEU   7  -3.733  -7.025 -12.168
   10   HD11  LEU   7          1HD1      LEU   7  -4.885  -8.854 -11.037
   11   HD12  LEU   7          2HD1      LEU   7  -6.472  -8.133 -11.386
   12   HD13  LEU   7          3HD1      LEU   7  -5.361  -7.331 -10.264
   13   HD21  LEU   7          3HD2      LEU   7  -4.606  -8.951 -13.496
   14   HD22  LEU   7          1HD2      LEU   7  -4.469  -7.472 -14.455
   15   HD23  LEU   7          2HD2      LEU   7  -6.064  -8.004 -13.858
   16    H    LYS   8           H        LYS   8  -3.291  -3.637 -11.994
   17    HA   LYS   8           HA       LYS   8  -0.925  -4.367 -13.658
   18    HB3  LYS   8           2HB      LYS   8  -1.596  -2.220 -14.479
   19    HG3  LYS   8           2HG      LYS   8  -1.524  -1.162 -11.620
   20    HD3  LYS   8           2HD      LYS   8  -2.315   0.257 -14.196
   21    HE3  LYS   8           2HE      LYS   8  -1.770   1.210 -11.346
   22    HZ1  LYS   8           3HZ      LYS   8  -2.801   2.754 -13.660
   23    HZ2  LYS   8           1HZ      LYS   8  -1.261   2.827 -13.119
   24    HZ3  LYS   8           2HZ      LYS   8  -2.467   3.351 -12.158
   25    H    THR   9           H        THR   9   0.879  -4.874 -12.571
   26    HA   THR   9           HA       THR   9   0.934  -4.644  -9.609
   27    HB   THR   9           HB       THR   9   1.649  -6.751 -10.495
   28    HG1  THR   9           1HG      THR   9   4.040  -5.542  -9.694
   29   HG21  THR   9          3HG2      THR   9   2.581  -6.245 -12.675
   30   HG22  THR   9          1HG2      THR   9   3.832  -6.975 -11.672
   31   HG23  THR   9          2HG2      THR   9   3.851  -5.227 -11.963
   32    H    GLN  10           H        GLN  10   2.411  -3.344  -8.460
   33    HA   GLN  10           HA       GLN  10   4.504  -1.897  -9.756
   34    HB3  GLN  10           2HB      GLN  10   2.533  -0.470 -10.486
   35    HG3  GLN  10           2HG      GLN  10   2.278   0.031  -7.473
   36   HE21  GLN  10          1HE2      GLN  10   3.348   2.225  -7.930
   37   HE22  GLN  10          2HE2      GLN  10   2.347   3.452  -8.710
   38    H    GLN  11           H        GLN  11   5.399  -0.190  -8.210
   39    HA   GLN  11           HA       GLN  11   5.158  -1.072  -5.375
   40    HB3  GLN  11           2HB      GLN  11   7.534  -0.364  -5.142
   41    HG3  GLN  11           2HG      GLN  11   6.899  -2.801  -5.740
   42   HE21  GLN  11          1HE2      GLN  11   9.277  -1.481  -8.141
   43   HE22  GLN  11          2HE2      GLN  11   8.656  -2.446  -9.477
   44    H    MET  12           H        MET  12   6.044   0.671  -3.894
   45    HA   MET  12           HA       MET  12   6.050   3.408  -4.777
   46    HB3  MET  12           2HB      MET  12   3.666   3.322  -4.495
   47    HG3  MET  12           2HG      MET  12   2.963   2.954  -1.898
   48    HE1  MET  12           3HE      MET  12   1.526   2.800  -4.730
   49    HE2  MET  12           1HE      MET  12   0.346   1.532  -4.375
   50    HE3  MET  12           2HE      MET  12   0.713   2.757  -3.143
   51    H    GLN  13           H        GLN  13   6.811   4.879  -3.194
   52    HA   GLN  13           HA       GLN  13   8.293   3.704  -0.916
   53    HB3  GLN  13           2HB      GLN  13   9.001   6.141  -0.615
   54    HG3  GLN  13           2HG      GLN  13  10.515   4.499  -1.669
   55   HE21  GLN  13          1HE2      GLN  13   9.289   6.568  -4.447
   56   HE22  GLN  13          2HE2      GLN  13   9.573   5.250  -5.585
   57    H    VAL  14           H        VAL  14   7.849   4.355   1.196
   58    HA   VAL  14           HA       VAL  14   5.330   5.678   1.905
   59    HB   VAL  14           HB       VAL  14   5.641   2.646   2.032
   60   HG11  VAL  14          1HG1      VAL  14   3.471   2.647   3.359
   61   HG12  VAL  14          2HG1      VAL  14   4.870   3.207   4.265
   62   HG13  VAL  14          3HG1      VAL  14   3.707   4.387   3.621
   63   HG21  VAL  14          3HG2      VAL  14   4.550   3.312   0.021
   64   HG22  VAL  14          1HG2      VAL  14   3.322   2.678   1.094
   65   HG23  VAL  14          2HG2      VAL  14   3.478   4.435   0.898
   66    H    GLY  15           H        GLY  15   5.174   6.005   4.160
   67    HA2  GLY  15           2HA      GLY  15   7.623   6.401   5.596
   68    HA3  GLY  15           3HA      GLY  15   5.986   6.561   6.243
   69    H    GLY  16           H        GLY  16   6.789   5.732   8.221
   70    HA2  GLY  16           2HA      GLY  16   8.599   3.618   8.466
   71    HA3  GLY  16           3HA      GLY  16   7.689   4.355   9.790
   72    H    MET  17           H        MET  17   6.087   2.444   7.241
   73    HA   MET  17           HA       MET  17   4.777   0.713   9.072
   74    HB3  MET  17           2HB      MET  17   3.960   1.194   6.805
   75    HG3  MET  17           2HG      MET  17   6.177  -0.673   5.848
   76    HE1  MET  17           3HE      MET  17   6.598  -0.849   3.196
   77    HE2  MET  17           1HE      MET  17   5.532  -0.053   2.016
   78    HE3  MET  17           2HE      MET  17   6.480   0.918   3.164
   79    H    ARG  18           H        ARG  18   8.066   0.413   7.939
   80    HA   ARG  18           HA       ARG  18   8.416  -2.365   8.408
   81    HB3  ARG  18           2HB      ARG  18  10.040  -0.941   7.216
   82    HG3  ARG  18           2HG      ARG  18  10.811   0.110   9.979
   83    HD3  ARG  18           2HD      ARG  18  11.860   0.761   7.200
   84    HE   ARG  18           HE       ARG  18  11.811   2.392   9.510
   85   HH11  ARG  18          1HH1      ARG  18  14.312   1.224   7.237
   86   HH12  ARG  18          2HH1      ARG  18  15.273   2.676   7.510
   87   HH21  ARG  18          1HH2      ARG  18  13.187   4.231   9.696
   88   HH22  ARG  18          2HH2      ARG  18  14.674   4.233   8.754
   89    H    CYS  19           H        CYS  19   7.691   0.009  10.766
   90    HA   CYS  19           HA       CYS  19   8.886  -1.016  13.122
   91    HB3  CYS  19           2HB      CYS  19   6.775  -0.069  14.198
   92    HG   CYS  19           HG       CYS  19   8.014   1.910  11.846
   93    H    ALA  20           H        ALA  20   8.025  -2.377  14.792
   94    HA   ALA  20           HA       ALA  20   7.619  -4.981  13.952
   95    HB1  ALA  20           1HB      ALA  20   6.895  -3.744  16.639
   96    HB2  ALA  20           2HB      ALA  20   7.154  -5.473  16.330
   97    HB3  ALA  20           3HB      ALA  20   8.500  -4.332  16.148
   98    H    ALA  21           H        ALA  21   6.047  -5.971  12.964
   99    HA   ALA  21           HA       ALA  21   4.116  -6.701  12.178
  100    HB1  ALA  21           1HB      ALA  21   2.805  -5.736  14.741
  101    HB2  ALA  21           2HB      ALA  21   2.265  -7.034  13.666
  102    HB3  ALA  21           3HB      ALA  21   3.757  -7.231  14.598
  103    H    CYS  22           H        CYS  22   4.515  -3.367  12.374
  104    HA   CYS  22           HA       CYS  22   1.877  -2.495  11.654
  105    HB3  CYS  22           2HB      CYS  22   3.066  -0.400  10.951
  106    HG   CYS  22           HG       CYS  22   3.713   0.530  13.184
  107    H    ALA  23           H        ALA  23   4.556  -3.621   9.607
  108    HA   ALA  23           HA       ALA  23   3.552  -3.336   7.042
  109    HB1  ALA  23           1HB      ALA  23   4.824  -5.776   8.373
  110    HB2  ALA  23           2HB      ALA  23   4.780  -5.450   6.634
  111    HB3  ALA  23           3HB      ALA  23   5.687  -4.369   7.717
  112    H    SER  24           H        SER  24   2.334  -5.598   9.579
  113    HA   SER  24           HA       SER  24   0.581  -7.026   7.721
  114    HB3  SER  24           2HB      SER  24  -0.120  -8.253   9.643
  115    HG   SER  24           HG       SER  24   2.124  -8.477   8.949
  116    H    SER  25           H        SER  25   0.249  -4.272   9.906
  117    HA   SER  25           HA       SER  25  -2.641  -4.025   9.727
  118    HB3  SER  25           2HB      SER  25  -2.319  -1.896  10.784
  119    HG   SER  25           HG       SER  25  -0.955  -2.368  12.532
  120    H    ILE  26           H        ILE  26  -0.021  -3.147   7.642
  121    HA   ILE  26           HA       ILE  26  -1.886  -1.803   5.741
  122    HB   ILE  26           HB       ILE  26   1.002  -2.712   5.424
  123   HG13  ILE  26          2HG1      ILE  26   1.561  -0.276   5.468
  124   HG21  ILE  26          1HG2      ILE  26  -0.709  -1.017   3.570
  125   HG22  ILE  26          2HG2      ILE  26   1.041  -1.313   3.420
  126   HG23  ILE  26          3HG2      ILE  26  -0.091  -2.654   3.258
  127   HD11  ILE  26          3HD1      ILE  26   0.108   1.299   6.606
  128   HD12  ILE  26          1HD1      ILE  26  -0.753   0.697   5.182
  129   HD13  ILE  26          2HD1      ILE  26  -1.156   0.061   6.805
  130    H    GLU  27           H        GLU  27   0.038  -4.827   5.776
  131    HA   GLU  27           HA       GLU  27  -0.925  -5.564   3.238
  132    HB3  GLU  27           2HB      GLU  27   0.457  -7.330   5.298
  133    HG3  GLU  27           2HG      GLU  27   0.500  -7.341   2.242
  134    H    ARG  28           H        ARG  28  -2.087  -6.667   6.450
  135    HA   ARG  28           HA       ARG  28  -3.783  -8.753   5.239
  136    HB3  ARG  28           2HB      ARG  28  -3.795  -7.677   8.085
  137    HG3  ARG  28           2HG      ARG  28  -4.681 -10.356   6.908
  138    HD3  ARG  28           2HD      ARG  28  -5.633 -10.799   9.114
  139    HE   ARG  28           HE       ARG  28  -3.458 -11.685   9.051
  140   HH11  ARG  28          1HH1      ARG  28  -3.447  -8.452  10.617
  141   HH12  ARG  28          2HH1      ARG  28  -1.925  -8.805  11.400
  142   HH21  ARG  28          1HH2      ARG  28  -1.449 -11.892   9.890
  143   HH22  ARG  28          2HH2      ARG  28  -0.806 -10.724  11.017
  144    H    ALA  29           H        ALA  29  -4.341  -5.577   6.868
  145    HA   ALA  29           HA       ALA  29  -7.156  -5.504   6.429
  146    HB1  ALA  29           1HB      ALA  29  -5.151  -3.242   6.672
  147    HB2  ALA  29           2HB      ALA  29  -6.924  -3.074   6.768
  148    HB3  ALA  29           3HB      ALA  29  -6.053  -4.012   8.004
  149    H    LEU  30           H        LEU  30  -4.486  -4.587   4.222
  150    HA   LEU  30           HA       LEU  30  -6.003  -3.453   2.134
  151    HB3  LEU  30           2HB      LEU  30  -3.461  -5.116   2.195
  152    HG   LEU  30           HG       LEU  30  -3.992  -4.949  -0.156
  153   HD11  LEU  30          1HD1      LEU  30  -4.376  -1.961   0.373
  154   HD12  LEU  30          2HD1      LEU  30  -5.567  -3.106  -0.307
  155   HD13  LEU  30          3HD1      LEU  30  -4.143  -2.653  -1.243
  156   HD21  LEU  30          3HD2      LEU  30  -1.659  -4.586   0.624
  157   HD22  LEU  30          1HD2      LEU  30  -1.954  -2.839   0.707
  158   HD23  LEU  30          2HD2      LEU  30  -1.994  -3.669  -0.860
  159    H    GLU  31           H        GLU  31  -6.011  -6.847   3.146
  160    HA   GLU  31           HA       GLU  31  -7.447  -7.670   0.698
  161    HB3  GLU  31           2HB      GLU  31  -7.699  -9.808   1.762
  162    HG3  GLU  31           2HG      GLU  31  -4.876  -8.847   2.318
  163    H    ARG  32           H        ARG  32  -8.210  -6.599   4.002
  164    HA   ARG  32           HA       ARG  32 -11.055  -7.198   3.910
  165    HB3  ARG  32           2HB      ARG  32 -11.185  -5.888   5.950
  166    HG3  ARG  32           2HG      ARG  32  -9.379  -6.773   7.412
  167    HD3  ARG  32           2HD      ARG  32 -10.681  -8.847   5.599
  168    HE   ARG  32           HE       ARG  32  -9.903  -9.405   8.405
  169   HH11  ARG  32          1HH1      ARG  32  -9.241 -10.073   4.993
  170   HH12  ARG  32          2HH1      ARG  32  -8.038 -11.258   5.359
  171   HH21  ARG  32          1HH2      ARG  32  -8.250 -10.941   8.800
  172   HH22  ARG  32          2HH2      ARG  32  -7.514 -11.753   7.426
  173    H    LEU  33           H        LEU  33  -9.012  -4.660   2.669
  174    HA   LEU  33           HA       LEU  33 -11.106  -2.746   2.154
  175    HB3  LEU  33           2HB      LEU  33  -9.562  -1.869   0.383
  176    HG   LEU  33           HG       LEU  33  -8.008  -2.432   2.929
  177   HD11  LEU  33          1HD1      LEU  33  -6.686  -0.510   2.282
  178   HD12  LEU  33          2HD1      LEU  33  -7.731  -0.220   0.875
  179   HD13  LEU  33          3HD1      LEU  33  -6.705  -1.655   0.935
  180   HD21  LEU  33          3HD2      LEU  33  -9.795  -0.067   2.245
  181   HD22  LEU  33          1HD2      LEU  33  -8.698  -0.181   3.635
  182   HD23  LEU  33          2HD2      LEU  33 -10.088  -1.271   3.533
  183    H    LYS  34           H        LYS  34 -10.456  -5.797   0.632
  184    HA   LYS  34           HA       LYS  34 -11.393  -6.948  -1.054
  185    HB3  LYS  34           2HB      LYS  34 -13.709  -6.363  -1.761
  186    HG3  LYS  34           2HG      LYS  34 -13.293  -6.323   1.261
  187    HD3  LYS  34           2HD      LYS  34 -15.629  -7.112  -0.530
  188    HE3  LYS  34           2HE      LYS  34 -15.326  -7.345   2.491
  189    HZ1  LYS  34           3HZ      LYS  34 -17.622  -8.089   2.383
  190    HZ2  LYS  34           1HZ      LYS  34 -17.702  -7.803   0.761
  191    HZ3  LYS  34           2HZ      LYS  34 -17.509  -6.558   1.809
  192    H    GLY  35           H        GLY  35 -10.203  -3.926  -1.796
  193    HA2  GLY  35           2HA      GLY  35 -10.980  -3.961  -4.655
  194    HA3  GLY  35           3HA      GLY  35 -10.246  -2.618  -3.780
  195    H    VAL  36           H        VAL  36  -8.296  -5.381  -3.205
  196    HA   VAL  36           HA       VAL  36  -6.789  -4.940  -5.753
  197    HB   VAL  36           HB       VAL  36  -4.681  -4.838  -4.769
  198   HG11  VAL  36          1HG1      VAL  36  -6.362  -2.974  -3.054
  199   HG12  VAL  36          2HG1      VAL  36  -4.682  -2.754  -3.579
  200   HG13  VAL  36          3HG1      VAL  36  -5.990  -2.696  -4.767
  201   HG21  VAL  36          3HG2      VAL  36  -4.911  -6.431  -2.900
  202   HG22  VAL  36          1HG2      VAL  36  -4.135  -4.924  -2.433
  203   HG23  VAL  36          2HG2      VAL  36  -5.834  -5.210  -1.993
  204    H    ALA  37           H        ALA  37  -5.389  -6.608  -6.424
  205    HA   ALA  37           HA       ALA  37  -6.611  -9.247  -5.935
  206    HB1  ALA  37           1HB      ALA  37  -6.330  -8.390  -8.218
  207    HB2  ALA  37           2HB      ALA  37  -4.570  -8.273  -7.982
  208    HB3  ALA  37           3HB      ALA  37  -5.369  -9.860  -7.978
  209    H    GLU  38           H        GLU  38  -3.320  -7.801  -5.706
  210    HA   GLU  38           HA       GLU  38  -2.466  -9.931  -3.880
  211    HB3  GLU  38           2HB      GLU  38  -0.376 -10.323  -5.161
  212    HG3  GLU  38           2HG      GLU  38  -2.788 -11.092  -6.847
  213    H    ALA  39           H        ALA  39  -0.772  -9.244  -2.481
  214    HA   ALA  39           HA       ALA  39   0.725  -6.823  -3.004
  215    HB1  ALA  39           1HB      ALA  39  -0.264  -5.404  -1.289
  216    HB2  ALA  39           2HB      ALA  39  -1.502  -5.846  -2.478
  217    HB3  ALA  39           3HB      ALA  39  -1.472  -6.658  -0.901
  218    H    SER  40           H        SER  40   2.401  -6.433  -1.640
  219    HA   SER  40           HA       SER  40   2.816  -8.065   0.804
  220    HB3  SER  40           2HB      SER  40   4.608  -8.254  -1.638
  221    HG   SER  40           HG       SER  40   4.752  -9.711   0.837
  222    H    VAL  41           H        VAL  41   3.917  -6.922   2.329
  223    HA   VAL  41           HA       VAL  41   5.246  -4.358   1.572
  224    HB   VAL  41           HB       VAL  41   4.634  -5.565   4.313
  225   HG11  VAL  41          1HG1      VAL  41   6.647  -4.193   4.506
  226   HG12  VAL  41          2HG1      VAL  41   5.905  -2.909   3.535
  227   HG13  VAL  41          3HG1      VAL  41   5.283  -3.280   5.157
  228   HG21  VAL  41          3HG2      VAL  41   3.424  -3.158   2.882
  229   HG22  VAL  41          1HG2      VAL  41   2.626  -4.729   3.065
  230   HG23  VAL  41          2HG2      VAL  41   2.997  -3.753   4.494
  231    H    THR  42           H        THR  42   7.404  -4.183   1.375
  232    HA   THR  42           HA       THR  42   9.177  -6.440   2.178
  233    HB   THR  42           HB       THR  42   9.860  -3.961   0.549
  234    HG1  THR  42           1HG      THR  42  10.004  -5.792  -1.052
  235   HG21  THR  42          3HG2      THR  42  11.786  -5.020   1.742
  236   HG22  THR  42          1HG2      THR  42  11.890  -5.261   0.003
  237   HG23  THR  42          2HG2      THR  42  11.345  -6.597   1.046
  238    H    VAL  43           H        VAL  43   9.662  -6.315   4.231
  239    HA   VAL  43           HA       VAL  43   9.463  -3.821   5.760
  240    HB   VAL  43           HB       VAL  43  10.048  -6.697   6.557
  241   HG11  VAL  43          1HG1      VAL  43   9.544  -4.300   8.375
  242   HG12  VAL  43          2HG1      VAL  43   9.526  -6.000   8.889
  243   HG13  VAL  43          3HG1      VAL  43  11.025  -5.283   8.301
  244   HG21  VAL  43          3HG2      VAL  43   7.771  -6.344   5.711
  245   HG22  VAL  43          1HG2      VAL  43   7.691  -6.504   7.471
  246   HG23  VAL  43          2HG2      VAL  43   7.601  -4.893   6.719
  247    H    ALA  44           H        ALA  44  12.108  -5.894   4.600
  248    HA   ALA  44           HA       ALA  44  14.221  -4.814   6.199
  249    HB1  ALA  44           1HB      ALA  44  14.386  -6.912   4.899
  250    HB2  ALA  44           2HB      ALA  44  14.280  -5.996   3.376
  251    HB3  ALA  44           3HB      ALA  44  15.676  -5.786   4.452
  252    H    THR  45           H        THR  45  12.832  -3.688   3.096
  253    HA   THR  45           HA       THR  45  14.655  -1.347   3.003
  254    HB   THR  45           HB       THR  45  13.508  -0.886   0.861
  255    HG1  THR  45           1HG      THR  45  12.189  -2.673   0.070
  256   HG21  THR  45          3HG2      THR  45  14.481  -2.708  -0.409
  257   HG22  THR  45          1HG2      THR  45  14.555  -3.743   1.034
  258   HG23  THR  45          2HG2      THR  45  15.564  -2.284   0.919
  259    H    GLY  46           H        GLY  46  11.178  -2.082   3.456
  260    HA2  GLY  46           2HA      GLY  46   9.595  -0.791   4.615
  261    HA3  GLY  46           3HA      GLY  46  10.687   0.613   4.605
  262    H    ARG  47           H        ARG  47   9.394  -1.577   2.079
  263    HA   ARG  47           HA       ARG  47   8.143   0.696   0.606
  264    HB3  ARG  47           2HB      ARG  47   9.173   0.148  -1.455
  265    HG3  ARG  47           2HG      ARG  47  11.402  -0.025   0.600
  266    HD3  ARG  47           2HD      ARG  47  11.765  -0.655  -1.980
  267    HE   ARG  47           HE       ARG  47  11.059   1.518  -2.884
  268   HH11  ARG  47          1HH1      ARG  47  14.406   1.286  -1.623
  269   HH12  ARG  47          2HH1      ARG  47  14.924   2.551  -2.729
  270   HH21  ARG  47          1HH2      ARG  47  11.854   3.218  -4.055
  271   HH22  ARG  47          2HH2      ARG  47  13.568   3.602  -4.000
  272    H    LEU  48           H        LEU  48   6.708  -0.151  -1.198
  273    HA   LEU  48           HA       LEU  48   5.323  -2.660  -0.267
  274    HB3  LEU  48           2HB      LEU  48   3.583  -0.794  -1.644
  275    HG   LEU  48           HG       LEU  48   3.702  -1.593   1.284
  276   HD11  LEU  48          1HD1      LEU  48   1.316  -0.699   1.263
  277   HD12  LEU  48          2HD1      LEU  48   1.667   0.004  -0.324
  278   HD13  LEU  48          3HD1      LEU  48   2.581   0.526   1.106
  279   HD21  LEU  48          3HD2      LEU  48   3.163  -3.519  -0.160
  280   HD22  LEU  48          1HD2      LEU  48   1.922  -2.569  -1.008
  281   HD23  LEU  48          2HD2      LEU  48   1.717  -3.003   0.703
  282    H    THR  49           H        THR  49   4.178  -3.924  -1.802
  283    HA   THR  49           HA       THR  49   4.422  -3.272  -4.706
  284    HB   THR  49           HB       THR  49   4.661  -6.111  -3.637
  285    HG1  THR  49           1HG      THR  49   6.586  -5.438  -3.169
  286   HG21  THR  49          3HG2      THR  49   5.422  -6.568  -5.953
  287   HG22  THR  49          1HG2      THR  49   5.170  -4.861  -6.384
  288   HG23  THR  49          2HG2      THR  49   3.789  -5.893  -5.949
  289    H    VAL  50           H        VAL  50   2.494  -3.455  -5.712
  290    HA   VAL  50           HA       VAL  50   0.254  -4.953  -4.473
  291    HB   VAL  50           HB       VAL  50   0.204  -2.787  -3.342
  292   HG11  VAL  50          1HG1      VAL  50  -0.304  -0.697  -4.494
  293   HG12  VAL  50          2HG1      VAL  50   1.238  -1.343  -5.072
  294   HG13  VAL  50          3HG1      VAL  50  -0.221  -1.495  -6.072
  295   HG21  VAL  50          3HG2      VAL  50  -2.118  -2.207  -3.699
  296   HG22  VAL  50          1HG2      VAL  50  -2.134  -2.996  -5.281
  297   HG23  VAL  50          2HG2      VAL  50  -1.936  -3.966  -3.807
  298    H    THR  51           H        THR  51  -1.357  -5.562  -5.834
  299    HA   THR  51           HA       THR  51  -1.205  -4.848  -8.734
  300    HB   THR  51           HB       THR  51  -1.979  -7.531  -7.496
  301    HG1  THR  51           1HG      THR  51   0.268  -7.143  -7.492
  302   HG21  THR  51          3HG2      THR  51  -3.181  -7.002  -9.666
  303   HG22  THR  51          1HG2      THR  51  -1.992  -8.290  -9.882
  304   HG23  THR  51          2HG2      THR  51  -1.635  -6.644 -10.433
  305    H    TYR  52           H        TYR  52  -2.968  -3.676  -9.330
  306    HA   TYR  52           HA       TYR  52  -5.656  -4.311  -8.238
  307    HB3  TYR  52           2HB      TYR  52  -4.552  -2.747  -6.645
  308    HD1  TYR  52           1HD      TYR  52  -2.314  -1.878  -7.447
  309    HD2  TYR  52           2HD      TYR  52  -6.046  -0.089  -8.658
  310    HE1  TYR  52           1HE      TYR  52  -1.105   0.171  -8.140
  311    HE2  TYR  52           2HE      TYR  52  -4.825   1.971  -9.363
  312    HH   TYR  52           HH       TYR  52  -1.250   2.240  -9.087
  313    H    ASP  53           H        ASP  53  -7.468  -3.159  -9.248
  314    HA   ASP  53           HA       ASP  53  -7.091  -2.653 -12.103
  315    HB3  ASP  53           2HB      ASP  53  -9.566  -2.988 -10.376
  316    HA   PRO  54           HA       PRO  54  -7.126   1.698 -10.795
  317    HB3  PRO  54           2HB      PRO  54  -5.298   1.902 -12.200
  318    HG3  PRO  54           2HG      PRO  54  -5.224   0.776 -14.329
  319    HD3  PRO  54           2HD      PRO  54  -5.542  -0.880 -12.686
  320    H    LYS  55           H        LYS  55  -9.608   0.200 -12.180
  321    HA   LYS  55           HA       LYS  55 -11.173   2.719 -12.723
  322    HB3  LYS  55           2HB      LYS  55 -12.572   1.342 -14.307
  323    HG3  LYS  55           2HG      LYS  55 -11.071   1.336 -16.239
  324    HD3  LYS  55           2HD      LYS  55 -10.442   3.856 -14.663
  325    HE3  LYS  55           2HE      LYS  55 -11.231   3.310 -17.562
  326    HZ1  LYS  55           3HZ      LYS  55 -10.124   5.814 -16.437
  327    HZ2  LYS  55           1HZ      LYS  55 -11.744   5.576 -16.621
  328    HZ3  LYS  55           2HZ      LYS  55 -10.762   5.571 -17.934
  329    H    GLN  56           H        GLN  56 -11.196  -0.616 -11.492
  330    HA   GLN  56           HA       GLN  56 -13.775  -0.221 -10.132
  331    HB3  GLN  56           2HB      GLN  56 -13.215  -2.287  -8.926
  332    HG3  GLN  56           2HG      GLN  56 -13.050  -3.871 -10.780
  333   HE21  GLN  56          1HE2      GLN  56 -15.332  -3.426  -9.755
  334   HE22  GLN  56          2HE2      GLN  56 -16.477  -2.590 -10.792
  335    H    VAL  57           H        VAL  57 -10.331   0.371  -9.256
  336    HA   VAL  57           HA       VAL  57 -11.366   2.212  -7.190
  337    HB   VAL  57           HB       VAL  57  -9.697   1.620  -5.503
  338   HG11  VAL  57          1HG1      VAL  57 -11.452  -0.786  -6.114
  339   HG12  VAL  57          2HG1      VAL  57 -10.755  -0.329  -4.549
  340   HG13  VAL  57          3HG1      VAL  57 -11.980   0.705  -5.296
  341   HG21  VAL  57          3HG2      VAL  57  -8.469  -0.508  -5.552
  342   HG22  VAL  57          1HG2      VAL  57  -9.117  -0.886  -7.160
  343   HG23  VAL  57          2HG2      VAL  57  -8.006   0.480  -6.940
  344    H    SER  58           H        SER  58  -8.981   3.251  -6.232
  345    HA   SER  58           HA       SER  58  -7.071   3.501  -8.443
  346    HB3  SER  58           2HB      SER  58  -8.847   5.331  -8.752
  347    HG   SER  58           HG       SER  58  -7.681   7.096  -7.190
  348    H    GLU  59           H        GLU  59  -5.231   5.042  -7.594
  349    HA   GLU  59           HA       GLU  59  -3.766   4.166  -5.469
  350    HB3  GLU  59           2HB      GLU  59  -2.881   6.547  -5.308
  351    HG3  GLU  59           2HG      GLU  59  -2.942   4.861  -7.722
  352    H    ILE  60           H        ILE  60  -6.553   6.274  -5.155
  353    HA   ILE  60           HA       ILE  60  -6.473   7.249  -2.514
  354    HB   ILE  60           HB       ILE  60  -8.669   6.245  -4.359
  355   HG13  ILE  60          2HG1      ILE  60  -9.265   8.651  -4.501
  356   HG21  ILE  60          1HG2      ILE  60  -9.083   7.345  -1.579
  357   HG22  ILE  60          2HG2      ILE  60 -10.325   7.368  -2.853
  358   HG23  ILE  60          3HG2      ILE  60  -9.685   5.823  -2.312
  359   HD11  ILE  60          3HD1      ILE  60  -7.775  10.401  -3.865
  360   HD12  ILE  60          1HD1      ILE  60  -8.078   9.468  -2.385
  361   HD13  ILE  60          2HD1      ILE  60  -6.548   9.273  -3.288
  362    H    THR  61           H        THR  61  -7.561   3.986  -3.546
  363    HA   THR  61           HA       THR  61  -8.559   3.294  -0.956
  364    HB   THR  61           HB       THR  61  -7.792   1.701  -3.420
  365    HG1  THR  61           1HG      THR  61 -10.251   2.310  -2.117
  366   HG21  THR  61          3HG2      THR  61  -7.646   0.070  -1.588
  367   HG22  THR  61          1HG2      THR  61  -9.157  -0.165  -2.474
  368   HG23  THR  61          2HG2      THR  61  -9.177   0.662  -0.898
  369    H    ILE  62           H        ILE  62  -5.277   3.036  -2.237
  370    HA   ILE  62           HA       ILE  62  -4.466   1.711   0.330
  371    HB   ILE  62           HB       ILE  62  -3.722   0.784  -1.881
  372   HG13  ILE  62          2HG1      ILE  62  -2.710   0.207   0.260
  373   HG21  ILE  62          1HG2      ILE  62  -1.831   3.172  -1.970
  374   HG22  ILE  62          2HG2      ILE  62  -1.866   1.786  -3.084
  375   HG23  ILE  62          3HG2      ILE  62  -3.216   2.900  -3.056
  376   HD11  ILE  62          3HD1      ILE  62  -0.482   0.492  -1.797
  377   HD12  ILE  62          1HD1      ILE  62  -0.637  -0.709  -0.502
  378   HD13  ILE  62          2HD1      ILE  62  -1.753  -0.753  -1.877
  379    H    GLN  63           H        GLN  63  -4.209   4.817  -1.349
  380    HA   GLN  63           HA       GLN  63  -2.351   6.144   0.307
  381    HB3  GLN  63           2HB      GLN  63  -4.940   7.262  -0.853
  382    HG3  GLN  63           2HG      GLN  63  -2.259   8.669  -0.549
  383   HE21  GLN  63          1HE2      GLN  63  -5.376  10.198   0.042
  384   HE22  GLN  63          2HE2      GLN  63  -5.500  11.003  -1.500
  385    H    GLU  64           H        GLU  64  -5.905   5.761   0.808
  386    HA   GLU  64           HA       GLU  64  -5.966   7.138   3.340
  387    HB3  GLU  64           2HB      GLU  64  -8.149   5.949   3.613
  388    HG3  GLU  64           2HG      GLU  64  -7.916   7.218   0.857
  389    H    ARG  65           H        ARG  65  -5.561   3.631   2.621
  390    HA   ARG  65           HA       ARG  65  -5.565   2.744   5.337
  391    HB3  ARG  65           2HB      ARG  65  -4.063   1.716   2.886
  392    HG3  ARG  65           2HG      ARG  65  -3.369   0.743   5.268
  393    HD3  ARG  65           2HD      ARG  65  -4.540  -1.284   5.809
  394    HE   ARG  65           HE       ARG  65  -6.663   0.858   5.763
  395   HH11  ARG  65          1HH1      ARG  65  -4.578  -1.256   7.785
  396   HH12  ARG  65          2HH1      ARG  65  -5.477  -0.843   9.197
  397   HH21  ARG  65          1HH2      ARG  65  -7.617   1.410   7.635
  398   HH22  ARG  65          2HH2      ARG  65  -7.159   0.615   9.132
  399    H    ILE  66           H        ILE  66  -2.859   3.807   3.258
  400    HA   ILE  66           HA       ILE  66  -0.829   3.494   5.305
  401    HB   ILE  66           HB       ILE  66  -0.922   5.127   2.733
  402   HG13  ILE  66          2HG1      ILE  66  -1.055   2.486   2.712
  403   HG21  ILE  66          1HG2      ILE  66   1.446   4.419   4.521
  404   HG22  ILE  66          2HG2      ILE  66   1.569   5.211   2.932
  405   HG23  ILE  66          3HG2      ILE  66   0.795   6.057   4.263
  406   HD11  ILE  66          3HD1      ILE  66   1.174   3.876   1.190
  407   HD12  ILE  66          1HD1      ILE  66   0.519   2.270   0.841
  408   HD13  ILE  66          2HD1      ILE  66  -0.520   3.698   0.675
  409    H    ALA  67           H        ALA  67  -2.812   6.331   4.353
  410    HA   ALA  67           HA       ALA  67  -1.653   8.127   6.257
  411    HB1  ALA  67           1HB      ALA  67  -2.950   8.872   4.319
  412    HB2  ALA  67           2HB      ALA  67  -4.397   8.055   4.933
  413    HB3  ALA  67           3HB      ALA  67  -3.721   9.440   5.812
  414    H    ALA  68           H        ALA  68  -4.277   5.703   6.600
  415    HA   ALA  68           HA       ALA  68  -5.265   6.732   9.122
  416    HB1  ALA  68           1HB      ALA  68  -6.673   4.708   9.009
  417    HB2  ALA  68           2HB      ALA  68  -6.661   5.551   7.447
  418    HB3  ALA  68           3HB      ALA  68  -5.696   4.079   7.662
  419    H    LEU  69           H        LEU  69  -2.822   4.380   8.194
  420    HA   LEU  69           HA       LEU  69  -2.272   3.523  10.922
  421    HB3  LEU  69           2HB      LEU  69   0.075   3.136   9.532
  422    HG   LEU  69           HG       LEU  69  -0.579   0.898   9.023
  423   HD11  LEU  69          1HD1      LEU  69  -1.094   0.131  11.215
  424   HD12  LEU  69          2HD1      LEU  69  -1.969   1.600  11.624
  425   HD13  LEU  69          3HD1      LEU  69  -0.199   1.642  11.425
  426   HD21  LEU  69          3HD2      LEU  69  -3.465   1.673   9.662
  427   HD22  LEU  69          1HD2      LEU  69  -2.858   0.048   9.297
  428   HD23  LEU  69          2HD2      LEU  69  -2.825   1.303   8.048
  429    H    GLY  70           H        GLY  70  -1.688   6.499   9.339
  430    HA2  GLY  70           2HA      GLY  70  -0.839   8.417  10.385
  431    HA3  GLY  70           3HA      GLY  70   0.034   7.421  11.574
  432    H    TYR  71           H        TYR  71   0.437   6.409   8.305
  433    HA   TYR  71           HA       TYR  71   3.105   7.751   8.085
  434    HB3  TYR  71           2HB      TYR  71   3.670   5.979   6.527
  435    HD1  TYR  71           2HD      TYR  71   4.413   6.263   9.310
  436    HD2  TYR  71           1HD      TYR  71   1.923   3.260   7.476
  437    HE1  TYR  71           2HE      TYR  71   4.924   4.716  11.166
  438    HE2  TYR  71           1HE      TYR  71   2.413   1.708   9.362
  439    HH   TYR  71           HH       TYR  71   4.376   2.755  12.168
  440    H    THR  72           H        THR  72   3.513   7.828   5.422
  441    HA   THR  72           HA       THR  72   1.093   8.866   4.060
  442    HB   THR  72           HB       THR  72   2.487  10.725   3.055
  443    HG1  THR  72           1HG      THR  72   4.292  11.346   4.174
  444   HG21  THR  72          3HG2      THR  72   2.149  10.944   6.076
  445   HG22  THR  72          1HG2      THR  72   0.835  11.140   4.896
  446   HG23  THR  72          2HG2      THR  72   2.204  12.265   4.897
  447    H    LEU  73           H        LEU  73   1.132   8.712   1.835
  448    HA   LEU  73           HA       LEU  73   2.920   6.635   0.713
  449    HB3  LEU  73           2HB      LEU  73   0.277   7.909  -0.100
  450    HG   LEU  73           HG       LEU  73   1.450   7.313  -2.212
  451   HD11  LEU  73          1HD1      LEU  73   2.923   5.496  -1.384
  452   HD12  LEU  73          2HD1      LEU  73   1.894   4.925  -2.699
  453   HD13  LEU  73          3HD1      LEU  73   1.495   4.502  -1.031
  454   HD21  LEU  73          3HD2      LEU  73  -0.834   5.441  -1.456
  455   HD22  LEU  73          1HD2      LEU  73  -0.334   5.873  -3.106
  456   HD23  LEU  73          2HD2      LEU  73  -0.998   7.115  -2.036
  457    H    ALA  74           H        ALA  74   4.482   6.998  -0.758
  458    HA   ALA  74           HA       ALA  74   4.390   9.437  -2.479
  459    HB1  ALA  74           1HB      ALA  74   6.834   8.150  -1.175
  460    HB2  ALA  74           2HB      ALA  74   6.860   9.501  -2.335
  461    HB3  ALA  74           3HB      ALA  74   6.122   9.713  -0.739
  462    H    GLU  75           H        GLU  75   3.232   8.138  -3.973
  463    HA   GLU  75           HA       GLU  75   4.435   5.713  -5.137
  464    HB3  GLU  75           2HB      GLU  75   1.842   7.200  -5.764
  465    HG3  GLU  75           2HG      GLU  75   1.268   4.852  -6.690
  466    HA   PRO  76           HA       PRO  76   6.670   8.703  -7.188
  467    HB3  PRO  76           2HB      PRO  76   8.434   7.213  -7.006
  468    HG3  PRO  76           2HG      PRO  76   8.128   4.899  -7.501
  469    HD3  PRO  76           2HD      PRO  76   6.418   5.400  -5.985
  Start of MODEL   14
    1    H2   PRO   6           2H       PRO   6  -4.497  -5.429 -17.481
    2    HA   PRO   6           HA       PRO   6  -6.715  -3.550 -17.772
    3    HB3  PRO   6           2HB      PRO   6  -8.314  -5.045 -17.248
    4    HG3  PRO   6           2HG      PRO   6  -7.835  -6.792 -18.730
    5    HD3  PRO   6           2HD      PRO   6  -6.360  -5.273 -19.760
    6    H    LEU   7           H        LEU   7  -5.037  -5.548 -15.224
    7    HA   LEU   7           HA       LEU   7  -5.002  -3.143 -13.495
    8    HB3  LEU   7           2HB      LEU   7  -6.594  -4.773 -12.659
    9    HG   LEU   7           HG       LEU   7  -4.292  -6.758 -12.474
   10   HD11  LEU   7          1HD1      LEU   7  -5.647  -7.983 -10.860
   11   HD12  LEU   7          2HD1      LEU   7  -6.948  -6.776 -10.969
   12   HD13  LEU   7          3HD1      LEU   7  -5.391  -6.345 -10.250
   13   HD21  LEU   7          3HD2      LEU   7  -6.011  -8.387 -13.266
   14   HD22  LEU   7          1HD2      LEU   7  -5.758  -7.118 -14.459
   15   HD23  LEU   7          2HD2      LEU   7  -7.191  -7.068 -13.422
   16    H    LYS   8           H        LYS   8  -3.143  -2.713 -12.368
   17    HA   LYS   8           HA       LYS   8  -0.695  -3.937 -13.593
   18    HB3  LYS   8           2HB      LYS   8  -0.996  -1.647 -14.299
   19    HG3  LYS   8           2HG      LYS   8  -1.433  -1.061 -11.352
   20    HD3  LYS   8           2HD      LYS   8  -0.757   1.067 -13.410
   21    HE3  LYS   8           2HE      LYS   8  -1.032   0.981 -10.371
   22    HZ1  LYS   8           3HZ      LYS   8  -0.222   3.223 -10.312
   23    HZ2  LYS   8           1HZ      LYS   8  -0.157   3.333 -11.949
   24    HZ3  LYS   8           2HZ      LYS   8   0.888   2.368 -11.169
   25    H    THR   9           H        THR   9   1.149  -4.321 -12.324
   26    HA   THR   9           HA       THR   9   0.818  -4.187  -9.348
   27    HB   THR   9           HB       THR   9   3.067  -5.542 -10.870
   28    HG1  THR   9           1HG      THR   9   0.776  -6.671  -9.639
   29   HG21  THR   9          3HG2      THR   9   3.210  -6.811  -8.662
   30   HG22  THR   9          1HG2      THR   9   2.087  -5.628  -7.969
   31   HG23  THR   9          2HG2      THR   9   3.685  -5.116  -8.560
   32    H    GLN  10           H        GLN  10   2.390  -3.072  -8.084
   33    HA   GLN  10           HA       GLN  10   4.365  -1.328  -9.349
   34    HB3  GLN  10           2HB      GLN  10   1.762  -0.339  -8.127
   35    HG3  GLN  10           2HG      GLN  10   3.448   1.169  -7.203
   36   HE21  GLN  10          1HE2      GLN  10   3.655   3.593  -9.321
   37   HE22  GLN  10          2HE2      GLN  10   5.260   3.301  -9.960
   38    H    GLN  11           H        GLN  11   5.744  -0.404  -7.797
   39    HA   GLN  11           HA       GLN  11   5.544  -1.491  -5.038
   40    HB3  GLN  11           2HB      GLN  11   8.055  -0.384  -6.335
   41    HG3  GLN  11           2HG      GLN  11   7.718  -2.481  -4.142
   42   HE21  GLN  11          1HE2      GLN  11   9.658  -3.610  -3.844
   43   HE22  GLN  11          2HE2      GLN  11  11.226  -2.966  -4.279
   44    H    MET  12           H        MET  12   5.891   0.076  -3.291
   45    HA   MET  12           HA       MET  12   6.086   2.921  -4.067
   46    HB3  MET  12           2HB      MET  12   3.715   2.615  -4.057
   47    HG3  MET  12           2HG      MET  12   4.052   1.464  -1.255
   48    HE1  MET  12           3HE      MET  12   1.448   2.972  -3.922
   49    HE2  MET  12           1HE      MET  12   1.168   1.216  -3.873
   50    HE3  MET  12           2HE      MET  12  -0.051   2.336  -3.224
   51    H    GLN  13           H        GLN  13   7.048   4.225  -2.681
   52    HA   GLN  13           HA       GLN  13   8.177   3.133  -0.212
   53    HB3  GLN  13           2HB      GLN  13   9.093   5.493   0.031
   54    HG3  GLN  13           2HG      GLN  13   9.803   4.100  -2.582
   55   HE21  GLN  13          1HE2      GLN  13  11.457   5.198  -3.704
   56   HE22  GLN  13          2HE2      GLN  13  12.482   6.401  -2.930
   57    H    VAL  14           H        VAL  14   7.608   3.663   1.810
   58    HA   VAL  14           HA       VAL  14   5.194   5.198   2.509
   59    HB   VAL  14           HB       VAL  14   5.202   2.130   2.486
   60   HG11  VAL  14          1HG1      VAL  14   4.298   2.778   4.651
   61   HG12  VAL  14          2HG1      VAL  14   3.301   4.046   3.911
   62   HG13  VAL  14          3HG1      VAL  14   2.947   2.328   3.621
   63   HG21  VAL  14          3HG2      VAL  14   3.247   4.110   1.278
   64   HG22  VAL  14          1HG2      VAL  14   4.383   3.079   0.379
   65   HG23  VAL  14          2HG2      VAL  14   3.067   2.342   1.283
   66    H    GLY  15           H        GLY  15   5.720   6.031   4.454
   67    HA2  GLY  15           2HA      GLY  15   8.044   5.292   5.891
   68    HA3  GLY  15           3HA      GLY  15   6.752   6.339   6.514
   69    H    GLY  16           H        GLY  16   4.786   4.103   6.271
   70    HA2  GLY  16           2HA      GLY  16   5.176   2.850   8.888
   71    HA3  GLY  16           3HA      GLY  16   3.736   2.763   7.849
   72    H    MET  17           H        MET  17   6.979   1.852   6.765
   73    HA   MET  17           HA       MET  17   6.148  -1.047   6.747
   74    HB3  MET  17           2HB      MET  17   7.750  -1.220   4.803
   75    HG3  MET  17           2HG      MET  17   6.236  -0.014   3.166
   76    HE1  MET  17           3HE      MET  17   3.311  -0.675   5.418
   77    HE2  MET  17           1HE      MET  17   3.134  -0.406   3.665
   78    HE3  MET  17           2HE      MET  17   2.646  -1.961   4.380
   79    H    ARG  18           H        ARG  18   8.839   1.177   7.518
   80    HA   ARG  18           HA       ARG  18  10.813  -0.888   7.737
   81    HB3  ARG  18           2HB      ARG  18  12.162   0.900   8.903
   82    HG3  ARG  18           2HG      ARG  18  10.823   1.799   6.318
   83    HD3  ARG  18           2HD      ARG  18  13.600   2.308   7.498
   84    HE   ARG  18           HE       ARG  18  12.833   3.700   5.061
   85   HH11  ARG  18          1HH1      ARG  18  14.560   0.787   6.207
   86   HH12  ARG  18          2HH1      ARG  18  15.559   0.743   4.773
   87   HH21  ARG  18          1HH2      ARG  18  14.223   3.536   3.266
   88   HH22  ARG  18          2HH2      ARG  18  15.287   2.170   3.130
   89    H    CYS  19           H        CYS  19   8.388   0.051  10.002
   90    HA   CYS  19           HA       CYS  19   9.592  -1.719  12.089
   91    HB3  CYS  19           2HB      CYS  19   7.186   0.146  12.109
   92    HG   CYS  19           HG       CYS  19   7.061  -0.195  14.777
   93    H    ALA  20           H        ALA  20   8.932  -3.801  12.222
   94    HA   ALA  20           HA       ALA  20   7.279  -4.943  10.204
   95    HB1  ALA  20           1HB      ALA  20   8.136  -6.116  12.886
   96    HB2  ALA  20           2HB      ALA  20   7.552  -7.028  11.482
   97    HB3  ALA  20           3HB      ALA  20   9.090  -6.153  11.391
   98    H    ALA  21           H        ALA  21   6.416  -4.039  13.572
   99    HA   ALA  21           HA       ALA  21   3.710  -4.939  13.498
  100    HB1  ALA  21           1HB      ALA  21   3.376  -3.330  15.322
  101    HB2  ALA  21           2HB      ALA  21   4.907  -4.196  15.536
  102    HB3  ALA  21           3HB      ALA  21   4.907  -2.523  14.934
  103    H    CYS  22           H        CYS  22   5.167  -2.007  12.049
  104    HA   CYS  22           HA       CYS  22   2.560  -0.874  11.402
  105    HB3  CYS  22           2HB      CYS  22   3.915   0.791  10.097
  106    HG   CYS  22           HG       CYS  22   5.137   2.106  11.992
  107    H    ALA  23           H        ALA  23   5.101  -2.436   9.364
  108    HA   ALA  23           HA       ALA  23   3.636  -2.728   7.003
  109    HB1  ALA  23           1HB      ALA  23   6.014  -3.344   7.409
  110    HB2  ALA  23           2HB      ALA  23   5.481  -4.740   8.370
  111    HB3  ALA  23           3HB      ALA  23   5.108  -4.644   6.640
  112    H    SER  24           H        SER  24   3.257  -4.484  10.074
  113    HA   SER  24           HA       SER  24   1.466  -6.562   8.969
  114    HB3  SER  24           2HB      SER  24   1.187  -7.260  11.296
  115    HG   SER  24           HG       SER  24   3.912  -6.516  10.878
  116    H    SER  25           H        SER  25   1.028  -3.365  10.308
  117    HA   SER  25           HA       SER  25  -1.869  -3.690  10.846
  118    HB3  SER  25           2HB      SER  25  -1.817  -1.375  11.498
  119    HG   SER  25           HG       SER  25   0.628  -2.532  12.456
  120    H    ILE  26           H        ILE  26   0.209  -2.718   8.237
  121    HA   ILE  26           HA       ILE  26  -2.085  -1.842   6.571
  122    HB   ILE  26           HB       ILE  26   0.814  -2.421   5.847
  123   HG13  ILE  26          2HG1      ILE  26   1.097   0.052   5.725
  124   HG21  ILE  26          1HG2      ILE  26  -0.545  -2.593   3.871
  125   HG22  ILE  26          2HG2      ILE  26  -1.423  -1.098   4.263
  126   HG23  ILE  26          3HG2      ILE  26   0.298  -1.042   3.822
  127   HD11  ILE  26          3HD1      ILE  26  -0.340   1.526   6.994
  128   HD12  ILE  26          1HD1      ILE  26  -1.274   0.783   5.699
  129   HD13  ILE  26          2HD1      ILE  26  -1.448   0.195   7.387
  130    H    GLU  27           H        GLU  27   0.145  -4.707   6.598
  131    HA   GLU  27           HA       GLU  27  -1.146  -5.840   4.349
  132    HB3  GLU  27           2HB      GLU  27   0.425  -7.418   6.424
  133    HG3  GLU  27           2HG      GLU  27   0.090  -7.627   3.391
  134    H    ARG  28           H        ARG  28  -1.851  -6.358   7.860
  135    HA   ARG  28           HA       ARG  28  -3.631  -8.555   7.366
  136    HB3  ARG  28           2HB      ARG  28  -3.861  -6.671   9.718
  137    HG3  ARG  28           2HG      ARG  28  -4.138  -9.704   9.448
  138    HD3  ARG  28           2HD      ARG  28  -4.970  -7.841  11.704
  139    HE   ARG  28           HE       ARG  28  -5.603 -10.601  11.140
  140   HH11  ARG  28          1HH1      ARG  28  -4.888  -8.530  13.939
  141   HH12  ARG  28          2HH1      ARG  28  -5.604  -9.690  15.032
  142   HH21  ARG  28          1HH2      ARG  28  -6.556 -11.892  12.521
  143   HH22  ARG  28          2HH2      ARG  28  -6.670 -11.486  14.240
  144    H    ALA  29           H        ALA  29  -4.105  -5.131   6.811
  145    HA   ALA  29           HA       ALA  29  -7.050  -5.508   6.444
  146    HB1  ALA  29           1HB      ALA  29  -6.331  -3.505   7.626
  147    HB2  ALA  29           2HB      ALA  29  -5.287  -3.032   6.260
  148    HB3  ALA  29           3HB      ALA  29  -7.054  -3.089   6.055
  149    H    LEU  30           H        LEU  30  -4.066  -5.017   4.547
  150    HA   LEU  30           HA       LEU  30  -5.231  -4.029   2.245
  151    HB3  LEU  30           2HB      LEU  30  -2.720  -5.732   2.448
  152    HG   LEU  30           HG       LEU  30  -3.088  -5.193   0.099
  153   HD11  LEU  30          1HD1      LEU  30  -4.696  -3.348   0.201
  154   HD12  LEU  30          2HD1      LEU  30  -3.259  -2.802  -0.658
  155   HD13  LEU  30          3HD1      LEU  30  -3.509  -2.322   1.037
  156   HD21  LEU  30          3HD2      LEU  30  -0.795  -4.929   1.009
  157   HD22  LEU  30          1HD2      LEU  30  -1.136  -3.220   1.369
  158   HD23  LEU  30          2HD2      LEU  30  -1.105  -3.781  -0.313
  159    H    GLU  31           H        GLU  31  -5.490  -7.341   3.217
  160    HA   GLU  31           HA       GLU  31  -6.093  -8.336   0.535
  161    HB3  GLU  31           2HB      GLU  31  -5.161  -9.826   2.282
  162    HG3  GLU  31           2HG      GLU  31  -7.814  -9.349   3.737
  163    H    ARG  32           H        ARG  32  -7.878  -6.554   2.876
  164    HA   ARG  32           HA       ARG  32 -10.449  -7.386   1.660
  165    HB3  ARG  32           2HB      ARG  32 -10.276  -8.373   3.816
  166    HG3  ARG  32           2HG      ARG  32 -10.165  -5.572   5.019
  167    HD3  ARG  32           2HD      ARG  32  -9.956  -6.766   7.159
  168    HE   ARG  32           HE       ARG  32 -12.245  -6.271   6.706
  169   HH11  ARG  32          1HH1      ARG  32 -11.469  -9.703   6.048
  170   HH12  ARG  32          2HH1      ARG  32 -13.155 -10.131   6.085
  171   HH21  ARG  32          1HH2      ARG  32 -14.354  -6.951   6.542
  172   HH22  ARG  32          2HH2      ARG  32 -14.721  -8.664   6.413
  173    H    LEU  33           H        LEU  33  -8.436  -4.736   1.766
  174    HA   LEU  33           HA       LEU  33 -10.364  -2.626   1.971
  175    HB3  LEU  33           2HB      LEU  33  -8.673  -1.240   0.817
  176    HG   LEU  33           HG       LEU  33  -7.223  -3.063   2.742
  177   HD11  LEU  33          1HD1      LEU  33  -6.732  -0.145   2.062
  178   HD12  LEU  33          2HD1      LEU  33  -5.839  -1.503   1.352
  179   HD13  LEU  33          3HD1      LEU  33  -5.740  -1.199   3.094
  180   HD21  LEU  33          3HD2      LEU  33  -7.804  -1.369   4.493
  181   HD22  LEU  33          1HD2      LEU  33  -9.213  -2.258   3.906
  182   HD23  LEU  33          2HD2      LEU  33  -8.911  -0.599   3.339
  183    H    LYS  34           H        LYS  34 -10.223  -4.937  -0.532
  184    HA   LYS  34           HA       LYS  34 -11.489  -5.248  -2.348
  185    HB3  LYS  34           2HB      LYS  34 -12.872  -2.583  -1.909
  186    HG3  LYS  34           2HG      LYS  34 -13.743  -5.277  -3.038
  187    HD3  LYS  34           2HD      LYS  34 -15.376  -2.828  -2.263
  188    HE3  LYS  34           2HE      LYS  34 -16.186  -5.347  -3.785
  189    HZ1  LYS  34           3HZ      LYS  34 -18.352  -4.160  -3.824
  190    HZ2  LYS  34           1HZ      LYS  34 -17.775  -3.087  -2.702
  191    HZ3  LYS  34           2HZ      LYS  34 -17.931  -4.675  -2.328
  192    H    GLY  35           H        GLY  35 -11.485  -4.902  -4.610
  193    HA2  GLY  35           2HA      GLY  35 -10.849  -3.980  -6.650
  194    HA3  GLY  35           3HA      GLY  35 -10.409  -2.469  -5.825
  195    H    VAL  36           H        VAL  36  -8.491  -3.309  -4.054
  196    HA   VAL  36           HA       VAL  36  -6.083  -4.038  -5.430
  197    HB   VAL  36           HB       VAL  36  -5.266  -4.827  -3.170
  198   HG11  VAL  36          1HG1      VAL  36  -6.456  -2.029  -3.276
  199   HG12  VAL  36          2HG1      VAL  36  -5.145  -2.584  -2.213
  200   HG13  VAL  36          3HG1      VAL  36  -4.894  -2.538  -3.966
  201   HG21  VAL  36          3HG2      VAL  36  -7.361  -5.481  -2.045
  202   HG22  VAL  36          1HG2      VAL  36  -6.592  -4.155  -1.170
  203   HG23  VAL  36          2HG2      VAL  36  -7.984  -3.823  -2.186
  204    H    ALA  37           H        ALA  37  -5.336  -5.899  -6.186
  205    HA   ALA  37           HA       ALA  37  -7.038  -8.336  -5.960
  206    HB1  ALA  37           1HB      ALA  37  -5.836  -9.018  -7.991
  207    HB2  ALA  37           2HB      ALA  37  -6.559  -7.413  -8.184
  208    HB3  ALA  37           3HB      ALA  37  -4.810  -7.571  -7.896
  209    H    GLU  38           H        GLU  38  -3.591  -7.382  -5.629
  210    HA   GLU  38           HA       GLU  38  -2.994  -9.718  -3.958
  211    HB3  GLU  38           2HB      GLU  38  -2.054  -9.412  -6.829
  212    HG3  GLU  38           2HG      GLU  38  -0.771 -10.932  -4.572
  213    H    ALA  39           H        ALA  39  -1.198  -9.372  -2.622
  214    HA   ALA  39           HA       ALA  39   0.705  -7.211  -3.111
  215    HB1  ALA  39           1HB      ALA  39  -0.033  -5.765  -1.286
  216    HB2  ALA  39           2HB      ALA  39  -1.334  -5.927  -2.472
  217    HB3  ALA  39           3HB      ALA  39  -1.412  -6.839  -0.950
  218    H    SER  40           H        SER  40   2.321  -6.969  -1.509
  219    HA   SER  40           HA       SER  40   2.360  -8.694   0.857
  220    HB3  SER  40           2HB      SER  40   4.497  -9.219  -1.217
  221    HG   SER  40           HG       SER  40   3.874 -11.291   0.286
  222    H    VAL  41           H        VAL  41   3.550  -7.778   2.451
  223    HA   VAL  41           HA       VAL  41   5.001  -5.263   1.838
  224    HB   VAL  41           HB       VAL  41   5.135  -4.869   4.230
  225   HG11  VAL  41          1HG1      VAL  41   2.759  -4.674   4.705
  226   HG12  VAL  41          2HG1      VAL  41   3.091  -4.263   3.026
  227   HG13  VAL  41          3HG1      VAL  41   2.367  -5.831   3.408
  228   HG21  VAL  41          3HG2      VAL  41   3.959  -6.486   5.817
  229   HG22  VAL  41          1HG2      VAL  41   4.141  -7.711   4.554
  230   HG23  VAL  41          2HG2      VAL  41   5.570  -6.943   5.246
  231    H    THR  42           H        THR  42   7.133  -4.721   2.472
  232    HA   THR  42           HA       THR  42   8.866  -6.911   3.498
  233    HB   THR  42           HB       THR  42   9.477  -6.902   1.232
  234    HG1  THR  42           1HG      THR  42  11.568  -6.499   1.499
  235   HG21  THR  42          3HG2      THR  42   8.642  -4.773   0.397
  236   HG22  THR  42          1HG2      THR  42  10.362  -4.922   0.054
  237   HG23  THR  42          2HG2      THR  42   9.831  -3.882   1.378
  238    H    VAL  43           H        VAL  43   9.896  -6.385   5.200
  239    HA   VAL  43           HA       VAL  43   9.658  -3.645   6.335
  240    HB   VAL  43           HB       VAL  43  10.658  -6.245   7.578
  241   HG11  VAL  43          1HG1      VAL  43   9.973  -3.588   8.921
  242   HG12  VAL  43          2HG1      VAL  43  10.415  -5.090   9.753
  243   HG13  VAL  43          3HG1      VAL  43  11.605  -4.269   8.747
  244   HG21  VAL  43          3HG2      VAL  43   8.243  -6.377   7.058
  245   HG22  VAL  43          1HG2      VAL  43   8.516  -6.287   8.795
  246   HG23  VAL  43          2HG2      VAL  43   7.978  -4.841   7.910
  247    H    ALA  44           H        ALA  44  12.006  -6.131   5.299
  248    HA   ALA  44           HA       ALA  44  14.403  -4.916   6.194
  249    HB1  ALA  44           1HB      ALA  44  15.462  -6.543   4.652
  250    HB2  ALA  44           2HB      ALA  44  14.157  -7.295   5.583
  251    HB3  ALA  44           3HB      ALA  44  13.891  -6.854   3.880
  252    H    THR  45           H        THR  45  12.760  -4.637   3.004
  253    HA   THR  45           HA       THR  45  14.573  -2.442   2.155
  254    HB   THR  45           HB       THR  45  11.978  -3.062   0.760
  255    HG1  THR  45           1HG      THR  45  12.932  -4.716  -0.347
  256   HG21  THR  45          3HG2      THR  45  13.315  -2.533  -1.236
  257   HG22  THR  45          1HG2      THR  45  14.792  -2.431  -0.253
  258   HG23  THR  45          2HG2      THR  45  13.501  -1.236  -0.045
  259    H    GLY  46           H        GLY  46  11.440  -2.885   3.698
  260    HA2  GLY  46           2HA      GLY  46  10.091  -1.385   4.786
  261    HA3  GLY  46           3HA      GLY  46  11.259  -0.086   4.423
  262    H    ARG  47           H        ARG  47   9.144  -2.228   2.413
  263    HA   ARG  47           HA       ARG  47   7.955   0.115   1.055
  264    HB3  ARG  47           2HB      ARG  47   8.557  -0.694  -1.192
  265    HG3  ARG  47           2HG      ARG  47  11.131  -0.358   0.371
  266    HD3  ARG  47           2HD      ARG  47  10.371   0.479  -2.453
  267    HE   ARG  47           HE       ARG  47  12.609   1.192  -0.875
  268   HH11  ARG  47          1HH1      ARG  47  12.009  -0.113  -4.141
  269   HH12  ARG  47          2HH1      ARG  47  13.521   0.527  -4.739
  270   HH21  ARG  47          1HH2      ARG  47  14.597   1.891  -1.759
  271   HH22  ARG  47          2HH2      ARG  47  15.026   1.415  -3.377
  272    H    LEU  48           H        LEU  48   6.311  -0.574  -0.549
  273    HA   LEU  48           HA       LEU  48   5.085  -3.234   0.101
  274    HB3  LEU  48           2HB      LEU  48   3.200  -1.338  -1.076
  275    HG   LEU  48           HG       LEU  48   3.395  -2.472   1.736
  276   HD11  LEU  48          1HD1      LEU  48   0.947  -1.940   1.788
  277   HD12  LEU  48          2HD1      LEU  48   1.106  -1.185   0.188
  278   HD13  LEU  48          3HD1      LEU  48   1.944  -0.482   1.587
  279   HD21  LEU  48          3HD2      LEU  48   3.166  -4.322   0.096
  280   HD22  LEU  48          1HD2      LEU  48   1.812  -3.477  -0.687
  281   HD23  LEU  48          2HD2      LEU  48   1.653  -4.103   0.966
  282    H    THR  49           H        THR  49   4.286  -4.466  -1.580
  283    HA   THR  49           HA       THR  49   4.444  -3.432  -4.394
  284    HB   THR  49           HB       THR  49   4.676  -6.353  -3.554
  285    HG1  THR  49           1HG      THR  49   6.606  -5.536  -3.189
  286   HG21  THR  49          3HG2      THR  49   3.571  -6.017  -5.755
  287   HG22  THR  49          1HG2      THR  49   5.175  -6.714  -5.944
  288   HG23  THR  49          2HG2      THR  49   4.925  -4.984  -6.277
  289    H    VAL  50           H        VAL  50   2.496  -3.332  -5.306
  290    HA   VAL  50           HA       VAL  50   0.241  -4.957  -4.253
  291    HB   VAL  50           HB       VAL  50   0.173  -2.940  -2.906
  292   HG11  VAL  50          1HG1      VAL  50   1.308  -1.328  -4.396
  293   HG12  VAL  50          2HG1      VAL  50  -0.101  -1.327  -5.479
  294   HG13  VAL  50          3HG1      VAL  50  -0.248  -0.715  -3.823
  295   HG21  VAL  50          3HG2      VAL  50  -1.981  -3.992  -3.592
  296   HG22  VAL  50          1HG2      VAL  50  -2.121  -2.256  -3.276
  297   HG23  VAL  50          2HG2      VAL  50  -2.090  -2.847  -4.943
  298    H    THR  51           H        THR  51  -1.262  -5.502  -5.667
  299    HA   THR  51           HA       THR  51  -1.129  -4.559  -8.491
  300    HB   THR  51           HB       THR  51  -2.160  -7.207  -7.371
  301    HG1  THR  51           1HG      THR  51  -0.335  -8.029  -8.503
  302   HG21  THR  51          3HG2      THR  51  -1.684  -6.291 -10.269
  303   HG22  THR  51          1HG2      THR  51  -3.270  -6.491  -9.518
  304   HG23  THR  51          2HG2      THR  51  -2.234  -7.898  -9.743
  305    H    TYR  52           H        TYR  52  -2.871  -3.412  -9.191
  306    HA   TYR  52           HA       TYR  52  -5.552  -3.896  -8.096
  307    HB3  TYR  52           2HB      TYR  52  -4.503  -2.356  -6.443
  308    HD1  TYR  52           2HD      TYR  52  -5.876   0.184  -8.744
  309    HD2  TYR  52           1HD      TYR  52  -2.293  -1.313  -6.872
  310    HE1  TYR  52           2HE      TYR  52  -4.691   2.292  -9.323
  311    HE2  TYR  52           1HE      TYR  52  -1.117   0.815  -7.410
  312    HH   TYR  52           HH       TYR  52  -1.320   2.995  -8.362
  313    H    ASP  53           H        ASP  53  -7.298  -2.813  -9.224
  314    HA   ASP  53           HA       ASP  53  -6.686  -2.367 -12.067
  315    HB3  ASP  53           2HB      ASP  53  -9.277  -2.826 -10.576
  316    HA   PRO  54           HA       PRO  54  -6.804   1.948 -10.895
  317    HB3  PRO  54           2HB      PRO  54  -4.900   2.009 -12.232
  318    HG3  PRO  54           2HG      PRO  54  -4.855   0.965 -14.397
  319    HD3  PRO  54           2HD      PRO  54  -5.295  -0.699 -12.789
  320    H    LYS  55           H        LYS  55  -9.355   0.613 -12.008
  321    HA   LYS  55           HA       LYS  55 -10.769   3.174 -12.337
  322    HB3  LYS  55           2HB      LYS  55 -10.302   2.617 -14.620
  323    HG3  LYS  55           2HG      LYS  55 -11.869   0.051 -14.194
  324    HD3  LYS  55           2HD      LYS  55 -10.519   1.010 -16.731
  325    HE3  LYS  55           2HE      LYS  55 -11.298  -1.406 -16.400
  326    HZ1  LYS  55           3HZ      LYS  55 -13.633  -1.785 -16.678
  327    HZ2  LYS  55           1HZ      LYS  55 -13.966  -0.189 -16.855
  328    HZ3  LYS  55           2HZ      LYS  55 -13.493  -0.753 -15.398
  329    H    GLN  56           H        GLN  56 -11.089  -0.323 -11.657
  330    HA   GLN  56           HA       GLN  56 -13.566  -0.073 -10.166
  331    HB3  GLN  56           2HB      GLN  56 -12.482  -1.910  -8.740
  332    HG3  GLN  56           2HG      GLN  56 -12.803  -2.186 -11.735
  333   HE21  GLN  56          1HE2      GLN  56 -12.436  -4.156 -12.764
  334   HE22  GLN  56          2HE2      GLN  56 -11.695  -5.539 -11.967
  335    H    VAL  57           H        VAL  57 -10.102   0.472  -9.214
  336    HA   VAL  57           HA       VAL  57 -11.016   2.421  -7.175
  337    HB   VAL  57           HB       VAL  57  -9.433   1.568  -5.509
  338   HG11  VAL  57          1HG1      VAL  57 -10.771  -0.304  -4.696
  339   HG12  VAL  57          2HG1      VAL  57 -11.801   0.984  -5.338
  340   HG13  VAL  57          3HG1      VAL  57 -11.532  -0.495  -6.287
  341   HG21  VAL  57          3HG2      VAL  57  -7.882   0.296  -6.976
  342   HG22  VAL  57          1HG2      VAL  57  -8.494  -0.701  -5.651
  343   HG23  VAL  57          2HG2      VAL  57  -9.153  -0.906  -7.286
  344    H    SER  58           H        SER  58  -8.759   3.287  -6.138
  345    HA   SER  58           HA       SER  58  -6.606   3.523  -8.106
  346    HB3  SER  58           2HB      SER  58  -8.152   5.338  -8.806
  347    HG   SER  58           HG       SER  58  -9.140   5.841  -6.843
  348    H    GLU  59           H        GLU  59  -4.991   5.225  -7.005
  349    HA   GLU  59           HA       GLU  59  -3.734   4.360  -4.782
  350    HB3  GLU  59           2HB      GLU  59  -4.206   7.313  -5.383
  351    HG3  GLU  59           2HG      GLU  59  -1.742   5.735  -4.536
  352    H    ILE  60           H        ILE  60  -6.639   6.356  -4.699
  353    HA   ILE  60           HA       ILE  60  -6.866   7.144  -2.004
  354    HB   ILE  60           HB       ILE  60  -8.803   6.458  -4.224
  355   HG13  ILE  60          2HG1      ILE  60  -8.419   9.014  -2.600
  356   HG21  ILE  60          1HG2      ILE  60  -9.654   7.109  -1.381
  357   HG22  ILE  60          2HG2      ILE  60 -10.711   7.205  -2.812
  358   HG23  ILE  60          3HG2      ILE  60 -10.052   5.648  -2.330
  359   HD11  ILE  60          3HD1      ILE  60  -7.414   8.370  -5.407
  360   HD12  ILE  60          1HD1      ILE  60  -7.513   9.995  -4.708
  361   HD13  ILE  60          2HD1      ILE  60  -6.422   8.805  -3.990
  362    H    THR  61           H        THR  61  -7.813   3.939  -3.375
  363    HA   THR  61           HA       THR  61  -9.101   2.979  -1.028
  364    HB   THR  61           HB       THR  61  -7.920   1.738  -3.498
  365    HG1  THR  61           1HG      THR  61  -9.976   2.567  -3.502
  366   HG21  THR  61          3HG2      THR  61  -7.308   0.012  -1.832
  367   HG22  THR  61          1HG2      THR  61  -8.656  -0.491  -2.845
  368   HG23  THR  61          2HG2      THR  61  -8.967   0.057  -1.183
  369    H    ILE  62           H        ILE  62  -5.678   2.965  -1.815
  370    HA   ILE  62           HA       ILE  62  -5.089   1.479   0.718
  371    HB   ILE  62           HB       ILE  62  -4.196   0.649  -1.458
  372   HG13  ILE  62          2HG1      ILE  62  -3.361  -0.071   0.660
  373   HG21  ILE  62          1HG2      ILE  62  -3.636   2.790  -2.529
  374   HG22  ILE  62          2HG2      ILE  62  -2.360   3.061  -1.321
  375   HG23  ILE  62          3HG2      ILE  62  -2.251   1.711  -2.473
  376   HD11  ILE  62          3HD1      ILE  62  -2.036  -0.762  -1.399
  377   HD12  ILE  62          1HD1      ILE  62  -0.874   0.525  -0.991
  378   HD13  ILE  62          2HD1      ILE  62  -1.163  -0.817   0.143
  379    H    GLN  63           H        GLN  63  -4.756   4.720  -0.687
  380    HA   GLN  63           HA       GLN  63  -3.235   5.832   1.474
  381    HB3  GLN  63           2HB      GLN  63  -5.549   7.265   0.136
  382    HG3  GLN  63           2HG      GLN  63  -3.948   8.282   1.973
  383   HE21  GLN  63          1HE2      GLN  63  -2.770   9.284  -1.214
  384   HE22  GLN  63          2HE2      GLN  63  -1.059   9.093  -0.861
  385    H    GLU  64           H        GLU  64  -6.765   5.238   1.104
  386    HA   GLU  64           HA       GLU  64  -7.602   6.153   3.658
  387    HB3  GLU  64           2HB      GLU  64  -9.583   4.567   3.137
  388    HG3  GLU  64           2HG      GLU  64 -10.359   5.833   1.123
  389    H    ARG  65           H        ARG  65  -5.420   3.740   3.279
  390    HA   ARG  65           HA       ARG  65  -6.003   2.845   6.056
  391    HB3  ARG  65           2HB      ARG  65  -4.845   1.172   3.817
  392    HG3  ARG  65           2HG      ARG  65  -3.453   0.611   5.660
  393    HD3  ARG  65           2HD      ARG  65  -4.615   1.459   7.658
  394    HE   ARG  65           HE       ARG  65  -6.963   0.732   7.089
  395   HH11  ARG  65          1HH1      ARG  65  -5.052  -0.962   9.490
  396   HH12  ARG  65          2HH1      ARG  65  -6.400  -1.980   9.950
  397   HH21  ARG  65          1HH2      ARG  65  -8.627  -0.675   7.668
  398   HH22  ARG  65          2HH2      ARG  65  -8.317  -1.818   8.976
  399    H    ILE  66           H        ILE  66  -3.367   3.519   3.647
  400    HA   ILE  66           HA       ILE  66  -1.295   3.523   5.663
  401    HB   ILE  66           HB       ILE  66  -1.422   4.759   2.887
  402   HG13  ILE  66          2HG1      ILE  66  -1.545   2.170   3.272
  403   HG21  ILE  66          1HG2      ILE  66   1.087   4.887   3.040
  404   HG22  ILE  66          2HG2      ILE  66   0.292   5.970   4.169
  405   HG23  ILE  66          3HG2      ILE  66   0.982   4.442   4.751
  406   HD11  ILE  66          3HD1      ILE  66  -0.948   3.094   1.086
  407   HD12  ILE  66          1HD1      ILE  66   0.765   3.185   1.584
  408   HD13  ILE  66          2HD1      ILE  66  -0.043   1.618   1.464
  409    H    ALA  67           H        ALA  67  -3.303   6.245   4.452
  410    HA   ALA  67           HA       ALA  67  -2.004   8.139   6.239
  411    HB1  ALA  67           1HB      ALA  67  -4.579   8.362   4.634
  412    HB2  ALA  67           2HB      ALA  67  -3.708   9.689   5.420
  413    HB3  ALA  67           3HB      ALA  67  -2.948   8.825   4.074
  414    H    ALA  68           H        ALA  68  -4.390   5.699   6.725
  415    HA   ALA  68           HA       ALA  68  -5.703   7.055   9.008
  416    HB1  ALA  68           1HB      ALA  68  -6.088   4.246   7.877
  417    HB2  ALA  68           2HB      ALA  68  -7.119   5.076   9.052
  418    HB3  ALA  68           3HB      ALA  68  -7.022   5.682   7.390
  419    H    LEU  69           H        LEU  69  -3.316   4.456   8.383
  420    HA   LEU  69           HA       LEU  69  -2.827   3.819  11.144
  421    HB3  LEU  69           2HB      LEU  69  -0.954   3.731   8.731
  422    HG   LEU  69           HG       LEU  69   0.253   3.420  10.888
  423   HD11  LEU  69          1HD1      LEU  69  -0.222   1.367  12.252
  424   HD12  LEU  69          2HD1      LEU  69  -1.704   1.126  11.298
  425   HD13  LEU  69          3HD1      LEU  69  -1.522   2.559  12.333
  426   HD21  LEU  69          3HD2      LEU  69   1.335   1.307  10.373
  427   HD22  LEU  69          1HD2      LEU  69   0.993   2.185   8.875
  428   HD23  LEU  69          2HD2      LEU  69  -0.034   0.812   9.363
  429    H    GLY  70           H        GLY  70  -1.893   6.504   9.106
  430    HA2  GLY  70           2HA      GLY  70  -1.518   8.643  10.161
  431    HA3  GLY  70           3HA      GLY  70  -0.529   7.863  11.408
  432    H    TYR  71           H        TYR  71  -0.181   7.015   7.986
  433    HA   TYR  71           HA       TYR  71   2.350   8.624   7.784
  434    HB3  TYR  71           2HB      TYR  71   3.132   6.755   6.302
  435    HD1  TYR  71           2HD      TYR  71   4.813   7.402   8.035
  436    HD2  TYR  71           1HD      TYR  71   1.592   4.664   8.869
  437    HE1  TYR  71           2HE      TYR  71   6.071   6.537   9.978
  438    HE2  TYR  71           1HE      TYR  71   2.862   3.781  10.832
  439    HH   TYR  71           HH       TYR  71   6.142   4.998  11.655
  440    H    THR  72           H        THR  72   2.609   7.971   4.970
  441    HA   THR  72           HA       THR  72   0.222   8.360   3.428
  442    HB   THR  72           HB       THR  72   2.060  10.747   3.787
  443    HG1  THR  72           1HG      THR  72  -0.051  10.356   4.835
  444   HG21  THR  72          3HG2      THR  72   0.979  11.800   1.822
  445   HG22  THR  72          1HG2      THR  72   0.219  10.250   1.400
  446   HG23  THR  72          2HG2      THR  72   1.990  10.440   1.348
  447    H    LEU  73           H        LEU  73   0.696   7.852   1.215
  448    HA   LEU  73           HA       LEU  73   3.321   6.483   0.869
  449    HB3  LEU  73           2HB      LEU  73   1.157   5.271   0.683
  450    HG   LEU  73           HG       LEU  73   0.171   7.264  -0.907
  451   HD11  LEU  73          1HD1      LEU  73   0.043   6.381  -3.229
  452   HD12  LEU  73          2HD1      LEU  73   1.223   5.130  -2.814
  453   HD13  LEU  73          3HD1      LEU  73   1.674   6.848  -2.800
  454   HD21  LEU  73          3HD2      LEU  73  -0.510   4.305  -1.115
  455   HD22  LEU  73          1HD2      LEU  73  -1.583   5.648  -1.581
  456   HD23  LEU  73          2HD2      LEU  73  -1.132   5.427   0.116
  457    H    ALA  74           H        ALA  74   4.447   6.484  -1.149
  458    HA   ALA  74           HA       ALA  74   3.807   8.741  -3.013
  459    HB1  ALA  74           1HB      ALA  74   6.245   8.889  -3.471
  460    HB2  ALA  74           2HB      ALA  74   5.878   9.254  -1.773
  461    HB3  ALA  74           3HB      ALA  74   6.560   7.673  -2.222
  462    H    GLU  75           H        GLU  75   3.047   7.942  -4.883
  463    HA   GLU  75           HA       GLU  75   4.182   5.413  -5.984
  464    HB3  GLU  75           2HB      GLU  75   1.348   6.398  -6.501
  465    HG3  GLU  75           2HG      GLU  75   1.180   3.724  -6.390
  466    HA   PRO  76           HA       PRO  76   5.629   8.870  -8.370
  467    HB3  PRO  76           2HB      PRO  76   7.708   7.987  -8.127
  468    HG3  PRO  76           2HG      PRO  76   8.073   5.638  -8.207
  469    HD3  PRO  76           2HD      PRO  76   6.357   5.974  -6.636
  Start of MODEL   15
    1    H2   PRO   6           2H       PRO   6  -9.154  -4.405 -16.378
    2    HA   PRO   6           HA       PRO   6  -7.548  -6.799 -16.377
    3    HB3  PRO   6           2HB      PRO   6  -5.797  -5.938 -17.774
    4    HG3  PRO   6           2HG      PRO   6  -7.707  -6.770 -19.008
    5    HD3  PRO   6           2HD      PRO   6  -9.836  -5.829 -18.653
    6    H    LEU   7           H        LEU   7  -5.721  -6.645 -14.969
    7    HA   LEU   7           HA       LEU   7  -5.532  -4.279 -13.192
    8    HB3  LEU   7           2HB      LEU   7  -7.125  -5.510 -12.041
    9    HG   LEU   7           HG       LEU   7  -6.792  -7.782 -13.100
   10   HD11  LEU   7          1HD1      LEU   7  -5.430  -9.421 -11.834
   11   HD12  LEU   7          2HD1      LEU   7  -4.707  -8.098 -10.899
   12   HD13  LEU   7          3HD1      LEU   7  -4.422  -8.239 -12.649
   13   HD21  LEU   7          3HD2      LEU   7  -8.384  -7.327 -11.267
   14   HD22  LEU   7          1HD2      LEU   7  -7.098  -7.590 -10.071
   15   HD23  LEU   7          2HD2      LEU   7  -7.668  -8.932 -11.084
   16    H    LYS   8           H        LYS   8  -3.639  -4.171 -11.882
   17    HA   LYS   8           HA       LYS   8  -1.267  -5.608 -12.913
   18    HB3  LYS   8           2HB      LYS   8  -1.798  -4.396 -14.853
   19    HG3  LYS   8           2HG      LYS   8  -2.520  -2.097 -13.013
   20    HD3  LYS   8           2HD      LYS   8  -2.662  -0.741 -15.183
   21    HE3  LYS   8           2HE      LYS   8   0.030  -1.426 -13.911
   22    HZ1  LYS   8           3HZ      LYS   8  -0.766   0.847 -15.618
   23    HZ2  LYS   8           1HZ      LYS   8   0.432  -0.237 -15.899
   24    HZ3  LYS   8           2HZ      LYS   8   0.591   0.848 -14.680
   25    H    THR   9           H        THR   9   0.740  -4.895 -12.181
   26    HA   THR   9           HA       THR   9   0.571  -4.194  -9.347
   27    HB   THR   9           HB       THR   9   1.762  -6.177 -10.395
   28    HG1  THR   9           1HG      THR   9   3.197  -6.147  -8.736
   29   HG21  THR   9          3HG2      THR   9   4.084  -4.214 -10.605
   30   HG22  THR   9          1HG2      THR   9   3.148  -4.757 -12.012
   31   HG23  THR   9          2HG2      THR   9   4.053  -5.934 -11.045
   32    H    GLN  10           H        GLN  10   2.174  -2.962  -8.261
   33    HA   GLN  10           HA       GLN  10   3.399  -0.635  -9.546
   34    HB3  GLN  10           2HB      GLN  10   0.988  -0.407  -7.665
   35    HG3  GLN  10           2HG      GLN  10   2.534   1.450  -7.228
   36   HE21  GLN  10          1HE2      GLN  10   4.442   2.332  -8.067
   37   HE22  GLN  10          2HE2      GLN  10   4.650   2.742  -9.769
   38    H    GLN  11           H        GLN  11   5.162  -0.047  -8.312
   39    HA   GLN  11           HA       GLN  11   5.309  -0.977  -5.489
   40    HB3  GLN  11           2HB      GLN  11   7.550   0.347  -7.025
   41    HG3  GLN  11           2HG      GLN  11   7.734  -1.981  -5.074
   42   HE21  GLN  11          1HE2      GLN  11   9.620  -1.866  -7.115
   43   HE22  GLN  11          2HE2      GLN  11  11.060  -1.017  -6.546
   44    H    MET  12           H        MET  12   5.951   0.498  -3.839
   45    HA   MET  12           HA       MET  12   6.263   3.352  -4.395
   46    HB3  MET  12           2HB      MET  12   3.855   3.220  -4.091
   47    HG3  MET  12           2HG      MET  12   4.416   2.063  -1.330
   48    HE1  MET  12           3HE      MET  12   1.647   2.956  -4.096
   49    HE2  MET  12           1HE      MET  12   1.469   1.228  -3.711
   50    HE3  MET  12           2HE      MET  12   0.210   2.390  -3.231
   51    H    GLN  13           H        GLN  13   7.140   4.503  -2.554
   52    HA   GLN  13           HA       GLN  13   8.445   2.796  -0.471
   53    HB3  GLN  13           2HB      GLN  13   8.966   5.703  -1.197
   54    HG3  GLN  13           2HG      GLN  13  10.587   3.856   0.597
   55   HE21  GLN  13          1HE2      GLN  13  12.664   4.435  -0.171
   56   HE22  GLN  13          2HE2      GLN  13  13.235   6.097  -0.156
   57    H    VAL  14           H        VAL  14   8.099   3.464   1.794
   58    HA   VAL  14           HA       VAL  14   5.777   5.197   2.335
   59    HB   VAL  14           HB       VAL  14   4.465   3.361   2.399
   60   HG11  VAL  14          1HG1      VAL  14   5.136   1.044   3.065
   61   HG12  VAL  14          2HG1      VAL  14   5.952   1.653   1.626
   62   HG13  VAL  14          3HG1      VAL  14   6.814   1.624   3.172
   63   HG21  VAL  14          3HG2      VAL  14   5.626   3.092   5.168
   64   HG22  VAL  14          1HG2      VAL  14   4.385   4.249   4.667
   65   HG23  VAL  14          2HG2      VAL  14   4.041   2.521   4.605
   66    H    GLY  15           H        GLY  15   6.023   6.413   3.999
   67    HA2  GLY  15           2HA      GLY  15   8.603   6.434   5.412
   68    HA3  GLY  15           3HA      GLY  15   7.341   7.683   5.456
   69    H    GLY  16           H        GLY  16   8.882   5.397   7.218
   70    HA2  GLY  16           2HA      GLY  16   8.738   5.126   9.481
   71    HA3  GLY  16           3HA      GLY  16   7.113   5.837   9.480
   72    H    MET  17           H        MET  17   6.504   3.362   7.367
   73    HA   MET  17           HA       MET  17   5.332   1.867   9.537
   74    HB3  MET  17           2HB      MET  17   4.522   2.266   7.059
   75    HG3  MET  17           2HG      MET  17   4.653   0.371   5.624
   76    HE1  MET  17           3HE      MET  17   6.439  -0.957   4.049
   77    HE2  MET  17           1HE      MET  17   8.165  -1.032   4.428
   78    HE3  MET  17           2HE      MET  17   7.004  -1.769   5.535
   79    H    ARG  18           H        ARG  18   8.458   1.700   8.714
   80    HA   ARG  18           HA       ARG  18   9.023  -0.976   8.182
   81    HB3  ARG  18           2HB      ARG  18  10.542   0.643   7.487
   82    HG3  ARG  18           2HG      ARG  18  10.835   1.506  10.394
   83    HD3  ARG  18           2HD      ARG  18  13.067   1.224   9.343
   84    HE   ARG  18           HE       ARG  18  11.894   2.683   7.120
   85   HH11  ARG  18          1HH1      ARG  18  14.971   2.231   8.860
   86   HH12  ARG  18          2HH1      ARG  18  15.913   2.761   7.477
   87   HH21  ARG  18          1HH2      ARG  18  13.260   3.399   5.387
   88   HH22  ARG  18          2HH2      ARG  18  14.990   3.360   5.635
   89    H    CYS  19           H        CYS  19   7.606  -1.936   9.833
   90    HA   CYS  19           HA       CYS  19   9.268  -3.305  11.839
   91    HB3  CYS  19           2HB      CYS  19   6.909  -1.498  12.509
   92    HG   CYS  19           HG       CYS  19   6.855  -2.320  14.998
   93    H    ALA  20           H        ALA  20   8.626  -5.423  12.078
   94    HA   ALA  20           HA       ALA  20   7.072  -6.572  10.012
   95    HB1  ALA  20           1HB      ALA  20   8.948  -7.648  11.278
   96    HB2  ALA  20           2HB      ALA  20   7.872  -7.804  12.683
   97    HB3  ALA  20           3HB      ALA  20   7.502  -8.673  11.180
   98    H    ALA  21           H        ALA  21   6.006  -5.565  13.216
   99    HA   ALA  21           HA       ALA  21   3.348  -6.796  12.973
  100    HB1  ALA  21           1HB      ALA  21   4.472  -6.448  15.159
  101    HB2  ALA  21           2HB      ALA  21   4.447  -4.687  14.893
  102    HB3  ALA  21           3HB      ALA  21   2.929  -5.591  15.066
  103    H    CYS  22           H        CYS  22   4.793  -3.605  12.233
  104    HA   CYS  22           HA       CYS  22   2.215  -2.338  11.762
  105    HB3  CYS  22           2HB      CYS  22   3.668  -0.452  10.953
  106    HG   CYS  22           HG       CYS  22   2.868  -0.545  13.410
  107    H    ALA  23           H        ALA  23   4.642  -3.868   9.612
  108    HA   ALA  23           HA       ALA  23   3.330  -3.578   7.132
  109    HB1  ALA  23           1HB      ALA  23   4.674  -6.006   8.398
  110    HB2  ALA  23           2HB      ALA  23   4.312  -5.803   6.669
  111    HB3  ALA  23           3HB      ALA  23   5.459  -4.718   7.465
  112    H    SER  24           H        SER  24   2.447  -5.656   9.957
  113    HA   SER  24           HA       SER  24   0.279  -6.975   8.524
  114    HB3  SER  24           2HB      SER  24  -0.383  -7.883  10.688
  115    HG   SER  24           HG       SER  24   1.547  -9.021  11.095
  116    H    SER  25           H        SER  25   0.465  -3.948  10.426
  117    HA   SER  25           HA       SER  25  -2.378  -3.598  10.598
  118    HB3  SER  25           2HB      SER  25  -1.977  -1.263  10.918
  119    HG   SER  25           HG       SER  25  -1.358  -2.183  12.749
  120    H    ILE  26           H        ILE  26  -0.062  -2.977   7.958
  121    HA   ILE  26           HA       ILE  26  -2.090  -1.844   6.159
  122    HB   ILE  26           HB       ILE  26   0.689  -3.003   5.713
  123   HG13  ILE  26          2HG1      ILE  26  -0.570  -0.243   5.391
  124   HG21  ILE  26          1HG2      ILE  26   0.481  -2.478   3.323
  125   HG22  ILE  26          2HG2      ILE  26  -0.618  -3.756   3.775
  126   HG23  ILE  26          3HG2      ILE  26  -1.247  -2.105   3.541
  127   HD11  ILE  26          3HD1      ILE  26   1.404   0.547   6.628
  128   HD12  ILE  26          1HD1      ILE  26   0.530  -0.642   7.608
  129   HD13  ILE  26          2HD1      ILE  26   2.018  -1.114   6.761
  130    H    GLU  27           H        GLU  27  -0.648  -5.125   6.420
  131    HA   GLU  27           HA       GLU  27  -2.236  -6.159   4.321
  132    HB3  GLU  27           2HB      GLU  27  -1.518  -8.411   5.198
  133    HG3  GLU  27           2HG      GLU  27   0.748  -6.385   5.026
  134    H    ARG  28           H        ARG  28  -2.972  -6.025   7.799
  135    HA   ARG  28           HA       ARG  28  -4.889  -8.036   8.013
  136    HB3  ARG  28           2HB      ARG  28  -4.707  -5.358   9.451
  137    HG3  ARG  28           2HG      ARG  28  -6.214  -7.908  10.197
  138    HD3  ARG  28           2HD      ARG  28  -6.731  -6.748  12.330
  139    HE   ARG  28           HE       ARG  28  -4.930  -8.338  12.458
  140   HH11  ARG  28          1HH1      ARG  28  -3.764  -4.960  12.459
  141   HH12  ARG  28          2HH1      ARG  28  -2.213  -5.456  13.122
  142   HH21  ARG  28          1HH2      ARG  28  -2.932  -8.831  13.240
  143   HH22  ARG  28          2HH2      ARG  28  -1.838  -7.558  13.713
  144    H    ALA  29           H        ALA  29  -5.361  -4.806   6.622
  145    HA   ALA  29           HA       ALA  29  -8.171  -5.637   5.928
  146    HB1  ALA  29           1HB      ALA  29  -7.071  -2.825   5.799
  147    HB2  ALA  29           2HB      ALA  29  -8.746  -3.353   5.638
  148    HB3  ALA  29           3HB      ALA  29  -7.942  -3.482   7.212
  149    H    LEU  30           H        LEU  30  -5.026  -4.611   4.460
  150    HA   LEU  30           HA       LEU  30  -5.953  -3.984   1.923
  151    HB3  LEU  30           2HB      LEU  30  -3.392  -5.425   2.688
  152    HG   LEU  30           HG       LEU  30  -3.505  -5.423   0.253
  153   HD11  LEU  30          1HD1      LEU  30  -4.060  -2.432   0.510
  154   HD12  LEU  30          2HD1      LEU  30  -5.102  -3.663  -0.246
  155   HD13  LEU  30          3HD1      LEU  30  -3.564  -3.235  -0.994
  156   HD21  LEU  30          3HD2      LEU  30  -1.471  -4.091  -0.191
  157   HD22  LEU  30          1HD2      LEU  30  -1.343  -4.949   1.356
  158   HD23  LEU  30          2HD2      LEU  30  -1.705  -3.206   1.325
  159    H    GLU  31           H        GLU  31  -5.524  -7.313   3.139
  160    HA   GLU  31           HA       GLU  31  -6.089  -8.456   0.488
  161    HB3  GLU  31           2HB      GLU  31  -5.782 -10.602   1.538
  162    HG3  GLU  31           2HG      GLU  31  -3.701  -8.712   2.717
  163    H    ARG  32           H        ARG  32  -8.002  -7.097   2.825
  164    HA   ARG  32           HA       ARG  32 -10.447  -8.558   2.001
  165    HB3  ARG  32           2HB      ARG  32 -11.473  -7.318   3.985
  166    HG3  ARG  32           2HG      ARG  32 -10.109  -8.558   5.797
  167    HD3  ARG  32           2HD      ARG  32 -12.280  -9.365   4.823
  168    HE   ARG  32           HE       ARG  32 -10.506 -11.155   3.181
  169   HH11  ARG  32          1HH1      ARG  32 -13.644  -9.376   3.366
  170   HH12  ARG  32          2HH1      ARG  32 -14.194 -10.210   1.925
  171   HH21  ARG  32          1HH2      ARG  32 -11.362 -11.894   1.179
  172   HH22  ARG  32          2HH2      ARG  32 -13.006 -11.446   0.772
  173    H    LEU  33           H        LEU  33  -8.690  -5.652   1.418
  174    HA   LEU  33           HA       LEU  33 -10.929  -3.869   0.918
  175    HB3  LEU  33           2HB      LEU  33  -9.208  -2.615  -0.485
  176    HG   LEU  33           HG       LEU  33  -8.181  -3.234   2.299
  177   HD11  LEU  33          1HD1      LEU  33  -7.698  -0.815   0.523
  178   HD12  LEU  33          2HD1      LEU  33  -6.558  -2.153   0.715
  179   HD13  LEU  33          3HD1      LEU  33  -6.971  -1.147   2.109
  180   HD21  LEU  33          3HD2      LEU  33  -9.277  -1.160   3.000
  181   HD22  LEU  33          1HD2      LEU  33 -10.471  -2.349   2.466
  182   HD23  LEU  33          2HD2      LEU  33 -10.019  -0.991   1.396
  183    H    LYS  34           H        LYS  34 -12.072  -3.415  -0.833
  184    HA   LYS  34           HA       LYS  34 -12.369  -5.404  -2.942
  185    HB3  LYS  34           2HB      LYS  34 -14.143  -3.805  -3.715
  186    HG3  LYS  34           2HG      LYS  34 -14.220  -4.410  -0.717
  187    HD3  LYS  34           2HD      LYS  34 -16.691  -4.453  -1.077
  188    HE3  LYS  34           2HE      LYS  34 -17.149  -2.038  -1.265
  189    HZ1  LYS  34           3HZ      LYS  34 -16.140  -2.847   0.833
  190    HZ2  LYS  34           1HZ      LYS  34 -15.771  -1.269   0.523
  191    HZ3  LYS  34           2HZ      LYS  34 -14.648  -2.415   0.289
  192    H    GLY  35           H        GLY  35 -12.286  -4.947  -5.254
  193    HA2  GLY  35           2HA      GLY  35 -11.398  -4.133  -7.211
  194    HA3  GLY  35           3HA      GLY  35 -10.937  -2.648  -6.350
  195    H    VAL  36           H        VAL  36  -9.114  -3.300  -4.616
  196    HA   VAL  36           HA       VAL  36  -6.711  -3.999  -6.065
  197    HB   VAL  36           HB       VAL  36  -6.738  -2.389  -4.229
  198   HG11  VAL  36          1HG1      VAL  36  -8.336  -3.511  -2.699
  199   HG12  VAL  36          2HG1      VAL  36  -7.097  -4.725  -2.316
  200   HG13  VAL  36          3HG1      VAL  36  -6.839  -3.018  -1.904
  201   HG21  VAL  36          3HG2      VAL  36  -4.606  -3.463  -4.805
  202   HG22  VAL  36          1HG2      VAL  36  -4.692  -3.044  -3.095
  203   HG23  VAL  36          2HG2      VAL  36  -4.899  -4.733  -3.595
  204    H    ALA  37           H        ALA  37  -5.421  -5.837  -5.945
  205    HA   ALA  37           HA       ALA  37  -7.008  -8.311  -5.381
  206    HB1  ALA  37           1HB      ALA  37  -6.817  -7.634  -7.726
  207    HB2  ALA  37           2HB      ALA  37  -5.043  -7.655  -7.612
  208    HB3  ALA  37           3HB      ALA  37  -5.967  -9.161  -7.433
  209    H    GLU  38           H        GLU  38  -3.497  -7.273  -5.525
  210    HA   GLU  38           HA       GLU  38  -2.828  -9.291  -3.566
  211    HB3  GLU  38           2HB      GLU  38  -2.948 -10.799  -5.420
  212    HG3  GLU  38           2HG      GLU  38  -0.975  -8.975  -6.844
  213    H    ALA  39           H        ALA  39  -0.889  -8.971  -2.506
  214    HA   ALA  39           HA       ALA  39   0.845  -6.734  -3.441
  215    HB1  ALA  39           1HB      ALA  39  -1.202  -5.836  -2.334
  216    HB2  ALA  39           2HB      ALA  39  -0.812  -6.776  -0.879
  217    HB3  ALA  39           3HB      ALA  39   0.265  -5.466  -1.412
  218    H    SER  40           H        SER  40   2.445  -6.153  -1.630
  219    HA   SER  40           HA       SER  40   3.087  -8.065   0.428
  220    HB3  SER  40           2HB      SER  40   5.121  -7.866  -1.821
  221    HG   SER  40           HG       SER  40   6.403  -8.805  -0.433
  222    H    VAL  41           H        VAL  41   4.326  -7.115   2.017
  223    HA   VAL  41           HA       VAL  41   5.217  -4.285   1.612
  224    HB   VAL  41           HB       VAL  41   4.814  -5.736   4.272
  225   HG11  VAL  41          1HG1      VAL  41   6.267  -3.786   4.443
  226   HG12  VAL  41          2HG1      VAL  41   5.097  -2.795   3.540
  227   HG13  VAL  41          3HG1      VAL  41   4.700  -3.409   5.158
  228   HG21  VAL  41          3HG2      VAL  41   2.612  -5.635   3.154
  229   HG22  VAL  41          1HG2      VAL  41   2.686  -4.476   4.480
  230   HG23  VAL  41          2HG2      VAL  41   2.853  -3.910   2.807
  231    H    THR  42           H        THR  42   7.330  -3.686   2.009
  232    HA   THR  42           HA       THR  42   9.308  -5.748   2.920
  233    HB   THR  42           HB       THR  42   9.735  -3.591   0.820
  234    HG1  THR  42           1HG      THR  42   8.622  -5.352   0.043
  235   HG21  THR  42          3HG2      THR  42  11.814  -3.923   2.074
  236   HG22  THR  42          1HG2      THR  42  11.944  -4.752   0.519
  237   HG23  THR  42          2HG2      THR  42  11.634  -5.683   1.991
  238    H    VAL  43           H        VAL  43   9.137  -5.143   4.998
  239    HA   VAL  43           HA       VAL  43   9.262  -2.520   6.084
  240    HB   VAL  43           HB       VAL  43   9.726  -5.314   7.082
  241   HG11  VAL  43          1HG1      VAL  43  11.477  -4.312   8.372
  242   HG12  VAL  43          2HG1      VAL  43  10.489  -2.888   8.733
  243   HG13  VAL  43          3HG1      VAL  43  10.064  -4.472   9.420
  244   HG21  VAL  43          3HG2      VAL  43   7.957  -2.998   7.990
  245   HG22  VAL  43          1HG2      VAL  43   7.495  -4.191   6.780
  246   HG23  VAL  43          2HG2      VAL  43   7.803  -4.720   8.445
  247    H    ALA  44           H        ALA  44  11.902  -4.787   5.186
  248    HA   ALA  44           HA       ALA  44  14.006  -3.683   6.615
  249    HB1  ALA  44           1HB      ALA  44  14.014  -4.981   3.846
  250    HB2  ALA  44           2HB      ALA  44  15.430  -4.797   4.899
  251    HB3  ALA  44           3HB      ALA  44  14.074  -5.822   5.410
  252    H    THR  45           H        THR  45  12.739  -2.444   3.578
  253    HA   THR  45           HA       THR  45  14.620  -0.118   3.690
  254    HB   THR  45           HB       THR  45  14.410  -0.044   1.182
  255    HG1  THR  45           1HG      THR  45  13.919  -2.655   0.871
  256   HG21  THR  45          3HG2      THR  45  16.074  -1.738   0.779
  257   HG22  THR  45          1HG2      THR  45  15.627  -2.625   2.258
  258   HG23  THR  45          2HG2      THR  45  16.375  -1.027   2.375
  259    H    GLY  46           H        GLY  46  11.445  -0.905   4.172
  260    HA2  GLY  46           2HA      GLY  46   9.662   0.489   4.581
  261    HA3  GLY  46           3HA      GLY  46  10.656   1.873   4.120
  262    H    ARG  47           H        ARG  47   9.427  -1.008   2.332
  263    HA   ARG  47           HA       ARG  47   8.237   0.805   0.278
  264    HB3  ARG  47           2HB      ARG  47   9.178  -0.573  -1.511
  265    HG3  ARG  47           2HG      ARG  47  11.416   0.302   0.362
  266    HD3  ARG  47           2HD      ARG  47  12.689   0.722  -1.670
  267    HE   ARG  47           HE       ARG  47  12.967  -1.523  -0.787
  268   HH11  ARG  47          1HH1      ARG  47  10.894  -1.443  -3.671
  269   HH12  ARG  47          2HH1      ARG  47  10.968  -3.180  -3.865
  270   HH21  ARG  47          1HH2      ARG  47  13.196  -3.697  -1.236
  271   HH22  ARG  47          2HH2      ARG  47  12.119  -4.436  -2.399
  272    H    LEU  48           H        LEU  48   6.869  -0.358  -1.284
  273    HA   LEU  48           HA       LEU  48   5.410  -2.722  -0.237
  274    HB3  LEU  48           2HB      LEU  48   3.651  -0.482  -1.070
  275    HG   LEU  48           HG       LEU  48   3.818  -2.097   1.504
  276   HD11  LEU  48          1HD1      LEU  48   1.625  -1.024   2.011
  277   HD12  LEU  48          2HD1      LEU  48   1.788  -0.038   0.543
  278   HD13  LEU  48          3HD1      LEU  48   2.927   0.171   1.895
  279   HD21  LEU  48          3HD2      LEU  48   1.817  -2.174  -0.823
  280   HD22  LEU  48          1HD2      LEU  48   1.636  -3.063   0.705
  281   HD23  LEU  48          2HD2      LEU  48   2.960  -3.454  -0.386
  282    H    THR  49           H        THR  49   4.207  -3.784  -1.807
  283    HA   THR  49           HA       THR  49   4.234  -2.776  -4.620
  284    HB   THR  49           HB       THR  49   4.705  -5.687  -3.898
  285    HG1  THR  49           1HG      THR  49   6.766  -4.336  -5.113
  286   HG21  THR  49          3HG2      THR  49   3.735  -5.342  -6.133
  287   HG22  THR  49          1HG2      THR  49   5.429  -5.821  -6.284
  288   HG23  THR  49          2HG2      THR  49   4.969  -4.119  -6.512
  289    H    VAL  50           H        VAL  50   2.269  -2.966  -5.567
  290    HA   VAL  50           HA       VAL  50   0.182  -4.730  -4.416
  291    HB   VAL  50           HB       VAL  50   0.119  -2.767  -2.980
  292   HG11  VAL  50          1HG1      VAL  50  -0.486  -0.543  -3.752
  293   HG12  VAL  50          2HG1      VAL  50   1.019  -1.043  -4.531
  294   HG13  VAL  50          3HG1      VAL  50  -0.508  -1.078  -5.440
  295   HG21  VAL  50          3HG2      VAL  50  -2.292  -2.784  -4.832
  296   HG22  VAL  50          1HG2      VAL  50  -1.995  -3.948  -3.525
  297   HG23  VAL  50          2HG2      VAL  50  -2.243  -2.234  -3.155
  298    H    THR  51           H        THR  51  -1.336  -5.367  -5.757
  299    HA   THR  51           HA       THR  51  -1.430  -4.372  -8.571
  300    HB   THR  51           HB       THR  51  -2.077  -7.063  -7.289
  301    HG1  THR  51           1HG      THR  51  -0.375  -7.369  -9.188
  302   HG21  THR  51          3HG2      THR  51  -2.215  -6.318 -10.258
  303   HG22  THR  51          1HG2      THR  51  -3.632  -6.606  -9.233
  304   HG23  THR  51          2HG2      THR  51  -2.507  -7.917  -9.543
  305    H    TYR  52           H        TYR  52  -3.264  -3.477  -9.312
  306    HA   TYR  52           HA       TYR  52  -5.871  -4.109  -8.085
  307    HB3  TYR  52           2HB      TYR  52  -5.195  -2.302  -6.689
  308    HD1  TYR  52           2HD      TYR  52  -5.764  -0.134  -9.672
  309    HD2  TYR  52           1HD      TYR  52  -2.980  -1.389  -6.627
  310    HE1  TYR  52           2HE      TYR  52  -4.278   1.779 -10.244
  311    HE2  TYR  52           1HE      TYR  52  -1.499   0.527  -7.189
  312    HH   TYR  52           HH       TYR  52  -2.273   2.873  -9.784
  313    H    ASP  53           H        ASP  53  -7.733  -3.274  -9.222
  314    HA   ASP  53           HA       ASP  53  -7.428  -3.102 -12.146
  315    HB3  ASP  53           2HB      ASP  53  -9.803  -3.357 -10.272
  316    HA   PRO  54           HA       PRO  54  -7.260   1.310 -11.283
  317    HB3  PRO  54           2HB      PRO  54  -5.565   1.308 -12.851
  318    HG3  PRO  54           2HG      PRO  54  -5.759   0.067 -14.895
  319    HD3  PRO  54           2HD      PRO  54  -6.008  -1.491 -13.137
  320    H    LYS  55           H        LYS  55  -9.932  -0.187 -12.247
  321    HA   LYS  55           HA       LYS  55 -11.402   2.277 -13.160
  322    HB3  LYS  55           2HB      LYS  55 -12.952   0.829 -14.352
  323    HG3  LYS  55           2HG      LYS  55 -11.623  -0.161 -16.121
  324    HD3  LYS  55           2HD      LYS  55 -10.193   2.391 -15.277
  325    HE3  LYS  55           2HE      LYS  55 -10.807   1.043 -17.942
  326    HZ1  LYS  55           3HZ      LYS  55  -9.588   2.871 -18.918
  327    HZ2  LYS  55           1HZ      LYS  55  -9.411   3.613 -17.458
  328    HZ3  LYS  55           2HZ      LYS  55 -10.903   3.446 -18.138
  329    H    GLN  56           H        GLN  56 -11.560  -0.714 -11.192
  330    HA   GLN  56           HA       GLN  56 -13.808   0.243  -9.584
  331    HB3  GLN  56           2HB      GLN  56 -12.609  -1.449  -7.888
  332    HG3  GLN  56           2HG      GLN  56 -13.701  -3.362  -8.777
  333   HE21  GLN  56          1HE2      GLN  56 -14.812  -1.708  -7.036
  334   HE22  GLN  56          2HE2      GLN  56 -16.260  -0.906  -7.643
  335    H    VAL  57           H        VAL  57 -10.234   0.614  -9.347
  336    HA   VAL  57           HA       VAL  57 -10.597   2.654  -7.248
  337    HB   VAL  57           HB       VAL  57  -9.086   1.593  -5.652
  338   HG11  VAL  57          1HG1      VAL  57 -11.416  -0.291  -6.143
  339   HG12  VAL  57          2HG1      VAL  57 -10.543  -0.034  -4.632
  340   HG13  VAL  57          3HG1      VAL  57 -11.521   1.279  -5.308
  341   HG21  VAL  57          3HG2      VAL  57  -7.823   0.073  -7.138
  342   HG22  VAL  57          1HG2      VAL  57  -8.496  -0.799  -5.758
  343   HG23  VAL  57          2HG2      VAL  57  -9.267  -0.942  -7.351
  344    H    SER  58           H        SER  58  -8.263   3.285  -6.422
  345    HA   SER  58           HA       SER  58  -6.117   2.835  -8.398
  346    HB3  SER  58           2HB      SER  58  -6.894   5.630  -7.458
  347    HG   SER  58           HG       SER  58  -4.898   5.960  -8.055
  348    H    GLU  59           H        GLU  59  -4.095   4.162  -7.263
  349    HA   GLU  59           HA       GLU  59  -3.411   2.912  -4.821
  350    HB3  GLU  59           2HB      GLU  59  -1.583   3.632  -5.908
  351    HG3  GLU  59           2HG      GLU  59  -2.467   5.057  -7.652
  352    H    ILE  60           H        ILE  60  -5.272   5.871  -5.283
  353    HA   ILE  60           HA       ILE  60  -5.542   6.961  -2.740
  354    HB   ILE  60           HB       ILE  60  -7.443   6.382  -5.000
  355   HG13  ILE  60          2HG1      ILE  60  -5.646   8.188  -5.010
  356   HG21  ILE  60          1HG2      ILE  60  -8.293   7.666  -2.377
  357   HG22  ILE  60          2HG2      ILE  60  -9.235   7.684  -3.885
  358   HG23  ILE  60          3HG2      ILE  60  -8.929   6.156  -3.092
  359   HD11  ILE  60          3HD1      ILE  60  -7.652   8.375  -6.485
  360   HD12  ILE  60          1HD1      ILE  60  -8.458   9.318  -5.207
  361   HD13  ILE  60          2HD1      ILE  60  -6.988   9.938  -5.964
  362    H    THR  61           H        THR  61  -6.875   3.790  -3.713
  363    HA   THR  61           HA       THR  61  -8.393   3.362  -1.289
  364    HB   THR  61           HB       THR  61  -7.459   1.640  -3.591
  365    HG1  THR  61           1HG      THR  61  -9.148   3.043  -3.933
  366   HG21  THR  61          3HG2      THR  61  -8.995  -0.138  -2.754
  367   HG22  THR  61          1HG2      THR  61  -9.099   0.707  -1.191
  368   HG23  THR  61          2HG2      THR  61  -7.550   0.030  -1.754
  369    H    ILE  62           H        ILE  62  -5.017   2.673  -2.073
  370    HA   ILE  62           HA       ILE  62  -4.683   1.312   0.581
  371    HB   ILE  62           HB       ILE  62  -3.700   0.251  -1.426
  372   HG13  ILE  62          2HG1      ILE  62  -2.868  -0.297   0.746
  373   HG21  ILE  62          1HG2      ILE  62  -3.065   2.171  -2.741
  374   HG22  ILE  62          2HG2      ILE  62  -1.832   2.653  -1.543
  375   HG23  ILE  62          3HG2      ILE  62  -1.680   1.157  -2.491
  376   HD11  ILE  62          3HD1      ILE  62  -0.388   0.141  -0.985
  377   HD12  ILE  62          1HD1      ILE  62  -0.635  -1.070   0.300
  378   HD13  ILE  62          2HD1      ILE  62  -1.542  -1.193  -1.218
  379    H    GLN  63           H        GLN  63  -3.958   4.351  -1.056
  380    HA   GLN  63           HA       GLN  63  -2.355   5.612   0.901
  381    HB3  GLN  63           2HB      GLN  63  -4.559   6.755  -0.850
  382    HG3  GLN  63           2HG      GLN  63  -2.134   8.154   0.317
  383   HE21  GLN  63          1HE2      GLN  63  -5.261   9.510  -0.781
  384   HE22  GLN  63          2HE2      GLN  63  -4.587  10.286  -2.223
  385    H    GLU  64           H        GLU  64  -5.996   5.596   0.699
  386    HA   GLU  64           HA       GLU  64  -6.284   6.934   3.186
  387    HB3  GLU  64           2HB      GLU  64  -8.059   6.797   1.457
  388    HG3  GLU  64           2HG      GLU  64  -8.123   3.906   2.276
  389    H    ARG  65           H        ARG  65  -5.062   3.838   2.811
  390    HA   ARG  65           HA       ARG  65  -5.771   3.100   5.610
  391    HB3  ARG  65           2HB      ARG  65  -4.249   1.413   3.568
  392    HG3  ARG  65           2HG      ARG  65  -5.115   1.138   6.448
  393    HD3  ARG  65           2HD      ARG  65  -4.483  -1.319   4.802
  394    HE   ARG  65           HE       ARG  65  -4.316  -1.958   7.057
  395   HH11  ARG  65          1HH1      ARG  65  -7.332  -0.064   6.734
  396   HH12  ARG  65          2HH1      ARG  65  -7.693  -0.259   8.426
  397   HH21  ARG  65          1HH2      ARG  65  -4.839  -2.154   9.119
  398   HH22  ARG  65          2HH2      ARG  65  -6.269  -1.429   9.805
  399    H    ILE  66           H        ILE  66  -2.879   3.539   3.474
  400    HA   ILE  66           HA       ILE  66  -0.957   3.304   5.600
  401    HB   ILE  66           HB       ILE  66  -0.732   4.811   2.963
  402   HG13  ILE  66          2HG1      ILE  66  -1.201   2.168   3.032
  403   HG21  ILE  66          1HG2      ILE  66   1.755   4.465   3.287
  404   HG22  ILE  66          2HG2      ILE  66   1.055   5.524   4.506
  405   HG23  ILE  66          3HG2      ILE  66   1.422   3.827   4.903
  406   HD11  ILE  66          3HD1      ILE  66   0.318   1.827   1.101
  407   HD12  ILE  66          1HD1      ILE  66  -0.687   3.276   0.953
  408   HD13  ILE  66          2HD1      ILE  66   1.040   3.415   1.387
  409    H    ALA  67           H        ALA  67  -2.552   6.257   4.311
  410    HA   ALA  67           HA       ALA  67  -1.201   8.068   6.066
  411    HB1  ALA  67           1HB      ALA  67  -3.054   9.597   5.419
  412    HB2  ALA  67           2HB      ALA  67  -2.366   8.761   4.014
  413    HB3  ALA  67           3HB      ALA  67  -3.927   8.239   4.687
  414    H    ALA  68           H        ALA  68  -4.209   6.163   6.431
  415    HA   ALA  68           HA       ALA  68  -5.128   7.386   8.881
  416    HB1  ALA  68           1HB      ALA  68  -6.595   6.289   7.221
  417    HB2  ALA  68           2HB      ALA  68  -5.836   4.719   7.565
  418    HB3  ALA  68           3HB      ALA  68  -6.768   5.550   8.823
  419    H    LEU  69           H        LEU  69  -2.993   4.664   8.204
  420    HA   LEU  69           HA       LEU  69  -2.749   3.780  10.998
  421    HB3  LEU  69           2HB      LEU  69  -0.843   2.470  10.003
  422    HG   LEU  69           HG       LEU  69  -3.520   2.216   8.553
  423   HD11  LEU  69          1HD1      LEU  69  -1.215   0.254   8.798
  424   HD12  LEU  69          2HD1      LEU  69  -1.649   1.158   7.329
  425   HD13  LEU  69          3HD1      LEU  69  -2.774  -0.036   7.994
  426   HD21  LEU  69          3HD2      LEU  69  -3.889   1.904  10.913
  427   HD22  LEU  69          1HD2      LEU  69  -2.428   0.911  11.075
  428   HD23  LEU  69          2HD2      LEU  69  -3.837   0.305  10.173
  429    H    GLY  70           H        GLY  70  -1.850   6.636   9.605
  430    HA2  GLY  70           2HA      GLY  70  -0.736   8.362  10.662
  431    HA3  GLY  70           3HA      GLY  70   0.034   7.205  11.781
  432    H    TYR  71           H        TYR  71   0.467   6.132   8.628
  433    HA   TYR  71           HA       TYR  71   3.261   7.147   8.523
  434    HB3  TYR  71           2HB      TYR  71   3.589   5.280   6.960
  435    HD1  TYR  71           1HD      TYR  71   4.522   5.524   9.600
  436    HD2  TYR  71           2HD      TYR  71   1.278   3.055   8.200
  437    HE1  TYR  71           1HE      TYR  71   4.688   4.145  11.660
  438    HE2  TYR  71           2HE      TYR  71   1.452   1.659  10.251
  439    HH   TYR  71           HH       TYR  71   2.444   1.407  12.296
  440    H    THR  72           H        THR  72   3.889   7.142   5.947
  441    HA   THR  72           HA       THR  72   1.942   8.773   4.398
  442    HB   THR  72           HB       THR  72   3.945  10.173   3.621
  443    HG1  THR  72           1HG      THR  72   5.738   9.304   4.338
  444   HG21  THR  72          3HG2      THR  72   2.264  11.103   5.162
  445   HG22  THR  72          1HG2      THR  72   3.887  11.719   5.504
  446   HG23  THR  72          2HG2      THR  72   3.173  10.474   6.552
  447    H    LEU  73           H        LEU  73   2.691   8.835   2.003
  448    HA   LEU  73           HA       LEU  73   4.303   6.426   1.343
  449    HB3  LEU  73           2HB      LEU  73   1.752   5.963   1.424
  450    HG   LEU  73           HG       LEU  73   1.943   7.005  -1.435
  451   HD11  LEU  73          1HD1      LEU  73  -0.306   5.642   0.087
  452   HD12  LEU  73          2HD1      LEU  73   0.692   4.913  -1.184
  453   HD13  LEU  73          3HD1      LEU  73  -0.398   6.244  -1.584
  454   HD21  LEU  73          3HD2      LEU  73   0.273   8.082   0.882
  455   HD22  LEU  73          1HD2      LEU  73   0.016   8.492  -0.833
  456   HD23  LEU  73          2HD2      LEU  73   1.517   8.950  -0.049
  457    H    ALA  74           H        ALA  74   4.914   6.199  -0.835
  458    HA   ALA  74           HA       ALA  74   5.052   8.666  -2.493
  459    HB1  ALA  74           1HB      ALA  74   7.352   7.065  -1.333
  460    HB2  ALA  74           2HB      ALA  74   7.544   8.222  -2.665
  461    HB3  ALA  74           3HB      ALA  74   6.989   8.772  -1.072
  462    H    GLU  75           H        GLU  75   3.495   7.545  -3.710
  463    HA   GLU  75           HA       GLU  75   4.369   5.275  -5.400
  464    HB3  GLU  75           2HB      GLU  75   1.726   6.792  -5.415
  465    HG3  GLU  75           2HG      GLU  75   0.940   4.507  -6.259
  466    HA   PRO  76           HA       PRO  76   6.437   8.656  -7.103
  467    HB3  PRO  76           2HB      PRO  76   8.113   7.939  -8.571
  468    HG3  PRO  76           2HG      PRO  76   8.100   6.168  -7.022
  469    HD3  PRO  76           2HD      PRO  76   6.147   5.219  -6.315
  Start of MODEL   16
    1    H2   PRO   6           2H       PRO   6  -7.573  -2.541 -16.628
    2    HA   PRO   6           HA       PRO   6  -8.204  -5.269 -15.818
    3    HB3  PRO   6           2HB      PRO   6  -6.633  -6.096 -17.356
    4    HG3  PRO   6           2HG      PRO   6  -8.160  -5.440 -19.003
    5    HD3  PRO   6           2HD      PRO   6  -9.673  -4.277 -17.733
    6    H    LEU   7           H        LEU   7  -6.495  -6.225 -14.479
    7    HA   LEU   7           HA       LEU   7  -5.488  -4.214 -12.598
    8    HB3  LEU   7           2HB      LEU   7  -6.860  -5.960 -11.743
    9    HG   LEU   7           HG       LEU   7  -5.808  -7.799 -13.454
   10   HD11  LEU   7          1HD1      LEU   7  -4.421  -8.400 -10.807
   11   HD12  LEU   7          2HD1      LEU   7  -3.580  -7.832 -12.268
   12   HD13  LEU   7          3HD1      LEU   7  -4.407  -9.395 -12.270
   13   HD21  LEU   7          3HD2      LEU   7  -6.867  -9.522 -12.013
   14   HD22  LEU   7          1HD2      LEU   7  -7.866  -8.066 -12.186
   15   HD23  LEU   7          2HD2      LEU   7  -6.948  -8.334 -10.691
   16    H    LYS   8           H        LYS   8  -3.433  -4.027 -11.848
   17    HA   LYS   8           HA       LYS   8  -1.218  -5.429 -13.171
   18    HB3  LYS   8           2HB      LYS   8  -1.894  -3.677 -14.823
   19    HG3  LYS   8           2HG      LYS   8  -1.044  -1.775 -12.618
   20    HD3  LYS   8           2HD      LYS   8  -1.928  -1.041 -15.413
   21    HE3  LYS   8           2HE      LYS   8  -2.378   0.638 -13.601
   22    HZ1  LYS   8           3HZ      LYS   8  -0.653   0.327 -12.046
   23    HZ2  LYS   8           1HZ      LYS   8  -0.282   1.765 -12.772
   24    HZ3  LYS   8           2HZ      LYS   8   0.545   0.424 -13.172
   25    H    THR   9           H        THR   9   0.785  -5.238 -12.241
   26    HA   THR   9           HA       THR   9   0.827  -4.650  -9.395
   27    HB   THR   9           HB       THR   9   1.991  -6.566 -10.446
   28    HG1  THR   9           1HG      THR   9   3.206  -6.496  -8.784
   29   HG21  THR   9          3HG2      THR   9   4.021  -4.469 -11.367
   30   HG22  THR   9          1HG2      THR   9   3.015  -5.469 -12.428
   31   HG23  THR   9          2HG2      THR   9   4.232  -6.229 -11.395
   32    H    GLN  10           H        GLN  10   2.396  -3.328  -8.320
   33    HA   GLN  10           HA       GLN  10   3.901  -1.271  -9.627
   34    HB3  GLN  10           2HB      GLN  10   1.434  -0.423  -8.022
   35    HG3  GLN  10           2HG      GLN  10   3.243   1.198  -7.707
   36   HE21  GLN  10          1HE2      GLN  10   5.281   1.818  -8.451
   37   HE22  GLN  10          2HE2      GLN  10   5.716   1.806 -10.156
   38    H    GLN  11           H        GLN  11   5.577  -0.743  -8.233
   39    HA   GLN  11           HA       GLN  11   5.125  -1.172  -5.321
   40    HB3  GLN  11           2HB      GLN  11   6.851  -2.686  -6.150
   41    HG3  GLN  11           2HG      GLN  11   8.353  -0.165  -6.936
   42   HE21  GLN  11          1HE2      GLN  11   9.200  -3.615  -7.472
   43   HE22  GLN  11          2HE2      GLN  11  10.757  -3.481  -6.702
   44    H    MET  12           H        MET  12   6.150   0.306  -3.847
   45    HA   MET  12           HA       MET  12   6.525   3.083  -4.815
   46    HB3  MET  12           2HB      MET  12   4.073   2.696  -4.621
   47    HG3  MET  12           2HG      MET  12   4.653   2.265  -1.645
   48    HE1  MET  12           3HE      MET  12   0.466   1.695  -3.484
   49    HE2  MET  12           1HE      MET  12   1.868   2.022  -4.523
   50    HE3  MET  12           2HE      MET  12   1.818   0.544  -3.533
   51    H    GLN  13           H        GLN  13   6.940   4.594  -3.035
   52    HA   GLN  13           HA       GLN  13   8.387   3.344  -0.751
   53    HB3  GLN  13           2HB      GLN  13   9.290   5.699  -0.436
   54    HG3  GLN  13           2HG      GLN  13   9.930   4.376  -3.117
   55   HE21  GLN  13          1HE2      GLN  13  11.694   5.833  -0.294
   56   HE22  GLN  13          2HE2      GLN  13  12.741   6.821  -1.287
   57    H    VAL  14           H        VAL  14   7.931   4.170   1.358
   58    HA   VAL  14           HA       VAL  14   5.355   5.502   1.903
   59    HB   VAL  14           HB       VAL  14   5.787   2.506   2.303
   60   HG11  VAL  14          1HG1      VAL  14   3.628   2.505   3.639
   61   HG12  VAL  14          2HG1      VAL  14   4.986   3.217   4.495
   62   HG13  VAL  14          3HG1      VAL  14   3.760   4.271   3.761
   63   HG21  VAL  14          3HG2      VAL  14   4.635   3.069   0.264
   64   HG22  VAL  14          1HG2      VAL  14   3.492   2.345   1.373
   65   HG23  VAL  14          2HG2      VAL  14   3.486   4.105   1.139
   66    H    GLY  15           H        GLY  15   5.110   5.958   4.189
   67    HA2  GLY  15           2HA      GLY  15   7.471   6.671   5.611
   68    HA3  GLY  15           3HA      GLY  15   5.851   6.578   6.299
   69    H    GLY  16           H        GLY  16   7.458   6.032   8.103
   70    HA2  GLY  16           2HA      GLY  16   9.104   3.730   8.033
   71    HA3  GLY  16           3HA      GLY  16   8.713   4.686   9.466
   72    H    MET  17           H        MET  17   7.234   2.187   7.357
   73    HA   MET  17           HA       MET  17   5.507   1.078   9.356
   74    HB3  MET  17           2HB      MET  17   5.411  -0.892   7.798
   75    HG3  MET  17           2HG      MET  17   5.212   1.796   6.386
   76    HE1  MET  17           3HE      MET  17   5.161  -0.413   3.239
   77    HE2  MET  17           1HE      MET  17   5.934   0.908   4.142
   78    HE3  MET  17           2HE      MET  17   6.214  -0.784   4.613
   79    H    ARG  18           H        ARG  18   8.935   0.499   8.786
   80    HA   ARG  18           HA       ARG  18   8.993  -1.824  10.614
   81    HB3  ARG  18           2HB      ARG  18  11.536  -1.611  10.210
   82    HG3  ARG  18           2HG      ARG  18  11.393  -2.383   7.805
   83    HD3  ARG  18           2HD      ARG  18   9.719  -4.308   8.311
   84    HE   ARG  18           HE       ARG  18  12.365  -4.123   8.896
   85   HH11  ARG  18          1HH1      ARG  18   9.756  -5.826  10.652
   86   HH12  ARG  18          2HH1      ARG  18  10.808  -7.187  10.960
   87   HH21  ARG  18          1HH2      ARG  18  13.572  -5.752   9.395
   88   HH22  ARG  18          2HH2      ARG  18  13.017  -7.107  10.367
   89    H    CYS  19           H        CYS  19  10.618  -1.870  12.297
   90    HA   CYS  19           HA       CYS  19  11.196  -1.393  14.419
   91    HB3  CYS  19           2HB      CYS  19  11.729   0.849  15.169
   92    HG   CYS  19           HG       CYS  19  13.478  -0.559  13.724
   93    H    ALA  20           H        ALA  20   8.742  -2.153  13.609
   94    HA   ALA  20           HA       ALA  20   6.809  -1.895  15.614
   95    HB1  ALA  20           1HB      ALA  20   6.407   0.020  13.261
   96    HB2  ALA  20           2HB      ALA  20   5.129  -0.450  14.401
   97    HB3  ALA  20           3HB      ALA  20   6.524   0.451  14.985
   98    H    ALA  21           H        ALA  21   4.674  -2.843  14.862
   99    HA   ALA  21           HA       ALA  21   5.134  -5.023  12.963
  100    HB1  ALA  21           1HB      ALA  21   2.719  -4.320  14.691
  101    HB2  ALA  21           2HB      ALA  21   3.015  -5.866  13.872
  102    HB3  ALA  21           3HB      ALA  21   4.080  -5.353  15.189
  103    H    CYS  22           H        CYS  22   4.373  -1.963  12.160
  104    HA   CYS  22           HA       CYS  22   1.763  -2.033  11.173
  105    HB3  CYS  22           2HB      CYS  22   2.445   0.084   9.992
  106    HG   CYS  22           HG       CYS  22   3.312   1.511  12.119
  107    H    ALA  23           H        ALA  23   4.616  -3.179   9.432
  108    HA   ALA  23           HA       ALA  23   3.491  -3.386   6.825
  109    HB1  ALA  23           1HB      ALA  23   5.223  -5.171   6.584
  110    HB2  ALA  23           2HB      ALA  23   5.887  -3.710   7.338
  111    HB3  ALA  23           3HB      ALA  23   5.502  -5.136   8.333
  112    H    SER  24           H        SER  24   2.875  -5.290   9.769
  113    HA   SER  24           HA       SER  24   1.310  -7.337   8.319
  114    HB3  SER  24           2HB      SER  24   0.770  -8.151  10.556
  115    HG   SER  24           HG       SER  24   3.154  -8.239  11.279
  116    H    SER  25           H        SER  25   0.656  -4.403  10.318
  117    HA   SER  25           HA       SER  25  -2.164  -4.632  10.358
  118    HB3  SER  25           2HB      SER  25  -2.227  -2.337  11.022
  119    HG   SER  25           HG       SER  25  -0.797  -2.378  12.721
  120    H    ILE  26           H        ILE  26  -0.127  -2.872   7.940
  121    HA   ILE  26           HA       ILE  26  -2.441  -2.204   6.279
  122    HB   ILE  26           HB       ILE  26   0.548  -2.269   5.802
  123   HG13  ILE  26          2HG1      ILE  26  -1.569  -0.098   5.925
  124   HG21  ILE  26          1HG2      ILE  26  -0.329  -3.074   3.675
  125   HG22  ILE  26          2HG2      ILE  26  -1.537  -1.760   3.645
  126   HG23  ILE  26          3HG2      ILE  26   0.204  -1.417   3.516
  127   HD11  ILE  26          3HD1      ILE  26  -0.212  -0.472   7.981
  128   HD12  ILE  26          1HD1      ILE  26   1.274  -0.258   7.025
  129   HD13  ILE  26          2HD1      ILE  26   0.161   1.105   7.215
  130    H    GLU  27           H        GLU  27  -0.101  -4.944   6.083
  131    HA   GLU  27           HA       GLU  27  -1.239  -5.911   3.663
  132    HB3  GLU  27           2HB      GLU  27   0.323  -7.585   5.652
  133    HG3  GLU  27           2HG      GLU  27   0.477  -7.358   2.605
  134    H    ARG  28           H        ARG  28  -2.074  -6.640   7.043
  135    HA   ARG  28           HA       ARG  28  -3.759  -8.919   6.485
  136    HB3  ARG  28           2HB      ARG  28  -3.747  -6.932   8.787
  137    HG3  ARG  28           2HG      ARG  28  -4.800  -9.793   8.598
  138    HD3  ARG  28           2HD      ARG  28  -3.547  -9.558  10.673
  139    HE   ARG  28           HE       ARG  28  -5.234  -7.139  11.249
  140   HH11  ARG  28          1HH1      ARG  28  -2.110  -8.776  11.808
  141   HH12  ARG  28          2HH1      ARG  28  -1.527  -7.437  12.746
  142   HH21  ARG  28          1HH2      ARG  28  -4.397  -5.494  12.331
  143   HH22  ARG  28          2HH2      ARG  28  -2.793  -5.569  13.024
  144    H    ALA  29           H        ALA  29  -4.320  -5.410   6.375
  145    HA   ALA  29           HA       ALA  29  -7.231  -5.737   5.987
  146    HB1  ALA  29           1HB      ALA  29  -7.228  -3.292   5.966
  147    HB2  ALA  29           2HB      ALA  29  -6.414  -3.937   7.411
  148    HB3  ALA  29           3HB      ALA  29  -5.450  -3.276   6.063
  149    H    LEU  30           H        LEU  30  -4.386  -5.128   3.953
  150    HA   LEU  30           HA       LEU  30  -5.617  -3.751   1.890
  151    HB3  LEU  30           2HB      LEU  30  -3.283  -5.704   1.727
  152    HG   LEU  30           HG       LEU  30  -3.559  -4.871  -0.496
  153   HD11  LEU  30          1HD1      LEU  30  -5.120  -3.026  -0.235
  154   HD12  LEU  30          2HD1      LEU  30  -3.650  -2.384  -0.977
  155   HD13  LEU  30          3HD1      LEU  30  -3.957  -2.111   0.753
  156   HD21  LEU  30          3HD2      LEU  30  -1.497  -3.580  -0.753
  157   HD22  LEU  30          1HD2      LEU  30  -1.274  -4.732   0.583
  158   HD23  LEU  30          2HD2      LEU  30  -1.581  -3.023   0.930
  159    H    GLU  31           H        GLU  31  -5.652  -7.253   2.305
  160    HA   GLU  31           HA       GLU  31  -7.109  -7.798  -0.158
  161    HB3  GLU  31           2HB      GLU  31  -5.690  -9.489   0.680
  162    HG3  GLU  31           2HG      GLU  31  -7.392  -9.843   3.175
  163    H    ARG  32           H        ARG  32  -8.078  -6.417   2.800
  164    HA   ARG  32           HA       ARG  32 -10.836  -7.436   2.676
  165    HB3  ARG  32           2HB      ARG  32 -11.205  -6.343   4.758
  166    HG3  ARG  32           2HG      ARG  32  -8.368  -7.458   4.910
  167    HD3  ARG  32           2HD      ARG  32  -9.277  -6.229   6.937
  168    HE   ARG  32           HE       ARG  32 -11.522  -6.746   7.260
  169   HH11  ARG  32          1HH1      ARG  32  -9.665  -9.760   7.256
  170   HH12  ARG  32          2HH1      ARG  32 -11.031 -10.718   7.755
  171   HH21  ARG  32          1HH2      ARG  32 -13.300  -8.039   7.631
  172   HH22  ARG  32          2HH2      ARG  32 -13.097  -9.758   7.855
  173    H    LEU  33           H        LEU  33  -9.007  -4.623   1.696
  174    HA   LEU  33           HA       LEU  33 -11.157  -2.749   1.466
  175    HB3  LEU  33           2HB      LEU  33  -9.647  -1.470   0.085
  176    HG   LEU  33           HG       LEU  33  -7.865  -2.927   2.066
  177   HD11  LEU  33          1HD1      LEU  33  -6.542  -0.906   2.082
  178   HD12  LEU  33          2HD1      LEU  33  -7.696  -0.094   1.006
  179   HD13  LEU  33          3HD1      LEU  33  -6.730  -1.458   0.407
  180   HD21  LEU  33          3HD2      LEU  33  -8.425  -1.128   3.684
  181   HD22  LEU  33          1HD2      LEU  33  -9.840  -2.114   3.300
  182   HD23  LEU  33          2HD2      LEU  33  -9.651  -0.506   2.561
  183    H    LYS  34           H        LYS  34 -10.935  -5.583  -0.275
  184    HA   LYS  34           HA       LYS  34 -12.079  -6.495  -1.980
  185    HB3  LYS  34           2HB      LYS  34 -14.400  -5.554  -2.370
  186    HG3  LYS  34           2HG      LYS  34 -13.514  -5.981   0.505
  187    HD3  LYS  34           2HD      LYS  34 -16.253  -6.406  -0.753
  188    HE3  LYS  34           2HE      LYS  34 -16.966  -6.644   1.612
  189    HZ1  LYS  34           3HZ      LYS  34 -14.782  -8.579   1.083
  190    HZ2  LYS  34           1HZ      LYS  34 -16.247  -8.660   0.375
  191    HZ3  LYS  34           2HZ      LYS  34 -16.119  -8.797   2.019
  192    H    GLY  35           H        GLY  35 -10.321  -3.976  -2.736
  193    HA2  GLY  35           2HA      GLY  35 -11.123  -3.969  -5.649
  194    HA3  GLY  35           3HA      GLY  35 -10.408  -2.594  -4.799
  195    H    VAL  36           H        VAL  36  -8.655  -5.057  -3.569
  196    HA   VAL  36           HA       VAL  36  -6.469  -4.604  -5.571
  197    HB   VAL  36           HB       VAL  36  -6.356  -4.999  -2.557
  198   HG11  VAL  36          1HG1      VAL  36  -4.060  -4.705  -4.519
  199   HG12  VAL  36          2HG1      VAL  36  -3.937  -4.661  -2.748
  200   HG13  VAL  36          3HG1      VAL  36  -4.435  -6.148  -3.546
  201   HG21  VAL  36          3HG2      VAL  36  -5.365  -2.706  -2.606
  202   HG22  VAL  36          1HG2      VAL  36  -5.667  -2.626  -4.347
  203   HG23  VAL  36          2HG2      VAL  36  -7.024  -2.725  -3.205
  204    H    ALA  37           H        ALA  37  -5.702  -6.267  -6.587
  205    HA   ALA  37           HA       ALA  37  -6.889  -8.923  -6.159
  206    HB1  ALA  37           1HB      ALA  37  -6.917  -7.785  -8.354
  207    HB2  ALA  37           2HB      ALA  37  -5.138  -7.748  -8.368
  208    HB3  ALA  37           3HB      ALA  37  -5.997  -9.300  -8.436
  209    H    GLU  38           H        GLU  38  -3.809  -7.438  -5.455
  210    HA   GLU  38           HA       GLU  38  -2.739  -9.812  -4.251
  211    HB3  GLU  38           2HB      GLU  38  -0.800  -9.046  -6.335
  212    HG3  GLU  38           2HG      GLU  38  -0.886 -11.482  -6.841
  213    H    ALA  39           H        ALA  39  -0.705  -9.326  -3.106
  214    HA   ALA  39           HA       ALA  39   0.525  -6.751  -3.271
  215    HB1  ALA  39           1HB      ALA  39  -1.614  -6.010  -2.220
  216    HB2  ALA  39           2HB      ALA  39  -1.327  -7.134  -0.876
  217    HB3  ALA  39           3HB      ALA  39  -0.218  -5.771  -1.166
  218    H    SER  40           H        SER  40   2.197  -6.354  -1.839
  219    HA   SER  40           HA       SER  40   3.009  -8.344   0.215
  220    HB3  SER  40           2HB      SER  40   5.304  -8.426  -0.742
  221    HG   SER  40           HG       SER  40   3.458  -9.294  -2.761
  222    H    VAL  41           H        VAL  41   3.439  -7.017   2.022
  223    HA   VAL  41           HA       VAL  41   4.630  -4.323   1.529
  224    HB   VAL  41           HB       VAL  41   4.143  -5.578   4.272
  225   HG11  VAL  41          1HG1      VAL  41   4.884  -2.789   3.283
  226   HG12  VAL  41          2HG1      VAL  41   4.412  -3.164   4.938
  227   HG13  VAL  41          3HG1      VAL  41   5.890  -3.867   4.277
  228   HG21  VAL  41          3HG2      VAL  41   2.197  -4.085   4.395
  229   HG22  VAL  41          1HG2      VAL  41   2.483  -3.503   2.751
  230   HG23  VAL  41          2HG2      VAL  41   1.988  -5.175   3.012
  231    H    THR  42           H        THR  42   6.744  -4.010   1.426
  232    HA   THR  42           HA       THR  42   8.526  -6.350   1.448
  233    HB   THR  42           HB       THR  42   9.045  -3.475   0.605
  234    HG1  THR  42           1HG      THR  42   8.123  -5.802  -0.737
  235   HG21  THR  42          3HG2      THR  42  10.822  -4.497  -0.783
  236   HG22  THR  42          1HG2      THR  42  10.470  -6.084  -0.068
  237   HG23  THR  42          2HG2      THR  42  11.127  -4.774   0.937
  238    H    VAL  43           H        VAL  43   9.041  -6.874   3.458
  239    HA   VAL  43           HA       VAL  43   9.198  -4.976   5.589
  240    HB   VAL  43           HB       VAL  43   9.744  -7.945   5.357
  241   HG11  VAL  43          1HG1      VAL  43   9.767  -6.403   7.967
  242   HG12  VAL  43          2HG1      VAL  43   9.783  -8.161   7.790
  243   HG13  VAL  43          3HG1      VAL  43  11.177  -7.223   7.248
  244   HG21  VAL  43          3HG2      VAL  43   7.407  -7.114   5.182
  245   HG22  VAL  43          1HG2      VAL  43   7.623  -8.010   6.691
  246   HG23  VAL  43          2HG2      VAL  43   7.601  -6.227   6.702
  247    H    ALA  44           H        ALA  44  11.820  -6.445   3.639
  248    HA   ALA  44           HA       ALA  44  13.976  -5.908   5.381
  249    HB1  ALA  44           1HB      ALA  44  14.116  -7.369   3.428
  250    HB2  ALA  44           2HB      ALA  44  13.884  -5.993   2.327
  251    HB3  ALA  44           3HB      ALA  44  15.349  -6.109   3.326
  252    H    THR  45           H        THR  45  13.106  -3.889   2.534
  253    HA   THR  45           HA       THR  45  14.630  -1.579   3.470
  254    HB   THR  45           HB       THR  45  13.661  -0.594   1.323
  255    HG1  THR  45           1HG      THR  45  12.777  -2.369  -0.047
  256   HG21  THR  45          3HG2      THR  45  15.876  -1.740   1.391
  257   HG22  THR  45          1HG2      THR  45  15.047  -1.956  -0.157
  258   HG23  THR  45          2HG2      THR  45  15.080  -3.285   1.023
  259    H    GLY  46           H        GLY  46  11.293  -2.595   3.610
  260    HA2  GLY  46           2HA      GLY  46   9.457  -1.673   4.646
  261    HA3  GLY  46           3HA      GLY  46  10.399  -0.275   5.161
  262    H    ARG  47           H        ARG  47   9.143  -1.898   2.295
  263    HA   ARG  47           HA       ARG  47   8.125   0.613   1.054
  264    HB3  ARG  47           2HB      ARG  47   8.834  -0.278  -1.192
  265    HG3  ARG  47           2HG      ARG  47  11.235   0.136   0.613
  266    HD3  ARG  47           2HD      ARG  47  10.630   1.051  -2.229
  267    HE   ARG  47           HE       ARG  47  12.929   1.469  -0.388
  268   HH11  ARG  47          1HH1      ARG  47  11.790   1.983  -3.768
  269   HH12  ARG  47          2HH1      ARG  47  13.017   3.225  -3.966
  270   HH21  ARG  47          1HH2      ARG  47  14.337   3.006  -0.807
  271   HH22  ARG  47          2HH2      ARG  47  14.388   3.797  -2.376
  272    H    LEU  48           H        LEU  48   6.781  -0.390  -1.097
  273    HA   LEU  48           HA       LEU  48   5.124  -2.666  -0.119
  274    HB3  LEU  48           2HB      LEU  48   3.547  -0.342  -1.083
  275    HG   LEU  48           HG       LEU  48   3.419  -1.906   1.517
  276   HD11  LEU  48          1HD1      LEU  48   1.099  -0.891   1.577
  277   HD12  LEU  48          2HD1      LEU  48   1.559   0.095   0.178
  278   HD13  LEU  48          3HD1      LEU  48   2.412   0.289   1.731
  279   HD21  LEU  48          3HD2      LEU  48   1.798  -2.223  -1.064
  280   HD22  LEU  48          1HD2      LEU  48   1.350  -2.955   0.492
  281   HD23  LEU  48          2HD2      LEU  48   2.841  -3.440  -0.295
  282    H    THR  49           H        THR  49   4.117  -3.817  -1.680
  283    HA   THR  49           HA       THR  49   4.161  -2.889  -4.519
  284    HB   THR  49           HB       THR  49   4.849  -5.701  -3.597
  285    HG1  THR  49           1HG      THR  49   6.892  -5.031  -4.603
  286   HG21  THR  49          3HG2      THR  49   3.725  -5.653  -5.811
  287   HG22  THR  49          1HG2      THR  49   5.439  -6.013  -6.003
  288   HG23  THR  49          2HG2      THR  49   4.840  -4.383  -6.363
  289    H    VAL  50           H        VAL  50   2.292  -3.190  -5.553
  290    HA   VAL  50           HA       VAL  50   0.110  -4.807  -4.351
  291    HB   VAL  50           HB       VAL  50   0.146  -2.617  -3.175
  292   HG11  VAL  50          1HG1      VAL  50  -0.513  -0.551  -4.265
  293   HG12  VAL  50          2HG1      VAL  50   0.979  -1.156  -5.002
  294   HG13  VAL  50          3HG1      VAL  50  -0.570  -1.341  -5.848
  295   HG21  VAL  50          3HG2      VAL  50  -2.314  -3.020  -4.914
  296   HG22  VAL  50          1HG2      VAL  50  -1.928  -3.858  -3.392
  297   HG23  VAL  50          2HG2      VAL  50  -2.233  -2.113  -3.395
  298    H    THR  51           H        THR  51  -1.476  -5.440  -5.755
  299    HA   THR  51           HA       THR  51  -1.301  -4.558  -8.613
  300    HB   THR  51           HB       THR  51  -2.109  -7.266  -7.507
  301    HG1  THR  51           1HG      THR  51  -0.150  -7.862  -8.680
  302   HG21  THR  51          3HG2      THR  51  -3.245  -6.664  -9.681
  303   HG22  THR  51          1HG2      THR  51  -2.127  -8.027  -9.821
  304   HG23  THR  51          2HG2      THR  51  -1.647  -6.427 -10.406
  305    H    TYR  52           H        TYR  52  -3.028  -3.422  -9.242
  306    HA   TYR  52           HA       TYR  52  -5.746  -4.169  -8.380
  307    HB3  TYR  52           2HB      TYR  52  -4.940  -2.651  -6.604
  308    HD1  TYR  52           1HD      TYR  52  -6.063  -0.156  -9.166
  309    HD2  TYR  52           2HD      TYR  52  -2.891  -1.395  -6.527
  310    HE1  TYR  52           1HE      TYR  52  -4.961   2.032  -9.481
  311    HE2  TYR  52           2HE      TYR  52  -1.796   0.825  -6.805
  312    HH   TYR  52           HH       TYR  52  -2.044   2.976  -7.643
  313    H    ASP  53           H        ASP  53  -7.423  -2.616  -9.404
  314    HA   ASP  53           HA       ASP  53  -6.791  -2.326 -12.283
  315    HB3  ASP  53           2HB      ASP  53  -9.406  -2.691 -10.796
  316    HA   PRO  54           HA       PRO  54  -6.899   2.072 -11.116
  317    HB3  PRO  54           2HB      PRO  54  -5.555   3.191 -12.674
  318    HG3  PRO  54           2HG      PRO  54  -4.351   1.182 -12.169
  319    HD3  PRO  54           2HD      PRO  54  -5.296  -0.923 -12.572
  320    H    LYS  55           H        LYS  55  -9.378   0.562 -12.519
  321    HA   LYS  55           HA       LYS  55 -10.871   3.115 -13.094
  322    HB3  LYS  55           2HB      LYS  55 -12.340   1.886 -14.592
  323    HG3  LYS  55           2HG      LYS  55 -10.180   3.034 -15.487
  324    HD3  LYS  55           2HD      LYS  55  -9.253   0.246 -15.301
  325    HE3  LYS  55           2HE      LYS  55  -8.264   0.084 -17.533
  326    HZ1  LYS  55           3HZ      LYS  55 -11.165   0.479 -17.976
  327    HZ2  LYS  55           1HZ      LYS  55 -10.608  -0.802 -17.115
  328    HZ3  LYS  55           2HZ      LYS  55 -10.198  -0.592 -18.699
  329    H    GLN  56           H        GLN  56 -11.159  -0.313 -12.041
  330    HA   GLN  56           HA       GLN  56 -13.614   0.105 -10.596
  331    HB3  GLN  56           2HB      GLN  56 -13.009  -1.966  -9.377
  332    HG3  GLN  56           2HG      GLN  56 -12.369  -2.261 -12.346
  333   HE21  GLN  56          1HE2      GLN  56 -14.798  -3.822 -10.224
  334   HE22  GLN  56          2HE2      GLN  56 -14.052  -5.429 -10.323
  335    H    VAL  57           H        VAL  57 -10.221   0.701  -9.650
  336    HA   VAL  57           HA       VAL  57 -11.184   2.430  -7.487
  337    HB   VAL  57           HB       VAL  57  -9.620   1.605  -5.799
  338   HG11  VAL  57          1HG1      VAL  57 -10.826  -0.289  -4.972
  339   HG12  VAL  57          2HG1      VAL  57 -11.971   0.837  -5.714
  340   HG13  VAL  57          3HG1      VAL  57 -11.497  -0.654  -6.570
  341   HG21  VAL  57          3HG2      VAL  57  -8.561  -0.620  -5.949
  342   HG22  VAL  57          1HG2      VAL  57  -9.169  -0.828  -7.603
  343   HG23  VAL  57          2HG2      VAL  57  -7.966   0.427  -7.242
  344    H    SER  58           H        SER  58  -8.800   3.266  -6.387
  345    HA   SER  58           HA       SER  58  -6.724   3.446  -8.450
  346    HB3  SER  58           2HB      SER  58  -8.325   5.376  -8.911
  347    HG   SER  58           HG       SER  58  -8.862   6.092  -6.901
  348    H    GLU  59           H        GLU  59  -4.979   5.142  -7.393
  349    HA   GLU  59           HA       GLU  59  -3.757   4.109  -5.146
  350    HB3  GLU  59           2HB      GLU  59  -2.785   5.766  -6.661
  351    HG3  GLU  59           2HG      GLU  59  -4.475   7.866  -5.221
  352    H    ILE  60           H        ILE  60  -6.589   6.177  -5.115
  353    HA   ILE  60           HA       ILE  60  -6.628   7.199  -2.469
  354    HB   ILE  60           HB       ILE  60  -8.692   6.331  -4.494
  355   HG13  ILE  60          2HG1      ILE  60  -9.207   8.641  -4.730
  356   HG21  ILE  60          1HG2      ILE  60  -9.865   5.756  -2.552
  357   HG22  ILE  60          2HG2      ILE  60  -9.358   7.239  -1.695
  358   HG23  ILE  60          3HG2      ILE  60 -10.496   7.318  -3.073
  359   HD11  ILE  60          3HD1      ILE  60  -7.178   9.302  -2.552
  360   HD12  ILE  60          1HD1      ILE  60  -8.003  10.453  -3.612
  361   HD13  ILE  60          2HD1      ILE  60  -8.940   9.523  -2.435
  362    H    THR  61           H        THR  61  -7.658   3.959  -3.585
  363    HA   THR  61           HA       THR  61  -8.816   3.038  -1.184
  364    HB   THR  61           HB       THR  61  -7.382   1.600  -3.450
  365    HG1  THR  61           1HG      THR  61  -9.397   2.581  -3.842
  366   HG21  THR  61          3HG2      THR  61  -8.900   0.371  -1.111
  367   HG22  THR  61          1HG2      THR  61  -7.208   0.043  -1.569
  368   HG23  THR  61          2HG2      THR  61  -8.525  -0.474  -2.630
  369    H    ILE  62           H        ILE  62  -5.397   2.874  -2.145
  370    HA   ILE  62           HA       ILE  62  -4.684   1.673   0.478
  371    HB   ILE  62           HB       ILE  62  -3.834   0.823  -1.752
  372   HG13  ILE  62          2HG1      ILE  62  -2.987   0.086   0.374
  373   HG21  ILE  62          1HG2      ILE  62  -3.245   3.013  -2.765
  374   HG22  ILE  62          2HG2      ILE  62  -1.916   3.182  -1.592
  375   HG23  ILE  62          3HG2      ILE  62  -1.916   1.868  -2.789
  376   HD11  ILE  62          3HD1      ILE  62  -0.548   0.637  -1.364
  377   HD12  ILE  62          1HD1      ILE  62  -0.789  -0.675  -0.199
  378   HD13  ILE  62          2HD1      ILE  62  -1.733  -0.647  -1.697
  379    H    GLN  63           H        GLN  63  -4.463   4.820  -1.102
  380    HA   GLN  63           HA       GLN  63  -2.674   6.136   0.635
  381    HB3  GLN  63           2HB      GLN  63  -5.265   7.216  -0.580
  382    HG3  GLN  63           2HG      GLN  63  -2.750   8.595   0.433
  383   HE21  GLN  63          1HE2      GLN  63  -5.878  10.163  -0.284
  384   HE22  GLN  63          2HE2      GLN  63  -5.214  11.121  -1.609
  385    H    GLU  64           H        GLU  64  -6.234   5.686   1.051
  386    HA   GLU  64           HA       GLU  64  -6.478   6.906   3.613
  387    HB3  GLU  64           2HB      GLU  64  -8.386   5.295   3.920
  388    HG3  GLU  64           2HG      GLU  64  -8.592   6.429   1.122
  389    H    ARG  65           H        ARG  65  -5.721   3.486   2.842
  390    HA   ARG  65           HA       ARG  65  -5.768   2.683   5.601
  391    HB3  ARG  65           2HB      ARG  65  -4.580   1.340   3.128
  392    HG3  ARG  65           2HG      ARG  65  -3.767   0.093   5.007
  393    HD3  ARG  65           2HD      ARG  65  -5.085   0.778   6.901
  394    HE   ARG  65           HE       ARG  65  -7.348   0.849   5.503
  395   HH11  ARG  65          1HH1      ARG  65  -6.637  -1.416   8.177
  396   HH12  ARG  65          2HH1      ARG  65  -8.332  -1.582   8.531
  397   HH21  ARG  65          1HH2      ARG  65  -9.384   0.564   5.997
  398   HH22  ARG  65          2HH2      ARG  65  -9.898  -0.562   7.245
  399    H    ILE  66           H        ILE  66  -3.081   3.645   3.440
  400    HA   ILE  66           HA       ILE  66  -1.039   3.143   5.488
  401    HB   ILE  66           HB       ILE  66  -0.982   4.838   2.956
  402   HG13  ILE  66          2HG1      ILE  66  -1.288   2.212   2.828
  403   HG21  ILE  66          1HG2      ILE  66   0.745   5.607   4.520
  404   HG22  ILE  66          2HG2      ILE  66   1.247   3.923   4.840
  405   HG23  ILE  66          3HG2      ILE  66   1.521   4.680   3.248
  406   HD11  ILE  66          3HD1      ILE  66  -0.621   3.499   0.872
  407   HD12  ILE  66          1HD1      ILE  66   1.085   3.472   1.406
  408   HD13  ILE  66          2HD1      ILE  66   0.265   1.971   0.972
  409    H    ALA  67           H        ALA  67  -2.946   6.049   4.551
  410    HA   ALA  67           HA       ALA  67  -1.735   7.817   6.411
  411    HB1  ALA  67           1HB      ALA  67  -3.847   9.117   6.146
  412    HB2  ALA  67           2HB      ALA  67  -3.191   8.589   4.595
  413    HB3  ALA  67           3HB      ALA  67  -4.582   7.747   5.297
  414    H    ALA  68           H        ALA  68  -4.433   5.498   6.775
  415    HA   ALA  68           HA       ALA  68  -5.348   6.368   9.309
  416    HB1  ALA  68           1HB      ALA  68  -6.672   4.275   9.221
  417    HB2  ALA  68           2HB      ALA  68  -6.700   5.144   7.673
  418    HB3  ALA  68           3HB      ALA  68  -5.676   3.703   7.863
  419    H    LEU  69           H        LEU  69  -2.882   3.875   8.554
  420    HA   LEU  69           HA       LEU  69  -2.403   3.302  11.413
  421    HB3  LEU  69           2HB      LEU  69  -0.241   2.305  10.474
  422    HG   LEU  69           HG       LEU  69  -1.116   0.271   9.909
  423   HD11  LEU  69          1HD1      LEU  69  -3.381   1.402  11.589
  424   HD12  LEU  69          2HD1      LEU  69  -1.766   0.983  12.214
  425   HD13  LEU  69          3HD1      LEU  69  -2.815  -0.264  11.518
  426   HD21  LEU  69          3HD2      LEU  69  -3.309  -0.215   9.031
  427   HD22  LEU  69          1HD2      LEU  69  -2.491   0.943   7.983
  428   HD23  LEU  69          2HD2      LEU  69  -3.775   1.496   9.088
  429    H    GLY  70           H        GLY  70  -1.812   6.023   9.583
  430    HA2  GLY  70           2HA      GLY  70  -1.239   7.950  10.852
  431    HA3  GLY  70           3HA      GLY  70   0.078   7.058  11.641
  432    H    TYR  71           H        TYR  71   0.263   6.258   8.397
  433    HA   TYR  71           HA       TYR  71   2.643   8.011   8.171
  434    HB3  TYR  71           2HB      TYR  71   3.365   6.320   6.531
  435    HD1  TYR  71           2HD      TYR  71   4.830   6.427   8.597
  436    HD2  TYR  71           1HD      TYR  71   1.348   3.901   8.300
  437    HE1  TYR  71           2HE      TYR  71   5.737   4.975  10.385
  438    HE2  TYR  71           1HE      TYR  71   2.245   2.453  10.120
  439    HH   TYR  71           HH       TYR  71   5.515   3.000  11.478
  440    H    THR  72           H        THR  72   3.061   7.794   5.447
  441    HA   THR  72           HA       THR  72   0.785   8.636   3.868
  442    HB   THR  72           HB       THR  72   2.062  10.529   2.788
  443    HG1  THR  72           1HG      THR  72   3.667  10.339   5.137
  444   HG21  THR  72          3HG2      THR  72   1.606  11.124   5.734
  445   HG22  THR  72          1HG2      THR  72   0.311  11.021   4.517
  446   HG23  THR  72          2HG2      THR  72   1.577  12.254   4.370
  447    H    LEU  73           H        LEU  73   1.351   8.427   1.523
  448    HA   LEU  73           HA       LEU  73   3.633   6.563   1.043
  449    HB3  LEU  73           2HB      LEU  73   1.229   5.735   0.856
  450    HG   LEU  73           HG       LEU  73   1.367   7.082  -1.874
  451   HD11  LEU  73          1HD1      LEU  73   0.475   4.775  -1.901
  452   HD12  LEU  73          2HD1      LEU  73  -0.767   5.969  -2.304
  453   HD13  LEU  73          3HD1      LEU  73  -0.739   5.237  -0.687
  454   HD21  LEU  73          3HD2      LEU  73   0.536   8.752  -0.292
  455   HD22  LEU  73          1HD2      LEU  73  -0.560   7.549   0.429
  456   HD23  LEU  73          2HD2      LEU  73  -0.832   8.126  -1.218
  457    H    ALA  74           H        ALA  74   4.513   6.427  -1.121
  458    HA   ALA  74           HA       ALA  74   4.318   8.785  -2.911
  459    HB1  ALA  74           1HB      ALA  74   6.175   9.313  -1.432
  460    HB2  ALA  74           2HB      ALA  74   6.884   7.707  -1.676
  461    HB3  ALA  74           3HB      ALA  74   6.810   8.860  -3.024
  462    H    GLU  75           H        GLU  75   3.157   7.485  -4.298
  463    HA   GLU  75           HA       GLU  75   4.538   5.214  -5.646
  464    HB3  GLU  75           2HB      GLU  75   1.659   6.134  -5.566
  465    HG3  GLU  75           2HG      GLU  75   1.624   3.667  -6.793
  466    HA   PRO  76           HA       PRO  76   6.127   8.555  -7.642
  467    HB3  PRO  76           2HB      PRO  76   8.028   7.376  -8.026
  468    HG3  PRO  76           2HG      PRO  76   7.923   5.068  -8.594
  469    HD3  PRO  76           2HD      PRO  76   6.537   5.390  -6.697
  Start of MODEL   17
    1    H2   PRO   6           2H       PRO   6  -7.230  -3.574 -16.695
    2    HA   PRO   6           HA       PRO   6  -8.947  -5.169 -14.947
    3    HB3  PRO   6           2HB      PRO   6  -8.174  -7.126 -16.043
    4    HG3  PRO   6           2HG      PRO   6  -9.638  -6.344 -17.694
    5    HD3  PRO   6           2HD      PRO   6 -10.078  -4.212 -17.061
    6    H    LEU   7           H        LEU   7  -7.364  -6.666 -13.631
    7    HA   LEU   7           HA       LEU   7  -5.871  -4.952 -11.974
    8    HB3  LEU   7           2HB      LEU   7  -7.024  -7.028 -11.259
    9    HG   LEU   7           HG       LEU   7  -4.546  -8.483 -12.321
   10   HD11  LEU   7          1HD1      LEU   7  -6.757  -9.457 -10.473
   11   HD12  LEU   7          2HD1      LEU   7  -5.056  -9.160 -10.032
   12   HD13  LEU   7          3HD1      LEU   7  -5.454 -10.453 -11.164
   13   HD21  LEU   7          3HD2      LEU   7  -6.250 -10.011 -13.365
   14   HD22  LEU   7          1HD2      LEU   7  -6.245  -8.402 -14.075
   15   HD23  LEU   7          2HD2      LEU   7  -7.517  -8.856 -12.911
   16    H    LYS   8           H        LYS   8  -3.837  -4.370 -11.694
   17    HA   LYS   8           HA       LYS   8  -1.574  -5.731 -13.014
   18    HB3  LYS   8           2HB      LYS   8  -2.024  -4.280 -14.783
   19    HG3  LYS   8           2HG      LYS   8  -2.889  -2.225 -12.740
   20    HD3  LYS   8           2HD      LYS   8  -3.038  -0.666 -14.792
   21    HE3  LYS   8           2HE      LYS   8  -0.306  -1.278 -13.592
   22    HZ1  LYS   8           3HZ      LYS   8   0.051   1.072 -13.850
   23    HZ2  LYS   8           1HZ      LYS   8  -1.380   1.290 -14.627
   24    HZ3  LYS   8           2HZ      LYS   8  -0.181   0.399 -15.320
   25    H    THR   9           H        THR   9   0.453  -5.324 -12.107
   26    HA   THR   9           HA       THR   9   0.321  -4.605  -9.256
   27    HB   THR   9           HB       THR   9   1.325  -6.713  -9.969
   28    HG1  THR   9           1HG      THR   9   2.776  -6.582  -8.409
   29   HG21  THR   9          3HG2      THR   9   3.636  -5.034 -11.033
   30   HG22  THR   9          1HG2      THR   9   2.504  -5.954 -12.035
   31   HG23  THR   9          2HG2      THR   9   3.560  -6.800 -10.896
   32    H    GLN  10           H        GLN  10   1.880  -3.327  -8.133
   33    HA   GLN  10           HA       GLN  10   3.490  -1.334  -9.522
   34    HB3  GLN  10           2HB      GLN  10   1.041  -0.514  -7.890
   35    HG3  GLN  10           2HG      GLN  10   2.930   1.198  -7.936
   36   HE21  GLN  10          1HE2      GLN  10   2.494   3.464  -9.721
   37   HE22  GLN  10          2HE2      GLN  10   3.337   3.049 -11.215
   38    H    GLN  11           H        GLN  11   5.080  -0.504  -8.161
   39    HA   GLN  11           HA       GLN  11   5.123  -1.347  -5.303
   40    HB3  GLN  11           2HB      GLN  11   7.506  -0.428  -5.466
   41    HG3  GLN  11           2HG      GLN  11   7.056  -2.758  -7.348
   42   HE21  GLN  11          1HE2      GLN  11   9.242  -1.643  -8.178
   43   HE22  GLN  11          2HE2      GLN  11  10.666  -2.153  -7.304
   44    H    MET  12           H        MET  12   5.650   0.163  -3.647
   45    HA   MET  12           HA       MET  12   6.062   2.968  -4.194
   46    HB3  MET  12           2HB      MET  12   3.723   3.084  -4.453
   47    HG3  MET  12           2HG      MET  12   2.977   2.262  -1.695
   48    HE1  MET  12           3HE      MET  12   0.886   0.969  -5.650
   49    HE2  MET  12           1HE      MET  12   2.471   1.762  -5.690
   50    HE3  MET  12           2HE      MET  12   2.290   0.192  -4.890
   51    H    GLN  13           H        GLN  13   6.375   4.276  -2.285
   52    HA   GLN  13           HA       GLN  13   7.811   2.763  -0.166
   53    HB3  GLN  13           2HB      GLN  13   8.900   4.941   0.277
   54    HG3  GLN  13           2HG      GLN  13  10.174   5.301  -1.734
   55   HE21  GLN  13          1HE2      GLN  13  11.211   3.730  -0.031
   56   HE22  GLN  13          2HE2      GLN  13  11.423   2.074  -0.614
   57    H    VAL  14           H        VAL  14   7.615   3.721   2.101
   58    HA   VAL  14           HA       VAL  14   4.987   4.794   2.813
   59    HB   VAL  14           HB       VAL  14   4.123   2.710   2.184
   60   HG11  VAL  14          1HG1      VAL  14   4.980   0.509   2.852
   61   HG12  VAL  14          2HG1      VAL  14   6.124   1.373   1.833
   62   HG13  VAL  14          3HG1      VAL  14   6.409   1.269   3.584
   63   HG21  VAL  14          3HG2      VAL  14   3.460   3.487   4.472
   64   HG22  VAL  14          1HG2      VAL  14   3.288   1.739   4.220
   65   HG23  VAL  14          2HG2      VAL  14   4.646   2.375   5.166
   66    H    GLY  15           H        GLY  15   5.292   5.940   4.536
   67    HA2  GLY  15           2HA      GLY  15   7.721   5.865   6.005
   68    HA3  GLY  15           3HA      GLY  15   6.304   6.864   6.385
   69    H    GLY  16           H        GLY  16   4.951   3.956   6.632
   70    HA2  GLY  16           2HA      GLY  16   5.264   3.865   9.561
   71    HA3  GLY  16           3HA      GLY  16   4.150   2.897   8.565
   72    H    MET  17           H        MET  17   6.483   1.978   6.830
   73    HA   MET  17           HA       MET  17   7.088  -0.406   8.317
   74    HB3  MET  17           2HB      MET  17   8.835  -0.659   6.381
   75    HG3  MET  17           2HG      MET  17   6.794  -1.978   6.469
   76    HE1  MET  17           3HE      MET  17   4.502  -2.720   5.188
   77    HE2  MET  17           1HE      MET  17   3.350  -1.549   4.517
   78    HE3  MET  17           2HE      MET  17   4.935  -1.783   3.746
   79    H    ARG  18           H        ARG  18   8.857  -1.052   9.411
   80    HA   ARG  18           HA       ARG  18  10.525  -0.942  10.857
   81    HB3  ARG  18           2HB      ARG  18  12.567   0.278  10.354
   82    HG3  ARG  18           2HG      ARG  18  11.348  -0.654   7.713
   83    HD3  ARG  18           2HD      ARG  18  13.661  -1.523   7.336
   84    HE   ARG  18           HE       ARG  18  12.874   1.015   6.845
   85   HH11  ARG  18          1HH1      ARG  18  16.051  -0.357   7.681
   86   HH12  ARG  18          2HH1      ARG  18  16.899   0.993   6.965
   87   HH21  ARG  18          1HH2      ARG  18  14.063   2.724   5.994
   88   HH22  ARG  18          2HH2      ARG  18  15.799   2.706   6.044
   89    H    CYS  19           H        CYS  19   8.380   1.489  10.799
   90    HA   CYS  19           HA       CYS  19   9.384   2.768  13.319
   91    HB3  CYS  19           2HB      CYS  19   7.819   4.574  12.600
   92    HG   CYS  19           HG       CYS  19   9.151   5.612  10.580
   93    H    ALA  20           H        ALA  20   6.756   0.857  11.999
   94    HA   ALA  20           HA       ALA  20   5.707   0.297  14.699
   95    HB1  ALA  20           1HB      ALA  20   3.373   0.832  13.900
   96    HB2  ALA  20           2HB      ALA  20   4.409   2.256  13.960
   97    HB3  ALA  20           3HB      ALA  20   4.067   1.484  12.406
   98    H    ALA  21           H        ALA  21   3.771  -1.424  14.263
   99    HA   ALA  21           HA       ALA  21   4.873  -3.682  12.839
  100    HB1  ALA  21           1HB      ALA  21   3.533  -3.801  14.938
  101    HB2  ALA  21           2HB      ALA  21   2.101  -3.250  14.037
  102    HB3  ALA  21           3HB      ALA  21   2.855  -4.807  13.644
  103    H    CYS  22           H        CYS  22   4.091  -1.215  11.199
  104    HA   CYS  22           HA       CYS  22   1.779  -1.567   9.714
  105    HB3  CYS  22           2HB      CYS  22   3.155  -0.089   8.025
  106    HG   CYS  22           HG       CYS  22   1.305   0.732   9.796
  107    H    ALA  23           H        ALA  23   4.866  -3.206   8.970
  108    HA   ALA  23           HA       ALA  23   4.279  -4.374   6.514
  109    HB1  ALA  23           1HB      ALA  23   6.325  -4.748   7.862
  110    HB2  ALA  23           2HB      ALA  23   5.391  -5.680   9.051
  111    HB3  ALA  23           3HB      ALA  23   5.597  -6.299   7.403
  112    H    SER  24           H        SER  24   2.734  -5.245   9.659
  113    HA   SER  24           HA       SER  24   0.999  -7.196   8.197
  114    HB3  SER  24           2HB      SER  24   1.523  -8.377  10.002
  115    HG   SER  24           HG       SER  24   1.720  -7.190  12.175
  116    H    SER  25           H        SER  25   0.772  -4.157  10.120
  117    HA   SER  25           HA       SER  25  -2.064  -4.031  10.071
  118    HB3  SER  25           2HB      SER  25  -1.885  -1.963  11.022
  119    HG   SER  25           HG       SER  25  -0.306  -3.054  12.251
  120    H    ILE  26           H        ILE  26   0.232  -3.103   7.569
  121    HA   ILE  26           HA       ILE  26  -1.859  -2.080   5.747
  122    HB   ILE  26           HB       ILE  26   1.114  -2.700   5.496
  123   HG13  ILE  26          2HG1      ILE  26  -0.713  -0.307   5.044
  124   HG21  ILE  26          1HG2      ILE  26   0.207  -3.804   3.506
  125   HG22  ILE  26          2HG2      ILE  26  -0.625  -2.285   3.067
  126   HG23  ILE  26          3HG2      ILE  26   1.161  -2.400   3.173
  127   HD11  ILE  26          3HD1      ILE  26   0.907   0.895   6.378
  128   HD12  ILE  26          1HD1      ILE  26   0.586  -0.627   7.243
  129   HD13  ILE  26          2HD1      ILE  26   2.053  -0.450   6.263
  130    H    GLU  27           H        GLU  27   0.073  -5.128   5.923
  131    HA   GLU  27           HA       GLU  27  -1.296  -5.948   3.569
  132    HB3  GLU  27           2HB      GLU  27   0.327  -7.888   5.192
  133    HG3  GLU  27           2HG      GLU  27   0.634  -7.054   2.270
  134    H    ARG  28           H        ARG  28  -2.011  -6.627   6.960
  135    HA   ARG  28           HA       ARG  28  -3.736  -8.916   6.378
  136    HB3  ARG  28           2HB      ARG  28  -3.598  -7.210   8.888
  137    HG3  ARG  28           2HG      ARG  28  -4.443 -10.104   8.380
  138    HD3  ARG  28           2HD      ARG  28  -3.945  -8.585  10.962
  139    HE   ARG  28           HE       ARG  28  -5.855  -9.938  11.407
  140   HH11  ARG  28          1HH1      ARG  28  -3.155 -12.034  10.425
  141   HH12  ARG  28          2HH1      ARG  28  -3.653 -13.277  11.564
  142   HH21  ARG  28          1HH2      ARG  28  -6.435 -11.612  12.706
  143   HH22  ARG  28          2HH2      ARG  28  -5.532 -13.112  12.680
  144    H    ALA  29           H        ALA  29  -4.151  -5.569   5.880
  145    HA   ALA  29           HA       ALA  29  -7.117  -5.983   5.531
  146    HB1  ALA  29           1HB      ALA  29  -6.613  -4.081   6.981
  147    HB2  ALA  29           2HB      ALA  29  -5.490  -3.428   5.768
  148    HB3  ALA  29           3HB      ALA  29  -7.234  -3.517   5.412
  149    H    LEU  30           H        LEU  30  -4.108  -4.957   3.889
  150    HA   LEU  30           HA       LEU  30  -5.252  -3.821   1.662
  151    HB3  LEU  30           2HB      LEU  30  -2.623  -5.338   1.820
  152    HG   LEU  30           HG       LEU  30  -2.998  -4.686  -0.498
  153   HD11  LEU  30          1HD1      LEU  30  -3.643  -1.923   0.619
  154   HD12  LEU  30          2HD1      LEU  30  -4.676  -2.979  -0.381
  155   HD13  LEU  30          3HD1      LEU  30  -3.250  -2.235  -1.085
  156   HD21  LEU  30          3HD2      LEU  30  -1.176  -2.642   0.836
  157   HD22  LEU  30          1HD2      LEU  30  -1.029  -3.308  -0.801
  158   HD23  LEU  30          2HD2      LEU  30  -0.744  -4.347   0.607
  159    H    GLU  31           H        GLU  31  -4.686  -7.348   2.035
  160    HA   GLU  31           HA       GLU  31  -5.388  -7.884  -0.729
  161    HB3  GLU  31           2HB      GLU  31  -3.933  -9.395   0.548
  162    HG3  GLU  31           2HG      GLU  31  -6.463 -10.136   2.090
  163    H    ARG  32           H        ARG  32  -7.288  -6.925   1.874
  164    HA   ARG  32           HA       ARG  32  -9.683  -8.419   1.014
  165    HB3  ARG  32           2HB      ARG  32 -10.647  -7.806   3.146
  166    HG3  ARG  32           2HG      ARG  32  -7.739  -8.620   3.634
  167    HD3  ARG  32           2HD      ARG  32 -10.249  -8.965   5.313
  168    HE   ARG  32           HE       ARG  32  -7.597 -10.179   5.533
  169   HH11  ARG  32          1HH1      ARG  32 -10.243  -8.929   7.565
  170   HH12  ARG  32          2HH1      ARG  32  -9.772 -10.016   8.874
  171   HH21  ARG  32          1HH2      ARG  32  -7.110 -11.429   7.248
  172   HH22  ARG  32          2HH2      ARG  32  -8.115 -11.397   8.696
  173    H    LEU  33           H        LEU  33  -8.320  -5.177   1.044
  174    HA   LEU  33           HA       LEU  33 -10.586  -3.537   0.943
  175    HB3  LEU  33           2HB      LEU  33  -9.184  -1.952  -0.363
  176    HG   LEU  33           HG       LEU  33  -7.460  -3.282   1.758
  177   HD11  LEU  33          1HD1      LEU  33  -6.351  -1.665   0.142
  178   HD12  LEU  33          2HD1      LEU  33  -6.276  -1.175   1.847
  179   HD13  LEU  33          3HD1      LEU  33  -7.443  -0.418   0.745
  180   HD21  LEU  33          3HD2      LEU  33  -9.587  -2.587   2.801
  181   HD22  LEU  33          1HD2      LEU  33  -9.437  -0.977   2.045
  182   HD23  LEU  33          2HD2      LEU  33  -8.273  -1.493   3.276
  183    H    LYS  34           H        LYS  34 -12.191  -3.162  -0.405
  184    HA   LYS  34           HA       LYS  34 -12.851  -4.827  -2.546
  185    HB3  LYS  34           2HB      LYS  34 -14.554  -2.976  -3.063
  186    HG3  LYS  34           2HG      LYS  34 -14.270  -4.136  -0.266
  187    HD3  LYS  34           2HD      LYS  34 -15.653  -2.156  -0.006
  188    HE3  LYS  34           2HE      LYS  34 -17.450  -3.345  -2.180
  189    HZ1  LYS  34           3HZ      LYS  34 -18.662  -2.248  -0.403
  190    HZ2  LYS  34           1HZ      LYS  34 -18.732  -1.320  -1.752
  191    HZ3  LYS  34           2HZ      LYS  34 -17.720  -0.900  -0.527
  192    H    GLY  35           H        GLY  35 -11.783  -5.118  -4.367
  193    HA2  GLY  35           2HA      GLY  35 -11.323  -4.430  -6.616
  194    HA3  GLY  35           3HA      GLY  35 -10.938  -2.792  -6.056
  195    H    VAL  36           H        VAL  36  -9.341  -4.728  -3.861
  196    HA   VAL  36           HA       VAL  36  -6.825  -4.730  -5.476
  197    HB   VAL  36           HB       VAL  36  -7.214  -5.111  -2.486
  198   HG11  VAL  36          1HG1      VAL  36  -4.685  -4.870  -4.187
  199   HG12  VAL  36          2HG1      VAL  36  -4.707  -4.762  -2.422
  200   HG13  VAL  36          3HG1      VAL  36  -5.174  -6.271  -3.207
  201   HG21  VAL  36          3HG2      VAL  36  -6.159  -2.854  -2.318
  202   HG22  VAL  36          1HG2      VAL  36  -6.189  -2.717  -4.087
  203   HG23  VAL  36          2HG2      VAL  36  -7.705  -2.795  -3.163
  204    H    ALA  37           H        ALA  37  -5.801  -6.560  -6.043
  205    HA   ALA  37           HA       ALA  37  -7.281  -9.135  -5.603
  206    HB1  ALA  37           1HB      ALA  37  -5.651  -8.103  -7.956
  207    HB2  ALA  37           2HB      ALA  37  -6.533  -9.648  -7.885
  208    HB3  ALA  37           3HB      ALA  37  -7.428  -8.118  -7.837
  209    H    GLU  38           H        GLU  38  -4.017  -7.778  -5.362
  210    HA   GLU  38           HA       GLU  38  -3.054 -10.169  -4.048
  211    HB3  GLU  38           2HB      GLU  38  -1.650  -9.403  -6.643
  212    HG3  GLU  38           2HG      GLU  38  -1.403 -11.922  -4.959
  213    H    ALA  39           H        ALA  39  -1.307  -9.573  -2.631
  214    HA   ALA  39           HA       ALA  39   0.026  -6.960  -3.035
  215    HB1  ALA  39           1HB      ALA  39  -0.852  -6.040  -0.940
  216    HB2  ALA  39           2HB      ALA  39  -2.167  -6.340  -2.093
  217    HB3  ALA  39           3HB      ALA  39  -1.906  -7.456  -0.728
  218    H    SER  40           H        SER  40   1.874  -6.639  -1.863
  219    HA   SER  40           HA       SER  40   2.705  -8.680   0.139
  220    HB3  SER  40           2HB      SER  40   4.807  -9.102  -1.097
  221    HG   SER  40           HG       SER  40   3.702 -10.213  -2.952
  222    H    VAL  41           H        VAL  41   3.672  -7.589   1.797
  223    HA   VAL  41           HA       VAL  41   5.083  -5.013   1.287
  224    HB   VAL  41           HB       VAL  41   5.540  -4.900   3.659
  225   HG11  VAL  41          1HG1      VAL  41   3.428  -4.033   2.788
  226   HG12  VAL  41          2HG1      VAL  41   2.639  -5.595   3.054
  227   HG13  VAL  41          3HG1      VAL  41   3.222  -4.645   4.434
  228   HG21  VAL  41          3HG2      VAL  41   5.869  -7.290   4.198
  229   HG22  VAL  41          1HG2      VAL  41   4.700  -6.518   5.268
  230   HG23  VAL  41          2HG2      VAL  41   4.133  -7.580   3.978
  231    H    THR  42           H        THR  42   7.301  -4.647   1.838
  232    HA   THR  42           HA       THR  42   9.093  -7.052   2.006
  233    HB   THR  42           HB       THR  42   9.500  -4.599   0.246
  234    HG1  THR  42           1HG      THR  42   8.221  -6.006  -0.799
  235   HG21  THR  42          3HG2      THR  42  11.545  -5.756  -0.511
  236   HG22  THR  42          1HG2      THR  42  11.293  -7.021   0.713
  237   HG23  THR  42          2HG2      THR  42  11.651  -5.356   1.203
  238    H    VAL  43           H        VAL  43   9.706  -6.893   4.081
  239    HA   VAL  43           HA       VAL  43  10.210  -4.311   5.388
  240    HB   VAL  43           HB       VAL  43  10.616  -7.176   6.309
  241   HG11  VAL  43          1HG1      VAL  43  10.863  -6.224   8.620
  242   HG12  VAL  43          2HG1      VAL  43  12.231  -5.835   7.582
  243   HG13  VAL  43          3HG1      VAL  43  10.996  -4.599   7.912
  244   HG21  VAL  43          3HG2      VAL  43   8.608  -5.016   7.121
  245   HG22  VAL  43          1HG2      VAL  43   8.241  -6.386   6.062
  246   HG23  VAL  43          2HG2      VAL  43   8.668  -6.676   7.752
  247    H    ALA  44           H        ALA  44  12.214  -6.705   3.696
  248    HA   ALA  44           HA       ALA  44  14.750  -6.038   4.724
  249    HB1  ALA  44           1HB      ALA  44  15.585  -7.138   2.686
  250    HB2  ALA  44           2HB      ALA  44  14.221  -8.031   3.372
  251    HB3  ALA  44           3HB      ALA  44  13.979  -7.012   1.935
  252    H    THR  45           H        THR  45  12.922  -4.314   2.236
  253    HA   THR  45           HA       THR  45  15.042  -2.193   2.158
  254    HB   THR  45           HB       THR  45  14.098  -1.619  -0.113
  255    HG1  THR  45           1HG      THR  45  13.073  -3.609  -1.052
  256   HG21  THR  45          3HG2      THR  45  15.329  -3.332  -1.295
  257   HG22  THR  45          1HG2      THR  45  15.261  -4.427   0.103
  258   HG23  THR  45          2HG2      THR  45  16.203  -2.917   0.178
  259    H    GLY  46           H        GLY  46  11.790  -2.889   3.037
  260    HA2  GLY  46           2HA      GLY  46  10.324  -1.626   4.242
  261    HA3  GLY  46           3HA      GLY  46  11.425  -0.242   4.173
  262    H    ARG  47           H        ARG  47   9.141  -2.139   2.204
  263    HA   ARG  47           HA       ARG  47   7.942   0.236   1.016
  264    HB3  ARG  47           2HB      ARG  47   9.974   0.074  -0.340
  265    HG3  ARG  47           2HG      ARG  47   8.963  -2.729  -0.993
  266    HD3  ARG  47           2HD      ARG  47   9.579  -1.577  -3.052
  267    HE   ARG  47           HE       ARG  47  11.845  -0.554  -1.579
  268   HH11  ARG  47          1HH1      ARG  47  10.895  -1.619  -4.816
  269   HH12  ARG  47          2HH1      ARG  47  12.116  -0.627  -5.586
  270   HH21  ARG  47          1HH2      ARG  47  13.456   0.573  -2.609
  271   HH22  ARG  47          2HH2      ARG  47  13.593   0.541  -4.345
  272    H    LEU  48           H        LEU  48   6.509  -0.584  -0.937
  273    HA   LEU  48           HA       LEU  48   4.909  -2.917   0.001
  274    HB3  LEU  48           2HB      LEU  48   3.410  -0.524  -0.939
  275    HG   LEU  48           HG       LEU  48   3.380  -1.896   1.769
  276   HD11  LEU  48          1HD1      LEU  48   1.066  -0.739   1.753
  277   HD12  LEU  48          2HD1      LEU  48   1.626   0.138   0.328
  278   HD13  LEU  48          3HD1      LEU  48   2.481   0.329   1.871
  279   HD21  LEU  48          3HD2      LEU  48   1.634  -2.390  -0.699
  280   HD22  LEU  48          1HD2      LEU  48   1.295  -3.011   0.930
  281   HD23  LEU  48          2HD2      LEU  48   2.727  -3.561   0.084
  282    H    THR  49           H        THR  49   3.690  -3.962  -1.552
  283    HA   THR  49           HA       THR  49   3.783  -3.066  -4.393
  284    HB   THR  49           HB       THR  49   4.272  -5.932  -3.500
  285    HG1  THR  49           1HG      THR  49   6.390  -5.191  -4.622
  286   HG21  THR  49          3HG2      THR  49   4.873  -6.257  -5.872
  287   HG22  THR  49          1HG2      THR  49   4.510  -4.550  -6.216
  288   HG23  THR  49          2HG2      THR  49   3.216  -5.680  -5.750
  289    H    VAL  50           H        VAL  50   1.876  -3.274  -5.387
  290    HA   VAL  50           HA       VAL  50  -0.294  -4.932  -4.199
  291    HB   VAL  50           HB       VAL  50  -0.303  -2.741  -3.023
  292   HG11  VAL  50          1HG1      VAL  50  -1.000  -1.506  -5.714
  293   HG12  VAL  50          2HG1      VAL  50  -0.974  -0.686  -4.144
  294   HG13  VAL  50          3HG1      VAL  50   0.530  -1.304  -4.843
  295   HG21  VAL  50          3HG2      VAL  50  -2.746  -3.261  -4.760
  296   HG22  VAL  50          1HG2      VAL  50  -2.383  -3.967  -3.173
  297   HG23  VAL  50          2HG2      VAL  50  -2.700  -2.225  -3.327
  298    H    THR  51           H        THR  51  -1.827  -5.605  -5.591
  299    HA   THR  51           HA       THR  51  -1.732  -4.738  -8.454
  300    HB   THR  51           HB       THR  51  -2.341  -7.450  -7.222
  301    HG1  THR  51           1HG      THR  51  -0.153  -7.027  -7.477
  302   HG21  THR  51          3HG2      THR  51  -2.548  -8.253  -9.564
  303   HG22  THR  51          1HG2      THR  51  -2.489  -6.572 -10.139
  304   HG23  THR  51          2HG2      THR  51  -3.835  -7.136  -9.121
  305    H    TYR  52           H        TYR  52  -3.445  -3.706  -9.102
  306    HA   TYR  52           HA       TYR  52  -6.173  -4.351  -8.211
  307    HB3  TYR  52           2HB      TYR  52  -5.404  -2.807  -6.479
  308    HD1  TYR  52           1HD      TYR  52  -6.054  -0.391  -9.280
  309    HD2  TYR  52           2HD      TYR  52  -3.371  -1.605  -6.152
  310    HE1  TYR  52           1HE      TYR  52  -4.709   1.665  -9.644
  311    HE2  TYR  52           2HE      TYR  52  -2.043   0.479  -6.481
  312    HH   TYR  52           HH       TYR  52  -1.889   2.511  -7.614
  313    H    ASP  53           H        ASP  53  -7.834  -3.027  -9.473
  314    HA   ASP  53           HA       ASP  53  -6.921  -2.524 -12.241
  315    HB3  ASP  53           2HB      ASP  53  -9.652  -2.875 -11.004
  316    HA   PRO  54           HA       PRO  54  -6.816   1.759 -10.928
  317    HB3  PRO  54           2HB      PRO  54  -4.805   1.716 -12.114
  318    HG3  PRO  54           2HG      PRO  54  -4.681   0.753 -14.298
  319    HD3  PRO  54           2HD      PRO  54  -5.338  -0.944 -12.807
  320    H    LYS  55           H        LYS  55  -9.357   0.613 -12.287
  321    HA   LYS  55           HA       LYS  55 -10.523   3.321 -12.813
  322    HB3  LYS  55           2HB      LYS  55 -12.184   2.218 -14.323
  323    HG3  LYS  55           2HG      LYS  55  -9.313   2.039 -15.339
  324    HD3  LYS  55           2HD      LYS  55 -11.095   1.280 -16.917
  325    HE3  LYS  55           2HE      LYS  55 -12.021   4.195 -16.795
  326    HZ1  LYS  55           3HZ      LYS  55 -13.065   1.854 -18.259
  327    HZ2  LYS  55           1HZ      LYS  55 -12.285   3.178 -18.943
  328    HZ3  LYS  55           2HZ      LYS  55 -13.767   3.324 -18.221
  329    H    GLN  56           H        GLN  56 -11.134  -0.024 -11.693
  330    HA   GLN  56           HA       GLN  56 -13.440   0.624 -10.067
  331    HB3  GLN  56           2HB      GLN  56 -12.482  -1.366  -8.676
  332    HG3  GLN  56           2HG      GLN  56 -13.050  -3.066 -10.403
  333   HE21  GLN  56          1HE2      GLN  56 -15.256  -1.463 -12.161
  334   HE22  GLN  56          2HE2      GLN  56 -16.504  -1.201 -10.947
  335    H    VAL  57           H        VAL  57  -9.887   0.901  -9.405
  336    HA   VAL  57           HA       VAL  57 -10.625   2.740  -7.168
  337    HB   VAL  57           HB       VAL  57  -8.901   1.877  -5.735
  338   HG11  VAL  57          1HG1      VAL  57 -11.139   0.897  -5.459
  339   HG12  VAL  57          2HG1      VAL  57 -10.733  -0.410  -6.592
  340   HG13  VAL  57          3HG1      VAL  57  -9.877  -0.271  -5.049
  341   HG21  VAL  57          3HG2      VAL  57  -7.313   0.964  -7.397
  342   HG22  VAL  57          1HG2      VAL  57  -7.693  -0.217  -6.143
  343   HG23  VAL  57          2HG2      VAL  57  -8.438  -0.369  -7.746
  344    H    SER  58           H        SER  58  -8.488   3.809  -6.316
  345    HA   SER  58           HA       SER  58  -6.432   4.220  -8.408
  346    HB3  SER  58           2HB      SER  58  -8.102   6.155  -8.484
  347    HG   SER  58           HG       SER  58  -8.228   7.505  -6.778
  348    H    GLU  59           H        GLU  59  -4.647   5.687  -7.139
  349    HA   GLU  59           HA       GLU  59  -3.510   4.351  -5.000
  350    HB3  GLU  59           2HB      GLU  59  -2.402   6.107  -6.295
  351    HG3  GLU  59           2HG      GLU  59  -3.935   8.102  -4.567
  352    H    ILE  60           H        ILE  60  -6.321   6.482  -4.786
  353    HA   ILE  60           HA       ILE  60  -6.363   7.159  -2.019
  354    HB   ILE  60           HB       ILE  60  -8.416   6.812  -4.181
  355   HG13  ILE  60          2HG1      ILE  60  -7.937   9.101  -2.224
  356   HG21  ILE  60          1HG2      ILE  60  -9.160   7.116  -1.265
  357   HG22  ILE  60          2HG2      ILE  60 -10.251   7.424  -2.641
  358   HG23  ILE  60          3HG2      ILE  60  -9.630   5.795  -2.385
  359   HD11  ILE  60          3HD1      ILE  60  -6.877   8.847  -5.068
  360   HD12  ILE  60          1HD1      ILE  60  -6.936  10.346  -4.123
  361   HD13  ILE  60          2HD1      ILE  60  -5.913   9.012  -3.578
  362    H    THR  61           H        THR  61  -7.168   4.037  -3.537
  363    HA   THR  61           HA       THR  61  -8.436   2.884  -1.213
  364    HB   THR  61           HB       THR  61  -7.147   1.718  -3.689
  365    HG1  THR  61           1HG      THR  61  -9.184   2.701  -3.788
  366   HG21  THR  61          3HG2      THR  61  -6.801  -0.032  -1.986
  367   HG22  THR  61          1HG2      THR  61  -8.172  -0.454  -3.020
  368   HG23  THR  61          2HG2      THR  61  -8.465   0.195  -1.390
  369    H    ILE  62           H        ILE  62  -5.003   3.047  -2.148
  370    HA   ILE  62           HA       ILE  62  -4.362   1.553   0.369
  371    HB   ILE  62           HB       ILE  62  -3.479   0.683  -1.730
  372   HG13  ILE  62          2HG1      ILE  62  -2.365   0.304   0.445
  373   HG21  ILE  62          1HG2      ILE  62  -3.133   2.781  -2.997
  374   HG22  ILE  62          2HG2      ILE  62  -1.753   3.184  -1.949
  375   HG23  ILE  62          3HG2      ILE  62  -1.713   1.753  -3.005
  376   HD11  ILE  62          3HD1      ILE  62  -0.228   0.506  -1.703
  377   HD12  ILE  62          1HD1      ILE  62  -0.378  -0.673  -0.381
  378   HD13  ILE  62          2HD1      ILE  62  -1.502  -0.737  -1.737
  379    H    GLN  63           H        GLN  63  -3.845   4.737  -1.109
  380    HA   GLN  63           HA       GLN  63  -2.122   6.026   0.697
  381    HB3  GLN  63           2HB      GLN  63  -3.879   7.986   0.234
  382    HG3  GLN  63           2HG      GLN  63  -3.289   8.069  -2.248
  383   HE21  GLN  63          1HE2      GLN  63  -1.159   8.971  -2.996
  384   HE22  GLN  63          2HE2      GLN  63  -0.057   9.561  -1.753
  385    H    GLU  64           H        GLU  64  -5.674   5.596   1.025
  386    HA   GLU  64           HA       GLU  64  -5.891   6.868   3.578
  387    HB3  GLU  64           2HB      GLU  64  -8.162   5.637   3.522
  388    HG3  GLU  64           2HG      GLU  64  -8.853   6.823   1.293
  389    H    ARG  65           H        ARG  65  -4.976   3.547   2.795
  390    HA   ARG  65           HA       ARG  65  -5.439   2.485   5.478
  391    HB3  ARG  65           2HB      ARG  65  -3.596   1.583   3.218
  392    HG3  ARG  65           2HG      ARG  65  -3.138   0.613   5.633
  393    HD3  ARG  65           2HD      ARG  65  -4.281  -1.520   5.978
  394    HE   ARG  65           HE       ARG  65  -6.470   0.507   5.832
  395   HH11  ARG  65          1HH1      ARG  65  -4.349  -1.468   7.980
  396   HH12  ARG  65          2HH1      ARG  65  -5.251  -0.941   9.376
  397   HH21  ARG  65          1HH2      ARG  65  -7.517   1.044   7.703
  398   HH22  ARG  65          2HH2      ARG  65  -7.063   0.301   9.209
  399    H    ILE  66           H        ILE  66  -2.513   3.674   3.739
  400    HA   ILE  66           HA       ILE  66  -0.852   3.475   6.127
  401    HB   ILE  66           HB       ILE  66  -0.437   4.973   3.505
  402   HG13  ILE  66          2HG1      ILE  66   0.875   2.453   4.656
  403   HG21  ILE  66          1HG2      ILE  66   1.930   5.233   4.269
  404   HG22  ILE  66          2HG2      ILE  66   0.805   6.134   5.273
  405   HG23  ILE  66          3HG2      ILE  66   1.471   4.586   5.857
  406   HD11  ILE  66          3HD1      ILE  66   0.261   1.399   2.478
  407   HD12  ILE  66          1HD1      ILE  66  -1.155   1.744   3.485
  408   HD13  ILE  66          2HD1      ILE  66  -0.731   2.806   2.110
  409    H    ALA  67           H        ALA  67  -2.762   6.188   4.769
  410    HA   ALA  67           HA       ALA  67  -1.916   8.105   6.671
  411    HB1  ALA  67           1HB      ALA  67  -3.070   8.652   4.575
  412    HB2  ALA  67           2HB      ALA  67  -4.553   7.874   5.163
  413    HB3  ALA  67           3HB      ALA  67  -3.937   9.334   5.959
  414    H    ALA  68           H        ALA  68  -4.673   5.774   6.836
  415    HA   ALA  68           HA       ALA  68  -5.674   6.701   9.381
  416    HB1  ALA  68           1HB      ALA  68  -7.049   5.552   7.717
  417    HB2  ALA  68           2HB      ALA  68  -6.059   4.081   7.870
  418    HB3  ALA  68           3HB      ALA  68  -7.045   4.645   9.240
  419    H    LEU  69           H        LEU  69  -3.120   4.458   8.529
  420    HA   LEU  69           HA       LEU  69  -2.702   3.506  11.279
  421    HB3  LEU  69           2HB      LEU  69  -0.597   2.563  10.182
  422    HG   LEU  69           HG       LEU  69  -3.302   1.927   8.905
  423   HD11  LEU  69          1HD1      LEU  69  -2.212  -0.119   8.081
  424   HD12  LEU  69          2HD1      LEU  69  -0.654   0.455   8.729
  425   HD13  LEU  69          3HD1      LEU  69  -1.449   1.322   7.396
  426   HD21  LEU  69          3HD2      LEU  69  -3.154  -0.097  10.347
  427   HD22  LEU  69          1HD2      LEU  69  -3.249   1.388  11.293
  428   HD23  LEU  69          2HD2      LEU  69  -1.689   0.561  11.105
  429    H    GLY  70           H        GLY  70  -2.186   6.507   9.978
  430    HA2  GLY  70           2HA      GLY  70  -1.419   8.311  11.257
  431    HA3  GLY  70           3HA      GLY  70  -0.438   7.215  12.256
  432    H    TYR  71           H        TYR  71   0.036   6.722   8.891
  433    HA   TYR  71           HA       TYR  71   2.513   8.420   8.893
  434    HB3  TYR  71           2HB      TYR  71   3.540   6.527   7.593
  435    HD1  TYR  71           1HD      TYR  71   5.041   7.287   9.437
  436    HD2  TYR  71           2HD      TYR  71   1.803   4.519  10.105
  437    HE1  TYR  71           1HE      TYR  71   6.034   6.662  11.618
  438    HE2  TYR  71           2HE      TYR  71   2.778   3.911  12.308
  439    HH   TYR  71           HH       TYR  71   4.329   4.502  13.908
  440    H    THR  72           H        THR  72   3.297   8.002   6.280
  441    HA   THR  72           HA       THR  72   0.982   8.604   4.505
  442    HB   THR  72           HB       THR  72   3.533  10.292   4.523
  443    HG1  THR  72           1HG      THR  72   0.943  11.003   5.420
  444   HG21  THR  72          3HG2      THR  72   2.156  11.842   3.147
  445   HG22  THR  72          1HG2      THR  72   0.833  10.647   3.133
  446   HG23  THR  72          2HG2      THR  72   2.379  10.284   2.351
  447    H    LEU  73           H        LEU  73   1.202   7.751   2.523
  448    HA   LEU  73           HA       LEU  73   3.478   6.014   1.795
  449    HB3  LEU  73           2HB      LEU  73   0.681   6.570   0.711
  450    HG   LEU  73           HG       LEU  73   2.733   4.672  -0.414
  451   HD11  LEU  73          1HD1      LEU  73   1.140   3.154   0.587
  452   HD12  LEU  73          2HD1      LEU  73   0.812   3.205  -1.143
  453   HD13  LEU  73          3HD1      LEU  73  -0.237   4.099  -0.036
  454   HD21  LEU  73          3HD2      LEU  73   1.558   5.130  -2.509
  455   HD22  LEU  73          1HD2      LEU  73   1.905   6.685  -1.740
  456   HD23  LEU  73          2HD2      LEU  73   0.275   6.007  -1.652
  457    H    ALA  74           H        ALA  74   4.531   6.135  -0.324
  458    HA   ALA  74           HA       ALA  74   4.053   8.595  -1.918
  459    HB1  ALA  74           1HB      ALA  74   5.978   9.163  -0.476
  460    HB2  ALA  74           2HB      ALA  74   6.832   7.716  -1.032
  461    HB3  ALA  74           3HB      ALA  74   6.462   9.022  -2.175
  462    H    GLU  75           H        GLU  75   3.729   8.064  -4.001
  463    HA   GLU  75           HA       GLU  75   4.585   5.359  -4.934
  464    HB3  GLU  75           2HB      GLU  75   2.527   7.134  -6.254
  465    HG3  GLU  75           2HG      GLU  75   2.642   4.106  -6.221
  466    HA   PRO  76           HA       PRO  76   7.705   8.034  -6.249
  467    HB3  PRO  76           2HB      PRO  76   9.196   6.424  -5.651
  468    HG3  PRO  76           2HG      PRO  76   8.749   4.124  -6.075
  469    HD3  PRO  76           2HD      PRO  76   6.844   4.996  -4.991
  Start of MODEL   18
    1    H2   PRO   6           2H       PRO   6  -9.839  -4.973 -15.491
    2    HA   PRO   6           HA       PRO   6  -8.102  -7.317 -15.682
    3    HB3  PRO   6           2HB      PRO   6  -7.099  -6.465 -17.614
    4    HG3  PRO   6           2HG      PRO   6  -9.130  -6.856 -18.710
    5    HD3  PRO   6           2HD      PRO   6 -10.370  -7.490 -16.897
    6    H    LEU   7           H        LEU   7  -6.159  -7.146 -14.577
    7    HA   LEU   7           HA       LEU   7  -5.845  -4.792 -12.763
    8    HB3  LEU   7           2HB      LEU   7  -6.904  -6.446 -11.434
    9    HG   LEU   7           HG       LEU   7  -5.307  -8.429 -13.028
   10   HD11  LEU   7          1HD1      LEU   7  -5.286 -10.098 -11.261
   11   HD12  LEU   7          2HD1      LEU   7  -5.818  -8.885 -10.072
   12   HD13  LEU   7          3HD1      LEU   7  -4.234  -8.739 -10.881
   13   HD21  LEU   7          3HD2      LEU   7  -7.783  -8.249 -13.218
   14   HD22  LEU   7          1HD2      LEU   7  -7.940  -8.611 -11.490
   15   HD23  LEU   7          2HD2      LEU   7  -7.294  -9.834 -12.605
   16    H    LYS   8           H        LYS   8  -3.792  -4.427 -11.926
   17    HA   LYS   8           HA       LYS   8  -1.488  -5.832 -13.083
   18    HB3  LYS   8           2HB      LYS   8  -2.213  -4.260 -14.872
   19    HG3  LYS   8           2HG      LYS   8  -1.303  -2.088 -12.927
   20    HD3  LYS   8           2HD      LYS   8  -2.245  -1.967 -15.809
   21    HE3  LYS   8           2HE      LYS   8  -1.146   0.266 -14.035
   22    HZ1  LYS   8           3HZ      LYS   8  -2.556   0.284 -16.630
   23    HZ2  LYS   8           1HZ      LYS   8  -0.949   0.504 -16.482
   24    HZ3  LYS   8           2HZ      LYS   8  -2.029   1.624 -15.857
   25    H    THR   9           H        THR   9   0.546  -5.217 -12.284
   26    HA   THR   9           HA       THR   9   0.375  -4.729  -9.384
   27    HB   THR   9           HB       THR   9   2.611  -5.882 -11.075
   28    HG1  THR   9           1HG      THR   9   0.613  -7.229  -9.580
   29   HG21  THR   9          3HG2      THR   9   2.009  -5.992  -8.082
   30   HG22  THR   9          1HG2      THR   9   3.470  -5.356  -8.877
   31   HG23  THR   9          2HG2      THR   9   3.136  -7.089  -8.904
   32    H    GLN  10           H        GLN  10   1.938  -3.472  -8.242
   33    HA   GLN  10           HA       GLN  10   3.368  -1.316  -9.640
   34    HB3  GLN  10           2HB      GLN  10   0.868  -0.954  -7.913
   35    HG3  GLN  10           2HG      GLN  10   2.393   0.906  -7.425
   36   HE21  GLN  10          1HE2      GLN  10   4.437   1.506  -8.228
   37   HE22  GLN  10          2HE2      GLN  10   4.686   2.091  -9.854
   38    H    GLN  11           H        GLN  11   5.104  -0.741  -8.406
   39    HA   GLN  11           HA       GLN  11   5.172  -1.511  -5.524
   40    HB3  GLN  11           2HB      GLN  11   7.515  -0.740  -7.298
   41    HG3  GLN  11           2HG      GLN  11   7.328  -2.541  -4.836
   42   HE21  GLN  11          1HE2      GLN  11   8.553  -3.940  -6.763
   43   HE22  GLN  11          2HE2      GLN  11  10.297  -3.747  -6.642
   44    H    MET  12           H        MET  12   5.736   0.021  -3.936
   45    HA   MET  12           HA       MET  12   6.201   2.847  -4.674
   46    HB3  MET  12           2HB      MET  12   3.766   2.644  -4.571
   47    HG3  MET  12           2HG      MET  12   3.050   2.442  -1.934
   48    HE1  MET  12           3HE      MET  12   1.751   2.048  -5.051
   49    HE2  MET  12           1HE      MET  12   0.412   1.045  -4.498
   50    HE3  MET  12           2HE      MET  12   0.925   2.426  -3.517
   51    H    GLN  13           H        GLN  13   6.468   4.210  -2.698
   52    HA   GLN  13           HA       GLN  13   8.013   2.789  -0.596
   53    HB3  GLN  13           2HB      GLN  13   7.980   5.734  -1.379
   54    HG3  GLN  13           2HG      GLN  13  10.091   4.142   0.147
   55   HE21  GLN  13          1HE2      GLN  13  12.035   5.376   0.675
   56   HE22  GLN  13          2HE2      GLN  13  12.388   6.857  -0.206
   57    H    VAL  14           H        VAL  14   7.728   3.541   1.627
   58    HA   VAL  14           HA       VAL  14   5.490   5.340   2.233
   59    HB   VAL  14           HB       VAL  14   4.332   3.238   2.207
   60   HG11  VAL  14          1HG1      VAL  14   6.122   1.617   2.319
   61   HG12  VAL  14          2HG1      VAL  14   6.494   2.086   3.999
   62   HG13  VAL  14          3HG1      VAL  14   4.947   1.306   3.586
   63   HG21  VAL  14          3HG2      VAL  14   3.867   4.787   4.136
   64   HG22  VAL  14          1HG2      VAL  14   3.454   3.088   4.432
   65   HG23  VAL  14          2HG2      VAL  14   4.924   3.781   5.141
   66    H    GLY  15           H        GLY  15   5.647   6.186   4.428
   67    HA2  GLY  15           2HA      GLY  15   8.400   6.514   5.374
   68    HA3  GLY  15           3HA      GLY  15   6.938   7.201   6.090
   69    H    GLY  16           H        GLY  16   6.462   6.467   8.052
   70    HA2  GLY  16           2HA      GLY  16   8.100   4.718   9.434
   71    HA3  GLY  16           3HA      GLY  16   6.557   5.325  10.016
   72    H    MET  17           H        MET  17   6.086   3.299   7.236
   73    HA   MET  17           HA       MET  17   5.048   1.097   8.839
   74    HB3  MET  17           2HB      MET  17   5.560   1.020   5.875
   75    HG3  MET  17           2HG      MET  17   3.147   0.128   7.485
   76    HE1  MET  17           3HE      MET  17   4.455  -1.841   3.523
   77    HE2  MET  17           1HE      MET  17   5.535  -0.780   4.436
   78    HE3  MET  17           2HE      MET  17   4.965  -2.290   5.163
   79    H    ARG  18           H        ARG  18   8.132   1.895   8.346
   80    HA   ARG  18           HA       ARG  18   9.527  -0.441   7.522
   81    HB3  ARG  18           2HB      ARG  18  10.441   1.753   7.279
   82    HG3  ARG  18           2HG      ARG  18  10.393   1.958  10.322
   83    HD3  ARG  18           2HD      ARG  18  12.402   3.022   9.272
   84    HE   ARG  18           HE       ARG  18  11.694   3.849   7.174
   85   HH11  ARG  18          1HH1      ARG  18  10.357   5.901   9.800
   86   HH12  ARG  18          2HH1      ARG  18  10.354   7.289   8.740
   87   HH21  ARG  18          1HH2      ARG  18  11.316   5.616   5.894
   88   HH22  ARG  18          2HH2      ARG  18  10.925   7.156   6.640
   89    H    CYS  19           H        CYS  19   7.740  -1.419   9.397
   90    HA   CYS  19           HA       CYS  19   9.499  -2.948  11.137
   91    HB3  CYS  19           2HB      CYS  19   7.327  -1.167  12.347
   92    HG   CYS  19           HG       CYS  19   9.506  -3.126  13.900
   93    H    ALA  20           H        ALA  20   8.638  -4.990  11.453
   94    HA   ALA  20           HA       ALA  20   6.713  -5.928   9.621
   95    HB1  ALA  20           1HB      ALA  20   7.713  -7.146  12.235
   96    HB2  ALA  20           2HB      ALA  20   6.852  -8.018  10.956
   97    HB3  ALA  20           3HB      ALA  20   8.453  -7.325  10.623
   98    H    ALA  21           H        ALA  21   6.206  -5.029  13.040
   99    HA   ALA  21           HA       ALA  21   3.582  -6.048  13.340
  100    HB1  ALA  21           1HB      ALA  21   4.871  -3.577  14.607
  101    HB2  ALA  21           2HB      ALA  21   3.427  -4.419  15.198
  102    HB3  ALA  21           3HB      ALA  21   4.989  -5.249  15.205
  103    H    CYS  22           H        CYS  22   4.565  -2.749  12.201
  104    HA   CYS  22           HA       CYS  22   1.755  -2.142  11.677
  105    HB3  CYS  22           2HB      CYS  22   3.160  -0.418  12.692
  106    HG   CYS  22           HG       CYS  22   5.079   0.933  11.521
  107    H    ALA  23           H        ALA  23   4.553  -2.953   9.621
  108    HA   ALA  23           HA       ALA  23   3.266  -2.764   7.101
  109    HB1  ALA  23           1HB      ALA  23   4.872  -4.468   6.490
  110    HB2  ALA  23           2HB      ALA  23   5.646  -3.337   7.594
  111    HB3  ALA  23           3HB      ALA  23   5.117  -4.932   8.182
  112    H    SER  24           H        SER  24   2.907  -5.252   9.684
  113    HA   SER  24           HA       SER  24   1.070  -6.874   8.088
  114    HB3  SER  24           2HB      SER  24   0.706  -8.040  10.293
  115    HG   SER  24           HG       SER  24   3.005  -8.635  10.484
  116    H    SER  25           H        SER  25   0.614  -4.071  10.150
  117    HA   SER  25           HA       SER  25  -2.259  -4.432  10.503
  118    HB3  SER  25           2HB      SER  25  -2.274  -2.190  11.343
  119    HG   SER  25           HG       SER  25  -1.314  -3.214  12.952
  120    H    ILE  26           H        ILE  26  -0.173  -2.939   8.058
  121    HA   ILE  26           HA       ILE  26  -2.501  -2.083   6.435
  122    HB   ILE  26           HB       ILE  26   0.480  -2.246   5.895
  123   HG13  ILE  26          2HG1      ILE  26  -1.476   0.098   5.823
  124   HG21  ILE  26          1HG2      ILE  26  -0.521  -2.968   3.804
  125   HG22  ILE  26          2HG2      ILE  26  -1.743  -1.671   3.888
  126   HG23  ILE  26          3HG2      ILE  26  -0.032  -1.294   3.622
  127   HD11  ILE  26          3HD1      ILE  26  -0.682  -0.241   8.138
  128   HD12  ILE  26          1HD1      ILE  26   0.991  -0.310   7.545
  129   HD13  ILE  26          2HD1      ILE  26   0.071   1.196   7.398
  130    H    GLU  27           H        GLU  27  -0.116  -4.808   6.224
  131    HA   GLU  27           HA       GLU  27  -1.222  -5.766   3.843
  132    HB3  GLU  27           2HB      GLU  27   0.255  -7.528   5.840
  133    HG3  GLU  27           2HG      GLU  27   0.151  -7.399   2.787
  134    H    ARG  28           H        ARG  28  -2.136  -6.719   7.177
  135    HA   ARG  28           HA       ARG  28  -3.829  -8.918   6.488
  136    HB3  ARG  28           2HB      ARG  28  -4.066  -6.927   8.786
  137    HG3  ARG  28           2HG      ARG  28  -5.235  -9.737   8.466
  138    HD3  ARG  28           2HD      ARG  28  -5.212  -7.760  10.765
  139    HE   ARG  28           HE       ARG  28  -7.449  -8.234  10.832
  140   HH11  ARG  28          1HH1      ARG  28  -5.815 -11.370  10.372
  141   HH12  ARG  28          2HH1      ARG  28  -7.321 -12.227  10.630
  142   HH21  ARG  28          1HH2      ARG  28  -9.283  -9.418  11.089
  143   HH22  ARG  28          2HH2      ARG  28  -9.270 -11.135  10.812
  144    H    ALA  29           H        ALA  29  -4.523  -5.405   6.606
  145    HA   ALA  29           HA       ALA  29  -7.372  -5.828   5.943
  146    HB1  ALA  29           1HB      ALA  29  -5.713  -3.299   6.293
  147    HB2  ALA  29           2HB      ALA  29  -7.468  -3.370   6.011
  148    HB3  ALA  29           3HB      ALA  29  -6.783  -4.040   7.515
  149    H    LEU  30           H        LEU  30  -4.385  -4.831   4.263
  150    HA   LEU  30           HA       LEU  30  -5.453  -3.418   2.173
  151    HB3  LEU  30           2HB      LEU  30  -3.039  -5.261   2.129
  152    HG   LEU  30           HG       LEU  30  -3.417  -4.595  -0.171
  153   HD11  LEU  30          1HD1      LEU  30  -3.789  -1.756   0.889
  154   HD12  LEU  30          2HD1      LEU  30  -4.979  -2.743   0.013
  155   HD13  LEU  30          3HD1      LEU  30  -3.545  -2.167  -0.827
  156   HD21  LEU  30          3HD2      LEU  30  -1.105  -4.399   0.777
  157   HD22  LEU  30          1HD2      LEU  30  -1.408  -2.676   1.085
  158   HD23  LEU  30          2HD2      LEU  30  -1.401  -3.292  -0.581
  159    H    GLU  31           H        GLU  31  -5.068  -6.992   2.172
  160    HA   GLU  31           HA       GLU  31  -6.177  -7.239  -0.507
  161    HB3  GLU  31           2HB      GLU  31  -5.991  -9.619  -0.142
  162    HG3  GLU  31           2HG      GLU  31  -3.628  -8.326   1.296
  163    H    ARG  32           H        ARG  32  -7.538  -6.833   2.589
  164    HA   ARG  32           HA       ARG  32 -10.207  -7.835   1.866
  165    HB3  ARG  32           2HB      ARG  32 -10.753  -7.280   4.247
  166    HG3  ARG  32           2HG      ARG  32  -8.339  -9.118   3.894
  167    HD3  ARG  32           2HD      ARG  32 -10.437  -8.826   6.073
  168    HE   ARG  32           HE       ARG  32 -10.211 -11.100   6.189
  169   HH11  ARG  32          1HH1      ARG  32  -6.910  -9.772   5.973
  170   HH12  ARG  32          2HH1      ARG  32  -6.218 -11.353   6.296
  171   HH21  ARG  32          1HH2      ARG  32  -9.225 -13.048   6.440
  172   HH22  ARG  32          2HH2      ARG  32  -7.498 -13.148   6.665
  173    H    LEU  33           H        LEU  33  -8.472  -4.918   1.491
  174    HA   LEU  33           HA       LEU  33 -10.784  -3.122   1.576
  175    HB3  LEU  33           2HB      LEU  33  -9.446  -1.620   0.207
  176    HG   LEU  33           HG       LEU  33  -7.510  -2.919   2.132
  177   HD11  LEU  33          1HD1      LEU  33  -6.627  -1.256   0.442
  178   HD12  LEU  33          2HD1      LEU  33  -6.399  -0.780   2.134
  179   HD13  LEU  33          3HD1      LEU  33  -7.699  -0.050   1.166
  180   HD21  LEU  33          3HD2      LEU  33  -9.524  -2.382   3.408
  181   HD22  LEU  33          1HD2      LEU  33  -9.551  -0.746   2.702
  182   HD23  LEU  33          2HD2      LEU  33  -8.228  -1.237   3.780
  183    H    LYS  34           H        LYS  34 -11.479  -2.026  -0.495
  184    HA   LYS  34           HA       LYS  34 -12.633  -3.985  -2.324
  185    HB3  LYS  34           2HB      LYS  34 -13.863  -2.020  -1.460
  186    HG3  LYS  34           2HG      LYS  34 -12.164  -0.348  -3.373
  187    HD3  LYS  34           2HD      LYS  34 -14.294   0.435  -1.341
  188    HE3  LYS  34           2HE      LYS  34 -12.944   2.021  -3.569
  189    HZ1  LYS  34           3HZ      LYS  34 -14.230   3.845  -2.673
  190    HZ2  LYS  34           1HZ      LYS  34 -14.803   2.909  -1.434
  191    HZ3  LYS  34           2HZ      LYS  34 -15.255   2.612  -2.969
  192    H    GLY  35           H        GLY  35 -12.351  -4.000  -4.611
  193    HA2  GLY  35           2HA      GLY  35 -11.429  -3.654  -6.685
  194    HA3  GLY  35           3HA      GLY  35 -10.676  -2.188  -6.034
  195    H    VAL  36           H        VAL  36  -8.931  -3.483  -4.140
  196    HA   VAL  36           HA       VAL  36  -6.795  -4.259  -5.942
  197    HB   VAL  36           HB       VAL  36  -5.309  -4.249  -4.109
  198   HG11  VAL  36          1HG1      VAL  36  -6.171  -1.985  -4.841
  199   HG12  VAL  36          2HG1      VAL  36  -7.317  -2.033  -3.495
  200   HG13  VAL  36          3HG1      VAL  36  -5.574  -2.032  -3.179
  201   HG21  VAL  36          3HG2      VAL  36  -6.020  -3.953  -1.773
  202   HG22  VAL  36          1HG2      VAL  36  -7.716  -4.212  -2.243
  203   HG23  VAL  36          2HG2      VAL  36  -6.517  -5.519  -2.416
  204    H    ALA  37           H        ALA  37  -5.592  -6.152  -6.002
  205    HA   ALA  37           HA       ALA  37  -7.240  -8.594  -5.547
  206    HB1  ALA  37           1HB      ALA  37  -5.966  -9.483  -7.440
  207    HB2  ALA  37           2HB      ALA  37  -6.696  -7.924  -7.867
  208    HB3  ALA  37           3HB      ALA  37  -4.962  -8.020  -7.487
  209    H    GLU  38           H        GLU  38  -3.773  -7.528  -5.250
  210    HA   GLU  38           HA       GLU  38  -3.274  -9.450  -3.183
  211    HB3  GLU  38           2HB      GLU  38  -3.313 -11.083  -4.922
  212    HG3  GLU  38           2HG      GLU  38  -1.200  -9.439  -6.367
  213    H    ALA  39           H        ALA  39  -1.186  -9.284  -2.163
  214    HA   ALA  39           HA       ALA  39   0.498  -7.022  -3.012
  215    HB1  ALA  39           1HB      ALA  39  -1.580  -6.013  -2.047
  216    HB2  ALA  39           2HB      ALA  39  -1.239  -6.844  -0.515
  217    HB3  ALA  39           3HB      ALA  39  -0.115  -5.608  -1.133
  218    H    SER  40           H        SER  40   2.219  -6.460  -1.559
  219    HA   SER  40           HA       SER  40   2.954  -8.335   0.604
  220    HB3  SER  40           2HB      SER  40   5.076  -8.961  -0.348
  221    HG   SER  40           HG       SER  40   2.794  -9.861  -1.266
  222    H    VAL  41           H        VAL  41   3.775  -7.122   2.217
  223    HA   VAL  41           HA       VAL  41   4.972  -4.493   1.804
  224    HB   VAL  41           HB       VAL  41   5.342  -4.464   4.219
  225   HG11  VAL  41          1HG1      VAL  41   3.154  -3.848   3.330
  226   HG12  VAL  41          2HG1      VAL  41   2.598  -5.523   3.445
  227   HG13  VAL  41          3HG1      VAL  41   3.007  -4.608   4.909
  228   HG21  VAL  41          3HG2      VAL  41   6.039  -6.632   4.834
  229   HG22  VAL  41          1HG2      VAL  41   4.450  -6.454   5.591
  230   HG23  VAL  41          2HG2      VAL  41   4.630  -7.417   4.125
  231    H    THR  42           H        THR  42   7.040  -3.774   2.191
  232    HA   THR  42           HA       THR  42   9.271  -5.778   2.382
  233    HB   THR  42           HB       THR  42   9.191  -3.233   0.728
  234    HG1  THR  42           1HG      THR  42   9.546  -4.997  -0.906
  235   HG21  THR  42          3HG2      THR  42  11.360  -3.951  -0.086
  236   HG22  THR  42          1HG2      THR  42  11.297  -5.435   0.899
  237   HG23  THR  42          2HG2      THR  42  11.446  -3.843   1.673
  238    H    VAL  43           H        VAL  43   9.557  -5.569   4.530
  239    HA   VAL  43           HA       VAL  43   9.221  -3.094   5.961
  240    HB   VAL  43           HB       VAL  43  10.235  -5.844   6.708
  241   HG11  VAL  43          1HG1      VAL  43  10.104  -5.175   9.118
  242   HG12  VAL  43          2HG1      VAL  43  11.461  -4.425   8.276
  243   HG13  VAL  43          3HG1      VAL  43   9.997  -3.474   8.614
  244   HG21  VAL  43          3HG2      VAL  43   8.112  -5.923   7.916
  245   HG22  VAL  43          1HG2      VAL  43   7.816  -4.199   7.568
  246   HG23  VAL  43          2HG2      VAL  43   7.785  -5.394   6.260
  247    H    ALA  44           H        ALA  44  12.158  -4.653   4.633
  248    HA   ALA  44           HA       ALA  44  14.058  -3.386   6.325
  249    HB1  ALA  44           1HB      ALA  44  14.519  -5.386   4.973
  250    HB2  ALA  44           2HB      ALA  44  14.342  -4.441   3.474
  251    HB3  ALA  44           3HB      ALA  44  15.674  -4.100   4.588
  252    H    THR  45           H        THR  45  12.406  -2.061   3.539
  253    HA   THR  45           HA       THR  45  13.969   0.498   3.784
  254    HB   THR  45           HB       THR  45  12.826   0.947   1.504
  255    HG1  THR  45           1HG      THR  45  12.923  -1.837   1.231
  256   HG21  THR  45          3HG2      THR  45  15.175   0.691   1.509
  257   HG22  THR  45          1HG2      THR  45  14.581  -0.422   0.276
  258   HG23  THR  45          2HG2      THR  45  15.095  -1.039   1.865
  259    H    GLY  46           H        GLY  46  10.787  -0.924   4.214
  260    HA2  GLY  46           2HA      GLY  46   8.721   0.044   4.629
  261    HA3  GLY  46           3HA      GLY  46   9.457   1.662   4.675
  262    H    ARG  47           H        ARG  47   8.975  -1.047   2.404
  263    HA   ARG  47           HA       ARG  47   7.771   0.776   0.375
  264    HB3  ARG  47           2HB      ARG  47   8.914  -0.635  -1.398
  265    HG3  ARG  47           2HG      ARG  47  10.756   0.996   0.402
  266    HD3  ARG  47           2HD      ARG  47  11.961  -0.367  -1.311
  267    HE   ARG  47           HE       ARG  47  10.822  -0.545  -3.288
  268   HH11  ARG  47          1HH1      ARG  47  11.096   2.965  -2.644
  269   HH12  ARG  47          2HH1      ARG  47  10.106   3.347  -4.046
  270   HH21  ARG  47          1HH2      ARG  47  10.092   0.127  -5.281
  271   HH22  ARG  47          2HH2      ARG  47   9.868   1.832  -5.641
  272    H    LEU  48           H        LEU  48   6.635  -0.623  -1.358
  273    HA   LEU  48           HA       LEU  48   5.337  -3.038  -0.268
  274    HB3  LEU  48           2HB      LEU  48   3.419  -0.796  -0.899
  275    HG   LEU  48           HG       LEU  48   3.622  -2.824   1.358
  276   HD11  LEU  48          1HD1      LEU  48   2.727  -0.703   2.181
  277   HD12  LEU  48          2HD1      LEU  48   1.451  -1.931   2.091
  278   HD13  LEU  48          3HD1      LEU  48   1.555  -0.659   0.849
  279   HD21  LEU  48          3HD2      LEU  48   1.399  -3.622   0.457
  280   HD22  LEU  48          1HD2      LEU  48   2.750  -3.930  -0.611
  281   HD23  LEU  48          2HD2      LEU  48   1.649  -2.577  -0.961
  282    H    THR  49           H        THR  49   4.170  -4.186  -1.777
  283    HA   THR  49           HA       THR  49   4.111  -3.266  -4.632
  284    HB   THR  49           HB       THR  49   4.590  -6.120  -3.669
  285    HG1  THR  49           1HG      THR  49   6.447  -4.981  -3.434
  286   HG21  THR  49          3HG2      THR  49   5.027  -6.544  -6.086
  287   HG22  THR  49          1HG2      THR  49   4.529  -4.879  -6.461
  288   HG23  THR  49          2HG2      THR  49   3.357  -6.049  -5.801
  289    H    VAL  50           H        VAL  50   2.106  -3.259  -5.400
  290    HA   VAL  50           HA       VAL  50   0.020  -5.019  -4.198
  291    HB   VAL  50           HB       VAL  50  -0.095  -2.839  -3.033
  292   HG11  VAL  50          1HG1      VAL  50  -0.800  -1.641  -5.749
  293   HG12  VAL  50          2HG1      VAL  50  -0.864  -0.818  -4.185
  294   HG13  VAL  50          3HG1      VAL  50   0.695  -1.347  -4.846
  295   HG21  VAL  50          3HG2      VAL  50  -2.146  -4.187  -3.309
  296   HG22  VAL  50          1HG2      VAL  50  -2.490  -2.450  -3.278
  297   HG23  VAL  50          2HG2      VAL  50  -2.518  -3.327  -4.814
  298    H    THR  51           H        THR  51  -1.554  -5.676  -5.543
  299    HA   THR  51           HA       THR  51  -1.479  -4.902  -8.441
  300    HB   THR  51           HB       THR  51  -2.212  -7.530  -7.057
  301    HG1  THR  51           1HG      THR  51  -0.020  -7.386  -7.267
  302   HG21  THR  51          3HG2      THR  51  -3.603  -7.154  -9.135
  303   HG22  THR  51          1HG2      THR  51  -2.396  -8.421  -9.386
  304   HG23  THR  51          2HG2      THR  51  -2.132  -6.799 -10.054
  305    H    TYR  52           H        TYR  52  -3.289  -3.982  -9.211
  306    HA   TYR  52           HA       TYR  52  -5.901  -4.528  -7.991
  307    HB3  TYR  52           2HB      TYR  52  -5.007  -2.882  -6.494
  308    HD1  TYR  52           1HD      TYR  52  -5.682  -0.731  -9.533
  309    HD2  TYR  52           2HD      TYR  52  -3.132  -1.577  -6.172
  310    HE1  TYR  52           1HE      TYR  52  -4.403   1.347  -9.983
  311    HE2  TYR  52           2HE      TYR  52  -1.872   0.521  -6.594
  312    HH   TYR  52           HH       TYR  52  -1.726   2.445  -7.860
  313    H    ASP  53           H        ASP  53  -7.698  -3.206  -9.005
  314    HA   ASP  53           HA       ASP  53  -7.468  -3.289 -11.919
  315    HB3  ASP  53           2HB      ASP  53  -9.786  -2.823 -10.012
  316    HA   PRO  54           HA       PRO  54  -6.385   1.049 -11.348
  317    HB3  PRO  54           2HB      PRO  54  -4.658   0.567 -12.831
  318    HG3  PRO  54           2HG      PRO  54  -5.024  -0.786 -14.771
  319    HD3  PRO  54           2HD      PRO  54  -5.685  -2.114 -12.955
  320    H    LYS  55           H        LYS  55  -9.250   0.013 -12.389
  321    HA   LYS  55           HA       LYS  55 -10.175   2.669 -13.497
  322    HB3  LYS  55           2HB      LYS  55 -11.989   1.533 -14.585
  323    HG3  LYS  55           2HG      LYS  55  -9.468  -0.068 -15.216
  324    HD3  LYS  55           2HD      LYS  55 -11.938   0.427 -16.933
  325    HE3  LYS  55           2HE      LYS  55  -9.441  -1.283 -17.213
  326    HZ1  LYS  55           3HZ      LYS  55 -11.397  -2.655 -17.643
  327    HZ2  LYS  55           1HZ      LYS  55 -10.518  -2.418 -19.016
  328    HZ3  LYS  55           2HZ      LYS  55 -11.938  -1.616 -18.776
  329    H    GLN  56           H        GLN  56 -11.071  -0.151 -11.493
  330    HA   GLN  56           HA       GLN  56 -13.072   1.164  -9.871
  331    HB3  GLN  56           2HB      GLN  56 -12.530  -0.747  -8.277
  332    HG3  GLN  56           2HG      GLN  56 -13.029  -2.667  -9.867
  333   HE21  GLN  56          1HE2      GLN  56 -15.339  -2.914 -10.935
  334   HE22  GLN  56          2HE2      GLN  56 -16.581  -1.929 -10.179
  335    H    VAL  57           H        VAL  57  -9.454   0.892  -9.508
  336    HA   VAL  57           HA       VAL  57  -9.648   2.998  -7.429
  337    HB   VAL  57           HB       VAL  57  -8.315   1.821  -5.786
  338   HG11  VAL  57          1HG1      VAL  57  -9.921   0.217  -4.916
  339   HG12  VAL  57          2HG1      VAL  57 -10.759   1.639  -5.549
  340   HG13  VAL  57          3HG1      VAL  57 -10.742   0.118  -6.475
  341   HG21  VAL  57          3HG2      VAL  57  -8.560  -0.662  -7.556
  342   HG22  VAL  57          1HG2      VAL  57  -7.069   0.261  -7.261
  343   HG23  VAL  57          2HG2      VAL  57  -7.855  -0.598  -5.931
  344    H    SER  58           H        SER  58  -7.287   3.353  -6.466
  345    HA   SER  58           HA       SER  58  -5.079   3.145  -8.340
  346    HB3  SER  58           2HB      SER  58  -6.415   5.116  -9.201
  347    HG   SER  58           HG       SER  58  -7.095   6.271  -7.489
  348    H    GLU  59           H        GLU  59  -3.457   5.227  -7.148
  349    HA   GLU  59           HA       GLU  59  -2.416   4.151  -4.806
  350    HB3  GLU  59           2HB      GLU  59  -1.430   5.982  -6.244
  351    HG3  GLU  59           2HG      GLU  59  -3.006   7.886  -4.444
  352    H    ILE  60           H        ILE  60  -5.287   6.078  -5.117
  353    HA   ILE  60           HA       ILE  60  -5.574   7.242  -2.536
  354    HB   ILE  60           HB       ILE  60  -7.480   6.329  -4.725
  355   HG13  ILE  60          2HG1      ILE  60  -7.775   8.672  -5.215
  356   HG21  ILE  60          1HG2      ILE  60  -8.206   7.595  -2.097
  357   HG22  ILE  60          2HG2      ILE  60  -9.244   7.723  -3.548
  358   HG23  ILE  60          3HG2      ILE  60  -8.874   6.135  -2.873
  359   HD11  ILE  60          3HD1      ILE  60  -6.374  10.438  -4.311
  360   HD12  ILE  60          1HD1      ILE  60  -7.352   9.742  -3.009
  361   HD13  ILE  60          2HD1      ILE  60  -5.624   9.331  -3.157
  362    H    THR  61           H        THR  61  -6.852   4.077  -3.662
  363    HA   THR  61           HA       THR  61  -8.255   3.591  -1.218
  364    HB   THR  61           HB       THR  61  -7.351   1.769  -3.477
  365    HG1  THR  61           1HG      THR  61  -9.798   3.025  -2.711
  366   HG21  THR  61          3HG2      THR  61  -9.307   1.161  -1.204
  367   HG22  THR  61          1HG2      THR  61  -7.793   0.294  -1.566
  368   HG23  THR  61          2HG2      THR  61  -9.146   0.209  -2.695
  369    H    ILE  62           H        ILE  62  -4.977   2.793  -2.174
  370    HA   ILE  62           HA       ILE  62  -4.493   1.302   0.334
  371    HB   ILE  62           HB       ILE  62  -3.538   0.464  -1.722
  372   HG13  ILE  62          2HG1      ILE  62  -2.357   0.102   0.422
  373   HG21  ILE  62          1HG2      ILE  62  -1.896   3.017  -1.961
  374   HG22  ILE  62          2HG2      ILE  62  -1.788   1.585  -3.007
  375   HG23  ILE  62          3HG2      ILE  62  -3.251   2.540  -3.013
  376   HD11  ILE  62          3HD1      ILE  62  -0.299  -0.746  -0.439
  377   HD12  ILE  62          1HD1      ILE  62  -1.481  -0.936  -1.736
  378   HD13  ILE  62          2HD1      ILE  62  -0.290   0.387  -1.805
  379    H    GLN  63           H        GLN  63  -3.784   4.582  -0.966
  380    HA   GLN  63           HA       GLN  63  -2.206   5.533   1.193
  381    HB3  GLN  63           2HB      GLN  63  -4.366   7.086  -0.301
  382    HG3  GLN  63           2HG      GLN  63  -3.286   8.284   1.650
  383   HE21  GLN  63          1HE2      GLN  63  -0.935   9.030  -0.939
  384   HE22  GLN  63          2HE2      GLN  63   0.482   8.584   0.009
  385    H    GLU  64           H        GLU  64  -5.807   5.482   0.880
  386    HA   GLU  64           HA       GLU  64  -6.524   6.553   3.375
  387    HB3  GLU  64           2HB      GLU  64  -8.558   4.994   3.083
  388    HG3  GLU  64           2HG      GLU  64  -7.674   6.772   0.778
  389    H    ARG  65           H        ARG  65  -5.041   3.431   2.867
  390    HA   ARG  65           HA       ARG  65  -5.761   2.487   5.584
  391    HB3  ARG  65           2HB      ARG  65  -4.163   1.153   3.353
  392    HG3  ARG  65           2HG      ARG  65  -3.622  -0.008   5.376
  393    HD3  ARG  65           2HD      ARG  65  -5.245   0.659   7.002
  394    HE   ARG  65           HE       ARG  65  -7.221   0.367   5.099
  395   HH11  ARG  65          1HH1      ARG  65  -6.966  -0.976   8.416
  396   HH12  ARG  65          2HH1      ARG  65  -8.668  -0.652   8.675
  397   HH21  ARG  65          1HH2      ARG  65  -9.295   0.429   5.442
  398   HH22  ARG  65          2HH2      ARG  65 -10.022  -0.158   6.926
  399    H    ILE  66           H        ILE  66  -2.790   3.353   3.700
  400    HA   ILE  66           HA       ILE  66  -1.026   3.105   6.027
  401    HB   ILE  66           HB       ILE  66  -0.718   4.546   3.352
  402   HG13  ILE  66          2HG1      ILE  66   0.752   2.169   4.616
  403   HG21  ILE  66          1HG2      ILE  66   0.520   5.858   5.044
  404   HG22  ILE  66          2HG2      ILE  66   1.248   4.342   5.658
  405   HG23  ILE  66          3HG2      ILE  66   1.636   4.970   4.034
  406   HD11  ILE  66          3HD1      ILE  66  -1.287   1.349   3.468
  407   HD12  ILE  66          1HD1      ILE  66  -0.845   2.329   2.043
  408   HD13  ILE  66          2HD1      ILE  66   0.166   0.958   2.512
  409    H    ALA  67           H        ALA  67  -2.757   5.899   4.625
  410    HA   ALA  67           HA       ALA  67  -1.753   7.842   6.385
  411    HB1  ALA  67           1HB      ALA  67  -3.531   9.244   5.473
  412    HB2  ALA  67           2HB      ALA  67  -2.783   8.280   4.192
  413    HB3  ALA  67           3HB      ALA  67  -4.373   7.812   4.843
  414    H    ALA  68           H        ALA  68  -4.275   5.496   6.934
  415    HA   ALA  68           HA       ALA  68  -5.395   6.855   9.308
  416    HB1  ALA  68           1HB      ALA  68  -6.826   5.631   7.696
  417    HB2  ALA  68           2HB      ALA  68  -5.929   4.133   8.021
  418    HB3  ALA  68           3HB      ALA  68  -6.889   4.895   9.312
  419    H    LEU  69           H        LEU  69  -3.175   4.155   8.537
  420    HA   LEU  69           HA       LEU  69  -2.844   3.388  11.332
  421    HB3  LEU  69           2HB      LEU  69  -0.828   2.113  10.082
  422    HG   LEU  69           HG       LEU  69  -2.446   0.309   9.444
  423   HD11  LEU  69          1HD1      LEU  69  -2.772   1.462  12.247
  424   HD12  LEU  69          2HD1      LEU  69  -1.475   0.390  11.682
  425   HD13  LEU  69          3HD1      LEU  69  -3.147  -0.191  11.753
  426   HD21  LEU  69          3HD2      LEU  69  -4.793   0.457  10.019
  427   HD22  LEU  69          1HD2      LEU  69  -4.408   1.720   8.842
  428   HD23  LEU  69          2HD2      LEU  69  -4.626   2.125  10.556
  429    H    GLY  70           H        GLY  70  -1.484   5.969   9.579
  430    HA2  GLY  70           2HA      GLY  70  -0.737   7.695  11.132
  431    HA3  GLY  70           3HA      GLY  70   0.228   6.494  12.003
  432    H    TYR  71           H        TYR  71   0.361   6.402   8.525
  433    HA   TYR  71           HA       TYR  71   2.896   7.999   8.466
  434    HB3  TYR  71           2HB      TYR  71   4.074   6.277   7.426
  435    HD1  TYR  71           2HD      TYR  71   4.382   6.307  10.082
  436    HD2  TYR  71           1HD      TYR  71   1.864   3.535   7.947
  437    HE1  TYR  71           2HE      TYR  71   4.413   4.771  12.032
  438    HE2  TYR  71           1HE      TYR  71   1.885   2.004   9.906
  439    HH   TYR  71           HH       TYR  71   3.791   2.722  12.871
  440    H    THR  72           H        THR  72   3.493   7.906   5.792
  441    HA   THR  72           HA       THR  72   0.998   8.198   4.176
  442    HB   THR  72           HB       THR  72   3.203  10.268   4.406
  443    HG1  THR  72           1HG      THR  72   1.507  10.753   5.629
  444   HG21  THR  72          3HG2      THR  72   2.949   9.971   1.990
  445   HG22  THR  72          1HG2      THR  72   2.132  11.445   2.501
  446   HG23  THR  72          2HG2      THR  72   1.173   9.989   2.143
  447    H    LEU  73           H        LEU  73   1.129   7.454   2.183
  448    HA   LEU  73           HA       LEU  73   3.470   5.830   1.356
  449    HB3  LEU  73           2HB      LEU  73   0.519   5.960   0.595
  450    HG   LEU  73           HG       LEU  73   2.699   4.349  -0.722
  451   HD11  LEU  73          1HD1      LEU  73   0.911   2.642  -1.278
  452   HD12  LEU  73          2HD1      LEU  73  -0.163   3.464  -0.133
  453   HD13  LEU  73          3HD1      LEU  73   1.328   2.677   0.439
  454   HD21  LEU  73          3HD2      LEU  73   1.259   4.613  -2.709
  455   HD22  LEU  73          1HD2      LEU  73   1.575   6.202  -2.019
  456   HD23  LEU  73          2HD2      LEU  73   0.013   5.421  -1.735
  457    H    ALA  74           H        ALA  74   4.455   6.026  -0.643
  458    HA   ALA  74           HA       ALA  74   3.734   8.343  -2.364
  459    HB1  ALA  74           1HB      ALA  74   6.146   8.915  -2.501
  460    HB2  ALA  74           2HB      ALA  74   5.499   9.121  -0.857
  461    HB3  ALA  74           3HB      ALA  74   6.501   7.706  -1.255
  462    H    GLU  75           H        GLU  75   3.252   7.580  -4.262
  463    HA   GLU  75           HA       GLU  75   5.190   5.800  -5.668
  464    HB3  GLU  75           2HB      GLU  75   2.258   5.977  -6.401
  465    HG3  GLU  75           2HG      GLU  75   2.634   3.637  -7.093
  466    HA   PRO  76           HA       PRO  76   5.191  10.165  -6.909
  467    HB3  PRO  76           2HB      PRO  76   7.222  10.248  -5.838
  468    HG3  PRO  76           2HG      PRO  76   8.837   8.485  -6.077
  469    HD3  PRO  76           2HD      PRO  76   6.855   7.510  -5.250
  Start of MODEL   19
    1    H2   PRO   6           2H       PRO   6  -8.953  -4.608 -16.627
    2    HA   PRO   6           HA       PRO   6  -6.889  -6.676 -16.722
    3    HB3  PRO   6           2HB      PRO   6  -5.645  -5.610 -18.325
    4    HG3  PRO   6           2HG      PRO   6  -7.313  -5.642 -19.951
    5    HD3  PRO   6           2HD      PRO   6  -8.791  -6.780 -18.593
    6    H    LEU   7           H        LEU   7  -4.781  -5.750 -15.642
    7    HA   LEU   7           HA       LEU   7  -5.209  -3.764 -13.560
    8    HB3  LEU   7           2HB      LEU   7  -6.400  -5.790 -12.714
    9    HG   LEU   7           HG       LEU   7  -3.636  -7.042 -12.402
   10   HD11  LEU   7          1HD1      LEU   7  -6.411  -8.065 -11.660
   11   HD12  LEU   7          2HD1      LEU   7  -5.284  -7.276 -10.543
   12   HD13  LEU   7          3HD1      LEU   7  -4.850  -8.830 -11.281
   13   HD21  LEU   7          3HD2      LEU   7  -5.926  -7.988 -14.184
   14   HD22  LEU   7          1HD2      LEU   7  -4.531  -8.983 -13.711
   15   HD23  LEU   7          2HD2      LEU   7  -4.277  -7.550 -14.697
   16    H    LYS   8           H        LYS   8  -3.291  -3.354 -12.287
   17    HA   LYS   8           HA       LYS   8  -0.760  -4.101 -13.732
   18    HB3  LYS   8           2HB      LYS   8  -0.139  -1.737 -13.699
   19    HG3  LYS   8           2HG      LYS   8  -2.945  -1.999 -14.878
   20    HD3  LYS   8           2HD      LYS   8  -2.242  -0.260 -16.434
   21    HE3  LYS   8           2HE      LYS   8  -1.764   0.719 -13.582
   22    HZ1  LYS   8           3HZ      LYS   8  -3.084   2.052 -15.868
   23    HZ2  LYS   8           1HZ      LYS   8  -1.525   2.341 -15.428
   24    HZ3  LYS   8           2HZ      LYS   8  -2.757   2.719 -14.407
   25    H    THR   9           H        THR   9   1.014  -4.445 -12.455
   26    HA   THR   9           HA       THR   9   0.825  -4.153  -9.526
   27    HB   THR   9           HB       THR   9   1.879  -6.134 -10.631
   28    HG1  THR   9           1HG      THR   9   3.179  -6.278  -8.908
   29   HG21  THR   9          3HG2      THR   9   4.192  -6.048 -11.294
   30   HG22  THR   9          1HG2      THR   9   4.331  -4.328 -10.888
   31   HG23  THR   9          2HG2      THR   9   3.351  -4.838 -12.277
   32    H    GLN  10           H        GLN  10   2.521  -3.112  -8.275
   33    HA   GLN  10           HA       GLN  10   4.117  -0.996  -9.386
   34    HB3  GLN  10           2HB      GLN  10   1.614  -0.280  -7.783
   35    HG3  GLN  10           2HG      GLN  10   3.443   1.250  -7.107
   36   HE21  GLN  10          1HE2      GLN  10   3.017   3.441  -9.630
   37   HE22  GLN  10          2HE2      GLN  10   4.555   3.177 -10.453
   38    H    GLN  11           H        GLN  11   5.555  -0.160  -7.842
   39    HA   GLN  11           HA       GLN  11   5.618  -1.533  -5.192
   40    HB3  GLN  11           2HB      GLN  11   7.999  -0.321  -6.629
   41    HG3  GLN  11           2HG      GLN  11   7.911  -2.636  -4.650
   42   HE21  GLN  11          1HE2      GLN  11   9.708  -3.173  -6.451
   43   HE22  GLN  11          2HE2      GLN  11  11.279  -2.454  -6.107
   44    H    MET  12           H        MET  12   5.714  -0.189  -3.398
   45    HA   MET  12           HA       MET  12   5.292   2.736  -3.897
   46    HB3  MET  12           2HB      MET  12   3.509   0.714  -2.481
   47    HG3  MET  12           2HG      MET  12   3.106   3.715  -2.774
   48    HE1  MET  12           3HE      MET  12   0.978   1.862  -4.369
   49    HE2  MET  12           1HE      MET  12  -0.465   2.718  -3.798
   50    HE3  MET  12           2HE      MET  12   1.005   3.633  -4.172
   51    H    GLN  13           H        GLN  13   5.702   4.101  -2.153
   52    HA   GLN  13           HA       GLN  13   7.344   2.880   0.029
   53    HB3  GLN  13           2HB      GLN  13   8.239   5.247   0.244
   54    HG3  GLN  13           2HG      GLN  13   8.683   3.926  -2.467
   55   HE21  GLN  13          1HE2      GLN  13  11.395   3.851  -2.389
   56   HE22  GLN  13          2HE2      GLN  13  12.019   5.503  -2.458
   57    H    VAL  14           H        VAL  14   7.190   3.835   2.120
   58    HA   VAL  14           HA       VAL  14   4.563   4.934   2.901
   59    HB   VAL  14           HB       VAL  14   3.830   2.764   2.681
   60   HG11  VAL  14          1HG1      VAL  14   4.934   0.727   3.579
   61   HG12  VAL  14          2HG1      VAL  14   5.801   1.481   2.241
   62   HG13  VAL  14          3HG1      VAL  14   6.391   1.696   3.898
   63   HG21  VAL  14          3HG2      VAL  14   4.632   2.858   5.605
   64   HG22  VAL  14          1HG2      VAL  14   3.301   3.775   4.876
   65   HG23  VAL  14          2HG2      VAL  14   3.259   2.003   4.878
   66    H    GLY  15           H        GLY  15   5.216   6.521   4.112
   67    HA2  GLY  15           2HA      GLY  15   7.703   6.587   5.543
   68    HA3  GLY  15           3HA      GLY  15   6.409   7.802   5.610
   69    H    GLY  16           H        GLY  16   7.944   5.170   7.178
   70    HA2  GLY  16           2HA      GLY  16   7.815   5.275   9.668
   71    HA3  GLY  16           3HA      GLY  16   6.057   5.251   9.509
   72    H    MET  17           H        MET  17   6.637   3.140   7.156
   73    HA   MET  17           HA       MET  17   6.857   0.772   8.961
   74    HB3  MET  17           2HB      MET  17   6.422   0.821   5.962
   75    HG3  MET  17           2HG      MET  17   5.585  -1.177   8.099
   76    HE1  MET  17           3HE      MET  17   7.024  -2.525   4.855
   77    HE2  MET  17           1HE      MET  17   5.731  -2.318   3.654
   78    HE3  MET  17           2HE      MET  17   6.600  -0.899   4.274
   79    H    ARG  18           H        ARG  18   8.722  -0.279   9.181
   80    HA   ARG  18           HA       ARG  18  10.811  -0.873   7.555
   81    HB3  ARG  18           2HB      ARG  18  11.387   1.405   7.022
   82    HG3  ARG  18           2HG      ARG  18  11.812   1.884  10.001
   83    HD3  ARG  18           2HD      ARG  18  12.037   3.816   7.638
   84    HE   ARG  18           HE       ARG  18  13.452   4.486  10.050
   85   HH11  ARG  18          1HH1      ARG  18  10.328   4.957   8.459
   86   HH12  ARG  18          2HH1      ARG  18   9.909   6.293   9.515
   87   HH21  ARG  18          1HH2      ARG  18  12.872   6.184  11.344
   88   HH22  ARG  18          2HH2      ARG  18  11.343   6.991  11.103
   89    H    CYS  19           H        CYS  19  12.694  -1.655   8.689
   90    HA   CYS  19           HA       CYS  19  13.947  -2.557  10.313
   91    HB3  CYS  19           2HB      CYS  19  13.994  -1.497  12.536
   92    HG   CYS  19           HG       CYS  19  14.332   1.110  11.921
   93    H    ALA  20           H        ALA  20  10.693  -2.293  11.815
   94    HA   ALA  20           HA       ALA  20  10.473  -5.178  12.159
   95    HB1  ALA  20           1HB      ALA  20  12.005  -4.638  14.028
   96    HB2  ALA  20           2HB      ALA  20  10.870  -3.402  14.612
   97    HB3  ALA  20           3HB      ALA  20  10.412  -5.118  14.633
   98    H    ALA  21           H        ALA  21   8.479  -5.861  12.608
   99    HA   ALA  21           HA       ALA  21   6.243  -5.989  12.813
  100    HB1  ALA  21           1HB      ALA  21   7.112  -5.450  15.087
  101    HB2  ALA  21           2HB      ALA  21   6.712  -3.740  14.814
  102    HB3  ALA  21           3HB      ALA  21   5.429  -4.967  14.870
  103    H    CYS  22           H        CYS  22   4.192  -4.373  13.423
  104    HA   CYS  22           HA       CYS  22   2.745  -2.733  12.996
  105    HB3  CYS  22           2HB      CYS  22   3.642  -0.538  12.289
  106    HG   CYS  22           HG       CYS  22   5.518  -0.061  14.112
  107    H    ALA  23           H        ALA  23   4.511  -3.687  10.147
  108    HA   ALA  23           HA       ALA  23   2.986  -2.658   8.047
  109    HB1  ALA  23           1HB      ALA  23   4.273  -5.407   8.285
  110    HB2  ALA  23           2HB      ALA  23   3.939  -4.465   6.810
  111    HB3  ALA  23           3HB      ALA  23   5.129  -3.877   7.957
  112    H    SER  24           H        SER  24   2.149  -5.265  10.270
  113    HA   SER  24           HA       SER  24   0.053  -6.631   9.026
  114    HB3  SER  24           2HB      SER  24  -0.944  -6.691  11.399
  115    HG   SER  24           HG       SER  24   1.831  -7.306  11.258
  116    H    SER  25           H        SER  25  -0.156  -3.360  10.516
  117    HA   SER  25           HA       SER  25  -3.049  -3.297  10.320
  118    HB3  SER  25           2HB      SER  25  -2.911  -1.025  11.068
  119    HG   SER  25           HG       SER  25  -1.859  -1.291  12.940
  120    H    ILE  26           H        ILE  26  -0.635  -2.839   8.016
  121    HA   ILE  26           HA       ILE  26  -2.490  -1.516   6.074
  122    HB   ILE  26           HB       ILE  26   0.491  -1.973   6.166
  123   HG13  ILE  26          2HG1      ILE  26  -1.178   0.330   5.055
  124   HG21  ILE  26          1HG2      ILE  26   0.708  -1.534   3.762
  125   HG22  ILE  26          2HG2      ILE  26  -0.055  -3.080   4.053
  126   HG23  ILE  26          3HG2      ILE  26  -1.054  -1.692   3.555
  127   HD11  ILE  26          3HD1      ILE  26  -0.284   1.664   6.949
  128   HD12  ILE  26          1HD1      ILE  26  -1.436   0.428   7.482
  129   HD13  ILE  26          2HD1      ILE  26   0.317   0.175   7.706
  130    H    GLU  27           H        GLU  27  -0.496  -4.524   6.398
  131    HA   GLU  27           HA       GLU  27  -1.626  -5.501   3.965
  132    HB3  GLU  27           2HB      GLU  27  -0.245  -7.272   5.988
  133    HG3  GLU  27           2HG      GLU  27  -0.202  -7.161   2.929
  134    H    ARG  28           H        ARG  28  -2.484  -6.261   7.387
  135    HA   ARG  28           HA       ARG  28  -4.139  -8.517   6.687
  136    HB3  ARG  28           2HB      ARG  28  -5.054  -8.302   8.977
  137    HG3  ARG  28           2HG      ARG  28  -2.023  -7.962   8.828
  138    HD3  ARG  28           2HD      ARG  28  -3.720  -9.365  10.926
  139    HE   ARG  28           HE       ARG  28  -0.765  -8.750  10.879
  140   HH11  ARG  28          1HH1      ARG  28  -3.312 -11.068  11.813
  141   HH12  ARG  28          2HH1      ARG  28  -2.162 -12.020  12.716
  142   HH21  ARG  28          1HH2      ARG  28   0.619 -10.227  11.720
  143   HH22  ARG  28          2HH2      ARG  28  -0.008 -11.660  12.491
  144    H    ALA  29           H        ALA  29  -4.726  -5.127   6.410
  145    HA   ALA  29           HA       ALA  29  -7.650  -5.518   5.930
  146    HB1  ALA  29           1HB      ALA  29  -7.676  -3.060   5.742
  147    HB2  ALA  29           2HB      ALA  29  -6.989  -3.581   7.295
  148    HB3  ALA  29           3HB      ALA  29  -5.916  -3.009   5.992
  149    H    LEU  30           H        LEU  30  -4.594  -4.741   4.185
  150    HA   LEU  30           HA       LEU  30  -5.774  -3.997   1.734
  151    HB3  LEU  30           2HB      LEU  30  -3.082  -5.321   2.251
  152    HG   LEU  30           HG       LEU  30  -3.398  -5.056  -0.168
  153   HD11  LEU  30          1HD1      LEU  30  -3.991  -2.124   0.461
  154   HD12  LEU  30          2HD1      LEU  30  -5.112  -3.298  -0.265
  155   HD13  LEU  30          3HD1      LEU  30  -3.686  -2.783  -1.164
  156   HD21  LEU  30          3HD2      LEU  30  -1.601  -2.909   1.055
  157   HD22  LEU  30          1HD2      LEU  30  -1.460  -3.559  -0.590
  158   HD23  LEU  30          2HD2      LEU  30  -1.174  -4.616   0.807
  159    H    GLU  31           H        GLU  31  -5.358  -7.239   3.023
  160    HA   GLU  31           HA       GLU  31  -5.949  -8.590   0.508
  161    HB3  GLU  31           2HB      GLU  31  -4.692  -9.788   2.143
  162    HG3  GLU  31           2HG      GLU  31  -6.997  -9.217   4.012
  163    H    ARG  32           H        ARG  32  -7.877  -6.635   2.378
  164    HA   ARG  32           HA       ARG  32 -10.367  -8.103   1.745
  165    HB3  ARG  32           2HB      ARG  32 -11.412  -7.102   3.654
  166    HG3  ARG  32           2HG      ARG  32 -10.123  -7.885   5.558
  167    HD3  ARG  32           2HD      ARG  32  -9.407 -10.213   4.778
  168    HE   ARG  32           HE       ARG  32 -12.010 -10.107   3.582
  169   HH11  ARG  32          1HH1      ARG  32 -10.363  -9.896   6.716
  170   HH12  ARG  32          2HH1      ARG  32 -11.845 -10.135   7.603
  171   HH21  ARG  32          1HH2      ARG  32 -13.862 -10.392   4.757
  172   HH22  ARG  32          2HH2      ARG  32 -13.763 -10.619   6.492
  173    H    LEU  33           H        LEU  33  -8.753  -4.974   1.507
  174    HA   LEU  33           HA       LEU  33 -10.898  -3.285   0.770
  175    HB3  LEU  33           2HB      LEU  33  -9.217  -1.899  -0.334
  176    HG   LEU  33           HG       LEU  33  -7.879  -3.096   2.103
  177   HD11  LEU  33          1HD1      LEU  33  -7.652  -0.311   0.930
  178   HD12  LEU  33          2HD1      LEU  33  -6.475  -1.611   0.666
  179   HD13  LEU  33          3HD1      LEU  33  -6.742  -0.975   2.299
  180   HD21  LEU  33          3HD2      LEU  33  -8.926  -1.288   3.414
  181   HD22  LEU  33          1HD2      LEU  33 -10.142  -2.394   2.760
  182   HD23  LEU  33          2HD2      LEU  33  -9.878  -0.805   1.994
  183    H    LYS  34           H        LYS  34 -11.463  -2.322  -1.212
  184    HA   LYS  34           HA       LYS  34 -12.322  -4.284  -3.144
  185    HB3  LYS  34           2HB      LYS  34 -13.208  -2.173  -4.308
  186    HG3  LYS  34           2HG      LYS  34 -13.927  -2.464  -1.362
  187    HD3  LYS  34           2HD      LYS  34 -15.632  -1.554  -3.724
  188    HE3  LYS  34           2HE      LYS  34 -16.094  -1.636  -0.705
  189    HZ1  LYS  34           3HZ      LYS  34 -18.313  -0.945  -1.243
  190    HZ2  LYS  34           1HZ      LYS  34 -18.014  -0.849  -2.834
  191    HZ3  LYS  34           2HZ      LYS  34 -17.267   0.206  -1.810
  192    H    GLY  35           H        GLY  35 -11.848  -4.469  -5.351
  193    HA2  GLY  35           2HA      GLY  35 -10.811  -4.211  -7.388
  194    HA3  GLY  35           3HA      GLY  35 -10.188  -2.660  -6.807
  195    H    VAL  36           H        VAL  36  -8.542  -3.786  -4.696
  196    HA   VAL  36           HA       VAL  36  -6.167  -4.526  -6.118
  197    HB   VAL  36           HB       VAL  36  -6.069  -3.308  -4.042
  198   HG11  VAL  36          1HG1      VAL  36  -6.465  -4.288  -1.857
  199   HG12  VAL  36          2HG1      VAL  36  -7.947  -4.320  -2.809
  200   HG13  VAL  36          3HG1      VAL  36  -7.006  -5.810  -2.582
  201   HG21  VAL  36          3HG2      VAL  36  -4.095  -4.591  -4.693
  202   HG22  VAL  36          1HG2      VAL  36  -4.242  -4.519  -2.930
  203   HG23  VAL  36          2HG2      VAL  36  -4.674  -6.006  -3.792
  204    H    ALA  37           H        ALA  37  -5.279  -6.391  -6.632
  205    HA   ALA  37           HA       ALA  37  -6.827  -8.915  -6.137
  206    HB1  ALA  37           1HB      ALA  37  -5.056  -8.095  -8.468
  207    HB2  ALA  37           2HB      ALA  37  -6.097  -9.528  -8.382
  208    HB3  ALA  37           3HB      ALA  37  -6.834  -7.914  -8.443
  209    H    GLU  38           H        GLU  38  -3.613  -7.519  -5.779
  210    HA   GLU  38           HA       GLU  38  -2.664  -9.844  -4.418
  211    HB3  GLU  38           2HB      GLU  38  -1.401  -9.308  -7.133
  212    HG3  GLU  38           2HG      GLU  38  -0.653 -11.155  -4.845
  213    H    ALA  39           H        ALA  39  -1.167  -9.185  -2.882
  214    HA   ALA  39           HA       ALA  39   0.549  -6.854  -3.364
  215    HB1  ALA  39           1HB      ALA  39  -0.447  -5.480  -1.607
  216    HB2  ALA  39           2HB      ALA  39  -1.678  -5.856  -2.823
  217    HB3  ALA  39           3HB      ALA  39  -1.672  -6.727  -1.277
  218    H    SER  40           H        SER  40   1.975  -6.310  -1.584
  219    HA   SER  40           HA       SER  40   2.109  -8.092   0.714
  220    HB3  SER  40           2HB      SER  40   4.397  -8.229  -1.267
  221    HG   SER  40           HG       SER  40   5.367  -9.377   0.220
  222    H    VAL  41           H        VAL  41   3.122  -7.256   2.425
  223    HA   VAL  41           HA       VAL  41   4.586  -4.665   2.166
  224    HB   VAL  41           HB       VAL  41   4.696  -4.660   4.621
  225   HG11  VAL  41          1HG1      VAL  41   2.893  -3.505   3.512
  226   HG12  VAL  41          2HG1      VAL  41   1.909  -4.981   3.441
  227   HG13  VAL  41          3HG1      VAL  41   2.285  -4.225   5.005
  228   HG21  VAL  41          3HG2      VAL  41   4.717  -6.929   5.306
  229   HG22  VAL  41          1HG2      VAL  41   3.162  -6.301   5.875
  230   HG23  VAL  41          2HG2      VAL  41   3.228  -7.308   4.438
  231    H    THR  42           H        THR  42   6.718  -4.371   2.655
  232    HA   THR  42           HA       THR  42   8.412  -6.739   3.383
  233    HB   THR  42           HB       THR  42   9.150  -4.467   1.500
  234    HG1  THR  42           1HG      THR  42   8.721  -7.176   0.816
  235   HG21  THR  42          3HG2      THR  42  10.555  -7.078   2.233
  236   HG22  THR  42          1HG2      THR  42  11.100  -5.441   2.617
  237   HG23  THR  42          2HG2      THR  42  11.051  -5.974   0.930
  238    H    VAL  43           H        VAL  43   8.561  -6.249   5.521
  239    HA   VAL  43           HA       VAL  43   8.849  -3.617   6.615
  240    HB   VAL  43           HB       VAL  43   9.403  -6.372   7.758
  241   HG11  VAL  43          1HG1      VAL  43   9.538  -3.709   9.256
  242   HG12  VAL  43          2HG1      VAL  43   9.448  -5.313  10.015
  243   HG13  VAL  43          3HG1      VAL  43  10.863  -4.880   9.060
  244   HG21  VAL  43          3HG2      VAL  43   7.329  -5.884   9.017
  245   HG22  VAL  43          1HG2      VAL  43   7.279  -4.256   8.305
  246   HG23  VAL  43          2HG2      VAL  43   7.032  -5.687   7.281
  247    H    ALA  44           H        ALA  44  11.357  -6.057   5.674
  248    HA   ALA  44           HA       ALA  44  13.491  -4.838   7.084
  249    HB1  ALA  44           1HB      ALA  44  13.438  -7.178   6.273
  250    HB2  ALA  44           2HB      ALA  44  13.598  -6.591   4.594
  251    HB3  ALA  44           3HB      ALA  44  14.907  -6.328   5.762
  252    H    THR  45           H        THR  45  12.210  -3.954   3.954
  253    HA   THR  45           HA       THR  45  14.257  -1.783   3.699
  254    HB   THR  45           HB       THR  45  13.712  -1.871   1.225
  255    HG1  THR  45           1HG      THR  45  13.024  -4.149   0.706
  256   HG21  THR  45          3HG2      THR  45  14.943  -4.424   2.356
  257   HG22  THR  45          1HG2      THR  45  15.787  -2.867   2.241
  258   HG23  THR  45          2HG2      THR  45  15.248  -3.684   0.769
  259    H    GLY  46           H        GLY  46  11.241  -2.225   4.775
  260    HA2  GLY  46           2HA      GLY  46   9.466  -0.881   5.176
  261    HA3  GLY  46           3HA      GLY  46  10.569   0.464   4.856
  262    H    ARG  47           H        ARG  47   9.094  -2.009   2.657
  263    HA   ARG  47           HA       ARG  47   7.694   0.182   1.220
  264    HB3  ARG  47           2HB      ARG  47   9.812   0.195   0.167
  265    HG3  ARG  47           2HG      ARG  47  10.516  -2.226   0.587
  266    HD3  ARG  47           2HD      ARG  47   8.941  -2.641  -1.995
  267    HE   ARG  47           HE       ARG  47  11.430  -3.677  -1.453
  268   HH11  ARG  47          1HH1      ARG  47   8.262  -5.235  -2.001
  269   HH12  ARG  47          2HH1      ARG  47   9.040  -6.651  -2.672
  270   HH21  ARG  47          1HH2      ARG  47  12.244  -5.692  -1.967
  271   HH22  ARG  47          2HH2      ARG  47  11.188  -6.863  -2.734
  272    H    LEU  48           H        LEU  48   6.341  -0.523  -0.542
  273    HA   LEU  48           HA       LEU  48   4.828  -3.025   0.105
  274    HB3  LEU  48           2HB      LEU  48   3.084  -1.299  -1.209
  275    HG   LEU  48           HG       LEU  48   3.573  -1.433   1.791
  276   HD11  LEU  48          1HD1      LEU  48   1.368  -0.109   0.154
  277   HD12  LEU  48          2HD1      LEU  48   2.555   0.719   1.183
  278   HD13  LEU  48          3HD1      LEU  48   1.325  -0.322   1.918
  279   HD21  LEU  48          3HD2      LEU  48   2.747  -3.551   0.823
  280   HD22  LEU  48          1HD2      LEU  48   1.480  -2.688  -0.070
  281   HD23  LEU  48          2HD2      LEU  48   1.434  -2.765   1.700
  282    H    THR  49           H        THR  49   3.704  -3.993  -1.579
  283    HA   THR  49           HA       THR  49   4.332  -3.371  -4.436
  284    HB   THR  49           HB       THR  49   4.252  -6.215  -3.337
  285    HG1  THR  49           1HG      THR  49   6.117  -5.084  -2.605
  286   HG21  THR  49          3HG2      THR  49   5.188  -5.040  -6.002
  287   HG22  THR  49          1HG2      THR  49   3.679  -5.943  -5.744
  288   HG23  THR  49          2HG2      THR  49   5.239  -6.756  -5.545
  289    H    VAL  50           H        VAL  50   2.428  -3.326  -5.558
  290    HA   VAL  50           HA       VAL  50   0.045  -4.736  -4.504
  291    HB   VAL  50           HB       VAL  50   0.137  -2.664  -3.196
  292   HG11  VAL  50          1HG1      VAL  50  -0.216  -0.467  -4.127
  293   HG12  VAL  50          2HG1      VAL  50   1.248  -1.153  -4.843
  294   HG13  VAL  50          3HG1      VAL  50  -0.265  -1.100  -5.778
  295   HG21  VAL  50          3HG2      VAL  50  -2.025  -3.680  -3.665
  296   HG22  VAL  50          1HG2      VAL  50  -2.172  -1.918  -3.592
  297   HG23  VAL  50          2HG2      VAL  50  -2.188  -2.736  -5.160
  298    H    THR  51           H        THR  51  -1.300  -5.405  -5.973
  299    HA   THR  51           HA       THR  51  -1.218  -4.382  -8.779
  300    HB   THR  51           HB       THR  51  -1.815  -7.193  -7.741
  301    HG1  THR  51           1HG      THR  51   0.184  -7.599  -8.885
  302   HG21  THR  51          3HG2      THR  51  -3.051  -6.682  -9.854
  303   HG22  THR  51          1HG2      THR  51  -1.727  -7.808 -10.165
  304   HG23  THR  51          2HG2      THR  51  -1.558  -6.098 -10.606
  305    H    TYR  52           H        TYR  52  -3.040  -3.353  -9.349
  306    HA   TYR  52           HA       TYR  52  -5.675  -4.265  -8.378
  307    HB3  TYR  52           2HB      TYR  52  -4.835  -2.678  -6.651
  308    HD1  TYR  52           1HD      TYR  52  -6.429  -0.262  -8.936
  309    HD2  TYR  52           2HD      TYR  52  -2.797  -1.306  -6.881
  310    HE1  TYR  52           1HE      TYR  52  -5.515   1.976  -9.456
  311    HE2  TYR  52           2HE      TYR  52  -1.884   0.969  -7.344
  312    HH   TYR  52           HH       TYR  52  -3.746   3.394  -9.252
  313    H    ASP  53           H        ASP  53  -7.526  -3.372  -9.551
  314    HA   ASP  53           HA       ASP  53  -6.818  -2.818 -12.329
  315    HB3  ASP  53           2HB      ASP  53  -8.588  -4.480 -11.697
  316    HA   PRO  54           HA       PRO  54  -7.075   1.497 -11.644
  317    HB3  PRO  54           2HB      PRO  54  -5.593   1.548 -13.445
  318    HG3  PRO  54           2HG      PRO  54  -5.984   0.287 -15.421
  319    HD3  PRO  54           2HD      PRO  54  -5.964  -1.265 -13.673
  320    H    LYS  55           H        LYS  55  -9.861  -0.057 -12.172
  321    HA   LYS  55           HA       LYS  55 -11.354   2.339 -13.235
  322    HB3  LYS  55           2HB      LYS  55 -12.816   0.846 -14.436
  323    HG3  LYS  55           2HG      LYS  55 -10.071  -0.081 -15.285
  324    HD3  LYS  55           2HD      LYS  55 -12.205  -0.548 -16.620
  325    HE3  LYS  55           2HE      LYS  55 -11.886   2.417 -17.304
  326    HZ1  LYS  55           3HZ      LYS  55 -13.928   2.076 -18.494
  327    HZ2  LYS  55           1HZ      LYS  55 -14.007   0.485 -18.040
  328    HZ3  LYS  55           2HZ      LYS  55 -12.829   0.981 -19.058
  329    H    GLN  56           H        GLN  56 -11.621  -0.578 -11.175
  330    HA   GLN  56           HA       GLN  56 -14.066   0.378  -9.859
  331    HB3  GLN  56           2HB      GLN  56 -13.470  -1.425  -8.218
  332    HG3  GLN  56           2HG      GLN  56 -13.224  -2.510 -11.045
  333   HE21  GLN  56          1HE2      GLN  56 -12.066  -4.195  -9.600
  334   HE22  GLN  56          2HE2      GLN  56 -13.097  -5.358  -8.756
  335    H    VAL  57           H        VAL  57 -10.592   0.909  -9.399
  336    HA   VAL  57           HA       VAL  57 -11.145   2.773  -7.170
  337    HB   VAL  57           HB       VAL  57  -9.430   1.837  -5.714
  338   HG11  VAL  57          1HG1      VAL  57 -11.463  -0.344  -6.324
  339   HG12  VAL  57          2HG1      VAL  57 -10.579  -0.082  -4.813
  340   HG13  VAL  57          3HG1      VAL  57 -11.767   1.111  -5.343
  341   HG21  VAL  57          3HG2      VAL  57  -9.268  -0.525  -7.653
  342   HG22  VAL  57          1HG2      VAL  57  -7.994   0.678  -7.355
  343   HG23  VAL  57          2HG2      VAL  57  -8.481  -0.426  -6.066
  344    H    SER  58           H        SER  58  -8.823   3.650  -6.411
  345    HA   SER  58           HA       SER  58  -6.829   3.745  -8.588
  346    HB3  SER  58           2HB      SER  58  -8.307   5.785  -8.818
  347    HG   SER  58           HG       SER  58  -7.877   7.435  -7.223
  348    H    GLU  59           H        GLU  59  -5.000   5.450  -7.338
  349    HA   GLU  59           HA       GLU  59  -3.764   4.061  -5.235
  350    HB3  GLU  59           2HB      GLU  59  -2.593   6.138  -4.755
  351    HG3  GLU  59           2HG      GLU  59  -2.245   4.946  -7.115
  352    H    ILE  60           H        ILE  60  -6.586   6.117  -5.085
  353    HA   ILE  60           HA       ILE  60  -6.497   7.137  -2.441
  354    HB   ILE  60           HB       ILE  60  -8.655   6.450  -4.434
  355   HG13  ILE  60          2HG1      ILE  60  -9.011   8.851  -4.541
  356   HG21  ILE  60          1HG2      ILE  60  -9.855   5.966  -2.485
  357   HG22  ILE  60          2HG2      ILE  60  -9.237   7.415  -1.634
  358   HG23  ILE  60          3HG2      ILE  60 -10.360   7.569  -3.010
  359   HD11  ILE  60          3HD1      ILE  60  -8.218   9.532  -2.235
  360   HD12  ILE  60          1HD1      ILE  60  -6.546   9.223  -2.785
  361   HD13  ILE  60          2HD1      ILE  60  -7.517  10.463  -3.571
  362    H    THR  61           H        THR  61  -7.812   3.984  -3.495
  363    HA   THR  61           HA       THR  61  -8.939   3.247  -1.004
  364    HB   THR  61           HB       THR  61  -7.793   1.578  -3.273
  365    HG1  THR  61           1HG      THR  61 -10.465   2.220  -2.503
  366   HG21  THR  61          3HG2      THR  61  -9.338  -0.226  -2.439
  367   HG22  THR  61          1HG2      THR  61  -9.532   0.687  -0.924
  368   HG23  THR  61          2HG2      THR  61  -7.937   0.047  -1.399
  369    H    ILE  62           H        ILE  62  -5.587   2.848  -2.105
  370    HA   ILE  62           HA       ILE  62  -4.865   1.585   0.500
  371    HB   ILE  62           HB       ILE  62  -4.095   0.589  -1.620
  372   HG13  ILE  62          2HG1      ILE  62  -3.025   0.169   0.537
  373   HG21  ILE  62          1HG2      ILE  62  -2.291   3.029  -1.889
  374   HG22  ILE  62          2HG2      ILE  62  -2.271   1.570  -2.906
  375   HG23  ILE  62          3HG2      ILE  62  -3.671   2.621  -2.941
  376   HD11  ILE  62          3HD1      ILE  62  -2.060  -0.932  -1.507
  377   HD12  ILE  62          1HD1      ILE  62  -0.856   0.375  -1.594
  378   HD13  ILE  62          2HD1      ILE  62  -0.903  -0.699  -0.187
  379    H    GLN  63           H        GLN  63  -4.429   4.689  -1.174
  380    HA   GLN  63           HA       GLN  63  -2.629   5.932   0.613
  381    HB3  GLN  63           2HB      GLN  63  -5.097   7.206  -0.635
  382    HG3  GLN  63           2HG      GLN  63  -2.365   8.493  -0.527
  383   HE21  GLN  63          1HE2      GLN  63  -5.382   9.696   0.927
  384   HE22  GLN  63          2HE2      GLN  63  -5.848  10.715  -0.409
  385    H    GLU  64           H        GLU  64  -6.217   5.652   0.863
  386    HA   GLU  64           HA       GLU  64  -6.495   7.094   3.296
  387    HB3  GLU  64           2HB      GLU  64  -8.671   5.629   3.416
  388    HG3  GLU  64           2HG      GLU  64  -9.659   6.742   1.367
  389    H    ARG  65           H        ARG  65  -5.800   3.670   2.737
  390    HA   ARG  65           HA       ARG  65  -6.007   2.832   5.519
  391    HB3  ARG  65           2HB      ARG  65  -4.897   1.625   2.960
  392    HG3  ARG  65           2HG      ARG  65  -3.567   0.516   4.593
  393    HD3  ARG  65           2HD      ARG  65  -4.520   0.778   6.749
  394    HE   ARG  65           HE       ARG  65  -7.065   0.512   5.711
  395   HH11  ARG  65          1HH1      ARG  65  -5.333  -1.132   8.373
  396   HH12  ARG  65          2HH1      ARG  65  -6.826  -1.221   9.304
  397   HH21  ARG  65          1HH2      ARG  65  -8.848   0.210   6.917
  398   HH22  ARG  65          2HH2      ARG  65  -8.741  -0.577   8.491
  399    H    ILE  66           H        ILE  66  -3.290   3.818   3.378
  400    HA   ILE  66           HA       ILE  66  -1.270   3.401   5.450
  401    HB   ILE  66           HB       ILE  66  -1.278   4.958   2.833
  402   HG13  ILE  66          2HG1      ILE  66  -1.451   2.330   2.915
  403   HG21  ILE  66          1HG2      ILE  66   1.080   4.261   4.629
  404   HG22  ILE  66          2HG2      ILE  66   1.197   5.038   3.042
  405   HG23  ILE  66          3HG2      ILE  66   0.442   5.908   4.372
  406   HD11  ILE  66          3HD1      ILE  66  -0.840   3.466   0.869
  407   HD12  ILE  66          1HD1      ILE  66   0.866   3.585   1.388
  408   HD13  ILE  66          2HD1      ILE  66   0.131   2.004   1.091
  409    H    ALA  67           H        ALA  67  -3.005   6.365   4.358
  410    HA   ALA  67           HA       ALA  67  -1.660   8.117   6.130
  411    HB1  ALA  67           1HB      ALA  67  -4.441   8.289   4.881
  412    HB2  ALA  67           2HB      ALA  67  -3.593   9.637   5.673
  413    HB3  ALA  67           3HB      ALA  67  -2.926   8.920   4.202
  414    H    ALA  68           H        ALA  68  -4.897   6.544   6.617
  415    HA   ALA  68           HA       ALA  68  -5.385   7.921   9.056
  416    HB1  ALA  68           1HB      ALA  68  -7.145   6.919   7.630
  417    HB2  ALA  68           2HB      ALA  68  -6.552   5.290   8.038
  418    HB3  ALA  68           3HB      ALA  68  -7.264   6.324   9.292
  419    H    LEU  69           H        LEU  69  -3.716   4.856   8.479
  420    HA   LEU  69           HA       LEU  69  -3.635   4.132  11.319
  421    HB3  LEU  69           2HB      LEU  69  -2.041   2.337  10.277
  422    HG   LEU  69           HG       LEU  69  -3.857   0.996   9.321
  423   HD11  LEU  69          1HD1      LEU  69  -5.081   0.672  11.374
  424   HD12  LEU  69          2HD1      LEU  69  -4.712   2.314  11.929
  425   HD13  LEU  69          3HD1      LEU  69  -3.414   1.113  11.788
  426   HD21  LEU  69          3HD2      LEU  69  -5.293   2.776   8.302
  427   HD22  LEU  69          1HD2      LEU  69  -5.759   3.303   9.932
  428   HD23  LEU  69          2HD2      LEU  69  -6.190   1.689   9.369
  429    H    GLY  70           H        GLY  70  -1.940   6.496   9.681
  430    HA2  GLY  70           2HA      GLY  70  -0.632   7.913  11.064
  431    HA3  GLY  70           3HA      GLY  70   0.038   6.516  11.925
  432    H    TYR  71           H        TYR  71  -0.092   6.581   8.398
  433    HA   TYR  71           HA       TYR  71   2.857   7.084   8.259
  434    HB3  TYR  71           2HB      TYR  71   2.979   5.330   6.589
  435    HD1  TYR  71           1HD      TYR  71   0.090   4.006   8.518
  436    HD2  TYR  71           2HD      TYR  71   4.372   4.268   8.236
  437    HE1  TYR  71           1HE      TYR  71   0.305   2.292  10.313
  438    HE2  TYR  71           2HE      TYR  71   4.590   2.531  10.026
  439    HH   TYR  71           HH       TYR  71   1.777   1.065  11.645
  440    H    THR  72           H        THR  72   3.303   7.202   5.607
  441    HA   THR  72           HA       THR  72   1.234   8.813   4.234
  442    HB   THR  72           HB       THR  72   3.012  10.414   3.418
  443    HG1  THR  72           1HG      THR  72   4.745  10.619   5.104
  444   HG21  THR  72          3HG2      THR  72   1.349  11.024   5.187
  445   HG22  THR  72          1HG2      THR  72   2.885  11.892   5.311
  446   HG23  THR  72          2HG2      THR  72   2.539  10.553   6.420
  447    H    LEU  73           H        LEU  73   0.920   8.075   2.259
  448    HA   LEU  73           HA       LEU  73   2.605   6.121   0.974
  449    HB3  LEU  73           2HB      LEU  73   0.135   7.723   0.194
  450    HG   LEU  73           HG       LEU  73   1.589   5.707  -1.538
  451   HD11  LEU  73          1HD1      LEU  73  -0.601   4.679  -0.983
  452   HD12  LEU  73          2HD1      LEU  73  -0.553   5.202  -2.669
  453   HD13  LEU  73          3HD1      LEU  73  -1.426   6.171  -1.471
  454   HD21  LEU  73          3HD2      LEU  73   1.623   8.114  -2.280
  455   HD22  LEU  73          1HD2      LEU  73  -0.140   8.165  -2.168
  456   HD23  LEU  73          2HD2      LEU  73   0.650   7.138  -3.370
  457    H    ALA  74           H        ALA  74   4.088   6.280  -0.623
  458    HA   ALA  74           HA       ALA  74   3.874   8.627  -2.401
  459    HB1  ALA  74           1HB      ALA  74   6.262   8.801  -2.759
  460    HB2  ALA  74           2HB      ALA  74   5.904   9.040  -1.037
  461    HB3  ALA  74           3HB      ALA  74   6.577   7.512  -1.588
  462    H    GLU  75           H        GLU  75   3.831   8.115  -4.517
  463    HA   GLU  75           HA       GLU  75   4.175   5.266  -5.326
  464    HB3  GLU  75           2HB      GLU  75   1.771   7.034  -5.936
  465    HG3  GLU  75           2HG      GLU  75   0.816   4.713  -6.576
  466    HA   PRO  76           HA       PRO  76   6.699   7.595  -8.022
  467    HB3  PRO  76           2HB      PRO  76   8.187   5.864  -7.721
  468    HG3  PRO  76           2HG      PRO  76   7.452   3.575  -7.845
  469    HD3  PRO  76           2HD      PRO  76   6.167   4.661  -6.175
  Start of MODEL   20
    1    H2   PRO   6           2H       PRO   6  -7.319  -6.311 -17.287
    2    HA   PRO   6           HA       PRO   6  -5.058  -7.531 -16.825
    3    HB3  PRO   6           2HB      PRO   6  -3.862  -7.694 -18.749
    4    HG3  PRO   6           2HG      PRO   6  -5.442  -7.507 -20.407
    5    HD3  PRO   6           2HD      PRO   6  -7.471  -6.397 -19.870
    6    H    LEU   7           H        LEU   7  -4.990  -6.531 -14.920
    7    HA   LEU   7           HA       LEU   7  -5.487  -3.646 -14.738
    8    HB3  LEU   7           2HB      LEU   7  -6.745  -5.416 -13.456
    9    HG   LEU   7           HG       LEU   7  -4.436  -5.269 -11.479
   10   HD11  LEU   7          1HD1      LEU   7  -6.711  -5.361 -10.527
   11   HD12  LEU   7          2HD1      LEU   7  -5.851  -6.882 -10.234
   12   HD13  LEU   7          3HD1      LEU   7  -7.082  -6.795 -11.503
   13   HD21  LEU   7          3HD2      LEU   7  -4.185  -7.732 -11.751
   14   HD22  LEU   7          1HD2      LEU   7  -3.709  -6.860 -13.207
   15   HD23  LEU   7          2HD2      LEU   7  -5.288  -7.682 -13.137
   16    H    LYS   8           H        LYS   8  -4.271  -2.747 -12.532
   17    HA   LYS   8           HA       LYS   8  -1.485  -2.525 -13.578
   18    HB3  LYS   8           2HB      LYS   8  -1.540  -0.332 -12.260
   19    HG3  LYS   8           2HG      LYS   8  -3.479  -0.695 -14.583
   20    HD3  LYS   8           2HD      LYS   8  -3.742   1.546 -13.565
   21    HE3  LYS   8           2HE      LYS   8  -0.761   1.880 -14.091
   22    HZ1  LYS   8           3HZ      LYS   8  -2.030   3.872 -14.625
   23    HZ2  LYS   8           1HZ      LYS   8  -1.168   4.145 -13.271
   24    HZ3  LYS   8           2HZ      LYS   8  -2.787   3.864 -13.179
   25    H    THR   9           H        THR   9   0.278  -2.498 -12.281
   26    HA   THR   9           HA       THR   9   0.023  -3.278  -9.403
   27    HB   THR   9           HB       THR   9   2.040  -4.342 -11.427
   28    HG1  THR   9           1HG      THR   9   0.167  -5.411 -11.627
   29   HG21  THR   9          3HG2      THR   9   1.778  -4.860  -8.427
   30   HG22  THR   9          1HG2      THR   9   3.180  -4.167  -9.279
   31   HG23  THR   9          2HG2      THR   9   2.735  -5.851  -9.548
   32    H    GLN  10           H        GLN  10   1.647  -2.342  -8.004
   33    HA   GLN  10           HA       GLN  10   3.555  -0.509  -9.212
   34    HB3  GLN  10           2HB      GLN  10   1.396   0.507  -7.311
   35    HG3  GLN  10           2HG      GLN  10   3.395   1.863  -6.961
   36   HE21  GLN  10          1HE2      GLN  10   3.133   4.080  -9.396
   37   HE22  GLN  10          2HE2      GLN  10   4.479   3.550 -10.410
   38    H    GLN  11           H        GLN  11   5.124   0.260  -7.796
   39    HA   GLN  11           HA       GLN  11   5.398  -1.111  -5.179
   40    HB3  GLN  11           2HB      GLN  11   7.887  -1.167  -5.768
   41    HG3  GLN  11           2HG      GLN  11   6.073  -2.857  -7.546
   42   HE21  GLN  11          1HE2      GLN  11   8.234  -2.750  -8.940
   43   HE22  GLN  11          2HE2      GLN  11   9.398  -3.997  -8.523
   44    H    MET  12           H        MET  12   6.531   0.131  -3.569
   45    HA   MET  12           HA       MET  12   7.028   2.980  -4.065
   46    HB3  MET  12           2HB      MET  12   4.639   3.010  -4.166
   47    HG3  MET  12           2HG      MET  12   4.635   1.531  -1.497
   48    HE1  MET  12           3HE      MET  12   0.773   2.620  -3.807
   49    HE2  MET  12           1HE      MET  12   2.370   3.049  -4.449
   50    HE3  MET  12           2HE      MET  12   1.916   1.337  -4.260
   51    H    GLN  13           H        GLN  13   7.921   4.090  -2.375
   52    HA   GLN  13           HA       GLN  13   8.689   2.620   0.068
   53    HB3  GLN  13           2HB      GLN  13   9.699   4.818   0.726
   54    HG3  GLN  13           2HG      GLN  13  10.613   3.996  -2.053
   55   HE21  GLN  13          1HE2      GLN  13  13.194   4.074  -1.968
   56   HE22  GLN  13          2HE2      GLN  13  13.804   5.607  -1.344
   57    H    VAL  14           H        VAL  14   7.853   3.156   2.125
   58    HA   VAL  14           HA       VAL  14   5.388   4.793   2.346
   59    HB   VAL  14           HB       VAL  14   5.457   1.745   2.401
   60   HG11  VAL  14          1HG1      VAL  14   3.106   1.830   3.332
   61   HG12  VAL  14          2HG1      VAL  14   4.366   2.231   4.488
   62   HG13  VAL  14          3HG1      VAL  14   3.396   3.532   3.759
   63   HG21  VAL  14          3HG2      VAL  14   3.592   3.751   1.098
   64   HG22  VAL  14          1HG2      VAL  14   4.819   2.767   0.280
   65   HG23  VAL  14          2HG2      VAL  14   3.421   1.988   1.011
   66    H    GLY  15           H        GLY  15   5.275   5.695   4.320
   67    HA2  GLY  15           2HA      GLY  15   7.334   5.299   6.279
   68    HA3  GLY  15           3HA      GLY  15   5.843   6.231   6.511
   69    H    GLY  16           H        GLY  16   4.199   3.800   5.934
   70    HA2  GLY  16           2HA      GLY  16   4.025   2.618   8.586
   71    HA3  GLY  16           3HA      GLY  16   3.041   2.217   7.165
   72    H    MET  17           H        MET  17   6.395   1.927   6.508
   73    HA   MET  17           HA       MET  17   6.331  -1.036   7.008
   74    HB3  MET  17           2HB      MET  17   7.827  -1.046   4.905
   75    HG3  MET  17           2HG      MET  17   6.006  -0.951   3.328
   76    HE1  MET  17           3HE      MET  17   7.332  -3.088   5.716
   77    HE2  MET  17           1HE      MET  17   6.386  -4.474   5.179
   78    HE3  MET  17           2HE      MET  17   7.099  -3.376   3.977
   79    H    ARG  18           H        ARG  18   7.935   1.617   8.200
   80    HA   ARG  18           HA       ARG  18  10.403   0.119   8.757
   81    HB3  ARG  18           2HB      ARG  18  11.193   0.775   6.687
   82    HG3  ARG  18           2HG      ARG  18   9.541   3.288   7.011
   83    HD3  ARG  18           2HD      ARG  18  11.549   2.808   4.780
   84    HE   ARG  18           HE       ARG  18  10.038   4.290   3.849
   85   HH11  ARG  18          1HH1      ARG  18  10.808   5.551   7.122
   86   HH12  ARG  18          2HH1      ARG  18   9.863   6.998   6.805
   87   HH21  ARG  18          1HH2      ARG  18   9.026   6.350   3.573
   88   HH22  ARG  18          2HH2      ARG  18   8.935   7.400   4.975
   89    H    CYS  19           H        CYS  19   8.388   2.690   9.721
   90    HA   CYS  19           HA       CYS  19  10.304   3.720  11.715
   91    HB3  CYS  19           2HB      CYS  19   8.204   4.985  12.395
   92    HG   CYS  19           HG       CYS  19   9.917   6.210  10.921
   93    H    ALA  20           H        ALA  20   7.879   1.197  11.515
   94    HA   ALA  20           HA       ALA  20   8.300   0.156  14.214
   95    HB1  ALA  20           1HB      ALA  20   5.765   1.647  13.393
   96    HB2  ALA  20           2HB      ALA  20   5.848   0.581  14.797
   97    HB3  ALA  20           3HB      ALA  20   6.848   2.041  14.742
   98    H    ALA  21           H        ALA  21   6.571  -1.616  14.606
   99    HA   ALA  21           HA       ALA  21   6.746  -3.622  12.598
  100    HB1  ALA  21           1HB      ALA  21   5.072  -3.512  15.142
  101    HB2  ALA  21           2HB      ALA  21   5.551  -4.974  14.256
  102    HB3  ALA  21           3HB      ALA  21   6.788  -3.984  15.045
  103    H    CYS  22           H        CYS  22   5.180  -1.318  11.628
  104    HA   CYS  22           HA       CYS  22   2.379  -1.874  11.668
  105    HB3  CYS  22           2HB      CYS  22   2.392   0.147  10.121
  106    HG   CYS  22           HG       CYS  22   2.264  -0.049  12.916
  107    H    ALA  23           H        ALA  23   4.686  -3.239   9.492
  108    HA   ALA  23           HA       ALA  23   3.282  -3.492   7.131
  109    HB1  ALA  23           1HB      ALA  23   4.605  -5.506   6.813
  110    HB2  ALA  23           2HB      ALA  23   5.576  -4.273   7.629
  111    HB3  ALA  23           3HB      ALA  23   4.897  -5.639   8.549
  112    H    SER  24           H        SER  24   2.593  -5.343  10.156
  113    HA   SER  24           HA       SER  24   0.807  -7.256   8.902
  114    HB3  SER  24           2HB      SER  24   0.089  -7.849  11.102
  115    HG   SER  24           HG       SER  24   2.013  -8.152  12.214
  116    H    SER  25           H        SER  25   0.239  -4.153  10.546
  117    HA   SER  25           HA       SER  25  -2.661  -4.197  10.142
  118    HB3  SER  25           2HB      SER  25  -2.665  -2.038  11.199
  119    HG   SER  25           HG       SER  25  -0.598  -3.578  12.438
  120    H    ILE  26           H        ILE  26  -0.161  -3.515   8.036
  121    HA   ILE  26           HA       ILE  26  -2.103  -2.159   6.204
  122    HB   ILE  26           HB       ILE  26   0.785  -2.980   5.697
  123   HG13  ILE  26          2HG1      ILE  26   1.232  -0.532   5.602
  124   HG21  ILE  26          1HG2      ILE  26   0.459  -1.581   3.619
  125   HG22  ILE  26          2HG2      ILE  26  -0.454  -3.091   3.631
  126   HG23  ILE  26          3HG2      ILE  26  -1.281  -1.555   3.959
  127   HD11  ILE  26          3HD1      ILE  26  -1.469  -0.200   6.989
  128   HD12  ILE  26          1HD1      ILE  26  -0.247   1.055   6.723
  129   HD13  ILE  26          2HD1      ILE  26  -1.097   0.361   5.336
  130    H    GLU  27           H        GLU  27  -0.118  -5.196   6.205
  131    HA   GLU  27           HA       GLU  27  -1.404  -6.064   3.852
  132    HB3  GLU  27           2HB      GLU  27  -0.106  -7.984   5.807
  133    HG3  GLU  27           2HG      GLU  27  -0.253  -7.718   2.768
  134    H    ARG  28           H        ARG  28  -2.216  -6.815   7.266
  135    HA   ARG  28           HA       ARG  28  -4.073  -8.913   6.810
  136    HB3  ARG  28           2HB      ARG  28  -3.923  -6.790   8.977
  137    HG3  ARG  28           2HG      ARG  28  -5.352  -9.481   9.000
  138    HD3  ARG  28           2HD      ARG  28  -4.096  -9.279  11.052
  139    HE   ARG  28           HE       ARG  28  -5.247  -6.512  11.322
  140   HH11  ARG  28          1HH1      ARG  28  -2.667  -8.778  12.321
  141   HH12  ARG  28          2HH1      ARG  28  -1.834  -7.468  13.144
  142   HH21  ARG  28          1HH2      ARG  28  -4.079  -5.015  12.321
  143   HH22  ARG  28          2HH2      ARG  28  -2.575  -5.440  13.146
  144    H    ALA  29           H        ALA  29  -4.513  -5.437   6.485
  145    HA   ALA  29           HA       ALA  29  -7.458  -5.696   6.045
  146    HB1  ALA  29           1HB      ALA  29  -6.645  -3.873   7.505
  147    HB2  ALA  29           2HB      ALA  29  -5.612  -3.264   6.193
  148    HB3  ALA  29           3HB      ALA  29  -7.383  -3.228   6.028
  149    H    LEU  30           H        LEU  30  -4.447  -4.725   4.357
  150    HA   LEU  30           HA       LEU  30  -5.588  -3.850   1.957
  151    HB3  LEU  30           2HB      LEU  30  -2.876  -5.141   2.437
  152    HG   LEU  30           HG       LEU  30  -3.244  -4.751   0.019
  153   HD11  LEU  30          1HD1      LEU  30  -3.480  -2.359  -0.776
  154   HD12  LEU  30          2HD1      LEU  30  -3.840  -1.887   0.901
  155   HD13  LEU  30          3HD1      LEU  30  -4.923  -2.987   0.026
  156   HD21  LEU  30          3HD2      LEU  30  -1.264  -3.364  -0.363
  157   HD22  LEU  30          1HD2      LEU  30  -1.001  -4.411   1.041
  158   HD23  LEU  30          2HD2      LEU  30  -1.380  -2.691   1.278
  159    H    GLU  31           H        GLU  31  -4.742  -7.208   2.881
  160    HA   GLU  31           HA       GLU  31  -5.357  -8.190   0.206
  161    HB3  GLU  31           2HB      GLU  31  -3.654  -9.238   1.672
  162    HG3  GLU  31           2HG      GLU  31  -5.998 -10.555   3.101
  163    H    ARG  32           H        ARG  32  -7.403  -7.120   2.641
  164    HA   ARG  32           HA       ARG  32  -9.519  -9.042   1.833
  165    HB3  ARG  32           2HB      ARG  32 -10.758  -8.282   3.843
  166    HG3  ARG  32           2HG      ARG  32  -7.946  -9.202   4.547
  167    HD3  ARG  32           2HD      ARG  32  -9.130 -10.504   6.301
  168    HE   ARG  32           HE       ARG  32  -8.314  -8.259   6.940
  169   HH11  ARG  32          1HH1      ARG  32 -11.873  -8.557   6.677
  170   HH12  ARG  32          2HH1      ARG  32 -12.127  -7.513   8.030
  171   HH21  ARG  32          1HH2      ARG  32  -8.817  -6.718   8.596
  172   HH22  ARG  32          2HH2      ARG  32 -10.494  -6.406   8.946
  173    H    LEU  33           H        LEU  33  -8.789  -5.562   2.126
  174    HA   LEU  33           HA       LEU  33 -11.417  -4.653   1.519
  175    HB3  LEU  33           2HB      LEU  33  -9.869  -3.358   2.770
  176    HG   LEU  33           HG       LEU  33  -7.754  -3.864   1.308
  177   HD11  LEU  33          1HD1      LEU  33  -8.499  -2.981  -0.857
  178   HD12  LEU  33          2HD1      LEU  33  -7.195  -1.974  -0.240
  179   HD13  LEU  33          3HD1      LEU  33  -8.875  -1.418  -0.112
  180   HD21  LEU  33          3HD2      LEU  33  -8.313  -1.064   2.384
  181   HD22  LEU  33          1HD2      LEU  33  -6.707  -1.764   2.102
  182   HD23  LEU  33          2HD2      LEU  33  -7.765  -2.456   3.341
  183    H    LYS  34           H        LYS  34 -12.314  -3.624  -0.266
  184    HA   LYS  34           HA       LYS  34 -12.067  -5.227  -2.609
  185    HB3  LYS  34           2HB      LYS  34 -13.648  -2.660  -2.127
  186    HG3  LYS  34           2HG      LYS  34 -14.007  -4.962  -4.080
  187    HD3  LYS  34           2HD      LYS  34 -16.085  -2.958  -3.103
  188    HE3  LYS  34           2HE      LYS  34 -16.161  -5.024  -5.349
  189    HZ1  LYS  34           3HZ      LYS  34 -18.351  -3.540  -4.013
  190    HZ2  LYS  34           1HZ      LYS  34 -18.213  -5.145  -4.158
  191    HZ3  LYS  34           2HZ      LYS  34 -18.515  -4.256  -5.507
  192    H    GLY  35           H        GLY  35 -11.761  -4.575  -4.843
  193    HA2  GLY  35           2HA      GLY  35 -11.018  -3.300  -6.620
  194    HA3  GLY  35           3HA      GLY  35 -10.563  -1.985  -5.505
  195    H    VAL  36           H        VAL  36  -8.837  -3.333  -3.825
  196    HA   VAL  36           HA       VAL  36  -6.415  -3.912  -5.361
  197    HB   VAL  36           HB       VAL  36  -7.081  -4.233  -2.411
  198   HG11  VAL  36          1HG1      VAL  36  -5.320  -5.864  -2.922
  199   HG12  VAL  36          2HG1      VAL  36  -4.402  -4.637  -3.822
  200   HG13  VAL  36          3HG1      VAL  36  -4.611  -4.497  -2.065
  201   HG21  VAL  36          3HG2      VAL  36  -5.351  -2.202  -3.899
  202   HG22  VAL  36          1HG2      VAL  36  -6.952  -1.887  -3.194
  203   HG23  VAL  36          2HG2      VAL  36  -5.588  -2.273  -2.145
  204    H    ALA  37           H        ALA  37  -5.633  -5.839  -5.934
  205    HA   ALA  37           HA       ALA  37  -7.407  -8.232  -5.625
  206    HB1  ALA  37           1HB      ALA  37  -6.783  -8.662  -8.003
  207    HB2  ALA  37           2HB      ALA  37  -7.550  -7.076  -7.807
  208    HB3  ALA  37           3HB      ALA  37  -5.783  -7.197  -7.991
  209    H    GLU  38           H        GLU  38  -4.081  -7.161  -5.401
  210    HA   GLU  38           HA       GLU  38  -3.233  -9.667  -4.290
  211    HB3  GLU  38           2HB      GLU  38  -1.440  -8.987  -6.580
  212    HG3  GLU  38           2HG      GLU  38  -1.455 -11.469  -6.862
  213    H    ALA  39           H        ALA  39  -1.166  -9.343  -3.093
  214    HA   ALA  39           HA       ALA  39   0.118  -6.740  -3.153
  215    HB1  ALA  39           1HB      ALA  39  -2.017  -6.102  -2.056
  216    HB2  ALA  39           2HB      ALA  39  -1.729  -7.330  -0.797
  217    HB3  ALA  39           3HB      ALA  39  -0.636  -5.939  -0.962
  218    H    SER  40           H        SER  40   1.930  -6.547  -1.886
  219    HA   SER  40           HA       SER  40   2.722  -8.767  -0.045
  220    HB3  SER  40           2HB      SER  40   4.924  -8.922  -1.156
  221    HG   SER  40           HG       SER  40   2.943  -9.446  -3.132
  222    H    VAL  41           H        VAL  41   3.022  -7.563   1.822
  223    HA   VAL  41           HA       VAL  41   4.596  -5.047   1.720
  224    HB   VAL  41           HB       VAL  41   4.514  -4.979   4.106
  225   HG11  VAL  41          1HG1      VAL  41   2.115  -4.795   4.464
  226   HG12  VAL  41          2HG1      VAL  41   2.565  -4.169   2.877
  227   HG13  VAL  41          3HG1      VAL  41   1.792  -5.762   3.008
  228   HG21  VAL  41          3HG2      VAL  41   3.532  -7.818   4.032
  229   HG22  VAL  41          1HG2      VAL  41   4.867  -7.106   4.935
  230   HG23  VAL  41          2HG2      VAL  41   3.203  -6.745   5.404
  231    H    THR  42           H        THR  42   6.776  -4.825   2.105
  232    HA   THR  42           HA       THR  42   8.420  -7.329   2.392
  233    HB   THR  42           HB       THR  42   9.064  -4.752   0.909
  234    HG1  THR  42           1HG      THR  42   8.443  -7.356  -0.049
  235   HG21  THR  42          3HG2      THR  42  10.931  -6.024  -0.044
  236   HG22  THR  42          1HG2      THR  42  10.488  -7.443   0.926
  237   HG23  THR  42          2HG2      THR  42  11.086  -5.974   1.719
  238    H    VAL  43           H        VAL  43   8.760  -7.297   4.567
  239    HA   VAL  43           HA       VAL  43   9.094  -4.870   6.091
  240    HB   VAL  43           HB       VAL  43   9.529  -7.799   6.787
  241   HG11  VAL  43          1HG1      VAL  43   9.472  -7.086   9.182
  242   HG12  VAL  43          2HG1      VAL  43  10.930  -6.534   8.363
  243   HG13  VAL  43          3HG1      VAL  43   9.600  -5.390   8.669
  244   HG21  VAL  43          3HG2      VAL  43   7.374  -5.764   7.498
  245   HG22  VAL  43          1HG2      VAL  43   7.187  -7.046   6.290
  246   HG23  VAL  43          2HG2      VAL  43   7.385  -7.476   7.994
  247    H    ALA  44           H        ALA  44  11.492  -7.196   4.724
  248    HA   ALA  44           HA       ALA  44  13.642  -6.483   6.406
  249    HB1  ALA  44           1HB      ALA  44  13.493  -8.541   5.052
  250    HB2  ALA  44           2HB      ALA  44  13.689  -7.592   3.561
  251    HB3  ALA  44           3HB      ALA  44  15.010  -7.682   4.748
  252    H    THR  45           H        THR  45  12.818  -5.136   3.222
  253    HA   THR  45           HA       THR  45  14.823  -2.952   3.515
  254    HB   THR  45           HB       THR  45  14.249  -2.535   1.098
  255    HG1  THR  45           1HG      THR  45  13.301  -4.583   0.186
  256   HG21  THR  45          3HG2      THR  45  16.243  -3.859   1.833
  257   HG22  THR  45          1HG2      THR  45  15.602  -4.362   0.265
  258   HG23  THR  45          2HG2      THR  45  15.272  -5.343   1.711
  259    H    GLY  46           H        GLY  46  11.477  -3.506   4.036
  260    HA2  GLY  46           2HA      GLY  46   9.886  -2.140   4.845
  261    HA3  GLY  46           3HA      GLY  46  11.030  -0.787   4.830
  262    H    ARG  47           H        ARG  47   9.802  -2.782   2.109
  263    HA   ARG  47           HA       ARG  47   8.581  -0.334   0.888
  264    HB3  ARG  47           2HB      ARG  47  10.682  -0.778  -0.221
  265    HG3  ARG  47           2HG      ARG  47   9.491  -3.449  -1.109
  266    HD3  ARG  47           2HD      ARG  47  10.878  -2.453  -2.872
  267    HE   ARG  47           HE       ARG  47  12.547  -1.549  -0.748
  268   HH11  ARG  47          1HH1      ARG  47  13.027  -2.791  -4.053
  269   HH12  ARG  47          2HH1      ARG  47  14.644  -2.119  -4.109
  270   HH21  ARG  47          1HH2      ARG  47  14.415  -0.654  -0.965
  271   HH22  ARG  47          2HH2      ARG  47  15.424  -0.850  -2.390
  272    H    LEU  48           H        LEU  48   7.214  -1.174  -1.152
  273    HA   LEU  48           HA       LEU  48   5.436  -3.404  -0.266
  274    HB3  LEU  48           2HB      LEU  48   3.923  -1.050  -1.159
  275    HG   LEU  48           HG       LEU  48   4.072  -2.569   1.485
  276   HD11  LEU  48          1HD1      LEU  48   2.025  -1.292   2.091
  277   HD12  LEU  48          2HD1      LEU  48   2.220  -0.302   0.628
  278   HD13  LEU  48          3HD1      LEU  48   3.444  -0.252   1.923
  279   HD21  LEU  48          3HD2      LEU  48   1.981  -2.508  -0.759
  280   HD22  LEU  48          1HD2      LEU  48   1.751  -3.311   0.805
  281   HD23  LEU  48          2HD2      LEU  48   3.001  -3.885  -0.294
  282    H    THR  49           H        THR  49   4.036  -4.221  -1.821
  283    HA   THR  49           HA       THR  49   4.100  -3.207  -4.615
  284    HB   THR  49           HB       THR  49   4.275  -6.179  -3.973
  285    HG1  THR  49           1HG      THR  49   6.250  -5.458  -3.595
  286   HG21  THR  49          3HG2      THR  49   4.772  -6.294  -6.436
  287   HG22  THR  49          1HG2      THR  49   4.374  -4.571  -6.570
  288   HG23  THR  49          2HG2      THR  49   3.129  -5.746  -6.082
  289    H    VAL  50           H        VAL  50   2.100  -3.090  -5.394
  290    HA   VAL  50           HA       VAL  50  -0.084  -4.735  -4.240
  291    HB   VAL  50           HB       VAL  50   0.017  -2.707  -2.839
  292   HG11  VAL  50          1HG1      VAL  50   0.876  -1.074  -4.493
  293   HG12  VAL  50          2HG1      VAL  50  -0.678  -1.134  -5.350
  294   HG13  VAL  50          3HG1      VAL  50  -0.600  -0.502  -3.705
  295   HG21  VAL  50          3HG2      VAL  50  -2.358  -2.134  -2.941
  296   HG22  VAL  50          1HG2      VAL  50  -2.493  -2.818  -4.562
  297   HG23  VAL  50          2HG2      VAL  50  -2.121  -3.873  -3.181
  298    H    THR  51           H        THR  51  -1.779  -5.122  -5.579
  299    HA   THR  51           HA       THR  51  -1.706  -4.113  -8.393
  300    HB   THR  51           HB       THR  51  -2.271  -6.928  -7.369
  301    HG1  THR  51           1HG      THR  51  -0.213  -6.095  -9.109
  302   HG21  THR  51          3HG2      THR  51  -2.229  -5.802 -10.212
  303   HG22  THR  51          1HG2      THR  51  -3.603  -6.538  -9.364
  304   HG23  THR  51          2HG2      THR  51  -2.213  -7.535  -9.806
  305    H    TYR  52           H        TYR  52  -3.641  -3.495  -9.209
  306    HA   TYR  52           HA       TYR  52  -6.170  -3.895  -7.763
  307    HB3  TYR  52           2HB      TYR  52  -5.133  -2.292  -6.313
  308    HD1  TYR  52           1HD      TYR  52  -2.739  -1.889  -6.689
  309    HD2  TYR  52           2HD      TYR  52  -5.745   0.300  -8.871
  310    HE1  TYR  52           1HE      TYR  52  -1.011  -0.271  -7.434
  311    HE2  TYR  52           2HE      TYR  52  -4.013   1.959  -9.573
  312    HH   TYR  52           HH       TYR  52  -1.798   2.600  -9.397
  313    H    ASP  53           H        ASP  53  -8.011  -2.824  -8.726
  314    HA   ASP  53           HA       ASP  53  -7.837  -2.685 -11.649
  315    HB3  ASP  53           2HB      ASP  53 -10.140  -2.657  -9.684
  316    HA   PRO  54           HA       PRO  54  -7.343   1.753 -10.930
  317    HB3  PRO  54           2HB      PRO  54  -5.597   1.532 -12.409
  318    HG3  PRO  54           2HG      PRO  54  -5.807   0.234 -14.445
  319    HD3  PRO  54           2HD      PRO  54  -6.170  -1.198 -12.608
  320    H    LYS  55           H        LYS  55 -10.035   0.363 -11.836
  321    HA   LYS  55           HA       LYS  55 -11.344   2.759 -13.077
  322    HB3  LYS  55           2HB      LYS  55 -11.885  -0.188 -13.620
  323    HG3  LYS  55           2HG      LYS  55 -12.988   2.410 -14.754
  324    HD3  LYS  55           2HD      LYS  55 -12.221   1.102 -16.644
  325    HE3  LYS  55           2HE      LYS  55 -12.267  -1.214 -15.733
  326    HZ1  LYS  55           3HZ      LYS  55 -14.339  -1.341 -14.624
  327    HZ2  LYS  55           1HZ      LYS  55 -14.453  -2.338 -15.931
  328    HZ3  LYS  55           2HZ      LYS  55 -15.198  -0.857 -15.956
  329    H    GLN  56           H        GLN  56 -11.806   0.069 -10.735
  330    HA   GLN  56           HA       GLN  56 -14.051   1.631  -9.525
  331    HB3  GLN  56           2HB      GLN  56 -14.192  -0.852  -9.890
  332    HG3  GLN  56           2HG      GLN  56 -12.694  -1.169  -7.274
  333   HE21  GLN  56          1HE2      GLN  56 -12.582  -2.825 -10.439
  334   HE22  GLN  56          2HE2      GLN  56 -13.282  -4.338  -9.873
  335    H    VAL  57           H        VAL  57 -10.608   1.354  -9.101
  336    HA   VAL  57           HA       VAL  57 -10.748   3.190  -6.837
  337    HB   VAL  57           HB       VAL  57  -9.099   1.994  -5.462
  338   HG11  VAL  57          1HG1      VAL  57 -11.494   1.770  -4.880
  339   HG12  VAL  57          2HG1      VAL  57 -11.558   0.249  -5.804
  340   HG13  VAL  57          3HG1      VAL  57 -10.520   0.377  -4.379
  341   HG21  VAL  57          3HG2      VAL  57  -8.595  -0.381  -5.745
  342   HG22  VAL  57          1HG2      VAL  57  -9.565  -0.448  -7.229
  343   HG23  VAL  57          2HG2      VAL  57  -8.073   0.515  -7.174
  344    H    SER  58           H        SER  58  -8.305   3.746  -6.247
  345    HA   SER  58           HA       SER  58  -6.397   3.198  -8.426
  346    HB3  SER  58           2HB      SER  58  -7.502   5.427  -8.982
  347    HG   SER  58           HG       SER  58  -5.920   6.902  -7.415
  348    H    GLU  59           H        GLU  59  -4.250   4.773  -7.450
  349    HA   GLU  59           HA       GLU  59  -3.282   3.461  -5.139
  350    HB3  GLU  59           2HB      GLU  59  -1.850   4.607  -6.752
  351    HG3  GLU  59           2HG      GLU  59  -1.415   7.043  -6.543
  352    H    ILE  60           H        ILE  60  -5.628   6.005  -5.301
  353    HA   ILE  60           HA       ILE  60  -5.500   7.153  -2.706
  354    HB   ILE  60           HB       ILE  60  -7.721   6.486  -4.643
  355   HG13  ILE  60          2HG1      ILE  60  -7.843   8.856  -5.057
  356   HG21  ILE  60          1HG2      ILE  60  -9.264   7.931  -3.304
  357   HG22  ILE  60          2HG2      ILE  60  -8.904   6.356  -2.603
  358   HG23  ILE  60          3HG2      ILE  60  -8.107   7.811  -1.951
  359   HD11  ILE  60          3HD1      ILE  60  -5.506   9.267  -3.135
  360   HD12  ILE  60          1HD1      ILE  60  -6.228  10.473  -4.207
  361   HD13  ILE  60          2HD1      ILE  60  -7.168   9.822  -2.859
  362    H    THR  61           H        THR  61  -6.744   3.927  -3.640
  363    HA   THR  61           HA       THR  61  -8.065   3.533  -1.090
  364    HB   THR  61           HB       THR  61  -7.442   1.743  -3.443
  365    HG1  THR  61           1HG      THR  61  -9.171   3.200  -3.552
  366   HG21  THR  61          3HG2      THR  61  -8.887   0.028  -2.358
  367   HG22  THR  61          1HG2      THR  61  -8.789   0.932  -0.829
  368   HG23  THR  61          2HG2      THR  61  -7.328   0.204  -1.542
  369    H    ILE  62           H        ILE  62  -4.859   2.343  -2.257
  370    HA   ILE  62           HA       ILE  62  -4.219   1.345   0.404
  371    HB   ILE  62           HB       ILE  62  -3.210   0.534  -1.748
  372   HG13  ILE  62          2HG1      ILE  62  -2.436  -0.094   0.478
  373   HG21  ILE  62          1HG2      ILE  62  -1.263   1.663  -2.680
  374   HG22  ILE  62          2HG2      ILE  62  -2.650   2.732  -2.753
  375   HG23  ILE  62          3HG2      ILE  62  -1.406   2.984  -1.504
  376   HD11  ILE  62          3HD1      ILE  62  -0.155  -0.758   0.061
  377   HD12  ILE  62          1HD1      ILE  62  -1.089  -0.955  -1.431
  378   HD13  ILE  62          2HD1      ILE  62   0.021   0.428  -1.247
  379    H    GLN  63           H        GLN  63  -3.727   4.531  -1.140
  380    HA   GLN  63           HA       GLN  63  -2.263   5.738   0.976
  381    HB3  GLN  63           2HB      GLN  63  -4.390   6.926  -0.853
  382    HG3  GLN  63           2HG      GLN  63  -2.702   8.965  -0.519
  383   HE21  GLN  63          1HE2      GLN  63  -4.537   8.097   2.426
  384   HE22  GLN  63          2HE2      GLN  63  -5.924   9.112   2.052
  385    H    GLU  64           H        GLU  64  -5.844   5.277   0.690
  386    HA   GLU  64           HA       GLU  64  -6.399   6.541   3.211
  387    HB3  GLU  64           2HB      GLU  64  -8.649   5.247   2.848
  388    HG3  GLU  64           2HG      GLU  64  -9.321   6.734   0.979
  389    H    ARG  65           H        ARG  65  -5.127   3.382   2.704
  390    HA   ARG  65           HA       ARG  65  -5.888   2.572   5.487
  391    HB3  ARG  65           2HB      ARG  65  -4.739   1.136   3.103
  392    HG3  ARG  65           2HG      ARG  65  -3.355   0.129   4.695
  393    HD3  ARG  65           2HD      ARG  65  -4.135   0.685   6.917
  394    HE   ARG  65           HE       ARG  65  -6.745   0.093   6.214
  395   HH11  ARG  65          1HH1      ARG  65  -4.627  -1.350   8.696
  396   HH12  ARG  65          2HH1      ARG  65  -5.908  -1.375   9.872
  397   HH21  ARG  65          1HH2      ARG  65  -8.318  -0.134   7.642
  398   HH22  ARG  65          2HH2      ARG  65  -8.039  -0.756   9.261
  399    H    ILE  66           H        ILE  66  -2.974   3.297   3.485
  400    HA   ILE  66           HA       ILE  66  -1.084   3.099   5.672
  401    HB   ILE  66           HB       ILE  66  -1.042   4.622   3.035
  402   HG13  ILE  66          2HG1      ILE  66  -1.068   2.025   3.094
  403   HG21  ILE  66          1HG2      ILE  66   1.418   4.856   3.393
  404   HG22  ILE  66          2HG2      ILE  66   0.501   5.764   4.577
  405   HG23  ILE  66          3HG2      ILE  66   1.232   4.210   5.037
  406   HD11  ILE  66          3HD1      ILE  66  -0.250   3.233   1.114
  407   HD12  ILE  66          1HD1      ILE  66   1.379   3.312   1.831
  408   HD13  ILE  66          2HD1      ILE  66   0.673   1.747   1.427
  409    H    ALA  67           H        ALA  67  -2.955   5.922   4.466
  410    HA   ALA  67           HA       ALA  67  -1.886   7.773   6.323
  411    HB1  ALA  67           1HB      ALA  67  -3.907   9.103   5.748
  412    HB2  ALA  67           2HB      ALA  67  -3.124   8.428   4.311
  413    HB3  ALA  67           3HB      ALA  67  -4.616   7.689   4.952
  414    H    ALA  68           H        ALA  68  -4.574   5.411   6.648
  415    HA   ALA  68           HA       ALA  68  -5.756   6.608   8.999
  416    HB1  ALA  68           1HB      ALA  68  -6.048   3.830   7.759
  417    HB2  ALA  68           2HB      ALA  68  -7.116   4.543   8.987
  418    HB3  ALA  68           3HB      ALA  68  -7.022   5.263   7.372
  419    H    LEU  69           H        LEU  69  -3.301   4.149   8.465
  420    HA   LEU  69           HA       LEU  69  -2.959   3.449  11.265
  421    HB3  LEU  69           2HB      LEU  69  -1.015   3.085   8.954
  422    HG   LEU  69           HG       LEU  69  -0.168   2.242  11.137
  423   HD11  LEU  69          1HD1      LEU  69  -2.749   0.612  11.165
  424   HD12  LEU  69          2HD1      LEU  69  -2.225   1.798  12.382
  425   HD13  LEU  69          3HD1      LEU  69  -1.343   0.284  12.208
  426   HD21  LEU  69          3HD2      LEU  69  -1.079   0.039   9.254
  427   HD22  LEU  69          1HD2      LEU  69   0.249  -0.063  10.422
  428   HD23  LEU  69          2HD2      LEU  69   0.372   1.055   9.052
  429    H    GLY  70           H        GLY  70  -2.299   6.289   9.642
  430    HA2  GLY  70           2HA      GLY  70  -1.635   8.211  10.738
  431    HA3  GLY  70           3HA      GLY  70  -0.619   7.286  11.857
  432    H    TYR  71           H        TYR  71  -0.086   6.489   8.528
  433    HA   TYR  71           HA       TYR  71   2.426   8.141   8.521
  434    HB3  TYR  71           2HB      TYR  71   3.350   6.282   7.155
  435    HD1  TYR  71           2HD      TYR  71   4.795   6.739   9.137
  436    HD2  TYR  71           1HD      TYR  71   1.306   4.212   9.369
  437    HE1  TYR  71           2HE      TYR  71   5.637   5.775  11.262
  438    HE2  TYR  71           1HE      TYR  71   2.141   3.255  11.501
  439    HH   TYR  71           HH       TYR  71   3.807   3.304  13.089
  440    H    THR  72           H        THR  72   3.173   7.683   5.867
  441    HA   THR  72           HA       THR  72   0.949   8.444   4.093
  442    HB   THR  72           HB       THR  72   2.289  10.145   2.934
  443    HG1  THR  72           1HG      THR  72   4.249  10.764   3.718
  444   HG21  THR  72          3HG2      THR  72   2.327  11.960   4.525
  445   HG22  THR  72          1HG2      THR  72   2.302  10.840   5.900
  446   HG23  THR  72          2HG2      THR  72   0.893  10.971   4.823
  447    H    LEU  73           H        LEU  73   2.007   8.436   1.726
  448    HA   LEU  73           HA       LEU  73   3.901   6.168   1.395
  449    HB3  LEU  73           2HB      LEU  73   1.482   5.499   0.975
  450    HG   LEU  73           HG       LEU  73   1.777   7.147  -1.584
  451   HD11  LEU  73          1HD1      LEU  73   0.837   4.898  -1.929
  452   HD12  LEU  73          2HD1      LEU  73  -0.389   6.145  -2.184
  453   HD13  LEU  73          3HD1      LEU  73  -0.387   5.202  -0.678
  454   HD21  LEU  73          3HD2      LEU  73  -0.390   8.198  -0.912
  455   HD22  LEU  73          1HD2      LEU  73   0.936   8.652   0.147
  456   HD23  LEU  73          2HD2      LEU  73  -0.241   7.431   0.689
  457    H    ALA  74           H        ALA  74   5.103   6.191  -0.631
  458    HA   ALA  74           HA       ALA  74   5.032   8.770  -2.169
  459    HB1  ALA  74           1HB      ALA  74   7.429   7.038  -1.420
  460    HB2  ALA  74           2HB      ALA  74   7.468   8.429  -2.518
  461    HB3  ALA  74           3HB      ALA  74   7.063   8.663  -0.803
  462    H    GLU  75           H        GLU  75   3.692   8.083  -3.822
  463    HA   GLU  75           HA       GLU  75   4.255   5.519  -5.198
  464    HB3  GLU  75           2HB      GLU  75   1.905   7.434  -5.456
  465    HG3  GLU  75           2HG      GLU  75   0.806   5.218  -6.227
  466    HA   PRO  76           HA       PRO  76   6.886   8.067  -7.220
  467    HB3  PRO  76           2HB      PRO  76   8.247   6.238  -7.428
  468    HG3  PRO  76           2HG      PRO  76   7.355   4.124  -8.122
  469    HD3  PRO  76           2HD      PRO  76   6.096   4.911  -6.275
  Start of MODEL   21
    1    H2   PRO   6           2H       PRO   6  -5.823  -4.532 -19.141
    2    HA   PRO   6           HA       PRO   6  -6.489  -6.871 -17.488
    3    HB3  PRO   6           2HB      PRO   6  -4.233  -7.600 -17.769
    4    HG3  PRO   6           2HG      PRO   6  -5.094  -8.158 -19.876
    5    HD3  PRO   6           2HD      PRO   6  -7.097  -7.072 -19.875
    6    H    LEU   7           H        LEU   7  -5.210  -6.858 -15.376
    7    HA   LEU   7           HA       LEU   7  -5.795  -4.394 -13.936
    8    HB3  LEU   7           2HB      LEU   7  -4.552  -5.871 -12.108
    9    HG   LEU   7           HG       LEU   7  -6.941  -5.369 -12.087
   10   HD11  LEU   7          1HD1      LEU   7  -7.741  -6.209 -14.235
   11   HD12  LEU   7          2HD1      LEU   7  -8.579  -7.057 -12.938
   12   HD13  LEU   7          3HD1      LEU   7  -7.257  -7.867 -13.805
   13   HD21  LEU   7          3HD2      LEU   7  -7.593  -7.324 -10.728
   14   HD22  LEU   7          1HD2      LEU   7  -5.930  -6.817 -10.394
   15   HD23  LEU   7          2HD2      LEU   7  -6.234  -8.250 -11.403
   16    H    LYS   8           H        LYS   8  -4.194  -3.428 -12.434
   17    HA   LYS   8           HA       LYS   8  -1.536  -3.168 -13.777
   18    HB3  LYS   8           2HB      LYS   8  -1.408  -0.893 -12.877
   19    HG3  LYS   8           2HG      LYS   8  -4.047  -1.223 -14.356
   20    HD3  LYS   8           2HD      LYS   8  -1.974   1.000 -14.544
   21    HE3  LYS   8           2HE      LYS   8  -4.914   0.772 -15.316
   22    HZ1  LYS   8           3HZ      LYS   8  -4.829   2.946 -15.972
   23    HZ2  LYS   8           1HZ      LYS   8  -3.201   3.010 -16.096
   24    HZ3  LYS   8           2HZ      LYS   8  -3.934   3.034 -14.607
   25    H    THR   9           H        THR   9   0.288  -3.440 -12.592
   26    HA   THR   9           HA       THR   9   0.044  -3.781  -9.625
   27    HB   THR   9           HB       THR   9   0.930  -5.765 -10.983
   28    HG1  THR   9           1HG      THR   9   1.149  -5.627  -8.820
   29   HG21  THR   9          3HG2      THR   9   2.528  -4.390 -12.422
   30   HG22  THR   9          1HG2      THR   9   3.241  -5.790 -11.603
   31   HG23  THR   9          2HG2      THR   9   3.519  -4.156 -10.969
   32    H    GLN  10           H        GLN  10   1.725  -2.746  -8.315
   33    HA   GLN  10           HA       GLN  10   3.238  -0.550  -9.518
   34    HB3  GLN  10           2HB      GLN  10   1.025   0.098  -7.535
   35    HG3  GLN  10           2HG      GLN  10   2.949   1.783  -8.030
   36   HE21  GLN  10          1HE2      GLN  10   3.026   3.999  -9.334
   37   HE22  GLN  10          2HE2      GLN  10   2.943   3.754 -11.083
   38    H    GLN  11           H        GLN  11   4.809   0.197  -8.028
   39    HA   GLN  11           HA       GLN  11   4.690  -0.860  -5.266
   40    HB3  GLN  11           2HB      GLN  11   6.307  -2.210  -6.583
   41    HG3  GLN  11           2HG      GLN  11   7.257  -0.193  -7.958
   42   HE21  GLN  11          1HE2      GLN  11   7.883   1.900  -7.427
   43   HE22  GLN  11          2HE2      GLN  11   9.127   2.298  -6.255
   44    H    MET  12           H        MET  12   5.982   0.456  -3.712
   45    HA   MET  12           HA       MET  12   6.293   3.284  -4.419
   46    HB3  MET  12           2HB      MET  12   3.898   3.142  -4.387
   47    HG3  MET  12           2HG      MET  12   4.140   1.964  -1.587
   48    HE1  MET  12           3HE      MET  12   0.143   2.563  -3.832
   49    HE2  MET  12           1HE      MET  12   1.719   2.765  -4.608
   50    HE3  MET  12           2HE      MET  12   1.220   1.162  -4.028
   51    H    GLN  13           H        GLN  13   7.048   4.635  -2.817
   52    HA   GLN  13           HA       GLN  13   8.417   3.271  -0.575
   53    HB3  GLN  13           2HB      GLN  13   9.483   5.523  -0.237
   54    HG3  GLN  13           2HG      GLN  13   9.844   4.457  -3.068
   55   HE21  GLN  13          1HE2      GLN  13  10.533   6.830  -3.485
   56   HE22  GLN  13          2HE2      GLN  13  12.180   7.189  -3.030
   57    H    VAL  14           H        VAL  14   7.784   3.447   1.481
   58    HA   VAL  14           HA       VAL  14   5.419   5.090   2.227
   59    HB   VAL  14           HB       VAL  14   5.503   2.038   2.198
   60   HG11  VAL  14          1HG1      VAL  14   3.388   3.846   3.466
   61   HG12  VAL  14          2HG1      VAL  14   3.281   2.083   3.299
   62   HG13  VAL  14          3HG1      VAL  14   4.493   2.796   4.364
   63   HG21  VAL  14          3HG2      VAL  14   4.794   3.084   0.088
   64   HG22  VAL  14          1HG2      VAL  14   3.464   2.221   0.863
   65   HG23  VAL  14          2HG2      VAL  14   3.539   3.985   0.953
   66    H    GLY  15           H        GLY  15   5.480   5.704   4.278
   67    HA2  GLY  15           2HA      GLY  15   8.007   5.515   5.649
   68    HA3  GLY  15           3HA      GLY  15   6.581   6.423   6.178
   69    H    GLY  16           H        GLY  16   8.458   4.912   7.708
   70    HA2  GLY  16           2HA      GLY  16   8.462   3.757   9.680
   71    HA3  GLY  16           3HA      GLY  16   6.691   3.733   9.590
   72    H    MET  17           H        MET  17   7.475   2.083   6.877
   73    HA   MET  17           HA       MET  17   6.471  -0.313   7.969
   74    HB3  MET  17           2HB      MET  17   7.000  -1.301   5.717
   75    HG3  MET  17           2HG      MET  17   5.547   0.202   4.428
   76    HE1  MET  17           3HE      MET  17   3.570   1.940   6.888
   77    HE2  MET  17           1HE      MET  17   2.977   0.772   8.087
   78    HE3  MET  17           2HE      MET  17   4.680   1.276   8.095
   79    H    ARG  18           H        ARG  18   9.904   0.554   7.796
   80    HA   ARG  18           HA       ARG  18  10.820  -2.185   8.223
   81    HB3  ARG  18           2HB      ARG  18  12.932  -1.155   8.991
   82    HG3  ARG  18           2HG      ARG  18  12.068   0.392   6.565
   83    HD3  ARG  18           2HD      ARG  18  14.310  -0.029   5.760
   84    HE   ARG  18           HE       ARG  18  15.319   0.273   8.437
   85   HH11  ARG  18          1HH1      ARG  18  13.559   2.149   5.962
   86   HH12  ARG  18          2HH1      ARG  18  13.953   3.660   6.774
   87   HH21  ARG  18          1HH2      ARG  18  15.807   2.257   9.319
   88   HH22  ARG  18          2HH2      ARG  18  15.299   3.718   8.527
   89    H    CYS  19           H        CYS  19   9.228   0.045  10.317
   90    HA   CYS  19           HA       CYS  19  10.623  -0.747  12.755
   91    HB3  CYS  19           2HB      CYS  19   8.163   1.007  12.627
   92    HG   CYS  19           HG       CYS  19   9.262   2.459  14.487
   93    H    ALA  20           H        ALA  20   9.409  -1.368  14.709
   94    HA   ALA  20           HA       ALA  20   8.524  -3.940  14.497
   95    HB1  ALA  20           1HB      ALA  20   7.888  -1.957  16.716
   96    HB2  ALA  20           2HB      ALA  20   7.809  -3.725  16.858
   97    HB3  ALA  20           3HB      ALA  20   9.366  -2.934  16.560
   98    H    ALA  21           H        ALA  21   6.809  -4.934  13.749
   99    HA   ALA  21           HA       ALA  21   4.707  -5.539  13.156
  100    HB1  ALA  21           1HB      ALA  21   3.869  -3.748  15.477
  101    HB2  ALA  21           2HB      ALA  21   2.934  -5.075  14.773
  102    HB3  ALA  21           3HB      ALA  21   4.452  -5.423  15.618
  103    H    CYS  22           H        CYS  22   5.689  -2.609  12.240
  104    HA   CYS  22           HA       CYS  22   3.263  -1.165  11.853
  105    HB3  CYS  22           2HB      CYS  22   4.795   0.285  10.378
  106    HG   CYS  22           HG       CYS  22   5.774  -0.786  13.388
  107    H    ALA  23           H        ALA  23   4.955  -3.319   9.590
  108    HA   ALA  23           HA       ALA  23   3.284  -2.814   7.321
  109    HB1  ALA  23           1HB      ALA  23   4.024  -5.150   6.707
  110    HB2  ALA  23           2HB      ALA  23   5.337  -4.020   7.111
  111    HB3  ALA  23           3HB      ALA  23   4.825  -5.257   8.278
  112    H    SER  24           H        SER  24   2.561  -4.572  10.326
  113    HA   SER  24           HA       SER  24   0.560  -6.331   9.223
  114    HB3  SER  24           2HB      SER  24  -0.104  -6.762  11.495
  115    HG   SER  24           HG       SER  24   1.920  -7.140  12.514
  116    H    SER  25           H        SER  25   0.347  -3.017  10.529
  117    HA   SER  25           HA       SER  25  -2.523  -2.996  10.739
  118    HB3  SER  25           2HB      SER  25  -2.280  -0.596  11.077
  119    HG   SER  25           HG       SER  25  -1.422  -0.897  12.937
  120    H    ILE  26           H        ILE  26  -0.391  -2.470   8.076
  121    HA   ILE  26           HA       ILE  26  -2.591  -1.405   6.342
  122    HB   ILE  26           HB       ILE  26   0.406  -1.731   6.049
  123   HG13  ILE  26          2HG1      ILE  26  -1.413   0.602   5.318
  124   HG21  ILE  26          1HG2      ILE  26   0.228  -1.141   3.656
  125   HG22  ILE  26          2HG2      ILE  26  -0.389  -2.747   3.994
  126   HG23  ILE  26          3HG2      ILE  26  -1.528  -1.401   3.722
  127   HD11  ILE  26          3HD1      ILE  26   0.440   0.298   7.719
  128   HD12  ILE  26          1HD1      ILE  26  -0.244   1.830   7.137
  129   HD13  ILE  26          2HD1      ILE  26  -1.324   0.570   7.756
  130    H    GLU  27           H        GLU  27  -0.415  -4.283   6.608
  131    HA   GLU  27           HA       GLU  27  -1.581  -5.437   4.281
  132    HB3  GLU  27           2HB      GLU  27  -0.030  -7.087   6.265
  133    HG3  GLU  27           2HG      GLU  27   0.158  -6.748   3.225
  134    H    ARG  28           H        ARG  28  -2.405  -5.829   7.715
  135    HA   ARG  28           HA       ARG  28  -4.045  -8.133   7.563
  136    HB3  ARG  28           2HB      ARG  28  -4.303  -5.662   9.318
  137    HG3  ARG  28           2HG      ARG  28  -5.457  -8.466   9.638
  138    HD3  ARG  28           2HD      ARG  28  -4.976  -6.296  11.721
  139    HE   ARG  28           HE       ARG  28  -6.318  -8.949  12.169
  140   HH11  ARG  28          1HH1      ARG  28  -6.231  -5.431  12.879
  141   HH12  ARG  28          2HH1      ARG  28  -7.608  -5.599  13.949
  142   HH21  ARG  28          1HH2      ARG  28  -7.936  -8.981  13.805
  143   HH22  ARG  28          2HH2      ARG  28  -8.453  -7.448  14.483
  144    H    ALA  29           H        ALA  29  -4.746  -4.854   6.456
  145    HA   ALA  29           HA       ALA  29  -7.547  -5.640   5.724
  146    HB1  ALA  29           1HB      ALA  29  -6.153  -2.929   5.724
  147    HB2  ALA  29           2HB      ALA  29  -7.854  -3.238   5.308
  148    HB3  ALA  29           3HB      ALA  29  -7.281  -3.521   6.966
  149    H    LEU  30           H        LEU  30  -4.453  -4.523   4.297
  150    HA   LEU  30           HA       LEU  30  -5.221  -3.617   1.892
  151    HB3  LEU  30           2HB      LEU  30  -2.789  -5.338   2.477
  152    HG   LEU  30           HG       LEU  30  -2.843  -4.959   0.074
  153   HD11  LEU  30          1HD1      LEU  30  -3.167  -2.004   0.747
  154   HD12  LEU  30          2HD1      LEU  30  -4.322  -3.031  -0.130
  155   HD13  LEU  30          3HD1      LEU  30  -2.774  -2.658  -0.866
  156   HD21  LEU  30          3HD2      LEU  30  -0.716  -3.678  -0.116
  157   HD22  LEU  30          1HD2      LEU  30  -0.681  -4.828   1.238
  158   HD23  LEU  30          2HD2      LEU  30  -0.926  -3.092   1.540
  159    H    GLU  31           H        GLU  31  -4.887  -7.118   2.487
  160    HA   GLU  31           HA       GLU  31  -5.199  -7.721  -0.367
  161    HB3  GLU  31           2HB      GLU  31  -4.863 -10.017   0.306
  162    HG3  GLU  31           2HG      GLU  31  -2.977  -8.360   2.015
  163    H    ARG  32           H        ARG  32  -7.375  -7.068   2.101
  164    HA   ARG  32           HA       ARG  32  -9.569  -8.357   0.581
  165    HB3  ARG  32           2HB      ARG  32  -9.392  -9.320   2.847
  166    HG3  ARG  32           2HG      ARG  32  -9.718  -6.412   3.676
  167    HD3  ARG  32           2HD      ARG  32  -9.964  -8.670   5.621
  168    HE   ARG  32           HE       ARG  32 -10.605  -5.759   5.562
  169   HH11  ARG  32          1HH1      ARG  32 -10.660  -8.696   7.565
  170   HH12  ARG  32          2HH1      ARG  32 -10.756  -7.756   9.036
  171   HH21  ARG  32          1HH2      ARG  32 -10.650  -4.662   7.484
  172   HH22  ARG  32          2HH2      ARG  32 -10.719  -5.534   8.991
  173    H    LEU  33           H        LEU  33  -8.088  -5.393   1.041
  174    HA   LEU  33           HA       LEU  33 -10.382  -3.613   0.948
  175    HB3  LEU  33           2HB      LEU  33  -8.845  -2.116  -0.362
  176    HG   LEU  33           HG       LEU  33  -7.502  -3.202   2.137
  177   HD11  LEU  33          1HD1      LEU  33  -7.194  -0.477   0.819
  178   HD12  LEU  33          2HD1      LEU  33  -6.053  -1.811   0.600
  179   HD13  LEU  33          3HD1      LEU  33  -6.296  -1.111   2.209
  180   HD21  LEU  33          3HD2      LEU  33  -9.754  -2.372   2.700
  181   HD22  LEU  33          1HD2      LEU  33  -9.421  -0.859   1.814
  182   HD23  LEU  33          2HD2      LEU  33  -8.512  -1.255   3.282
  183    H    LYS  34           H        LYS  34 -11.977  -3.740  -0.483
  184    HA   LYS  34           HA       LYS  34 -12.048  -6.037  -1.929
  185    HB3  LYS  34           2HB      LYS  34 -13.967  -3.913  -2.795
  186    HG3  LYS  34           2HG      LYS  34 -14.162  -6.577  -2.987
  187    HD3  LYS  34           2HD      LYS  34 -15.317  -5.969  -0.224
  188    HE3  LYS  34           2HE      LYS  34 -15.400  -8.579  -1.798
  189    HZ1  LYS  34           3HZ      LYS  34 -17.004  -9.191  -0.086
  190    HZ2  LYS  34           1HZ      LYS  34 -16.871  -7.748   0.660
  191    HZ3  LYS  34           2HZ      LYS  34 -15.607  -8.761   0.666
  192    H    GLY  35           H        GLY  35 -11.005  -2.990  -3.320
  193    HA2  GLY  35           2HA      GLY  35 -11.109  -3.923  -6.108
  194    HA3  GLY  35           3HA      GLY  35 -10.417  -2.407  -5.499
  195    H    VAL  36           H        VAL  36  -8.890  -4.661  -3.632
  196    HA   VAL  36           HA       VAL  36  -6.494  -4.661  -5.383
  197    HB   VAL  36           HB       VAL  36  -6.842  -5.344  -2.441
  198   HG11  VAL  36          1HG1      VAL  36  -4.932  -6.620  -3.299
  199   HG12  VAL  36          2HG1      VAL  36  -4.288  -5.170  -4.101
  200   HG13  VAL  36          3HG1      VAL  36  -4.345  -5.269  -2.331
  201   HG21  VAL  36          3HG2      VAL  36  -5.589  -3.215  -2.082
  202   HG22  VAL  36          1HG2      VAL  36  -5.602  -2.919  -3.832
  203   HG23  VAL  36          2HG2      VAL  36  -7.121  -2.931  -2.908
  204    H    ALA  37           H        ALA  37  -5.669  -6.405  -6.287
  205    HA   ALA  37           HA       ALA  37  -7.084  -9.022  -6.048
  206    HB1  ALA  37           1HB      ALA  37  -7.023  -7.896  -8.243
  207    HB2  ALA  37           2HB      ALA  37  -5.245  -7.878  -8.197
  208    HB3  ALA  37           3HB      ALA  37  -6.118  -9.422  -8.286
  209    H    GLU  38           H        GLU  38  -3.852  -7.619  -5.580
  210    HA   GLU  38           HA       GLU  38  -3.103  -9.652  -3.845
  211    HB3  GLU  38           2HB      GLU  38  -2.691 -11.203  -5.566
  212    HG3  GLU  38           2HG      GLU  38  -0.704  -9.346  -6.921
  213    H    ALA  39           H        ALA  39  -1.106  -9.251  -2.689
  214    HA   ALA  39           HA       ALA  39   0.446  -6.867  -3.250
  215    HB1  ALA  39           1HB      ALA  39  -0.515  -5.421  -1.552
  216    HB2  ALA  39           2HB      ALA  39  -1.780  -5.845  -2.706
  217    HB3  ALA  39           3HB      ALA  39  -1.730  -6.654  -1.129
  218    H    SER  40           H        SER  40   1.919  -6.272  -1.559
  219    HA   SER  40           HA       SER  40   2.194  -7.978   0.823
  220    HB3  SER  40           2HB      SER  40   4.217  -8.216  -1.437
  221    HG   SER  40           HG       SER  40   5.392  -8.665   0.293
  222    H    VAL  41           H        VAL  41   3.155  -6.812   2.430
  223    HA   VAL  41           HA       VAL  41   4.705  -4.353   1.727
  224    HB   VAL  41           HB       VAL  41   3.956  -5.364   4.493
  225   HG11  VAL  41          1HG1      VAL  41   4.401  -2.971   5.099
  226   HG12  VAL  41          2HG1      VAL  41   5.836  -3.778   4.458
  227   HG13  VAL  41          3HG1      VAL  41   4.911  -2.658   3.433
  228   HG21  VAL  41          3HG2      VAL  41   1.846  -4.909   3.292
  229   HG22  VAL  41          1HG2      VAL  41   2.150  -3.712   4.554
  230   HG23  VAL  41          2HG2      VAL  41   2.435  -3.296   2.858
  231    H    THR  42           H        THR  42   6.883  -4.543   1.571
  232    HA   THR  42           HA       THR  42   8.220  -7.040   2.473
  233    HB   THR  42           HB       THR  42   9.365  -4.738   0.844
  234    HG1  THR  42           1HG      THR  42   8.018  -7.142   0.108
  235   HG21  THR  42          3HG2      THR  42  10.966  -6.456   0.100
  236   HG22  THR  42          1HG2      THR  42  10.192  -7.669   1.150
  237   HG23  THR  42          2HG2      THR  42  11.043  -6.274   1.855
  238    H    VAL  43           H        VAL  43   8.458  -6.857   4.649
  239    HA   VAL  43           HA       VAL  43   8.987  -4.420   6.040
  240    HB   VAL  43           HB       VAL  43   9.319  -7.316   6.886
  241   HG11  VAL  43          1HG1      VAL  43   9.286  -6.483   9.247
  242   HG12  VAL  43          2HG1      VAL  43  10.759  -6.038   8.400
  243   HG13  VAL  43          3HG1      VAL  43   9.482  -4.823   8.645
  244   HG21  VAL  43          3HG2      VAL  43   7.181  -6.873   8.068
  245   HG22  VAL  43          1HG2      VAL  43   7.229  -5.192   7.496
  246   HG23  VAL  43          2HG2      VAL  43   7.005  -6.525   6.345
  247    H    ALA  44           H        ALA  44  11.268  -6.949   4.860
  248    HA   ALA  44           HA       ALA  44  13.512  -5.908   6.333
  249    HB1  ALA  44           1HB      ALA  44  13.419  -7.820   3.963
  250    HB2  ALA  44           2HB      ALA  44  14.768  -7.602   5.099
  251    HB3  ALA  44           3HB      ALA  44  13.240  -8.271   5.677
  252    H    THR  45           H        THR  45  12.086  -4.639   3.531
  253    HA   THR  45           HA       THR  45  14.491  -2.910   3.031
  254    HB   THR  45           HB       THR  45  13.682  -2.632   0.723
  255    HG1  THR  45           1HG      THR  45  12.001  -4.020   0.022
  256   HG21  THR  45          3HG2      THR  45  14.298  -4.768  -0.182
  257   HG22  THR  45          1HG2      THR  45  13.891  -5.618   1.320
  258   HG23  THR  45          2HG2      THR  45  15.287  -4.521   1.268
  259    H    GLY  46           H        GLY  46  11.125  -3.101   3.831
  260    HA2  GLY  46           2HA      GLY  46   9.692  -1.578   4.699
  261    HA3  GLY  46           3HA      GLY  46  10.982  -0.367   4.731
  262    H    ARG  47           H        ARG  47   9.206  -2.168   2.184
  263    HA   ARG  47           HA       ARG  47   7.945   0.262   1.199
  264    HB3  ARG  47           2HB      ARG  47  10.070   0.499   0.071
  265    HG3  ARG  47           2HG      ARG  47   9.521  -2.257  -1.106
  266    HD3  ARG  47           2HD      ARG  47  10.052  -0.680  -2.916
  267    HE   ARG  47           HE       ARG  47  12.327   0.105  -1.153
  268   HH11  ARG  47          1HH1      ARG  47  10.763   0.596  -4.334
  269   HH12  ARG  47          2HH1      ARG  47  11.745   1.994  -4.653
  270   HH21  ARG  47          1HH2      ARG  47  13.520   1.885  -1.677
  271   HH22  ARG  47          2HH2      ARG  47  13.269   2.724  -3.189
  272    H    LEU  48           H        LEU  48   6.645  -0.289  -0.917
  273    HA   LEU  48           HA       LEU  48   5.095  -2.757  -0.214
  274    HB3  LEU  48           2HB      LEU  48   3.536  -0.430  -1.140
  275    HG   LEU  48           HG       LEU  48   3.566  -1.934   1.502
  276   HD11  LEU  48          1HD1      LEU  48   2.661   0.259   1.861
  277   HD12  LEU  48          2HD1      LEU  48   1.288  -0.850   1.752
  278   HD13  LEU  48          3HD1      LEU  48   1.697   0.179   0.368
  279   HD21  LEU  48          3HD2      LEU  48   1.709  -2.184  -0.916
  280   HD22  LEU  48          1HD2      LEU  48   1.439  -2.944   0.668
  281   HD23  LEU  48          2HD2      LEU  48   2.824  -3.424  -0.293
  282    H    THR  49           H        THR  49   3.864  -3.742  -1.775
  283    HA   THR  49           HA       THR  49   3.888  -2.834  -4.617
  284    HB   THR  49           HB       THR  49   4.278  -5.741  -3.834
  285    HG1  THR  49           1HG      THR  49   6.101  -4.726  -3.207
  286   HG21  THR  49          3HG2      THR  49   4.953  -5.942  -6.214
  287   HG22  THR  49          1HG2      THR  49   4.658  -4.207  -6.454
  288   HG23  THR  49          2HG2      THR  49   3.314  -5.311  -6.081
  289    H    VAL  50           H        VAL  50   1.946  -3.039  -5.522
  290    HA   VAL  50           HA       VAL  50  -0.197  -4.675  -4.281
  291    HB   VAL  50           HB       VAL  50  -0.265  -2.525  -3.094
  292   HG11  VAL  50          1HG1      VAL  50   0.677  -1.025  -4.828
  293   HG12  VAL  50          2HG1      VAL  50  -0.814  -1.189  -5.779
  294   HG13  VAL  50          3HG1      VAL  50  -0.854  -0.424  -4.183
  295   HG21  VAL  50          3HG2      VAL  50  -2.620  -1.991  -3.396
  296   HG22  VAL  50          1HG2      VAL  50  -2.650  -2.801  -4.969
  297   HG23  VAL  50          2HG2      VAL  50  -2.378  -3.740  -3.484
  298    H    THR  51           H        THR  51  -1.784  -5.314  -5.672
  299    HA   THR  51           HA       THR  51  -1.689  -4.435  -8.531
  300    HB   THR  51           HB       THR  51  -2.178  -7.233  -7.396
  301    HG1  THR  51           1HG      THR  51  -0.015  -6.730  -7.371
  302   HG21  THR  51          3HG2      THR  51  -3.469  -6.832  -9.515
  303   HG22  THR  51          1HG2      THR  51  -2.112  -7.924  -9.798
  304   HG23  THR  51          2HG2      THR  51  -2.003  -6.227 -10.303
  305    H    TYR  52           H        TYR  52  -3.550  -3.658  -9.284
  306    HA   TYR  52           HA       TYR  52  -6.115  -4.190  -7.868
  307    HB3  TYR  52           2HB      TYR  52  -5.145  -2.336  -6.695
  308    HD1  TYR  52           2HD      TYR  52  -6.026  -0.577  -9.919
  309    HD2  TYR  52           1HD      TYR  52  -3.072  -1.213  -6.846
  310    HE1  TYR  52           2HE      TYR  52  -4.641   1.250 -10.873
  311    HE2  TYR  52           1HE      TYR  52  -1.699   0.635  -7.774
  312    HH   TYR  52           HH       TYR  52  -1.606   2.367  -9.357
  313    H    ASP  53           H        ASP  53  -8.029  -3.171  -8.925
  314    HA   ASP  53           HA       ASP  53  -7.872  -3.426 -11.859
  315    HB3  ASP  53           2HB      ASP  53 -10.241  -3.348  -9.977
  316    HA   PRO  54           HA       PRO  54  -7.606   1.048 -11.639
  317    HB3  PRO  54           2HB      PRO  54  -5.946   0.717 -13.241
  318    HG3  PRO  54           2HG      PRO  54  -6.297  -0.784 -15.117
  319    HD3  PRO  54           2HD      PRO  54  -6.441  -2.008 -13.096
  320    H    LYS  55           H        LYS  55 -10.306  -0.532 -12.388
  321    HA   LYS  55           HA       LYS  55 -11.808   1.879 -13.393
  322    HB3  LYS  55           2HB      LYS  55 -13.388   0.225 -14.486
  323    HG3  LYS  55           2HG      LYS  55 -11.977  -0.413 -16.432
  324    HD3  LYS  55           2HD      LYS  55 -11.204   1.787 -17.170
  325    HE3  LYS  55           2HE      LYS  55 -13.790   2.227 -15.619
  326    HZ1  LYS  55           3HZ      LYS  55 -14.322   3.499 -17.599
  327    HZ2  LYS  55           1HZ      LYS  55 -12.923   3.068 -18.327
  328    HZ3  LYS  55           2HZ      LYS  55 -12.863   4.047 -17.032
  329    H    GLN  56           H        GLN  56 -11.700  -0.911 -11.222
  330    HA   GLN  56           HA       GLN  56 -14.060   0.144  -9.755
  331    HB3  GLN  56           2HB      GLN  56 -13.576  -1.575  -8.113
  332    HG3  GLN  56           2HG      GLN  56 -13.991  -3.568  -9.339
  333   HE21  GLN  56          1HE2      GLN  56 -14.601  -2.616 -12.435
  334   HE22  GLN  56          2HE2      GLN  56 -16.161  -1.836 -12.199
  335    H    VAL  57           H        VAL  57 -10.456   0.399  -9.504
  336    HA   VAL  57           HA       VAL  57 -10.814   2.555  -7.493
  337    HB   VAL  57           HB       VAL  57  -9.320   1.540  -5.865
  338   HG11  VAL  57          1HG1      VAL  57 -10.773  -0.070  -4.830
  339   HG12  VAL  57          2HG1      VAL  57 -11.742   1.233  -5.532
  340   HG13  VAL  57          3HG1      VAL  57 -11.645  -0.354  -6.339
  341   HG21  VAL  57          3HG2      VAL  57  -8.659  -0.815  -5.928
  342   HG22  VAL  57          1HG2      VAL  57  -9.478  -1.044  -7.487
  343   HG23  VAL  57          2HG2      VAL  57  -8.049   0.003  -7.369
  344    H    SER  58           H        SER  58  -8.273   2.895  -6.575
  345    HA   SER  58           HA       SER  58  -6.233   2.713  -8.649
  346    HB3  SER  58           2HB      SER  58  -7.521   4.804  -9.266
  347    HG   SER  58           HG       SER  58  -8.094   5.699  -7.318
  348    H    GLU  59           H        GLU  59  -4.255   4.363  -7.557
  349    HA   GLU  59           HA       GLU  59  -3.469   3.169  -5.123
  350    HB3  GLU  59           2HB      GLU  59  -1.871   4.235  -6.565
  351    HG3  GLU  59           2HG      GLU  59  -1.488   6.710  -6.400
  352    H    ILE  60           H        ILE  60  -5.906   5.569  -5.509
  353    HA   ILE  60           HA       ILE  60  -5.858   6.835  -2.927
  354    HB   ILE  60           HB       ILE  60  -7.935   6.210  -5.010
  355   HG13  ILE  60          2HG1      ILE  60  -8.038   8.614  -5.338
  356   HG21  ILE  60          1HG2      ILE  60  -9.604   7.588  -3.820
  357   HG22  ILE  60          2HG2      ILE  60  -9.258   6.023  -3.091
  358   HG23  ILE  60          3HG2      ILE  60  -8.578   7.506  -2.363
  359   HD11  ILE  60          3HD1      ILE  60  -7.345   9.436  -3.063
  360   HD12  ILE  60          1HD1      ILE  60  -5.679   8.925  -3.442
  361   HD13  ILE  60          2HD1      ILE  60  -6.464  10.175  -4.410
  362    H    THR  61           H        THR  61  -7.027   3.599  -3.857
  363    HA   THR  61           HA       THR  61  -8.406   2.959  -1.420
  364    HB   THR  61           HB       THR  61  -7.036   1.314  -3.562
  365    HG1  THR  61           1HG      THR  61  -9.015   2.372  -3.967
  366   HG21  THR  61          3HG2      THR  61  -8.223  -0.663  -2.610
  367   HG22  THR  61          1HG2      THR  61  -8.560   0.276  -1.135
  368   HG23  THR  61          2HG2      THR  61  -6.884  -0.124  -1.596
  369    H    ILE  62           H        ILE  62  -4.968   2.820  -2.218
  370    HA   ILE  62           HA       ILE  62  -4.367   1.673   0.472
  371    HB   ILE  62           HB       ILE  62  -3.506   0.582  -1.575
  372   HG13  ILE  62          2HG1      ILE  62  -2.515   0.240   0.630
  373   HG21  ILE  62          1HG2      ILE  62  -1.599   1.505  -2.798
  374   HG22  ILE  62          2HG2      ILE  62  -3.008   2.521  -2.970
  375   HG23  ILE  62          3HG2      ILE  62  -1.695   3.016  -1.869
  376   HD11  ILE  62          3HD1      ILE  62  -1.511  -0.841  -1.500
  377   HD12  ILE  62          1HD1      ILE  62  -0.213   0.359  -1.347
  378   HD13  ILE  62          2HD1      ILE  62  -0.504  -0.805  -0.041
  379    H    GLN  63           H        GLN  63  -3.867   4.698  -1.341
  380    HA   GLN  63           HA       GLN  63  -2.190   6.103   0.430
  381    HB3  GLN  63           2HB      GLN  63  -4.719   7.064  -0.999
  382    HG3  GLN  63           2HG      GLN  63  -2.359   8.726  -0.025
  383   HE21  GLN  63          1HE2      GLN  63  -5.793   9.740  -0.110
  384   HE22  GLN  63          2HE2      GLN  63  -5.559  10.860  -1.448
  385    H    GLU  64           H        GLU  64  -5.791   5.849   0.646
  386    HA   GLU  64           HA       GLU  64  -5.933   7.316   3.077
  387    HB3  GLU  64           2HB      GLU  64  -8.246   6.370   3.228
  388    HG3  GLU  64           2HG      GLU  64  -9.125   7.186   1.075
  389    H    ARG  65           H        ARG  65  -5.523   3.845   2.497
  390    HA   ARG  65           HA       ARG  65  -5.846   2.924   5.185
  391    HB3  ARG  65           2HB      ARG  65  -4.122   1.772   2.930
  392    HG3  ARG  65           2HG      ARG  65  -3.682   0.519   4.946
  393    HD3  ARG  65           2HD      ARG  65  -5.479   0.950   6.439
  394    HE   ARG  65           HE       ARG  65  -7.208   0.741   4.238
  395   HH11  ARG  65          1HH1      ARG  65  -7.331  -0.491   7.583
  396   HH12  ARG  65          2HH1      ARG  65  -9.057  -0.220   7.649
  397   HH21  ARG  65          1HH2      ARG  65  -9.287   0.988   4.381
  398   HH22  ARG  65          2HH2      ARG  65 -10.174   0.590   5.846
  399    H    ILE  66           H        ILE  66  -2.973   4.048   3.379
  400    HA   ILE  66           HA       ILE  66  -1.119   3.497   5.588
  401    HB   ILE  66           HB       ILE  66  -0.936   5.097   3.002
  402   HG13  ILE  66          2HG1      ILE  66  -1.072   2.453   3.086
  403   HG21  ILE  66          1HG2      ILE  66   1.294   4.469   4.988
  404   HG22  ILE  66          2HG2      ILE  66   1.503   5.210   3.400
  405   HG23  ILE  66          3HG2      ILE  66   0.634   6.091   4.642
  406   HD11  ILE  66          3HD1      ILE  66  -0.408   3.575   1.045
  407   HD12  ILE  66          1HD1      ILE  66   1.250   3.799   1.656
  408   HD13  ILE  66          2HD1      ILE  66   0.628   2.173   1.343
  409    H    ALA  67           H        ALA  67  -2.708   6.486   4.379
  410    HA   ALA  67           HA       ALA  67  -1.437   8.196   6.245
  411    HB1  ALA  67           1HB      ALA  67  -3.193   9.809   5.533
  412    HB2  ALA  67           2HB      ALA  67  -2.499   8.936   4.153
  413    HB3  ALA  67           3HB      ALA  67  -4.104   8.488   4.771
  414    H    ALA  68           H        ALA  68  -4.632   6.478   6.486
  415    HA   ALA  68           HA       ALA  68  -5.478   7.786   8.899
  416    HB1  ALA  68           1HB      ALA  68  -7.226   6.031   8.902
  417    HB2  ALA  68           2HB      ALA  68  -7.034   6.750   7.296
  418    HB3  ALA  68           3HB      ALA  68  -6.349   5.145   7.635
  419    H    LEU  69           H        LEU  69  -3.678   4.754   8.353
  420    HA   LEU  69           HA       LEU  69  -3.711   4.025  11.192
  421    HB3  LEU  69           2HB      LEU  69  -2.008   2.273  10.213
  422    HG   LEU  69           HG       LEU  69  -3.750   0.862   9.263
  423   HD11  LEU  69          1HD1      LEU  69  -3.426   1.137  11.767
  424   HD12  LEU  69          2HD1      LEU  69  -5.026   0.545  11.272
  425   HD13  LEU  69          3HD1      LEU  69  -4.813   2.236  11.759
  426   HD21  LEU  69          3HD2      LEU  69  -5.185   2.586   8.129
  427   HD22  LEU  69          1HD2      LEU  69  -5.757   3.114   9.721
  428   HD23  LEU  69          2HD2      LEU  69  -6.090   1.471   9.156
  429    H    GLY  70           H        GLY  70  -2.218   6.537   9.898
  430    HA2  GLY  70           2HA      GLY  70  -0.950   7.970  11.235
  431    HA3  GLY  70           3HA      GLY  70  -0.317   6.589  12.163
  432    H    TYR  71           H        TYR  71  -0.030   5.999   8.837
  433    HA   TYR  71           HA       TYR  71   2.870   6.699   8.886
  434    HB3  TYR  71           2HB      TYR  71   3.077   4.926   7.205
  435    HD1  TYR  71           2HD      TYR  71   4.402   4.343   9.272
  436    HD2  TYR  71           1HD      TYR  71   0.215   3.409   8.884
  437    HE1  TYR  71           2HE      TYR  71   4.588   2.748  11.162
  438    HE2  TYR  71           1HE      TYR  71   0.390   1.819  10.794
  439    HH   TYR  71           HH       TYR  71   3.484   1.251  12.490
  440    H    THR  72           H        THR  72   3.452   6.647   6.228
  441    HA   THR  72           HA       THR  72   1.893   8.754   4.859
  442    HB   THR  72           HB       THR  72   4.072  10.041   4.506
  443    HG1  THR  72           1HG      THR  72   5.621   8.662   4.964
  444   HG21  THR  72          3HG2      THR  72   3.355   9.832   7.454
  445   HG22  THR  72          1HG2      THR  72   2.451  10.784   6.254
  446   HG23  THR  72          2HG2      THR  72   4.139  11.183   6.617
  447    H    LEU  73           H        LEU  73   2.902   9.154   2.581
  448    HA   LEU  73           HA       LEU  73   4.625   7.022   1.574
  449    HB3  LEU  73           2HB      LEU  73   2.270   6.045   1.527
  450    HG   LEU  73           HG       LEU  73   1.953   7.864  -0.905
  451   HD11  LEU  73          1HD1      LEU  73  -0.118   6.646  -1.312
  452   HD12  LEU  73          2HD1      LEU  73   0.169   5.630   0.117
  453   HD13  LEU  73          3HD1      LEU  73   1.256   5.528  -1.286
  454   HD21  LEU  73          3HD2      LEU  73   1.242   9.094   1.099
  455   HD22  LEU  73          1HD2      LEU  73   0.238   7.716   1.615
  456   HD23  LEU  73          2HD2      LEU  73  -0.149   8.625   0.134
  457    H    ALA  74           H        ALA  74   5.194   7.183  -0.668
  458    HA   ALA  74           HA       ALA  74   4.351   9.662  -2.079
  459    HB1  ALA  74           1HB      ALA  74   7.187   8.530  -2.051
  460    HB2  ALA  74           2HB      ALA  74   6.606   9.857  -3.081
  461    HB3  ALA  74           3HB      ALA  74   6.660  10.061  -1.317
  462    H    GLU  75           H        GLU  75   2.986   8.844  -3.575
  463    HA   GLU  75           HA       GLU  75   4.054   6.719  -5.402
  464    HB3  GLU  75           2HB      GLU  75   1.093   7.313  -5.316
  465    HG3  GLU  75           2HG      GLU  75   0.905   4.915  -5.751
  466    HA   PRO  76           HA       PRO  76   4.066  10.871  -7.328
  467    HB3  PRO  76           2HB      PRO  76   6.331  10.993  -7.015
  468    HG3  PRO  76           2HG      PRO  76   7.718   9.057  -7.172
  469    HD3  PRO  76           2HD      PRO  76   6.053   8.539  -5.591
  Start of MODEL   22
    1    H2   PRO   6           2H       PRO   6  -6.950  -3.598 -16.822
    2    HA   PRO   6           HA       PRO   6  -9.092  -4.543 -15.072
    3    HB3  PRO   6           2HB      PRO   6  -8.842  -6.728 -15.714
    4    HG3  PRO   6           2HG      PRO   6  -9.348  -6.341 -17.959
    5    HD3  PRO   6           2HD      PRO   6  -9.740  -4.099 -17.614
    6    H    LEU   7           H        LEU   7  -7.388  -6.362 -13.617
    7    HA   LEU   7           HA       LEU   7  -5.984  -4.511 -11.958
    8    HB3  LEU   7           2HB      LEU   7  -7.262  -6.411 -11.071
    9    HG   LEU   7           HG       LEU   7  -4.959  -8.175 -12.034
   10   HD11  LEU   7          1HD1      LEU   7  -7.300  -8.776 -10.187
   11   HD12  LEU   7          2HD1      LEU   7  -5.584  -8.653  -9.738
   12   HD13  LEU   7          3HD1      LEU   7  -6.122  -9.964 -10.789
   13   HD21  LEU   7          3HD2      LEU   7  -7.926  -8.217 -12.733
   14   HD22  LEU   7          1HD2      LEU   7  -6.831  -9.588 -13.016
   15   HD23  LEU   7          2HD2      LEU   7  -6.546  -8.069 -13.854
   16    H    LYS   8           H        LYS   8  -3.861  -4.237 -11.516
   17    HA   LYS   8           HA       LYS   8  -1.745  -5.637 -13.072
   18    HB3  LYS   8           2HB      LYS   8  -0.721  -3.431 -13.594
   19    HG3  LYS   8           2HG      LYS   8  -3.541  -3.458 -14.732
   20    HD3  LYS   8           2HD      LYS   8  -2.426  -2.669 -16.779
   21    HE3  LYS   8           2HE      LYS   8  -1.670  -0.917 -14.397
   22    HZ1  LYS   8           3HZ      LYS   8  -2.236  -0.189 -17.219
   23    HZ2  LYS   8           1HZ      LYS   8  -0.737  -0.231 -16.564
   24    HZ3  LYS   8           2HZ      LYS   8  -1.836   0.864 -16.035
   25    H    THR   9           H        THR   9   0.304  -5.591 -12.062
   26    HA   THR   9           HA       THR   9   0.341  -5.152  -9.168
   27    HB   THR   9           HB       THR   9   1.420  -7.076 -10.352
   28    HG1  THR   9           1HG      THR   9   3.057  -7.086  -8.878
   29   HG21  THR   9          3HG2      THR   9   3.635  -6.846 -11.280
   30   HG22  THR   9          1HG2      THR   9   3.679  -5.107 -10.930
   31   HG23  THR   9          2HG2      THR   9   2.583  -5.737 -12.176
   32    H    GLN  10           H        GLN  10   1.807  -3.804  -8.010
   33    HA   GLN  10           HA       GLN  10   3.188  -1.587  -9.328
   34    HB3  GLN  10           2HB      GLN  10   0.754  -1.155  -7.516
   35    HG3  GLN  10           2HG      GLN  10   2.364   0.689  -7.207
   36   HE21  GLN  10          1HE2      GLN  10   1.120   1.691 -10.384
   37   HE22  GLN  10          2HE2      GLN  10   2.679   1.947 -11.119
   38    H    GLN  11           H        GLN  11   4.544  -0.422  -7.825
   39    HA   GLN  11           HA       GLN  11   4.674  -1.456  -5.045
   40    HB3  GLN  11           2HB      GLN  11   7.197  -0.982  -5.189
   41    HG3  GLN  11           2HG      GLN  11   6.361  -3.329  -6.918
   42   HE21  GLN  11          1HE2      GLN  11   8.644  -2.996  -7.794
   43   HE22  GLN  11          2HE2      GLN  11  10.011  -3.428  -6.781
   44    H    MET  12           H        MET  12   5.488   0.067  -3.510
   45    HA   MET  12           HA       MET  12   6.210   2.769  -4.320
   46    HB3  MET  12           2HB      MET  12   3.791   3.049  -4.360
   47    HG3  MET  12           2HG      MET  12   2.576   3.107  -2.146
   48    HE1  MET  12           3HE      MET  12   0.719   0.821  -4.629
   49    HE2  MET  12           1HE      MET  12   0.850   2.426  -3.890
   50    HE3  MET  12           2HE      MET  12   2.071   1.871  -5.063
   51    H    GLN  13           H        GLN  13   6.798   4.145  -2.429
   52    HA   GLN  13           HA       GLN  13   7.830   2.553  -0.135
   53    HB3  GLN  13           2HB      GLN  13   8.304   5.478  -0.797
   54    HG3  GLN  13           2HG      GLN  13   9.977   3.573   0.900
   55   HE21  GLN  13          1HE2      GLN  13  11.856   4.605  -0.294
   56   HE22  GLN  13          2HE2      GLN  13  12.344   6.208   0.275
   57    H    VAL  14           H        VAL  14   7.150   3.018   1.970
   58    HA   VAL  14           HA       VAL  14   4.794   4.834   2.294
   59    HB   VAL  14           HB       VAL  14   3.945   2.711   2.666
   60   HG11  VAL  14          1HG1      VAL  14   4.857   1.032   4.260
   61   HG12  VAL  14          2HG1      VAL  14   5.869   1.279   2.841
   62   HG13  VAL  14          3HG1      VAL  14   6.339   2.002   4.398
   63   HG21  VAL  14          3HG2      VAL  14   3.378   4.403   4.415
   64   HG22  VAL  14          1HG2      VAL  14   3.258   2.733   5.000
   65   HG23  VAL  14          2HG2      VAL  14   4.647   3.739   5.452
   66    H    GLY  15           H        GLY  15   5.016   6.478   3.602
   67    HA2  GLY  15           2HA      GLY  15   7.683   7.119   4.622
   68    HA3  GLY  15           3HA      GLY  15   6.263   8.184   4.568
   69    H    GLY  16           H        GLY  16   8.230   6.208   6.493
   70    HA2  GLY  16           2HA      GLY  16   8.376   6.457   8.825
   71    HA3  GLY  16           3HA      GLY  16   6.637   6.758   8.942
   72    H    MET  17           H        MET  17   6.609   4.095   7.003
   73    HA   MET  17           HA       MET  17   6.507   2.261   9.364
   74    HB3  MET  17           2HB      MET  17   5.363   1.706   6.619
   75    HG3  MET  17           2HG      MET  17   3.705   0.428   7.902
   76    HE1  MET  17           3HE      MET  17   6.313  -0.338   6.101
   77    HE2  MET  17           1HE      MET  17   6.407  -2.069   6.429
   78    HE3  MET  17           2HE      MET  17   4.823  -1.308   6.146
   79    H    ARG  18           H        ARG  18   8.155   0.915   9.664
   80    HA   ARG  18           HA       ARG  18   9.211  -0.749   7.561
   81    HB3  ARG  18           2HB      ARG  18  10.572   1.060   6.965
   82    HG3  ARG  18           2HG      ARG  18  11.445   1.281   9.883
   83    HD3  ARG  18           2HD      ARG  18  13.303   1.681   8.343
   84    HE   ARG  18           HE       ARG  18  11.322   3.184   6.795
   85   HH11  ARG  18          1HH1      ARG  18  14.823   2.981   7.362
   86   HH12  ARG  18          2HH1      ARG  18  15.141   3.314   5.663
   87   HH21  ARG  18          1HH2      ARG  18  11.832   3.682   4.769
   88   HH22  ARG  18          2HH2      ARG  18  13.500   3.737   4.223
   89    H    CYS  19           H        CYS  19   7.808  -1.401   9.765
   90    HA   CYS  19           HA       CYS  19   9.705  -3.245  11.097
   91    HB3  CYS  19           2HB      CYS  19   9.326  -1.426  12.708
   92    HG   CYS  19           HG       CYS  19   7.045  -0.809  13.884
   93    H    ALA  20           H        ALA  20   8.908  -5.307  11.416
   94    HA   ALA  20           HA       ALA  20   6.723  -6.230   9.802
   95    HB1  ALA  20           1HB      ALA  20   8.628  -7.644  10.446
   96    HB2  ALA  20           2HB      ALA  20   8.157  -7.543  12.158
   97    HB3  ALA  20           3HB      ALA  20   7.100  -8.359  10.994
   98    H    ALA  21           H        ALA  21   6.868  -5.216  13.188
   99    HA   ALA  21           HA       ALA  21   4.341  -5.966  14.124
  100    HB1  ALA  21           1HB      ALA  21   6.124  -4.998  15.508
  101    HB2  ALA  21           2HB      ALA  21   5.942  -3.430  14.688
  102    HB3  ALA  21           3HB      ALA  21   4.628  -4.072  15.692
  103    H    CYS  22           H        CYS  22   5.043  -3.344  11.804
  104    HA   CYS  22           HA       CYS  22   2.115  -2.705  11.835
  105    HB3  CYS  22           2HB      CYS  22   4.292  -0.767  10.991
  106    HG   CYS  22           HG       CYS  22   1.584  -0.761  10.228
  107    H    ALA  23           H        ALA  23   4.754  -3.628   9.582
  108    HA   ALA  23           HA       ALA  23   3.419  -3.392   7.142
  109    HB1  ALA  23           1HB      ALA  23   5.643  -4.357   7.473
  110    HB2  ALA  23           2HB      ALA  23   4.958  -5.719   8.385
  111    HB3  ALA  23           3HB      ALA  23   4.557  -5.527   6.669
  112    H    SER  24           H        SER  24   2.806  -5.766   9.787
  113    HA   SER  24           HA       SER  24   0.802  -7.295   8.449
  114    HB3  SER  24           2HB      SER  24   0.164  -7.980  10.755
  115    HG   SER  24           HG       SER  24   2.743  -8.105   9.713
  116    H    SER  25           H        SER  25   0.499  -4.094   9.936
  117    HA   SER  25           HA       SER  25  -2.428  -4.166  10.051
  118    HB3  SER  25           2HB      SER  25  -2.327  -2.033  10.963
  119    HG   SER  25           HG       SER  25  -0.685  -2.006  12.458
  120    H    ILE  26           H        ILE  26  -0.009  -3.392   7.691
  121    HA   ILE  26           HA       ILE  26  -2.051  -2.219   5.846
  122    HB   ILE  26           HB       ILE  26   0.914  -2.848   5.505
  123   HG13  ILE  26          2HG1      ILE  26  -0.700  -0.284   5.682
  124   HG21  ILE  26          1HG2      ILE  26  -0.155  -3.427   3.409
  125   HG22  ILE  26          2HG2      ILE  26  -1.105  -1.914   3.428
  126   HG23  ILE  26          3HG2      ILE  26   0.658  -1.889   3.222
  127   HD11  ILE  26          3HD1      ILE  26   0.560  -0.924   7.736
  128   HD12  ILE  26          1HD1      ILE  26   2.051  -1.047   6.777
  129   HD13  ILE  26          2HD1      ILE  26   1.245   0.524   6.977
  130    H    GLU  27           H        GLU  27   0.039  -5.129   6.016
  131    HA   GLU  27           HA       GLU  27  -0.959  -6.194   3.611
  132    HB3  GLU  27           2HB      GLU  27   0.087  -8.368   4.439
  133    HG3  GLU  27           2HG      GLU  27   1.868  -5.913   4.738
  134    H    ARG  28           H        ARG  28  -2.120  -6.832   6.981
  135    HA   ARG  28           HA       ARG  28  -3.753  -9.072   6.207
  136    HB3  ARG  28           2HB      ARG  28  -4.109  -7.248   8.597
  137    HG3  ARG  28           2HG      ARG  28  -4.999 -10.100   7.974
  138    HD3  ARG  28           2HD      ARG  28  -6.034 -10.003  10.276
  139    HE   ARG  28           HE       ARG  28  -3.189  -9.846  10.864
  140   HH11  ARG  28          1HH1      ARG  28  -5.625 -12.018   9.370
  141   HH12  ARG  28          2HH1      ARG  28  -4.672 -13.416   9.840
  142   HH21  ARG  28          1HH2      ARG  28  -2.011 -11.748  11.125
  143   HH22  ARG  28          2HH2      ARG  28  -2.777 -13.283  10.708
  144    H    ALA  29           H        ALA  29  -4.581  -5.603   6.655
  145    HA   ALA  29           HA       ALA  29  -7.341  -5.931   5.832
  146    HB1  ALA  29           1HB      ALA  29  -6.617  -4.087   7.293
  147    HB2  ALA  29           2HB      ALA  29  -5.551  -3.460   6.009
  148    HB3  ALA  29           3HB      ALA  29  -7.318  -3.457   5.788
  149    H    LEU  30           H        LEU  30  -4.347  -5.003   4.079
  150    HA   LEU  30           HA       LEU  30  -5.546  -3.796   1.903
  151    HB3  LEU  30           2HB      LEU  30  -2.916  -5.306   2.046
  152    HG   LEU  30           HG       LEU  30  -3.242  -4.701  -0.291
  153   HD11  LEU  30          1HD1      LEU  30  -3.580  -2.313  -0.972
  154   HD12  LEU  30          2HD1      LEU  30  -3.906  -1.897   0.724
  155   HD13  LEU  30          3HD1      LEU  30  -4.988  -2.993  -0.166
  156   HD21  LEU  30          3HD2      LEU  30  -1.510  -2.584   1.070
  157   HD22  LEU  30          1HD2      LEU  30  -1.294  -3.266  -0.555
  158   HD23  LEU  30          2HD2      LEU  30  -1.027  -4.277   0.879
  159    H    GLU  31           H        GLU  31  -5.013  -7.331   2.205
  160    HA   GLU  31           HA       GLU  31  -5.873  -7.849  -0.530
  161    HB3  GLU  31           2HB      GLU  31  -4.425  -9.437   0.647
  162    HG3  GLU  31           2HG      GLU  31  -6.836  -9.875   2.467
  163    H    ARG  32           H        ARG  32  -7.557  -7.038   2.349
  164    HA   ARG  32           HA       ARG  32 -10.105  -8.137   1.349
  165    HB3  ARG  32           2HB      ARG  32 -11.011  -7.679   3.582
  166    HG3  ARG  32           2HG      ARG  32  -8.435  -9.218   3.991
  167    HD3  ARG  32           2HD      ARG  32 -11.307  -9.645   4.897
  168    HE   ARG  32           HE       ARG  32  -9.192 -11.545   4.654
  169   HH11  ARG  32          1HH1      ARG  32 -11.845 -10.724   6.861
  170   HH12  ARG  32          2HH1      ARG  32 -11.894 -12.336   7.531
  171   HH21  ARG  32          1HH2      ARG  32  -9.334 -13.559   5.506
  172   HH22  ARG  32          2HH2      ARG  32 -10.566 -13.955   6.678
  173    H    LEU  33           H        LEU  33  -8.384  -5.137   1.417
  174    HA   LEU  33           HA       LEU  33 -10.648  -3.341   1.315
  175    HB3  LEU  33           2HB      LEU  33  -9.113  -1.817   0.109
  176    HG   LEU  33           HG       LEU  33  -7.572  -3.092   2.391
  177   HD11  LEU  33          1HD1      LEU  33  -6.507  -0.917   2.580
  178   HD12  LEU  33          2HD1      LEU  33  -7.563  -0.246   1.318
  179   HD13  LEU  33          3HD1      LEU  33  -6.355  -1.471   0.905
  180   HD21  LEU  33          3HD2      LEU  33  -8.586  -1.363   3.847
  181   HD22  LEU  33          1HD2      LEU  33  -9.793  -2.517   3.258
  182   HD23  LEU  33          2HD2      LEU  33  -9.669  -0.897   2.524
  183    H    LYS  34           H        LYS  34 -11.858  -2.563  -0.312
  184    HA   LYS  34           HA       LYS  34 -12.591  -4.452  -2.303
  185    HB3  LYS  34           2HB      LYS  34 -14.090  -2.552  -3.077
  186    HG3  LYS  34           2HG      LYS  34 -14.053  -3.196  -0.093
  187    HD3  LYS  34           2HD      LYS  34 -15.639  -1.354  -0.746
  188    HE3  LYS  34           2HE      LYS  34 -16.784  -3.637  -2.423
  189    HZ1  LYS  34           3HZ      LYS  34 -18.527  -2.564  -1.128
  190    HZ2  LYS  34           1HZ      LYS  34 -18.724  -2.247  -2.719
  191    HZ3  LYS  34           2HZ      LYS  34 -18.109  -1.085  -1.728
  192    H    GLY  35           H        GLY  35 -12.002  -4.827  -4.316
  193    HA2  GLY  35           2HA      GLY  35 -11.347  -4.342  -6.518
  194    HA3  GLY  35           3HA      GLY  35 -10.666  -2.786  -6.008
  195    H    VAL  36           H        VAL  36  -9.382  -4.783  -3.774
  196    HA   VAL  36           HA       VAL  36  -6.834  -4.971  -5.270
  197    HB   VAL  36           HB       VAL  36  -7.340  -5.352  -2.301
  198   HG11  VAL  36          1HG1      VAL  36  -4.877  -4.853  -2.120
  199   HG12  VAL  36          2HG1      VAL  36  -5.198  -6.346  -2.999
  200   HG13  VAL  36          3HG1      VAL  36  -4.770  -4.861  -3.884
  201   HG21  VAL  36          3HG2      VAL  36  -6.458  -2.841  -3.799
  202   HG22  VAL  36          1HG2      VAL  36  -7.971  -3.053  -2.892
  203   HG23  VAL  36          2HG2      VAL  36  -6.431  -3.034  -2.039
  204    H    ALA  37           H        ALA  37  -5.758  -6.848  -5.656
  205    HA   ALA  37           HA       ALA  37  -7.215  -9.422  -5.109
  206    HB1  ALA  37           1HB      ALA  37  -5.438  -8.565  -7.426
  207    HB2  ALA  37           2HB      ALA  37  -6.324 -10.100  -7.300
  208    HB3  ALA  37           3HB      ALA  37  -7.219  -8.574  -7.437
  209    H    GLU  38           H        GLU  38  -4.004  -7.951  -4.805
  210    HA   GLU  38           HA       GLU  38  -2.961 -10.203  -3.326
  211    HB3  GLU  38           2HB      GLU  38  -1.799  -9.610  -6.076
  212    HG3  GLU  38           2HG      GLU  38  -0.856 -11.547  -3.927
  213    H    ALA  39           H        ALA  39  -1.286  -9.436  -1.900
  214    HA   ALA  39           HA       ALA  39   0.302  -7.108  -2.650
  215    HB1  ALA  39           1HB      ALA  39  -1.850  -6.061  -1.915
  216    HB2  ALA  39           2HB      ALA  39  -1.651  -6.836  -0.327
  217    HB3  ALA  39           3HB      ALA  39  -0.466  -5.633  -0.901
  218    H    SER  40           H        SER  40   1.995  -6.555  -1.178
  219    HA   SER  40           HA       SER  40   2.520  -8.137   1.224
  220    HB3  SER  40           2HB      SER  40   3.006  -9.840  -0.450
  221    HG   SER  40           HG       SER  40   3.547  -8.558  -2.235
  222    H    VAL  41           H        VAL  41   4.306  -7.415   2.460
  223    HA   VAL  41           HA       VAL  41   5.367  -4.753   1.751
  224    HB   VAL  41           HB       VAL  41   4.482  -5.479   4.108
  225   HG11  VAL  41          1HG1      VAL  41   5.889  -7.562   4.174
  226   HG12  VAL  41          2HG1      VAL  41   7.318  -6.529   4.368
  227   HG13  VAL  41          3HG1      VAL  41   6.063  -6.530   5.593
  228   HG21  VAL  41          3HG2      VAL  41   5.861  -3.923   5.237
  229   HG22  VAL  41          1HG2      VAL  41   7.124  -4.007   4.010
  230   HG23  VAL  41          2HG2      VAL  41   5.537  -3.311   3.617
  231    H    THR  42           H        THR  42   7.558  -4.110   1.791
  232    HA   THR  42           HA       THR  42   9.651  -6.200   2.189
  233    HB   THR  42           HB       THR  42   9.994  -3.762   0.406
  234    HG1  THR  42           1HG      THR  42   9.292  -4.975  -1.047
  235   HG21  THR  42          3HG2      THR  42  12.156  -4.843  -0.158
  236   HG22  THR  42          1HG2      THR  42  11.845  -6.110   1.049
  237   HG23  THR  42          2HG2      THR  42  12.085  -4.420   1.556
  238    H    VAL  43           H        VAL  43   9.720  -5.777   4.370
  239    HA   VAL  43           HA       VAL  43   9.294  -3.206   5.545
  240    HB   VAL  43           HB       VAL  43  10.224  -5.880   6.545
  241   HG11  VAL  43          1HG1      VAL  43  10.342  -5.024   8.886
  242   HG12  VAL  43          2HG1      VAL  43  11.709  -4.484   7.900
  243   HG13  VAL  43          3HG1      VAL  43  10.371  -3.372   8.250
  244   HG21  VAL  43          3HG2      VAL  43   8.066  -3.905   7.427
  245   HG22  VAL  43          1HG2      VAL  43   7.828  -5.209   6.258
  246   HG23  VAL  43          2HG2      VAL  43   8.216  -5.606   7.937
  247    H    ALA  44           H        ALA  44  12.343  -4.815   4.626
  248    HA   ALA  44           HA       ALA  44  14.211  -3.550   6.154
  249    HB1  ALA  44           1HB      ALA  44  15.782  -4.080   4.296
  250    HB2  ALA  44           2HB      ALA  44  14.619  -5.396   4.543
  251    HB3  ALA  44           3HB      ALA  44  14.408  -4.279   3.191
  252    H    THR  45           H        THR  45  12.895  -2.215   3.153
  253    HA   THR  45           HA       THR  45  14.259   0.415   3.612
  254    HB   THR  45           HB       THR  45  14.055   0.634   1.078
  255    HG1  THR  45           1HG      THR  45  14.149  -2.158   0.955
  256   HG21  THR  45          3HG2      THR  45  15.907  -1.521   2.195
  257   HG22  THR  45          1HG2      THR  45  16.202   0.230   2.201
  258   HG23  THR  45          2HG2      THR  45  16.117  -0.641   0.666
  259    H    GLY  46           H        GLY  46  11.342  -0.931   4.024
  260    HA2  GLY  46           2HA      GLY  46   9.332   0.035   4.531
  261    HA3  GLY  46           3HA      GLY  46  10.029   1.621   4.172
  262    H    ARG  47           H        ARG  47   9.537  -1.230   2.054
  263    HA   ARG  47           HA       ARG  47   7.787   0.442   0.300
  264    HB3  ARG  47           2HB      ARG  47   8.518  -1.047  -1.571
  265    HG3  ARG  47           2HG      ARG  47  11.066   0.185  -0.616
  266    HD3  ARG  47           2HD      ARG  47  10.920   1.273  -2.845
  267    HE   ARG  47           HE       ARG  47  11.063  -1.566  -2.585
  268   HH11  ARG  47          1HH1      ARG  47  10.507   0.849  -5.138
  269   HH12  ARG  47          2HH1      ARG  47  11.298  -0.158  -6.333
  270   HH21  ARG  47          1HH2      ARG  47  11.955  -2.818  -4.214
  271   HH22  ARG  47          2HH2      ARG  47  11.928  -2.257  -5.861
  272    H    LEU  48           H        LEU  48   6.337  -0.706  -1.075
  273    HA   LEU  48           HA       LEU  48   5.143  -3.224   0.000
  274    HB3  LEU  48           2HB      LEU  48   2.902  -2.022  -0.721
  275    HG   LEU  48           HG       LEU  48   4.397  -1.141   1.782
  276   HD11  LEU  48          1HD1      LEU  48   2.201  -0.254   2.507
  277   HD12  LEU  48          2HD1      LEU  48   1.525  -0.682   0.909
  278   HD13  LEU  48          3HD1      LEU  48   2.770   0.579   1.047
  279   HD21  LEU  48          3HD2      LEU  48   3.670  -3.572   1.612
  280   HD22  LEU  48          1HD2      LEU  48   2.013  -3.027   1.368
  281   HD23  LEU  48          2HD2      LEU  48   2.857  -2.689   2.903
  282    H    THR  49           H        THR  49   3.811  -4.267  -1.483
  283    HA   THR  49           HA       THR  49   3.939  -3.614  -4.377
  284    HB   THR  49           HB       THR  49   4.170  -6.457  -3.302
  285    HG1  THR  49           1HG      THR  49   6.122  -5.468  -3.117
  286   HG21  THR  49          3HG2      THR  49   4.542  -7.034  -5.682
  287   HG22  THR  49          1HG2      THR  49   4.287  -5.337  -6.151
  288   HG23  THR  49          2HG2      THR  49   2.957  -6.298  -5.475
  289    H    VAL  50           H        VAL  50   1.942  -3.768  -5.265
  290    HA   VAL  50           HA       VAL  50  -0.259  -5.178  -3.888
  291    HB   VAL  50           HB       VAL  50  -0.191  -2.994  -2.756
  292   HG11  VAL  50          1HG1      VAL  50  -0.741  -1.720  -5.471
  293   HG12  VAL  50          2HG1      VAL  50  -0.693  -0.909  -3.898
  294   HG13  VAL  50          3HG1      VAL  50   0.787  -1.608  -4.569
  295   HG21  VAL  50          3HG2      VAL  50  -2.369  -4.117  -3.062
  296   HG22  VAL  50          1HG2      VAL  50  -2.537  -2.355  -3.070
  297   HG23  VAL  50          2HG2      VAL  50  -2.618  -3.249  -4.590
  298    H    THR  51           H        THR  51  -1.903  -5.777  -5.201
  299    HA   THR  51           HA       THR  51  -1.820  -5.015  -8.091
  300    HB   THR  51           HB       THR  51  -2.604  -7.681  -6.830
  301    HG1  THR  51           1HG      THR  51  -0.766  -8.232  -8.318
  302   HG21  THR  51          3HG2      THR  51  -3.974  -7.128  -8.885
  303   HG22  THR  51          1HG2      THR  51  -2.846  -8.451  -9.179
  304   HG23  THR  51          2HG2      THR  51  -2.483  -6.819  -9.781
  305    H    TYR  52           H        TYR  52  -3.414  -3.765  -8.570
  306    HA   TYR  52           HA       TYR  52  -6.192  -4.348  -7.794
  307    HB3  TYR  52           2HB      TYR  52  -5.660  -2.905  -6.034
  308    HD1  TYR  52           1HD      TYR  52  -4.505  -0.914  -9.103
  309    HD2  TYR  52           2HD      TYR  52  -4.352  -1.461  -4.821
  310    HE1  TYR  52           1HE      TYR  52  -2.816   0.869  -8.930
  311    HE2  TYR  52           2HE      TYR  52  -2.670   0.359  -4.665
  312    HH   TYR  52           HH       TYR  52  -1.639   2.239  -7.541
  313    H    ASP  53           H        ASP  53  -7.665  -2.576  -9.052
  314    HA   ASP  53           HA       ASP  53  -6.696  -2.452 -11.849
  315    HB3  ASP  53           2HB      ASP  53  -9.464  -2.121 -10.651
  316    HA   PRO  54           HA       PRO  54  -5.963   1.805 -10.407
  317    HB3  PRO  54           2HB      PRO  54  -3.737   1.337 -10.940
  318    HG3  PRO  54           2HG      PRO  54  -3.148   0.199 -12.959
  319    HD3  PRO  54           2HD      PRO  54  -4.510  -1.243 -11.725
  320    H    LYS  55           H        LYS  55  -8.118   0.924 -12.470
  321    HA   LYS  55           HA       LYS  55  -8.723   3.746 -13.226
  322    HB3  LYS  55           2HB      LYS  55  -9.753   3.053 -15.348
  323    HG3  LYS  55           2HG      LYS  55  -6.859   2.133 -15.329
  324    HD3  LYS  55           2HD      LYS  55  -8.169   2.055 -17.522
  325    HE3  LYS  55           2HE      LYS  55  -8.097   5.070 -17.039
  326    HZ1  LYS  55           3HZ      LYS  55  -8.730   3.644 -19.559
  327    HZ2  LYS  55           1HZ      LYS  55  -7.395   4.583 -19.309
  328    HZ3  LYS  55           2HZ      LYS  55  -8.879   5.263 -19.310
  329    H    GLN  56           H        GLN  56  -9.993   0.508 -12.396
  330    HA   GLN  56           HA       GLN  56 -12.653   1.699 -11.813
  331    HB3  GLN  56           2HB      GLN  56 -13.225  -0.492 -10.901
  332    HG3  GLN  56           2HG      GLN  56 -13.187  -1.860 -12.837
  333   HE21  GLN  56          1HE2      GLN  56 -15.012   0.153 -12.494
  334   HE22  GLN  56          2HE2      GLN  56 -15.167   1.088 -13.971
  335    H    VAL  57           H        VAL  57  -9.653   1.149  -9.995
  336    HA   VAL  57           HA       VAL  57 -10.790   2.971  -7.965
  337    HB   VAL  57           HB       VAL  57  -9.604   1.890  -6.123
  338   HG11  VAL  57          1HG1      VAL  57 -11.594  -0.009  -7.438
  339   HG12  VAL  57          2HG1      VAL  57 -11.143   0.030  -5.730
  340   HG13  VAL  57          3HG1      VAL  57 -11.997   1.410  -6.444
  341   HG21  VAL  57          3HG2      VAL  57  -9.155  -0.508  -7.969
  342   HG22  VAL  57          1HG2      VAL  57  -7.879   0.598  -7.414
  343   HG23  VAL  57          2HG2      VAL  57  -8.754  -0.401  -6.247
  344    H    SER  58           H        SER  58  -8.338   3.350  -6.494
  345    HA   SER  58           HA       SER  58  -6.141   3.619  -8.411
  346    HB3  SER  58           2HB      SER  58  -7.668   5.689  -8.679
  347    HG   SER  58           HG       SER  58  -7.661   7.165  -7.104
  348    H    GLU  59           H        GLU  59  -4.300   4.892  -7.196
  349    HA   GLU  59           HA       GLU  59  -3.414   3.654  -4.888
  350    HB3  GLU  59           2HB      GLU  59  -2.037   5.033  -6.370
  351    HG3  GLU  59           2HG      GLU  59  -3.061   7.494  -4.900
  352    H    ILE  60           H        ILE  60  -5.947   6.038  -5.021
  353    HA   ILE  60           HA       ILE  60  -6.036   6.982  -2.325
  354    HB   ILE  60           HB       ILE  60  -8.030   6.488  -4.530
  355   HG13  ILE  60          2HG1      ILE  60  -8.284   8.890  -4.549
  356   HG21  ILE  60          1HG2      ILE  60  -9.421   5.925  -2.766
  357   HG22  ILE  60          2HG2      ILE  60  -8.848   7.289  -1.753
  358   HG23  ILE  60          3HG2      ILE  60  -9.818   7.575  -3.221
  359   HD11  ILE  60          3HD1      ILE  60  -6.951  10.428  -3.239
  360   HD12  ILE  60          1HD1      ILE  60  -7.928   9.451  -2.136
  361   HD13  ILE  60          2HD1      ILE  60  -6.194   9.111  -2.342
  362    H    THR  61           H        THR  61  -7.188   3.854  -3.638
  363    HA   THR  61           HA       THR  61  -8.661   3.037  -1.313
  364    HB   THR  61           HB       THR  61  -7.316   1.480  -3.541
  365    HG1  THR  61           1HG      THR  61  -9.178   2.772  -3.992
  366   HG21  THR  61          3HG2      THR  61  -7.460  -0.082  -1.641
  367   HG22  THR  61          1HG2      THR  61  -8.731  -0.441  -2.812
  368   HG23  THR  61          2HG2      THR  61  -9.132   0.435  -1.315
  369    H    ILE  62           H        ILE  62  -5.266   2.476  -2.147
  370    HA   ILE  62           HA       ILE  62  -4.671   1.198   0.457
  371    HB   ILE  62           HB       ILE  62  -3.663   0.374  -1.603
  372   HG13  ILE  62          2HG1      ILE  62  -2.504   0.193   0.611
  373   HG21  ILE  62          1HG2      ILE  62  -3.490   2.404  -2.940
  374   HG22  ILE  62          2HG2      ILE  62  -2.274   3.079  -1.829
  375   HG23  ILE  62          3HG2      ILE  62  -1.908   1.656  -2.818
  376   HD11  ILE  62          3HD1      ILE  62  -1.588  -0.951  -1.478
  377   HD12  ILE  62          1HD1      ILE  62  -0.447   0.409  -1.629
  378   HD13  ILE  62          2HD1      ILE  62  -0.425  -0.637  -0.193
  379    H    GLN  63           H        GLN  63  -4.243   4.426  -0.988
  380    HA   GLN  63           HA       GLN  63  -2.580   5.532   0.998
  381    HB3  GLN  63           2HB      GLN  63  -4.823   6.994  -0.457
  382    HG3  GLN  63           2HG      GLN  63  -2.093   7.905   0.560
  383   HE21  GLN  63          1HE2      GLN  63  -4.863  10.057   0.179
  384   HE22  GLN  63          2HE2      GLN  63  -4.247  10.851  -1.262
  385    H    GLU  64           H        GLU  64  -6.233   5.565   0.964
  386    HA   GLU  64           HA       GLU  64  -6.342   6.952   3.470
  387    HB3  GLU  64           2HB      GLU  64  -8.730   6.107   3.533
  388    HG3  GLU  64           2HG      GLU  64  -8.035   7.342   0.853
  389    H    ARG  65           H        ARG  65  -5.587   3.602   2.998
  390    HA   ARG  65           HA       ARG  65  -6.298   2.914   5.796
  391    HB3  ARG  65           2HB      ARG  65  -4.516   1.224   4.029
  392    HG3  ARG  65           2HG      ARG  65  -5.824  -0.635   4.985
  393    HD3  ARG  65           2HD      ARG  65  -4.939   1.182   7.255
  394    HE   ARG  65           HE       ARG  65  -4.502  -1.685   7.456
  395   HH11  ARG  65          1HH1      ARG  65  -6.819   0.854   8.445
  396   HH12  ARG  65          2HH1      ARG  65  -6.958   0.147  10.024
  397   HH21  ARG  65          1HH2      ARG  65  -4.986  -2.642   9.317
  398   HH22  ARG  65          2HH2      ARG  65  -5.870  -1.764  10.542
  399    H    ILE  66           H        ILE  66  -3.381   3.610   3.837
  400    HA   ILE  66           HA       ILE  66  -1.527   3.294   6.081
  401    HB   ILE  66           HB       ILE  66  -1.271   4.385   3.251
  402   HG13  ILE  66          2HG1      ILE  66  -1.790   1.909   3.617
  403   HG21  ILE  66          1HG2      ILE  66   1.177   4.255   3.552
  404   HG22  ILE  66          2HG2      ILE  66   0.483   5.429   4.652
  405   HG23  ILE  66          3HG2      ILE  66   0.952   3.814   5.259
  406   HD11  ILE  66          3HD1      ILE  66  -0.447   2.683   1.647
  407   HD12  ILE  66          1HD1      ILE  66   1.021   2.207   2.542
  408   HD13  ILE  66          2HD1      ILE  66  -0.215   0.996   2.142
  409    H    ALA  67           H        ALA  67  -2.984   6.135   4.521
  410    HA   ALA  67           HA       ALA  67  -1.792   8.168   6.104
  411    HB1  ALA  67           1HB      ALA  67  -3.718   9.480   5.252
  412    HB2  ALA  67           2HB      ALA  67  -2.990   8.504   3.966
  413    HB3  ALA  67           3HB      ALA  67  -4.517   7.994   4.724
  414    H    ALA  68           H        ALA  68  -4.323   5.846   6.909
  415    HA   ALA  68           HA       ALA  68  -5.307   7.392   9.227
  416    HB1  ALA  68           1HB      ALA  68  -6.048   4.627   8.187
  417    HB2  ALA  68           2HB      ALA  68  -6.889   5.563   9.442
  418    HB3  ALA  68           3HB      ALA  68  -6.858   6.153   7.771
  419    H    LEU  69           H        LEU  69  -3.507   4.343   8.657
  420    HA   LEU  69           HA       LEU  69  -2.940   3.544  11.305
  421    HB3  LEU  69           2HB      LEU  69  -0.839   2.574  10.212
  422    HG   LEU  69           HG       LEU  69  -3.531   1.974   8.925
  423   HD11  LEU  69          1HD1      LEU  69  -1.670   1.315   7.448
  424   HD12  LEU  69          2HD1      LEU  69  -2.395  -0.124   8.182
  425   HD13  LEU  69          3HD1      LEU  69  -0.863   0.506   8.811
  426   HD21  LEU  69          3HD2      LEU  69  -1.967   0.555  11.125
  427   HD22  LEU  69          1HD2      LEU  69  -3.462  -0.036  10.376
  428   HD23  LEU  69          2HD2      LEU  69  -3.492   1.441  11.336
  429    H    GLY  70           H        GLY  70  -1.585   6.276   9.612
  430    HA2  GLY  70           2HA      GLY  70  -0.799   8.051  11.154
  431    HA3  GLY  70           3HA      GLY  70   0.264   6.852  11.914
  432    H    TYR  71           H        TYR  71   0.052   6.651   8.438
  433    HA   TYR  71           HA       TYR  71   2.813   7.805   8.246
  434    HB3  TYR  71           2HB      TYR  71   3.193   5.994   6.618
  435    HD1  TYR  71           1HD      TYR  71   4.421   6.168   9.058
  436    HD2  TYR  71           2HD      TYR  71   1.016   3.709   8.118
  437    HE1  TYR  71           1HE      TYR  71   4.947   4.705  11.006
  438    HE2  TYR  71           2HE      TYR  71   1.520   2.262  10.061
  439    HH   TYR  71           HH       TYR  71   2.943   1.862  11.827
  440    H    THR  72           H        THR  72   3.289   7.796   5.647
  441    HA   THR  72           HA       THR  72   1.087   9.114   4.151
  442    HB   THR  72           HB       THR  72   2.748  10.596   3.024
  443    HG1  THR  72           1HG      THR  72   4.539  10.192   5.143
  444   HG21  THR  72          3HG2      THR  72   1.393  11.496   4.885
  445   HG22  THR  72          1HG2      THR  72   2.986  12.260   4.774
  446   HG23  THR  72          2HG2      THR  72   2.671  11.052   6.036
  447    H    LEU  73           H        LEU  73   1.673   9.044   1.704
  448    HA   LEU  73           HA       LEU  73   3.021   6.433   1.100
  449    HB3  LEU  73           2HB      LEU  73   0.700   7.645  -0.449
  450    HG   LEU  73           HG       LEU  73   1.900   5.684  -1.509
  451   HD11  LEU  73          1HD1      LEU  73   2.670   4.382   0.357
  452   HD12  LEU  73          2HD1      LEU  73   1.368   3.415  -0.350
  453   HD13  LEU  73          3HD1      LEU  73   1.063   4.369   1.106
  454   HD21  LEU  73          3HD2      LEU  73  -0.509   6.141  -1.923
  455   HD22  LEU  73          1HD2      LEU  73  -0.931   5.084  -0.557
  456   HD23  LEU  73          2HD2      LEU  73  -0.128   4.414  -1.992
  457    H    ALA  74           H        ALA  74   4.308   6.244  -0.732
  458    HA   ALA  74           HA       ALA  74   4.572   8.594  -2.554
  459    HB1  ALA  74           1HB      ALA  74   7.035   8.413  -2.327
  460    HB2  ALA  74           2HB      ALA  74   6.245   8.826  -0.789
  461    HB3  ALA  74           3HB      ALA  74   6.818   7.175  -1.072
  462    H    GLU  75           H        GLU  75   3.287   7.247  -3.984
  463    HA   GLU  75           HA       GLU  75   4.784   5.197  -5.504
  464    HB3  GLU  75           2HB      GLU  75   2.151   6.510  -6.264
  465    HG3  GLU  75           2HG      GLU  75   1.656   4.192  -7.094
  466    HA   PRO  76           HA       PRO  76   6.791   8.909  -6.373
  467    HB3  PRO  76           2HB      PRO  76   8.651   7.622  -5.919
  468    HG3  PRO  76           2HG      PRO  76   8.980   5.492  -6.973
  469    HD3  PRO  76           2HD      PRO  76   6.914   5.436  -5.840
  Start of MODEL   23
    1    H2   PRO   6           2H       PRO   6  -6.951  -3.125 -16.777
    2    HA   PRO   6           HA       PRO   6  -8.804  -4.927 -15.374
    3    HB3  PRO   6           2HB      PRO   6  -7.973  -6.769 -16.527
    4    HG3  PRO   6           2HG      PRO   6  -8.786  -5.940 -18.533
    5    HD3  PRO   6           2HD      PRO   6  -9.636  -3.989 -17.625
    6    H    LEU   7           H        LEU   7  -7.164  -6.570 -13.977
    7    HA   LEU   7           HA       LEU   7  -5.909  -4.733 -12.179
    8    HB3  LEU   7           2HB      LEU   7  -7.239  -6.580 -11.413
    9    HG   LEU   7           HG       LEU   7  -6.136  -8.302 -13.185
   10   HD11  LEU   7          1HD1      LEU   7  -4.604  -8.852 -10.611
   11   HD12  LEU   7          2HD1      LEU   7  -3.860  -8.193 -12.084
   12   HD13  LEU   7          3HD1      LEU   7  -4.562  -9.820 -12.091
   13   HD21  LEU   7          3HD2      LEU   7  -8.107  -8.754 -11.784
   14   HD22  LEU   7          1HD2      LEU   7  -7.065  -9.038 -10.373
   15   HD23  LEU   7          2HD2      LEU   7  -7.006 -10.141 -11.770
   16    H    LYS   8           H        LYS   8  -3.845  -4.566 -11.516
   17    HA   LYS   8           HA       LYS   8  -1.604  -5.605 -13.125
   18    HB3  LYS   8           2HB      LYS   8  -2.397  -3.848 -14.579
   19    HG3  LYS   8           2HG      LYS   8  -2.810  -2.275 -12.043
   20    HD3  LYS   8           2HD      LYS   8  -2.949  -0.201 -13.401
   21    HE3  LYS   8           2HE      LYS   8  -0.102  -1.296 -13.337
   22    HZ1  LYS   8           3HZ      LYS   8  -1.280   1.359 -12.717
   23    HZ2  LYS   8           1HZ      LYS   8  -0.303   1.032 -14.010
   24    HZ3  LYS   8           2HZ      LYS   8   0.287   0.946 -12.491
   25    H    THR   9           H        THR   9   0.467  -5.140 -12.312
   26    HA   THR   9           HA       THR   9   0.587  -4.751  -9.431
   27    HB   THR   9           HB       THR   9   2.913  -4.930 -11.373
   28    HG1  THR   9           1HG      THR   9   2.803  -7.089 -11.123
   29   HG21  THR   9          3HG2      THR   9   3.936  -6.128  -9.360
   30   HG22  THR   9          1HG2      THR   9   2.537  -5.591  -8.414
   31   HG23  THR   9          2HG2      THR   9   3.661  -4.401  -9.127
   32    H    GLN  10           H        GLN  10   1.619  -3.094  -8.293
   33    HA   GLN  10           HA       GLN  10   2.858  -0.853  -9.704
   34    HB3  GLN  10           2HB      GLN  10   0.806  -0.271  -7.546
   35    HG3  GLN  10           2HG      GLN  10   2.475   1.516  -8.302
   36   HE21  GLN  10          1HE2      GLN  10   2.234   3.590  -9.983
   37   HE22  GLN  10          2HE2      GLN  10   2.096   3.057 -11.658
   38    H    GLN  11           H        GLN  11   4.518   0.054  -8.430
   39    HA   GLN  11           HA       GLN  11   4.802  -0.894  -5.627
   40    HB3  GLN  11           2HB      GLN  11   7.014  -0.478  -7.679
   41    HG3  GLN  11           2HG      GLN  11   7.134  -1.698  -4.887
   42   HE21  GLN  11          1HE2      GLN  11   9.120  -2.611  -4.231
   43   HE22  GLN  11          2HE2      GLN  11  10.427  -2.910  -5.366
   44    H    MET  12           H        MET  12   5.610   0.576  -4.105
   45    HA   MET  12           HA       MET  12   6.127   3.381  -4.893
   46    HB3  MET  12           2HB      MET  12   3.722   3.350  -4.603
   47    HG3  MET  12           2HG      MET  12   2.915   2.890  -2.129
   48    HE1  MET  12           3HE      MET  12   1.815   2.412  -5.190
   49    HE2  MET  12           1HE      MET  12   0.620   1.170  -4.791
   50    HE3  MET  12           2HE      MET  12   0.840   2.554  -3.703
   51    H    GLN  13           H        GLN  13   6.775   4.707  -3.062
   52    HA   GLN  13           HA       GLN  13   8.230   3.273  -0.912
   53    HB3  GLN  13           2HB      GLN  13   8.672   5.709  -0.180
   54    HG3  GLN  13           2HG      GLN  13   9.782   4.975  -2.917
   55   HE21  GLN  13          1HE2      GLN  13   9.694   7.408  -3.304
   56   HE22  GLN  13          2HE2      GLN  13  10.836   8.432  -2.415
   57    H    VAL  14           H        VAL  14   7.520   3.380   1.232
   58    HA   VAL  14           HA       VAL  14   4.984   4.788   1.856
   59    HB   VAL  14           HB       VAL  14   5.461   1.794   2.021
   60   HG11  VAL  14          1HG1      VAL  14   3.347   1.642   3.356
   61   HG12  VAL  14          2HG1      VAL  14   4.622   2.460   4.263
   62   HG13  VAL  14          3HG1      VAL  14   3.338   3.414   3.509
   63   HG21  VAL  14          3HG2      VAL  14   3.274   3.513   0.830
   64   HG22  VAL  14          1HG2      VAL  14   4.457   2.490  -0.005
   65   HG23  VAL  14          2HG2      VAL  14   3.203   1.739   0.974
   66    H    GLY  15           H        GLY  15   5.527   6.092   3.383
   67    HA2  GLY  15           2HA      GLY  15   8.109   5.836   4.726
   68    HA3  GLY  15           3HA      GLY  15   7.034   7.247   4.729
   69    H    GLY  16           H        GLY  16   8.490   5.248   6.699
   70    HA2  GLY  16           2HA      GLY  16   8.268   5.235   9.056
   71    HA3  GLY  16           3HA      GLY  16   6.532   5.589   8.910
   72    H    MET  17           H        MET  17   6.994   3.180   6.720
   73    HA   MET  17           HA       MET  17   5.813   1.168   8.419
   74    HB3  MET  17           2HB      MET  17   6.853   1.101   5.563
   75    HG3  MET  17           2HG      MET  17   5.348  -0.998   7.168
   76    HE1  MET  17           3HE      MET  17   5.705  -1.190   2.566
   77    HE2  MET  17           1HE      MET  17   6.356   0.171   3.496
   78    HE3  MET  17           2HE      MET  17   7.056  -1.456   3.686
   79    H    ARG  18           H        ARG  18   6.816   0.021   9.866
   80    HA   ARG  18           HA       ARG  18   9.463  -1.209   9.308
   81    HB3  ARG  18           2HB      ARG  18  10.100  -0.766  11.666
   82    HG3  ARG  18           2HG      ARG  18   9.395   1.820  10.220
   83    HD3  ARG  18           2HD      ARG  18  11.534   2.617  11.200
   84    HE   ARG  18           HE       ARG  18  10.210   1.708  13.624
   85   HH11  ARG  18          1HH1      ARG  18   9.818   4.075  10.990
   86   HH12  ARG  18          2HH1      ARG  18   8.695   5.028  11.941
   87   HH21  ARG  18          1HH2      ARG  18   9.048   3.112  14.834
   88   HH22  ARG  18          2HH2      ARG  18   8.465   4.612  14.163
   89    H    CYS  19           H        CYS  19   9.869  -2.849  11.246
   90    HA   CYS  19           HA       CYS  19   8.241  -5.044  10.587
   91    HB3  CYS  19           2HB      CYS  19  10.176  -4.669  12.923
   92    HG   CYS  19           HG       CYS  19   9.606  -7.392  11.122
   93    H    ALA  20           H        ALA  20   8.261  -3.279  13.704
   94    HA   ALA  20           HA       ALA  20   7.141  -5.180  15.245
   95    HB1  ALA  20           1HB      ALA  20   6.739  -2.173  15.543
   96    HB2  ALA  20           2HB      ALA  20   6.626  -3.372  16.849
   97    HB3  ALA  20           3HB      ALA  20   8.174  -3.094  16.031
   98    H    ALA  21           H        ALA  21   5.077  -2.811  13.519
   99    HA   ALA  21           HA       ALA  21   2.752  -4.648  13.859
  100    HB1  ALA  21           1HB      ALA  21   2.765  -1.715  14.725
  101    HB2  ALA  21           2HB      ALA  21   1.357  -2.799  14.728
  102    HB3  ALA  21           3HB      ALA  21   2.721  -3.115  15.817
  103    H    CYS  22           H        CYS  22   4.056  -1.736  12.213
  104    HA   CYS  22           HA       CYS  22   1.877  -1.188  10.550
  105    HB3  CYS  22           2HB      CYS  22   4.850  -0.959   9.860
  106    HG   CYS  22           HG       CYS  22   2.423   1.165   9.146
  107    H    ALA  23           H        ALA  23   4.625  -3.296   9.663
  108    HA   ALA  23           HA       ALA  23   3.793  -4.343   7.270
  109    HB1  ALA  23           1HB      ALA  23   5.163  -5.724   9.637
  110    HB2  ALA  23           2HB      ALA  23   5.243  -6.272   7.955
  111    HB3  ALA  23           3HB      ALA  23   5.955  -4.711   8.413
  112    H    SER  24           H        SER  24   2.135  -4.930  10.298
  113    HA   SER  24           HA       SER  24   0.612  -7.249   9.119
  114    HB3  SER  24           2HB      SER  24  -0.244  -7.590  11.371
  115    HG   SER  24           HG       SER  24   2.596  -7.286  11.521
  116    H    SER  25           H        SER  25   0.087  -4.101  10.837
  117    HA   SER  25           HA       SER  25  -2.727  -4.145  10.503
  118    HB3  SER  25           2HB      SER  25  -2.726  -1.901  11.340
  119    HG   SER  25           HG       SER  25  -1.039  -2.059  13.032
  120    H    ILE  26           H        ILE  26  -0.236  -2.970   8.314
  121    HA   ILE  26           HA       ILE  26  -2.212  -1.916   6.360
  122    HB   ILE  26           HB       ILE  26   0.787  -2.285   6.378
  123   HG13  ILE  26          2HG1      ILE  26  -0.929   0.074   5.481
  124   HG21  ILE  26          1HG2      ILE  26   0.878  -1.576   4.003
  125   HG22  ILE  26          2HG2      ILE  26   0.252  -3.202   4.199
  126   HG23  ILE  26          3HG2      ILE  26  -0.871  -1.859   3.861
  127   HD11  ILE  26          3HD1      ILE  26  -0.039   1.249   7.488
  128   HD12  ILE  26          1HD1      ILE  26  -1.242   0.001   7.880
  129   HD13  ILE  26          2HD1      ILE  26   0.492  -0.323   8.137
  130    H    GLU  27           H        GLU  27  -0.099  -4.834   6.563
  131    HA   GLU  27           HA       GLU  27  -1.021  -5.702   4.025
  132    HB3  GLU  27           2HB      GLU  27   0.370  -7.476   6.056
  133    HG3  GLU  27           2HG      GLU  27   0.571  -7.194   3.017
  134    H    ARG  28           H        ARG  28  -2.109  -6.663   7.315
  135    HA   ARG  28           HA       ARG  28  -3.652  -8.915   6.431
  136    HB3  ARG  28           2HB      ARG  28  -4.160  -7.149   8.862
  137    HG3  ARG  28           2HG      ARG  28  -4.708 -10.102   8.288
  138    HD3  ARG  28           2HD      ARG  28  -5.402  -8.407  10.717
  139    HE   ARG  28           HE       ARG  28  -6.271 -11.083   9.813
  140   HH11  ARG  28          1HH1      ARG  28  -6.361  -8.824  12.568
  141   HH12  ARG  28          2HH1      ARG  28  -7.377  -9.938  13.465
  142   HH21  ARG  28          1HH2      ARG  28  -7.647 -12.255  10.946
  143   HH22  ARG  28          2HH2      ARG  28  -8.153 -11.775  12.561
  144    H    ALA  29           H        ALA  29  -4.451  -5.447   6.608
  145    HA   ALA  29           HA       ALA  29  -7.259  -5.895   5.790
  146    HB1  ALA  29           1HB      ALA  29  -6.798  -4.073   7.331
  147    HB2  ALA  29           2HB      ALA  29  -5.612  -3.370   6.195
  148    HB3  ALA  29           3HB      ALA  29  -7.341  -3.419   5.775
  149    H    LEU  30           H        LEU  30  -4.177  -5.161   4.171
  150    HA   LEU  30           HA       LEU  30  -5.173  -3.837   1.948
  151    HB3  LEU  30           2HB      LEU  30  -2.781  -5.704   2.061
  152    HG   LEU  30           HG       LEU  30  -2.999  -4.967  -0.230
  153   HD11  LEU  30          1HD1      LEU  30  -4.571  -3.114  -0.088
  154   HD12  LEU  30          2HD1      LEU  30  -3.093  -2.537  -0.843
  155   HD13  LEU  30          3HD1      LEU  30  -3.419  -2.148   0.863
  156   HD21  LEU  30          3HD2      LEU  30  -1.069  -3.126   1.261
  157   HD22  LEU  30          1HD2      LEU  30  -0.962  -3.589  -0.446
  158   HD23  LEU  30          2HD2      LEU  30  -0.745  -4.817   0.819
  159    H    GLU  31           H        GLU  31  -5.301  -7.311   2.493
  160    HA   GLU  31           HA       GLU  31  -6.236  -7.945  -0.207
  161    HB3  GLU  31           2HB      GLU  31  -4.950  -9.592   0.984
  162    HG3  GLU  31           2HG      GLU  31  -7.166  -9.627   3.086
  163    H    ARG  32           H        ARG  32  -7.753  -6.497   2.451
  164    HA   ARG  32           HA       ARG  32 -10.442  -7.525   1.746
  165    HB3  ARG  32           2HB      ARG  32 -11.189  -6.432   3.831
  166    HG3  ARG  32           2HG      ARG  32 -10.071  -7.745   5.519
  167    HD3  ARG  32           2HD      ARG  32 -10.079  -9.422   2.988
  168    HE   ARG  32           HE       ARG  32 -10.144 -10.077   5.811
  169   HH11  ARG  32          1HH1      ARG  32 -11.169 -11.230   2.614
  170   HH12  ARG  32          2HH1      ARG  32 -11.247 -12.874   3.168
  171   HH21  ARG  32          1HH2      ARG  32 -10.426 -12.211   6.446
  172   HH22  ARG  32          2HH2      ARG  32 -11.109 -13.381   5.319
  173    H    LEU  33           H        LEU  33  -8.410  -4.750   1.299
  174    HA   LEU  33           HA       LEU  33 -10.438  -2.747   1.030
  175    HB3  LEU  33           2HB      LEU  33  -8.786  -1.407  -0.070
  176    HG   LEU  33           HG       LEU  33  -7.151  -3.083   1.835
  177   HD11  LEU  33          1HD1      LEU  33  -6.978  -0.132   1.161
  178   HD12  LEU  33          2HD1      LEU  33  -6.008  -1.382   0.373
  179   HD13  LEU  33          3HD1      LEU  33  -5.824  -1.099   2.110
  180   HD21  LEU  33          3HD2      LEU  33  -9.059  -0.822   2.533
  181   HD22  LEU  33          1HD2      LEU  33  -7.821  -1.476   3.630
  182   HD23  LEU  33          2HD2      LEU  33  -9.152  -2.504   3.090
  183    H    LYS  34           H        LYS  34 -11.391  -1.797  -0.725
  184    HA   LYS  34           HA       LYS  34 -12.572  -3.368  -2.667
  185    HB3  LYS  34           2HB      LYS  34 -11.901  -0.396  -2.781
  186    HG3  LYS  34           2HG      LYS  34 -14.186  -1.935  -4.088
  187    HD3  LYS  34           2HD      LYS  34 -13.406   1.006  -4.182
  188    HE3  LYS  34           2HE      LYS  34 -15.397  -0.637  -5.817
  189    HZ1  LYS  34           3HZ      LYS  34 -16.299   1.511  -5.336
  190    HZ2  LYS  34           1HZ      LYS  34 -15.813   1.491  -6.908
  191    HZ3  LYS  34           2HZ      LYS  34 -14.897   2.277  -5.800
  192    H    GLY  35           H        GLY  35 -11.913  -4.389  -4.464
  193    HA2  GLY  35           2HA      GLY  35 -11.054  -4.657  -6.579
  194    HA3  GLY  35           3HA      GLY  35 -10.338  -3.032  -6.469
  195    H    VAL  36           H        VAL  36  -8.984  -4.505  -3.858
  196    HA   VAL  36           HA       VAL  36  -6.486  -4.922  -5.303
  197    HB   VAL  36           HB       VAL  36  -7.086  -5.294  -2.349
  198   HG11  VAL  36          1HG1      VAL  36  -4.434  -5.140  -3.871
  199   HG12  VAL  36          2HG1      VAL  36  -4.575  -5.050  -2.111
  200   HG13  VAL  36          3HG1      VAL  36  -5.045  -6.532  -2.947
  201   HG21  VAL  36          3HG2      VAL  36  -5.867  -2.940  -3.873
  202   HG22  VAL  36          1HG2      VAL  36  -7.435  -2.954  -3.036
  203   HG23  VAL  36          2HG2      VAL  36  -5.941  -3.081  -2.106
  204    H    ALA  37           H        ALA  37  -5.586  -6.727  -5.935
  205    HA   ALA  37           HA       ALA  37  -6.996  -9.328  -5.542
  206    HB1  ALA  37           1HB      ALA  37  -5.009  -8.366  -7.651
  207    HB2  ALA  37           2HB      ALA  37  -5.861  -9.922  -7.655
  208    HB3  ALA  37           3HB      ALA  37  -6.777  -8.414  -7.826
  209    H    GLU  38           H        GLU  38  -3.702  -7.933  -5.215
  210    HA   GLU  38           HA       GLU  38  -2.929  -9.726  -3.224
  211    HB3  GLU  38           2HB      GLU  38  -2.784 -11.570  -4.671
  212    HG3  GLU  38           2HG      GLU  38  -1.068  -9.900  -6.556
  213    H    ALA  39           H        ALA  39  -1.097  -9.184  -2.153
  214    HA   ALA  39           HA       ALA  39   0.776  -7.161  -3.193
  215    HB1  ALA  39           1HB      ALA  39  -1.270  -6.492  -1.031
  216    HB2  ALA  39           2HB      ALA  39  -0.043  -5.402  -1.728
  217    HB3  ALA  39           3HB      ALA  39  -1.404  -5.975  -2.719
  218    H    SER  40           H        SER  40   2.452  -6.596  -1.682
  219    HA   SER  40           HA       SER  40   2.529  -7.953   0.929
  220    HB3  SER  40           2HB      SER  40   4.681  -9.065   0.537
  221    HG   SER  40           HG       SER  40   3.012 -10.471   0.199
  222    H    VAL  41           H        VAL  41   3.824  -6.956   2.417
  223    HA   VAL  41           HA       VAL  41   5.029  -4.369   1.718
  224    HB   VAL  41           HB       VAL  41   5.458  -4.073   4.094
  225   HG11  VAL  41          1HG1      VAL  41   3.179  -3.629   3.253
  226   HG12  VAL  41          2HG1      VAL  41   2.699  -5.289   3.652
  227   HG13  VAL  41          3HG1      VAL  41   3.166  -4.163   4.940
  228   HG21  VAL  41          3HG2      VAL  41   6.223  -6.222   4.825
  229   HG22  VAL  41          1HG2      VAL  41   4.797  -5.777   5.761
  230   HG23  VAL  41          2HG2      VAL  41   4.660  -6.975   4.473
  231    H    THR  42           H        THR  42   7.182  -3.707   1.951
  232    HA   THR  42           HA       THR  42   9.260  -5.792   2.537
  233    HB   THR  42           HB       THR  42   9.369  -3.570   0.460
  234    HG1  THR  42           1HG      THR  42   8.419  -5.347  -0.322
  235   HG21  THR  42          3HG2      THR  42  11.634  -4.529  -0.048
  236   HG22  THR  42          1HG2      THR  42  11.552  -5.434   1.482
  237   HG23  THR  42          2HG2      THR  42  11.568  -3.660   1.486
  238    H    VAL  43           H        VAL  43   9.339  -5.302   4.681
  239    HA   VAL  43           HA       VAL  43   9.425  -2.670   5.793
  240    HB   VAL  43           HB       VAL  43  10.240  -5.407   6.778
  241   HG11  VAL  43          1HG1      VAL  43  10.528  -4.483   9.062
  242   HG12  VAL  43          2HG1      VAL  43  11.829  -4.022   7.970
  243   HG13  VAL  43          3HG1      VAL  43  10.560  -2.844   8.370
  244   HG21  VAL  43          3HG2      VAL  43   7.829  -4.782   6.597
  245   HG22  VAL  43          1HG2      VAL  43   8.312  -5.006   8.286
  246   HG23  VAL  43          2HG2      VAL  43   8.125  -3.366   7.626
  247    H    ALA  44           H        ALA  44  12.005  -4.740   4.505
  248    HA   ALA  44           HA       ALA  44  14.327  -3.744   5.508
  249    HB1  ALA  44           1HB      ALA  44  14.100  -5.602   3.891
  250    HB2  ALA  44           2HB      ALA  44  13.702  -4.452   2.594
  251    HB3  ALA  44           3HB      ALA  44  15.312  -4.436   3.326
  252    H    THR  45           H        THR  45  12.437  -2.099   2.995
  253    HA   THR  45           HA       THR  45  14.218   0.313   3.096
  254    HB   THR  45           HB       THR  45  13.689   0.503   0.632
  255    HG1  THR  45           1HG      THR  45  13.086  -1.690  -0.221
  256   HG21  THR  45          3HG2      THR  45  15.843  -0.473   1.505
  257   HG22  THR  45          1HG2      THR  45  15.352  -1.066  -0.086
  258   HG23  THR  45          2HG2      THR  45  15.120  -2.091   1.344
  259    H    GLY  46           H        GLY  46  11.130  -0.716   3.826
  260    HA2  GLY  46           2HA      GLY  46   9.121   0.360   4.147
  261    HA3  GLY  46           3HA      GLY  46   9.956   1.912   3.961
  262    H    ARG  47           H        ARG  47   9.348  -0.886   1.802
  263    HA   ARG  47           HA       ARG  47   8.019   0.905  -0.181
  264    HB3  ARG  47           2HB      ARG  47   9.153  -0.242  -2.018
  265    HG3  ARG  47           2HG      ARG  47  11.149   0.839   0.004
  266    HD3  ARG  47           2HD      ARG  47  11.976  -0.496  -2.114
  267    HE   ARG  47           HE       ARG  47  11.235   0.593  -4.039
  268   HH11  ARG  47          1HH1      ARG  47  12.639   3.085  -1.878
  269   HH12  ARG  47          2HH1      ARG  47  12.646   4.248  -3.185
  270   HH21  ARG  47          1HH2      ARG  47  11.246   2.129  -5.548
  271   HH22  ARG  47          2HH2      ARG  47  11.739   3.771  -5.190
  272    H    LEU  48           H        LEU  48   6.651  -0.292  -1.701
  273    HA   LEU  48           HA       LEU  48   5.535  -2.826  -0.603
  274    HB3  LEU  48           2HB      LEU  48   3.619  -0.552  -1.077
  275    HG   LEU  48           HG       LEU  48   3.883  -2.619   1.152
  276   HD11  LEU  48          1HD1      LEU  48   1.638  -1.748   1.842
  277   HD12  LEU  48          2HD1      LEU  48   1.836  -0.436   0.659
  278   HD13  LEU  48          3HD1      LEU  48   2.956  -0.577   2.033
  279   HD21  LEU  48          3HD2      LEU  48   3.005  -3.751  -0.807
  280   HD22  LEU  48          1HD2      LEU  48   1.884  -2.415  -1.155
  281   HD23  LEU  48          2HD2      LEU  48   1.658  -3.457   0.268
  282    H    THR  49           H        THR  49   4.349  -3.988  -2.056
  283    HA   THR  49           HA       THR  49   4.058  -3.009  -4.871
  284    HB   THR  49           HB       THR  49   4.915  -5.811  -4.029
  285    HG1  THR  49           1HG      THR  49   6.822  -5.096  -4.265
  286   HG21  THR  49          3HG2      THR  49   4.535  -4.541  -6.778
  287   HG22  THR  49          1HG2      THR  49   3.548  -5.852  -6.082
  288   HG23  THR  49          2HG2      THR  49   5.245  -6.142  -6.476
  289    H    VAL  50           H        VAL  50   2.052  -3.214  -5.567
  290    HA   VAL  50           HA       VAL  50   0.100  -5.039  -4.220
  291    HB   VAL  50           HB       VAL  50  -0.025  -2.894  -3.075
  292   HG11  VAL  50          1HG1      VAL  50  -0.584  -1.615  -5.781
  293   HG12  VAL  50          2HG1      VAL  50  -0.717  -0.811  -4.210
  294   HG13  VAL  50          3HG1      VAL  50   0.858  -1.371  -4.780
  295   HG21  VAL  50          3HG2      VAL  50  -2.457  -3.293  -4.869
  296   HG22  VAL  50          1HG2      VAL  50  -2.159  -4.048  -3.300
  297   HG23  VAL  50          2HG2      VAL  50  -2.409  -2.310  -3.404
  298    H    THR  51           H        THR  51  -1.524  -5.853  -5.471
  299    HA   THR  51           HA       THR  51  -1.611  -5.115  -8.365
  300    HB   THR  51           HB       THR  51  -2.600  -7.693  -7.072
  301    HG1  THR  51           1HG      THR  51  -0.436  -7.541  -6.868
  302   HG21  THR  51          3HG2      THR  51  -3.624  -7.090  -9.328
  303   HG22  THR  51          1HG2      THR  51  -2.571  -8.511  -9.419
  304   HG23  THR  51          2HG2      THR  51  -1.996  -6.938  -9.997
  305    H    TYR  52           H        TYR  52  -3.353  -3.966  -8.984
  306    HA   TYR  52           HA       TYR  52  -6.034  -4.501  -7.885
  307    HB3  TYR  52           2HB      TYR  52  -5.070  -2.908  -6.271
  308    HD1  TYR  52           1HD      TYR  52  -6.180  -0.378  -8.740
  309    HD2  TYR  52           2HD      TYR  52  -2.804  -2.019  -6.638
  310    HE1  TYR  52           1HE      TYR  52  -4.833   1.614  -9.357
  311    HE2  TYR  52           2HE      TYR  52  -1.475   0.012  -7.190
  312    HH   TYR  52           HH       TYR  52  -2.815   2.693  -9.139
  313    H    ASP  53           H        ASP  53  -7.734  -3.003  -8.966
  314    HA   ASP  53           HA       ASP  53  -7.177  -2.831 -11.859
  315    HB3  ASP  53           2HB      ASP  53  -9.768  -2.855 -10.280
  316    HA   PRO  54           HA       PRO  54  -6.651   1.484 -10.888
  317    HB3  PRO  54           2HB      PRO  54  -4.884   1.275 -12.376
  318    HG3  PRO  54           2HG      PRO  54  -5.158   0.166 -14.497
  319    HD3  PRO  54           2HD      PRO  54  -5.663  -1.376 -12.774
  320    H    LYS  55           H        LYS  55  -9.431   0.407 -12.097
  321    HA   LYS  55           HA       LYS  55 -10.524   3.165 -12.561
  322    HB3  LYS  55           2HB      LYS  55 -12.284   2.023 -14.054
  323    HG3  LYS  55           2HG      LYS  55  -9.478   2.334 -15.192
  324    HD3  LYS  55           2HD      LYS  55 -12.271   2.691 -16.391
  325    HE3  LYS  55           2HE      LYS  55 -10.892   2.949 -18.543
  326    HZ1  LYS  55           3HZ      LYS  55 -10.749   5.245 -16.664
  327    HZ2  LYS  55           1HZ      LYS  55 -12.063   4.834 -17.513
  328    HZ3  LYS  55           2HZ      LYS  55 -10.716   5.302 -18.317
  329    H    GLN  56           H        GLN  56 -11.138  -0.139 -11.370
  330    HA   GLN  56           HA       GLN  56 -13.475   0.617  -9.804
  331    HB3  GLN  56           2HB      GLN  56 -12.730  -1.364  -8.375
  332    HG3  GLN  56           2HG      GLN  56 -13.122  -1.701 -11.377
  333   HE21  GLN  56          1HE2      GLN  56 -13.435  -3.584  -8.239
  334   HE22  GLN  56          2HE2      GLN  56 -13.205  -5.121  -9.045
  335    H    VAL  57           H        VAL  57  -9.910   0.836  -9.182
  336    HA   VAL  57           HA       VAL  57 -10.475   2.899  -7.137
  337    HB   VAL  57           HB       VAL  57  -8.863   1.930  -5.542
  338   HG11  VAL  57          1HG1      VAL  57 -10.349   0.394  -4.480
  339   HG12  VAL  57          2HG1      VAL  57 -11.333   1.617  -5.282
  340   HG13  VAL  57          3HG1      VAL  57 -11.160   0.002  -6.010
  341   HG21  VAL  57          3HG2      VAL  57  -7.594   0.425  -7.030
  342   HG22  VAL  57          1HG2      VAL  57  -8.217  -0.433  -5.618
  343   HG23  VAL  57          2HG2      VAL  57  -9.013  -0.634  -7.191
  344    H    SER  58           H        SER  58  -8.168   3.799  -6.346
  345    HA   SER  58           HA       SER  58  -6.105   3.372  -8.452
  346    HB3  SER  58           2HB      SER  58  -7.358   5.667  -8.668
  347    HG   SER  58           HG       SER  58  -5.362   6.824  -7.251
  348    H    GLU  59           H        GLU  59  -3.960   4.503  -7.494
  349    HA   GLU  59           HA       GLU  59  -3.086   3.246  -5.159
  350    HB3  GLU  59           2HB      GLU  59  -1.605   4.179  -6.832
  351    HG3  GLU  59           2HG      GLU  59  -0.882   6.531  -6.763
  352    H    ILE  60           H        ILE  60  -5.341   5.839  -5.253
  353    HA   ILE  60           HA       ILE  60  -4.952   6.961  -2.625
  354    HB   ILE  60           HB       ILE  60  -7.108   6.918  -4.696
  355   HG13  ILE  60          2HG1      ILE  60  -6.012   9.070  -2.829
  356   HG21  ILE  60          1HG2      ILE  60  -7.810   7.563  -1.811
  357   HG22  ILE  60          2HG2      ILE  60  -8.792   7.949  -3.238
  358   HG23  ILE  60          3HG2      ILE  60  -8.509   6.265  -2.819
  359   HD11  ILE  60          3HD1      ILE  60  -4.915  10.024  -4.816
  360   HD12  ILE  60          1HD1      ILE  60  -4.253   8.423  -4.472
  361   HD13  ILE  60          2HD1      ILE  60  -5.434   8.644  -5.793
  362    H    THR  61           H        THR  61  -6.624   3.967  -3.668
  363    HA   THR  61           HA       THR  61  -7.969   3.526  -1.160
  364    HB   THR  61           HB       THR  61  -7.282   1.795  -3.543
  365    HG1  THR  61           1HG      THR  61  -9.018   3.182  -3.697
  366   HG21  THR  61          3HG2      THR  61  -7.180   0.159  -1.729
  367   HG22  THR  61          1HG2      THR  61  -8.739   0.024  -2.547
  368   HG23  THR  61          2HG2      THR  61  -8.638   0.853  -0.977
  369    H    ILE  62           H        ILE  62  -4.776   2.474  -2.279
  370    HA   ILE  62           HA       ILE  62  -4.186   1.148   0.288
  371    HB   ILE  62           HB       ILE  62  -3.265   0.285  -1.784
  372   HG13  ILE  62          2HG1      ILE  62  -2.162  -0.065   0.411
  373   HG21  ILE  62          1HG2      ILE  62  -2.930   2.337  -3.066
  374   HG22  ILE  62          2HG2      ILE  62  -1.617   2.842  -1.973
  375   HG23  ILE  62          3HG2      ILE  62  -1.448   1.408  -3.006
  376   HD11  ILE  62          3HD1      ILE  62  -0.115  -0.982  -0.378
  377   HD12  ILE  62          1HD1      ILE  62  -1.262  -1.155  -1.710
  378   HD13  ILE  62          2HD1      ILE  62  -0.031   0.132  -1.753
  379    H    GLN  63           H        GLN  63  -3.551   4.381  -1.103
  380    HA   GLN  63           HA       GLN  63  -2.013   5.365   1.079
  381    HB3  GLN  63           2HB      GLN  63  -4.011   6.869  -0.639
  382    HG3  GLN  63           2HG      GLN  63  -1.494   7.882   0.744
  383   HE21  GLN  63          1HE2      GLN  63  -4.643   9.144  -0.571
  384   HE22  GLN  63          2HE2      GLN  63  -3.898  10.439  -1.487
  385    H    GLU  64           H        GLU  64  -5.637   5.190   0.782
  386    HA   GLU  64           HA       GLU  64  -6.312   6.480   3.219
  387    HB3  GLU  64           2HB      GLU  64  -8.290   4.823   3.203
  388    HG3  GLU  64           2HG      GLU  64  -9.371   5.565   1.144
  389    H    ARG  65           H        ARG  65  -5.484   3.038   2.740
  390    HA   ARG  65           HA       ARG  65  -5.792   2.264   5.509
  391    HB3  ARG  65           2HB      ARG  65  -4.488   1.087   3.024
  392    HG3  ARG  65           2HG      ARG  65  -3.218  -0.060   4.656
  393    HD3  ARG  65           2HD      ARG  65  -4.180   0.211   6.799
  394    HE   ARG  65           HE       ARG  65  -6.725   0.026   5.714
  395   HH11  ARG  65          1HH1      ARG  65  -5.088  -1.650   8.395
  396   HH12  ARG  65          2HH1      ARG  65  -6.507  -1.482   9.409
  397   HH21  ARG  65          1HH2      ARG  65  -8.473   0.022   6.987
  398   HH22  ARG  65          2HH2      ARG  65  -8.424  -0.596   8.617
  399    H    ILE  66           H        ILE  66  -2.944   3.289   3.607
  400    HA   ILE  66           HA       ILE  66  -1.076   2.894   5.831
  401    HB   ILE  66           HB       ILE  66  -0.964   4.445   3.216
  402   HG13  ILE  66          2HG1      ILE  66  -1.096   1.826   3.263
  403   HG21  ILE  66          1HG2      ILE  66   0.634   5.421   4.892
  404   HG22  ILE  66          2HG2      ILE  66   1.356   3.798   5.077
  405   HG23  ILE  66          3HG2      ILE  66   1.434   4.670   3.530
  406   HD11  ILE  66          3HD1      ILE  66   1.333   3.101   1.976
  407   HD12  ILE  66          1HD1      ILE  66   0.621   1.533   1.571
  408   HD13  ILE  66          2HD1      ILE  66  -0.303   3.027   1.292
  409    H    ALA  67           H        ALA  67  -2.774   5.782   4.562
  410    HA   ALA  67           HA       ALA  67  -1.594   7.642   6.296
  411    HB1  ALA  67           1HB      ALA  67  -2.771   8.215   4.217
  412    HB2  ALA  67           2HB      ALA  67  -4.313   7.662   4.899
  413    HB3  ALA  67           3HB      ALA  67  -3.497   9.087   5.575
  414    H    ALA  68           H        ALA  68  -4.550   5.671   6.764
  415    HA   ALA  68           HA       ALA  68  -5.472   7.048   9.138
  416    HB1  ALA  68           1HB      ALA  68  -6.942   5.793   7.576
  417    HB2  ALA  68           2HB      ALA  68  -6.104   4.284   7.984
  418    HB3  ALA  68           3HB      ALA  68  -7.054   5.141   9.218
  419    H    LEU  69           H        LEU  69  -3.445   4.173   8.593
  420    HA   LEU  69           HA       LEU  69  -3.373   3.492  11.428
  421    HB3  LEU  69           2HB      LEU  69  -1.544   1.863  10.398
  422    HG   LEU  69           HG       LEU  69  -3.310   0.335   9.565
  423   HD11  LEU  69          1HD1      LEU  69  -2.672   0.475  11.977
  424   HD12  LEU  69          2HD1      LEU  69  -4.346  -0.051  11.717
  425   HD13  LEU  69          3HD1      LEU  69  -4.017   1.605  12.243
  426   HD21  LEU  69          3HD2      LEU  69  -4.967   1.939   8.652
  427   HD22  LEU  69          1HD2      LEU  69  -5.302   2.536  10.294
  428   HD23  LEU  69          2HD2      LEU  69  -5.690   0.879   9.870
  429    H    GLY  70           H        GLY  70  -1.819   5.998   9.940
  430    HA2  GLY  70           2HA      GLY  70  -0.602   7.488  11.358
  431    HA3  GLY  70           3HA      GLY  70   0.145   6.115  12.198
  432    H    TYR  71           H        TYR  71   0.059   6.026   8.723
  433    HA   TYR  71           HA       TYR  71   2.966   6.721   8.542
  434    HB3  TYR  71           2HB      TYR  71   3.177   4.790   7.072
  435    HD1  TYR  71           1HD      TYR  71   4.437   4.720   9.379
  436    HD2  TYR  71           2HD      TYR  71   0.479   3.140   8.787
  437    HE1  TYR  71           1HE      TYR  71   4.624   3.480  11.515
  438    HE2  TYR  71           2HE      TYR  71   0.685   1.840  10.910
  439    HH   TYR  71           HH       TYR  71   3.585   2.050  12.986
  440    H    THR  72           H        THR  72   3.426   6.656   5.879
  441    HA   THR  72           HA       THR  72   1.418   8.339   4.465
  442    HB   THR  72           HB       THR  72   3.333   9.888   3.749
  443    HG1  THR  72           1HG      THR  72   5.064   8.856   4.410
  444   HG21  THR  72          3HG2      THR  72   1.656  10.732   5.274
  445   HG22  THR  72          1HG2      THR  72   3.254  11.326   5.729
  446   HG23  THR  72          2HG2      THR  72   2.497  10.026   6.672
  447    H    LEU  73           H        LEU  73   2.168   8.714   2.116
  448    HA   LEU  73           HA       LEU  73   3.709   6.395   1.034
  449    HB3  LEU  73           2HB      LEU  73   0.795   7.099   0.539
  450    HG   LEU  73           HG       LEU  73   2.625   5.527  -1.295
  451   HD11  LEU  73          1HD1      LEU  73  -0.284   4.842  -0.708
  452   HD12  LEU  73          2HD1      LEU  73   1.143   3.806  -0.458
  453   HD13  LEU  73          3HD1      LEU  73   0.647   4.238  -2.095
  454   HD21  LEU  73          3HD2      LEU  73   1.727   7.723  -2.108
  455   HD22  LEU  73          1HD2      LEU  73   0.079   7.175  -1.760
  456   HD23  LEU  73          2HD2      LEU  73   1.037   6.387  -3.025
  457    H    ALA  74           H        ALA  74   4.737   6.689  -0.886
  458    HA   ALA  74           HA       ALA  74   4.116   9.081  -2.520
  459    HB1  ALA  74           1HB      ALA  74   6.522   9.575  -2.824
  460    HB2  ALA  74           2HB      ALA  74   6.016   9.768  -1.137
  461    HB3  ALA  74           3HB      ALA  74   6.929   8.326  -1.629
  462    H    GLU  75           H        GLU  75   3.711   8.480  -4.546
  463    HA   GLU  75           HA       GLU  75   4.789   5.905  -5.602
  464    HB3  GLU  75           2HB      GLU  75   1.946   6.964  -5.850
  465    HG3  GLU  75           2HG      GLU  75   1.441   4.635  -6.608
  466    HA   PRO  76           HA       PRO  76   6.557   8.926  -8.053
  467    HB3  PRO  76           2HB      PRO  76   8.292   7.489  -8.253
  468    HG3  PRO  76           2HG      PRO  76   7.952   5.181  -8.673
  469    HD3  PRO  76           2HD      PRO  76   6.694   5.815  -6.759
  Start of MODEL   24
    1    H2   PRO   6           2H       PRO   6  -6.986  -2.596 -17.210
    2    HA   PRO   6           HA       PRO   6  -7.671  -5.260 -16.340
    3    HB3  PRO   6           2HB      PRO   6  -6.605  -6.359 -17.969
    4    HG3  PRO   6           2HG      PRO   6  -6.294  -5.144 -19.976
    5    HD3  PRO   6           2HD      PRO   6  -8.375  -4.431 -19.034
    6    H    LEU   7           H        LEU   7  -6.447  -5.910 -14.530
    7    HA   LEU   7           HA       LEU   7  -5.084  -3.917 -13.011
    8    HB3  LEU   7           2HB      LEU   7  -6.347  -5.620 -11.947
    9    HG   LEU   7           HG       LEU   7  -5.998  -7.534 -13.573
   10   HD11  LEU   7          1HD1      LEU   7  -3.376  -7.849 -12.063
   11   HD12  LEU   7          2HD1      LEU   7  -3.607  -7.709 -13.820
   12   HD13  LEU   7          3HD1      LEU   7  -4.158  -9.150 -12.982
   13   HD21  LEU   7          3HD2      LEU   7  -7.123  -7.760 -11.368
   14   HD22  LEU   7          1HD2      LEU   7  -5.551  -8.108 -10.615
   15   HD23  LEU   7          2HD2      LEU   7  -6.241  -9.230 -11.806
   16    H    LYS   8           H        LYS   8  -2.974  -4.188 -12.048
   17    HA   LYS   8           HA       LYS   8  -0.812  -5.464 -13.444
   18    HB3  LYS   8           2HB      LYS   8  -1.124  -3.907 -15.190
   19    HG3  LYS   8           2HG      LYS   8  -1.302  -1.699 -13.094
   20    HD3  LYS   8           2HD      LYS   8  -1.099  -1.588 -16.133
   21    HE3  LYS   8           2HE      LYS   8  -2.049   0.499 -14.117
   22    HZ1  LYS   8           3HZ      LYS   8  -1.480   0.823 -17.017
   23    HZ2  LYS   8           1HZ      LYS   8  -0.646   1.507 -15.776
   24    HZ3  LYS   8           2HZ      LYS   8  -2.208   1.944 -16.047
   25    H    THR   9           H        THR   9   1.246  -5.142 -12.475
   26    HA   THR   9           HA       THR   9   1.054  -4.338  -9.647
   27    HB   THR   9           HB       THR   9   2.040  -6.507 -10.308
   28    HG1  THR   9           1HG      THR   9   3.512  -6.317  -8.649
   29   HG21  THR   9          3HG2      THR   9   3.481  -5.665 -12.218
   30   HG22  THR   9          1HG2      THR   9   4.356  -6.620 -11.005
   31   HG23  THR   9          2HG2      THR   9   4.509  -4.853 -11.020
   32    H    GLN  10           H        GLN  10   2.763  -3.169  -8.563
   33    HA   GLN  10           HA       GLN  10   4.300  -1.109  -9.897
   34    HB3  GLN  10           2HB      GLN  10   1.725  -0.369  -8.403
   35    HG3  GLN  10           2HG      GLN  10   3.369   1.389  -8.053
   36   HE21  GLN  10          1HE2      GLN  10   5.312   2.293  -8.678
   37   HE22  GLN  10          2HE2      GLN  10   5.877   2.355 -10.341
   38    H    GLN  11           H        GLN  11   5.824  -0.293  -8.418
   39    HA   GLN  11           HA       GLN  11   5.352  -0.872  -5.528
   40    HB3  GLN  11           2HB      GLN  11   7.326  -2.059  -6.482
   41    HG3  GLN  11           2HG      GLN  11   8.589   0.718  -6.566
   42   HE21  GLN  11          1HE2      GLN  11   9.348  -2.360  -8.248
   43   HE22  GLN  11          2HE2      GLN  11  10.917  -2.572  -7.448
   44    H    MET  12           H        MET  12   6.150   0.675  -3.999
   45    HA   MET  12           HA       MET  12   6.188   3.517  -4.870
   46    HB3  MET  12           2HB      MET  12   3.809   2.868  -4.526
   47    HG3  MET  12           2HG      MET  12   4.509   2.540  -1.565
   48    HE1  MET  12           3HE      MET  12   2.561   4.049  -0.777
   49    HE2  MET  12           1HE      MET  12   2.253   4.574  -2.448
   50    HE3  MET  12           2HE      MET  12   0.908   4.020  -1.433
   51    H    GLN  13           H        GLN  13   6.671   5.006  -3.064
   52    HA   GLN  13           HA       GLN  13   8.583   3.781  -1.135
   53    HB3  GLN  13           2HB      GLN  13   9.635   5.922  -1.003
   54    HG3  GLN  13           2HG      GLN  13  10.188   6.634  -3.277
   55   HE21  GLN  13          1HE2      GLN  13  12.100   5.439  -2.472
   56   HE22  GLN  13          2HE2      GLN  13  12.406   3.896  -3.252
   57    H    VAL  14           H        VAL  14   8.439   4.533   1.116
   58    HA   VAL  14           HA       VAL  14   5.884   5.639   2.033
   59    HB   VAL  14           HB       VAL  14   6.449   2.686   2.056
   60   HG11  VAL  14          1HG1      VAL  14   6.353   3.152   4.485
   61   HG12  VAL  14          2HG1      VAL  14   4.826   4.037   4.262
   62   HG13  VAL  14          3HG1      VAL  14   4.924   2.301   3.927
   63   HG21  VAL  14          3HG2      VAL  14   4.760   3.428   0.525
   64   HG22  VAL  14          1HG2      VAL  14   3.968   2.576   1.838
   65   HG23  VAL  14          2HG2      VAL  14   3.926   4.349   1.799
   66    H    GLY  15           H        GLY  15   5.882   6.315   4.129
   67    HA2  GLY  15           2HA      GLY  15   8.584   6.420   5.460
   68    HA3  GLY  15           3HA      GLY  15   7.445   7.763   5.404
   69    H    GLY  16           H        GLY  16   8.556   5.215   7.231
   70    HA2  GLY  16           2HA      GLY  16   8.145   5.224   9.571
   71    HA3  GLY  16           3HA      GLY  16   6.449   5.667   9.305
   72    H    MET  17           H        MET  17   7.394   3.053   7.207
   73    HA   MET  17           HA       MET  17   5.947   1.187   9.010
   74    HB3  MET  17           2HB      MET  17   6.040  -0.330   6.966
   75    HG3  MET  17           2HG      MET  17   4.514   2.058   6.096
   76    HE1  MET  17           3HE      MET  17   3.477  -1.248   4.161
   77    HE2  MET  17           1HE      MET  17   3.689   0.498   3.944
   78    HE3  MET  17           2HE      MET  17   5.047  -0.500   4.519
   79    H    ARG  18           H        ARG  18   6.606  -0.739   9.654
   80    HA   ARG  18           HA       ARG  18   9.310  -1.809   9.170
   81    HB3  ARG  18           2HB      ARG  18   9.688  -2.079  11.603
   82    HG3  ARG  18           2HG      ARG  18   9.250   0.868  11.048
   83    HD3  ARG  18           2HD      ARG  18  11.231  -0.650  12.799
   84    HE   ARG  18           HE       ARG  18  11.199   2.082  12.131
   85   HH11  ARG  18          1HH1      ARG  18  11.278   0.066  15.023
   86   HH12  ARG  18          2HH1      ARG  18  12.078   1.280  15.979
   87   HH21  ARG  18          1HH2      ARG  18  11.978   3.733  13.507
   88   HH22  ARG  18          2HH2      ARG  18  12.365   3.343  15.169
   89    H    CYS  19           H        CYS  19   9.476  -3.948  10.529
   90    HA   CYS  19           HA       CYS  19   7.453  -5.803   9.758
   91    HB3  CYS  19           2HB      CYS  19   9.537  -6.068  11.979
   92    HG   CYS  19           HG       CYS  19   9.677  -8.609  11.410
   93    H    ALA  20           H        ALA  20   8.144  -4.486  13.051
   94    HA   ALA  20           HA       ALA  20   5.873  -5.696  14.289
   95    HB1  ALA  20           1HB      ALA  20   7.448  -3.200  15.070
   96    HB2  ALA  20           2HB      ALA  20   6.351  -4.113  16.127
   97    HB3  ALA  20           3HB      ALA  20   7.840  -4.872  15.530
   98    H    ALA  21           H        ALA  21   3.836  -5.338  13.957
   99    HA   ALA  21           HA       ALA  21   1.803  -4.441  13.617
  100    HB1  ALA  21           1HB      ALA  21   2.479  -2.755  15.318
  101    HB2  ALA  21           2HB      ALA  21   3.020  -1.672  14.020
  102    HB3  ALA  21           3HB      ALA  21   1.317  -2.137  14.131
  103    H    CYS  22           H        CYS  22   3.947  -2.095  11.890
  104    HA   CYS  22           HA       CYS  22   1.895  -1.321  10.182
  105    HB3  CYS  22           2HB      CYS  22   3.443   0.098   9.197
  106    HG   CYS  22           HG       CYS  22   3.634   0.596  11.763
  107    H    ALA  23           H        ALA  23   4.584  -3.452   9.258
  108    HA   ALA  23           HA       ALA  23   3.734  -4.306   6.720
  109    HB1  ALA  23           1HB      ALA  23   5.377  -5.545   8.967
  110    HB2  ALA  23           2HB      ALA  23   5.304  -6.253   7.362
  111    HB3  ALA  23           3HB      ALA  23   5.976  -4.623   7.574
  112    H    SER  24           H        SER  24   2.193  -5.036   9.730
  113    HA   SER  24           HA       SER  24   0.808  -7.416   8.552
  114    HB3  SER  24           2HB      SER  24  -0.132  -7.779  10.736
  115    HG   SER  24           HG       SER  24   1.636  -8.599  11.603
  116    H    SER  25           H        SER  25   0.006  -4.264  10.240
  117    HA   SER  25           HA       SER  25  -2.750  -4.451   9.846
  118    HB3  SER  25           2HB      SER  25  -2.908  -2.202  10.459
  119    HG   SER  25           HG       SER  25  -1.653  -3.478  12.005
  120    H    ILE  26           H        ILE  26  -0.402  -2.929   7.605
  121    HA   ILE  26           HA       ILE  26  -2.333  -1.921   5.732
  122    HB   ILE  26           HB       ILE  26   0.610  -2.483   5.758
  123   HG13  ILE  26          2HG1      ILE  26  -1.035  -0.089   4.830
  124   HG21  ILE  26          1HG2      ILE  26  -0.771  -1.965   3.103
  125   HG22  ILE  26          2HG2      ILE  26   0.978  -1.978   3.430
  126   HG23  ILE  26          3HG2      ILE  26   0.071  -3.467   3.569
  127   HD11  ILE  26          3HD1      ILE  26   0.640  -0.460   7.356
  128   HD12  ILE  26          1HD1      ILE  26  -0.026   1.078   6.778
  129   HD13  ILE  26          2HD1      ILE  26  -1.121  -0.226   7.284
  130    H    GLU  27           H        GLU  27  -1.118  -5.184   6.167
  131    HA   GLU  27           HA       GLU  27  -2.318  -6.070   3.593
  132    HB3  GLU  27           2HB      GLU  27  -1.127  -8.209   4.129
  133    HG3  GLU  27           2HG      GLU  27   0.797  -5.851   4.006
  134    H    ARG  28           H        ARG  28  -2.754  -6.410   7.115
  135    HA   ARG  28           HA       ARG  28  -4.803  -8.439   7.002
  136    HB3  ARG  28           2HB      ARG  28  -4.277  -6.231   9.046
  137    HG3  ARG  28           2HG      ARG  28  -5.874  -8.826   9.203
  138    HD3  ARG  28           2HD      ARG  28  -4.885  -7.007  11.446
  139    HE   ARG  28           HE       ARG  28  -6.769  -7.807  12.464
  140   HH11  ARG  28          1HH1      ARG  28  -5.342 -10.571  10.734
  141   HH12  ARG  28          2HH1      ARG  28  -6.455 -11.690  11.487
  142   HH21  ARG  28          1HH2      ARG  28  -7.953  -9.411  13.559
  143   HH22  ARG  28          2HH2      ARG  28  -7.897 -11.061  12.957
  144    H    ALA  29           H        ALA  29  -4.858  -4.857   6.876
  145    HA   ALA  29           HA       ALA  29  -7.703  -4.637   6.407
  146    HB1  ALA  29           1HB      ALA  29  -5.408  -2.700   5.869
  147    HB2  ALA  29           2HB      ALA  29  -7.145  -2.298   5.902
  148    HB3  ALA  29           3HB      ALA  29  -6.329  -2.838   7.378
  149    H    LEU  30           H        LEU  30  -4.926  -5.066   4.187
  150    HA   LEU  30           HA       LEU  30  -5.904  -4.276   1.718
  151    HB3  LEU  30           2HB      LEU  30  -4.429  -6.852   2.440
  152    HG   LEU  30           HG       LEU  30  -3.299  -6.887   0.391
  153   HD11  LEU  30          1HD1      LEU  30  -4.787  -7.860  -1.121
  154   HD12  LEU  30          2HD1      LEU  30  -6.189  -7.040  -0.445
  155   HD13  LEU  30          3HD1      LEU  30  -5.333  -8.293   0.502
  156   HD21  LEU  30          3HD2      LEU  30  -3.959  -5.569  -1.547
  157   HD22  LEU  30          1HD2      LEU  30  -3.396  -4.539  -0.232
  158   HD23  LEU  30          2HD2      LEU  30  -5.142  -4.671  -0.559
  159    H    GLU  31           H        GLU  31  -6.462  -7.555   3.096
  160    HA   GLU  31           HA       GLU  31  -8.135  -8.173   0.877
  161    HB3  GLU  31           2HB      GLU  31  -6.794  -9.906   1.958
  162    HG3  GLU  31           2HG      GLU  31  -8.612  -9.460   4.352
  163    H    ARG  32           H        ARG  32  -8.833  -6.457   3.794
  164    HA   ARG  32           HA       ARG  32 -11.493  -7.439   4.261
  165    HB3  ARG  32           2HB      ARG  32  -9.917  -5.150   5.546
  166    HG3  ARG  32           2HG      ARG  32 -12.243  -6.873   6.376
  167    HD3  ARG  32           2HD      ARG  32 -10.654  -6.686   8.290
  168    HE   ARG  32           HE       ARG  32 -10.630  -3.852   7.654
  169   HH11  ARG  32          1HH1      ARG  32 -10.715  -5.972  10.528
  170   HH12  ARG  32          2HH1      ARG  32 -10.005  -4.751  11.540
  171   HH21  ARG  32          1HH2      ARG  32  -9.545  -2.394   9.052
  172   HH22  ARG  32          2HH2      ARG  32  -9.332  -2.827  10.725
  173    H    LEU  33           H        LEU  33  -9.954  -4.541   2.821
  174    HA   LEU  33           HA       LEU  33 -12.590  -3.335   2.332
  175    HB3  LEU  33           2HB      LEU  33 -10.987  -1.841   3.087
  176    HG   LEU  33           HG       LEU  33  -8.814  -2.714   2.346
  177   HD11  LEU  33          1HD1      LEU  33  -7.992  -2.179   0.046
  178   HD12  LEU  33          2HD1      LEU  33  -9.670  -1.835  -0.434
  179   HD13  LEU  33          3HD1      LEU  33  -9.205  -3.472   0.074
  180   HD21  LEU  33          3HD2      LEU  33  -9.496   0.088   1.365
  181   HD22  LEU  33          1HD2      LEU  33  -7.865  -0.511   1.697
  182   HD23  LEU  33          2HD2      LEU  33  -9.034  -0.376   3.020
  183    H    LYS  34           H        LYS  34 -11.262  -5.791   0.789
  184    HA   LYS  34           HA       LYS  34 -12.143  -7.008  -0.871
  185    HB3  LYS  34           2HB      LYS  34 -14.273  -6.424  -1.823
  186    HG3  LYS  34           2HG      LYS  34 -14.235  -5.359   1.033
  187    HD3  LYS  34           2HD      LYS  34 -16.519  -6.574  -0.579
  188    HE3  LYS  34           2HE      LYS  34 -17.880  -5.489   1.255
  189    HZ1  LYS  34           3HZ      LYS  34 -17.517  -7.179   2.856
  190    HZ2  LYS  34           1HZ      LYS  34 -15.996  -7.539   2.293
  191    HZ3  LYS  34           2HZ      LYS  34 -17.311  -7.853   1.386
  192    H    GLY  35           H        GLY  35 -11.435  -3.721  -1.969
  193    HA2  GLY  35           2HA      GLY  35 -11.810  -4.346  -4.767
  194    HA3  GLY  35           3HA      GLY  35 -11.241  -2.814  -4.088
  195    H    VAL  36           H        VAL  36  -9.113  -5.304  -3.097
  196    HA   VAL  36           HA       VAL  36  -7.214  -4.486  -5.265
  197    HB   VAL  36           HB       VAL  36  -6.476  -5.283  -2.439
  198   HG11  VAL  36          1HG1      VAL  36  -4.381  -3.974  -3.092
  199   HG12  VAL  36          2HG1      VAL  36  -4.617  -5.507  -3.937
  200   HG13  VAL  36          3HG1      VAL  36  -4.993  -3.966  -4.750
  201   HG21  VAL  36          3HG2      VAL  36  -7.825  -3.245  -2.254
  202   HG22  VAL  36          1HG2      VAL  36  -6.128  -2.865  -1.997
  203   HG23  VAL  36          2HG2      VAL  36  -6.886  -2.475  -3.558
  204    H    ALA  37           H        ALA  37  -5.931  -5.975  -6.256
  205    HA   ALA  37           HA       ALA  37  -6.817  -8.763  -6.134
  206    HB1  ALA  37           1HB      ALA  37  -6.543  -7.505  -8.255
  207    HB2  ALA  37           2HB      ALA  37  -4.806  -7.338  -7.923
  208    HB3  ALA  37           3HB      ALA  37  -5.500  -8.943  -8.203
  209    H    GLU  38           H        GLU  38  -3.775  -7.014  -5.267
  210    HA   GLU  38           HA       GLU  38  -2.884  -9.171  -3.623
  211    HB3  GLU  38           2HB      GLU  38  -1.254  -8.707  -6.141
  212    HG3  GLU  38           2HG      GLU  38  -0.945 -10.722  -3.895
  213    H    ALA  39           H        ALA  39  -1.216  -8.416  -2.201
  214    HA   ALA  39           HA       ALA  39   0.413  -6.157  -3.059
  215    HB1  ALA  39           1HB      ALA  39  -0.180  -4.634  -1.276
  216    HB2  ALA  39           2HB      ALA  39  -1.677  -5.099  -2.124
  217    HB3  ALA  39           3HB      ALA  39  -1.282  -5.837  -0.553
  218    H    SER  40           H        SER  40   2.250  -5.761  -1.697
  219    HA   SER  40           HA       SER  40   2.741  -7.618   0.547
  220    HB3  SER  40           2HB      SER  40   4.474  -7.732  -1.934
  221    HG   SER  40           HG       SER  40   5.510  -9.314  -0.847
  222    H    VAL  41           H        VAL  41   3.664  -6.407   2.089
  223    HA   VAL  41           HA       VAL  41   5.075  -3.930   1.625
  224    HB   VAL  41           HB       VAL  41   3.921  -4.573   3.750
  225   HG11  VAL  41          1HG1      VAL  41   4.788  -6.081   5.295
  226   HG12  VAL  41          2HG1      VAL  41   4.922  -6.952   3.780
  227   HG13  VAL  41          3HG1      VAL  41   6.364  -6.210   4.479
  228   HG21  VAL  41          3HG2      VAL  41   5.578  -2.709   3.658
  229   HG22  VAL  41          1HG2      VAL  41   5.398  -3.461   5.252
  230   HG23  VAL  41          2HG2      VAL  41   6.819  -3.827   4.264
  231    H    THR  42           H        THR  42   7.322  -3.454   1.895
  232    HA   THR  42           HA       THR  42   9.266  -5.739   1.807
  233    HB   THR  42           HB       THR  42   9.550  -3.056   0.391
  234    HG1  THR  42           1HG      THR  42   9.524  -4.488  -1.452
  235   HG21  THR  42          3HG2      THR  42  11.583  -4.099  -0.573
  236   HG22  THR  42          1HG2      THR  42  11.338  -5.538   0.444
  237   HG23  THR  42          2HG2      THR  42  11.720  -3.966   1.179
  238    H    VAL  43           H        VAL  43   9.535  -5.746   4.001
  239    HA   VAL  43           HA       VAL  43   9.581  -3.433   5.659
  240    HB   VAL  43           HB       VAL  43  10.449  -6.303   6.035
  241   HG11  VAL  43          1HG1      VAL  43  10.701  -4.163   8.193
  242   HG12  VAL  43          2HG1      VAL  43  10.822  -5.925   8.425
  243   HG13  VAL  43          3HG1      VAL  43  12.042  -5.097   7.482
  244   HG21  VAL  43          3HG2      VAL  43   8.353  -4.519   7.367
  245   HG22  VAL  43          1HG2      VAL  43   8.025  -5.642   6.039
  246   HG23  VAL  43          2HG2      VAL  43   8.537  -6.273   7.612
  247    H    ALA  44           H        ALA  44  12.315  -5.213   4.184
  248    HA   ALA  44           HA       ALA  44  14.487  -4.186   5.511
  249    HB1  ALA  44           1HB      ALA  44  15.690  -4.513   3.303
  250    HB2  ALA  44           2HB      ALA  44  14.667  -5.882   3.771
  251    HB3  ALA  44           3HB      ALA  44  14.117  -4.739   2.523
  252    H    THR  45           H        THR  45  12.766  -2.495   2.885
  253    HA   THR  45           HA       THR  45  14.465  -0.067   3.269
  254    HB   THR  45           HB       THR  45  13.590   0.482   0.972
  255    HG1  THR  45           1HG      THR  45  12.808  -1.505  -0.136
  256   HG21  THR  45          3HG2      THR  45  15.058  -1.093  -0.206
  257   HG22  THR  45          1HG2      THR  45  15.080  -2.175   1.196
  258   HG23  THR  45          2HG2      THR  45  15.818  -0.561   1.299
  259    H    GLY  46           H        GLY  46  11.497  -1.145   4.378
  260    HA2  GLY  46           2HA      GLY  46   9.513  -0.162   4.960
  261    HA3  GLY  46           3HA      GLY  46  10.370   1.390   4.947
  262    H    ARG  47           H        ARG  47   9.606  -0.923   2.312
  263    HA   ARG  47           HA       ARG  47   8.101   1.223   0.845
  264    HB3  ARG  47           2HB      ARG  47   9.066   0.383  -1.240
  265    HG3  ARG  47           2HG      ARG  47  11.258   1.085   0.724
  266    HD3  ARG  47           2HD      ARG  47  11.134   1.777  -2.223
  267    HE   ARG  47           HE       ARG  47  12.793   2.846  -0.505
  268   HH11  ARG  47          1HH1      ARG  47  13.620   0.072  -2.598
  269   HH12  ARG  47          2HH1      ARG  47  15.325   0.417  -2.481
  270   HH21  ARG  47          1HH2      ARG  47  15.032   3.126  -0.377
  271   HH22  ARG  47          2HH2      ARG  47  16.072   2.015  -1.240
  272    H    LEU  48           H        LEU  48   7.031  -0.047  -1.229
  273    HA   LEU  48           HA       LEU  48   5.559  -2.449  -0.277
  274    HB3  LEU  48           2HB      LEU  48   3.698  -0.439  -1.279
  275    HG   LEU  48           HG       LEU  48   3.964  -1.629   1.509
  276   HD11  LEU  48          1HD1      LEU  48   2.831   0.536   1.568
  277   HD12  LEU  48          2HD1      LEU  48   1.610  -0.735   1.728
  278   HD13  LEU  48          3HD1      LEU  48   1.825   0.088   0.175
  279   HD21  LEU  48          3HD2      LEU  48   2.070  -2.283  -0.811
  280   HD22  LEU  48          1HD2      LEU  48   1.983  -2.975   0.827
  281   HD23  LEU  48          2HD2      LEU  48   3.369  -3.319  -0.206
  282    H    THR  49           H        THR  49   4.432  -3.562  -1.884
  283    HA   THR  49           HA       THR  49   4.468  -2.582  -4.702
  284    HB   THR  49           HB       THR  49   4.937  -5.505  -4.092
  285    HG1  THR  49           1HG      THR  49   6.777  -4.796  -3.382
  286   HG21  THR  49          3HG2      THR  49   4.174  -4.890  -6.387
  287   HG22  THR  49          1HG2      THR  49   5.829  -5.508  -6.391
  288   HG23  THR  49          2HG2      THR  49   5.547  -3.763  -6.531
  289    H    VAL  50           H        VAL  50   2.612  -3.046  -5.812
  290    HA   VAL  50           HA       VAL  50   0.481  -4.661  -4.531
  291    HB   VAL  50           HB       VAL  50   0.283  -2.493  -3.454
  292   HG11  VAL  50          1HG1      VAL  50   1.303  -1.015  -5.148
  293   HG12  VAL  50          2HG1      VAL  50  -0.110  -1.237  -6.201
  294   HG13  VAL  50          3HG1      VAL  50  -0.283  -0.432  -4.635
  295   HG21  VAL  50          3HG2      VAL  50  -2.064  -1.958  -3.956
  296   HG22  VAL  50          1HG2      VAL  50  -1.984  -2.928  -5.437
  297   HG23  VAL  50          2HG2      VAL  50  -1.797  -3.701  -3.859
  298    H    THR  51           H        THR  51  -0.957  -5.526  -5.865
  299    HA   THR  51           HA       THR  51  -1.068  -4.744  -8.756
  300    HB   THR  51           HB       THR  51  -2.046  -7.325  -7.465
  301    HG1  THR  51           1HG      THR  51   0.268  -7.168  -7.576
  302   HG21  THR  51          3HG2      THR  51  -3.272  -6.663  -9.574
  303   HG22  THR  51          1HG2      THR  51  -2.258  -8.087  -9.825
  304   HG23  THR  51          2HG2      THR  51  -1.723  -6.503 -10.410
  305    H    TYR  52           H        TYR  52  -2.797  -3.537  -9.215
  306    HA   TYR  52           HA       TYR  52  -5.387  -4.186  -7.969
  307    HB3  TYR  52           2HB      TYR  52  -4.548  -2.406  -6.543
  308    HD1  TYR  52           2HD      TYR  52  -5.716  -0.307  -9.416
  309    HD2  TYR  52           1HD      TYR  52  -2.511  -1.163  -6.675
  310    HE1  TYR  52           2HE      TYR  52  -4.595   1.822 -10.058
  311    HE2  TYR  52           1HE      TYR  52  -1.399   0.972  -7.292
  312    HH   TYR  52           HH       TYR  52  -1.572   2.918  -8.467
  313    H    ASP  53           H        ASP  53  -7.226  -3.492  -9.111
  314    HA   ASP  53           HA       ASP  53  -6.877  -3.164 -11.999
  315    HB3  ASP  53           2HB      ASP  53  -9.365  -3.518 -10.311
  316    HA   PRO  54           HA       PRO  54  -7.065   1.238 -11.002
  317    HB3  PRO  54           2HB      PRO  54  -5.227   1.353 -12.422
  318    HG3  PRO  54           2HG      PRO  54  -5.169   0.139 -14.497
  319    HD3  PRO  54           2HD      PRO  54  -5.426  -1.418 -12.758
  320    H    LYS  55           H        LYS  55  -9.490  -0.426 -12.142
  321    HA   LYS  55           HA       LYS  55 -11.147   1.928 -12.997
  322    HB3  LYS  55           2HB      LYS  55 -12.384   0.498 -14.493
  323    HG3  LYS  55           2HG      LYS  55  -9.412   0.016 -15.037
  324    HD3  LYS  55           2HD      LYS  55 -11.813   0.356 -16.849
  325    HE3  LYS  55           2HE      LYS  55  -8.842   0.235 -17.552
  326    HZ1  LYS  55           3HZ      LYS  55  -9.659   0.667 -19.795
  327    HZ2  LYS  55           1HZ      LYS  55 -11.228   0.589 -19.287
  328    HZ3  LYS  55           2HZ      LYS  55 -10.268  -0.744 -19.252
  329    H    GLN  56           H        GLN  56 -11.204  -1.336 -11.467
  330    HA   GLN  56           HA       GLN  56 -13.545  -0.856  -9.858
  331    HB3  GLN  56           2HB      GLN  56 -12.536  -2.586  -8.328
  332    HG3  GLN  56           2HG      GLN  56 -12.279  -4.461  -9.983
  333   HE21  GLN  56          1HE2      GLN  56 -14.208  -5.409 -11.200
  334   HE22  GLN  56          2HE2      GLN  56 -15.770  -4.926 -10.508
  335    H    VAL  57           H        VAL  57 -10.060  -0.031  -9.275
  336    HA   VAL  57           HA       VAL  57 -10.956   1.939  -7.233
  337    HB   VAL  57           HB       VAL  57  -9.268   1.274  -5.625
  338   HG11  VAL  57          1HG1      VAL  57 -11.549   0.372  -5.378
  339   HG12  VAL  57          2HG1      VAL  57 -11.066  -1.102  -6.251
  340   HG13  VAL  57          3HG1      VAL  57 -10.319  -0.704  -4.701
  341   HG21  VAL  57          3HG2      VAL  57  -7.620   0.147  -7.121
  342   HG22  VAL  57          1HG2      VAL  57  -8.067  -0.874  -5.750
  343   HG23  VAL  57          2HG2      VAL  57  -8.754  -1.198  -7.353
  344    H    SER  58           H        SER  58  -8.463   2.811  -6.337
  345    HA   SER  58           HA       SER  58  -6.671   3.258  -8.604
  346    HB3  SER  58           2HB      SER  58  -8.523   5.110  -8.552
  347    HG   SER  58           HG       SER  58  -7.953   6.858  -7.239
  348    H    GLU  59           H        GLU  59  -4.789   4.731  -7.680
  349    HA   GLU  59           HA       GLU  59  -3.367   3.670  -5.559
  350    HB3  GLU  59           2HB      GLU  59  -2.495   5.222  -7.200
  351    HG3  GLU  59           2HG      GLU  59  -4.035   7.388  -5.708
  352    H    ILE  60           H        ILE  60  -6.191   5.694  -5.210
  353    HA   ILE  60           HA       ILE  60  -5.914   6.691  -2.536
  354    HB   ILE  60           HB       ILE  60  -8.170   6.039  -4.435
  355   HG13  ILE  60          2HG1      ILE  60  -6.691   8.060  -4.670
  356   HG21  ILE  60          1HG2      ILE  60  -9.846   6.964  -2.885
  357   HG22  ILE  60          2HG2      ILE  60  -9.210   5.410  -2.393
  358   HG23  ILE  60          3HG2      ILE  60  -8.646   6.902  -1.573
  359   HD11  ILE  60          3HD1      ILE  60  -8.357   9.673  -5.119
  360   HD12  ILE  60          1HD1      ILE  60  -9.093   8.102  -5.463
  361   HD13  ILE  60          2HD1      ILE  60  -9.490   8.966  -3.954
  362    H    THR  61           H        THR  61  -6.929   3.484  -3.718
  363    HA   THR  61           HA       THR  61  -7.864   2.610  -1.091
  364    HB   THR  61           HB       THR  61  -7.455   1.118  -3.706
  365    HG1  THR  61           1HG      THR  61  -9.735   2.223  -2.398
  366   HG21  THR  61          3HG2      THR  61  -7.709  -0.557  -1.969
  367   HG22  THR  61          1HG2      THR  61  -9.278  -0.376  -2.747
  368   HG23  THR  61          2HG2      THR  61  -8.990   0.384  -1.170
  369    H    ILE  62           H        ILE  62  -4.747   2.890  -2.322
  370    HA   ILE  62           HA       ILE  62  -3.878   1.245   0.036
  371    HB   ILE  62           HB       ILE  62  -3.016   0.431  -2.155
  372   HG13  ILE  62          2HG1      ILE  62  -2.034   0.095   0.213
  373   HG21  ILE  62          1HG2      ILE  62  -1.275   2.930  -2.071
  374   HG22  ILE  62          2HG2      ILE  62  -1.097   1.565  -3.187
  375   HG23  ILE  62          3HG2      ILE  62  -2.541   2.572  -3.271
  376   HD11  ILE  62          3HD1      ILE  62  -1.385  -1.327  -1.735
  377   HD12  ILE  62          1HD1      ILE  62  -0.038  -0.197  -2.056
  378   HD13  ILE  62          2HD1      ILE  62  -0.115  -1.112  -0.532
  379    H    GLN  63           H        GLN  63  -3.695   4.479  -1.421
  380    HA   GLN  63           HA       GLN  63  -1.961   5.711   0.379
  381    HB3  GLN  63           2HB      GLN  63  -4.620   6.771  -0.678
  382    HG3  GLN  63           2HG      GLN  63  -2.580   8.787  -0.553
  383   HE21  GLN  63          1HE2      GLN  63  -4.926   9.262  -1.519
  384   HE22  GLN  63          2HE2      GLN  63  -5.977  10.115  -0.388
  385    H    GLU  64           H        GLU  64  -5.524   5.326   0.936
  386    HA   GLU  64           HA       GLU  64  -5.256   6.604   3.481
  387    HB3  GLU  64           2HB      GLU  64  -7.576   6.155   3.844
  388    HG3  GLU  64           2HG      GLU  64  -7.304   6.587   0.844
  389    H    ARG  65           H        ARG  65  -5.181   3.130   2.632
  390    HA   ARG  65           HA       ARG  65  -5.079   2.144   5.318
  391    HB3  ARG  65           2HB      ARG  65  -3.533   0.344   4.077
  392    HG3  ARG  65           2HG      ARG  65  -6.468   0.660   3.360
  393    HD3  ARG  65           2HD      ARG  65  -6.363  -1.847   3.408
  394    HE   ARG  65           HE       ARG  65  -5.937  -0.561   1.246
  395   HH11  ARG  65          1HH1      ARG  65  -3.396  -2.762   2.491
  396   HH12  ARG  65          2HH1      ARG  65  -2.736  -2.956   0.899
  397   HH21  ARG  65          1HH2      ARG  65  -5.099  -0.923  -0.674
  398   HH22  ARG  65          2HH2      ARG  65  -3.760  -2.028  -0.921
  399    H    ILE  66           H        ILE  66  -2.726   4.072   3.671
  400    HA   ILE  66           HA       ILE  66  -0.616   3.281   5.670
  401    HB   ILE  66           HB       ILE  66  -0.430   4.966   3.137
  402   HG13  ILE  66          2HG1      ILE  66  -0.782   2.323   2.945
  403   HG21  ILE  66          1HG2      ILE  66   1.711   3.909   5.042
  404   HG22  ILE  66          2HG2      ILE  66   2.040   4.740   3.511
  405   HG23  ILE  66          3HG2      ILE  66   1.252   5.619   4.819
  406   HD11  ILE  66          3HD1      ILE  66   1.543   3.694   1.552
  407   HD12  ILE  66          1HD1      ILE  66   0.777   2.170   1.079
  408   HD13  ILE  66          2HD1      ILE  66  -0.157   3.670   1.019
  409    H    ALA  67           H        ALA  67  -2.430   6.103   4.425
  410    HA   ALA  67           HA       ALA  67  -1.235   7.968   6.264
  411    HB1  ALA  67           1HB      ALA  67  -2.150   8.566   4.042
  412    HB2  ALA  67           2HB      ALA  67  -3.788   8.139   4.589
  413    HB3  ALA  67           3HB      ALA  67  -2.931   9.505   5.330
  414    H    ALA  68           H        ALA  68  -4.235   5.987   6.476
  415    HA   ALA  68           HA       ALA  68  -5.208   7.330   8.885
  416    HB1  ALA  68           1HB      ALA  68  -6.704   6.261   7.208
  417    HB2  ALA  68           2HB      ALA  68  -6.013   4.673   7.619
  418    HB3  ALA  68           3HB      ALA  68  -6.905   5.592   8.836
  419    H    LEU  69           H        LEU  69  -3.432   4.314   8.210
  420    HA   LEU  69           HA       LEU  69  -3.416   3.347  10.921
  421    HB3  LEU  69           2HB      LEU  69  -1.527   1.891   9.898
  422    HG   LEU  69           HG       LEU  69  -3.013   0.586   8.406
  423   HD11  LEU  69          1HD1      LEU  69  -4.292   1.228  11.084
  424   HD12  LEU  69          2HD1      LEU  69  -2.872   0.186  10.859
  425   HD13  LEU  69          3HD1      LEU  69  -4.434  -0.272  10.157
  426   HD21  LEU  69          3HD2      LEU  69  -4.511   2.460   7.603
  427   HD22  LEU  69          1HD2      LEU  69  -5.278   2.456   9.202
  428   HD23  LEU  69          2HD2      LEU  69  -5.360   1.016   8.175
  429    H    GLY  70           H        GLY  70  -1.720   5.962   9.635
  430    HA2  GLY  70           2HA      GLY  70  -0.859   7.417  11.364
  431    HA3  GLY  70           3HA      GLY  70  -0.016   6.044  12.101
  432    H    TYR  71           H        TYR  71   0.262   6.123   8.667
  433    HA   TYR  71           HA       TYR  71   3.084   7.062   8.917
  434    HB3  TYR  71           2HB      TYR  71   3.668   5.237   7.473
  435    HD1  TYR  71           2HD      TYR  71   4.063   5.134  10.217
  436    HD2  TYR  71           1HD      TYR  71   1.001   3.068   7.991
  437    HE1  TYR  71           2HE      TYR  71   3.760   3.546  12.105
  438    HE2  TYR  71           1HE      TYR  71   0.718   1.464   9.868
  439    HH   TYR  71           HH       TYR  71   1.288   0.934  12.019
  440    H    THR  72           H        THR  72   3.771   6.920   6.176
  441    HA   THR  72           HA       THR  72   1.919   8.617   4.655
  442    HB   THR  72           HB       THR  72   3.275  10.225   6.013
  443    HG1  THR  72           1HG      THR  72   2.665  11.246   4.339
  444   HG21  THR  72          3HG2      THR  72   5.453   9.098   6.100
  445   HG22  THR  72          1HG2      THR  72   5.596  10.693   5.355
  446   HG23  THR  72          2HG2      THR  72   5.629   9.247   4.335
  447    H    LEU  73           H        LEU  73   3.165   9.209   2.468
  448    HA   LEU  73           HA       LEU  73   4.548   6.880   1.326
  449    HB3  LEU  73           2HB      LEU  73   2.188   6.142   1.491
  450    HG   LEU  73           HG       LEU  73   1.628   8.598  -0.241
  451   HD11  LEU  73          1HD1      LEU  73   0.968   6.700  -1.577
  452   HD12  LEU  73          2HD1      LEU  73  -0.477   7.479  -0.927
  453   HD13  LEU  73          3HD1      LEU  73   0.121   5.965  -0.200
  454   HD21  LEU  73          3HD2      LEU  73   0.071   7.316   2.056
  455   HD22  LEU  73          1HD2      LEU  73  -0.420   8.750   1.127
  456   HD23  LEU  73          2HD2      LEU  73   1.003   8.829   2.148
  457    H    ALA  74           H        ALA  74   5.009   7.017  -0.927
  458    HA   ALA  74           HA       ALA  74   4.092   9.298  -2.475
  459    HB1  ALA  74           1HB      ALA  74   6.346   9.972  -3.261
  460    HB2  ALA  74           2HB      ALA  74   6.143  10.279  -1.524
  461    HB3  ALA  74           3HB      ALA  74   7.088   8.879  -2.075
  462    H    GLU  75           H        GLU  75   3.431   8.482  -4.353
  463    HA   GLU  75           HA       GLU  75   4.957   6.252  -5.635
  464    HB3  GLU  75           2HB      GLU  75   1.937   6.612  -5.829
  465    HG3  GLU  75           2HG      GLU  75   2.237   4.116  -6.445
  466    HA   PRO  76           HA       PRO  76   5.031   9.913  -8.373
  467    HB3  PRO  76           2HB      PRO  76   7.103  10.376  -7.477
  468    HG3  PRO  76           2HG      PRO  76   8.646   8.654  -6.920
  469    HD3  PRO  76           2HD      PRO  76   6.744   8.030  -5.736
  Start of MODEL   25
    1    H2   PRO   6           2H       PRO   6  -6.450  -3.225 -17.248
    2    HA   PRO   6           HA       PRO   6  -8.318  -5.050 -15.975
    3    HB3  PRO   6           2HB      PRO   6  -7.525  -6.868 -17.017
    4    HG3  PRO   6           2HG      PRO   6  -7.012  -6.338 -19.249
    5    HD3  PRO   6           2HD      PRO   6  -8.611  -4.664 -18.643
    6    H    LEU   7           H        LEU   7  -7.056  -6.218 -14.139
    7    HA   LEU   7           HA       LEU   7  -5.688  -4.437 -12.461
    8    HB3  LEU   7           2HB      LEU   7  -6.845  -6.494 -11.721
    9    HG   LEU   7           HG       LEU   7  -4.332  -7.993 -12.616
   10   HD11  LEU   7          1HD1      LEU   7  -6.727  -8.891 -10.956
   11   HD12  LEU   7          2HD1      LEU   7  -5.073  -8.627 -10.363
   12   HD13  LEU   7          3HD1      LEU   7  -5.395  -9.932 -11.506
   13   HD21  LEU   7          3HD2      LEU   7  -5.955  -9.529 -13.775
   14   HD22  LEU   7          1HD2      LEU   7  -5.866  -7.933 -14.512
   15   HD23  LEU   7          2HD2      LEU   7  -7.244  -8.348 -13.457
   16    H    LYS   8           H        LYS   8  -3.630  -4.016 -11.962
   17    HA   LYS   8           HA       LYS   8  -1.408  -5.216 -13.522
   18    HB3  LYS   8           2HB      LYS   8  -2.108  -3.333 -14.904
   19    HG3  LYS   8           2HG      LYS   8  -1.725  -1.661 -12.405
   20    HD3  LYS   8           2HD      LYS   8  -2.290  -0.595 -15.189
   21    HE3  LYS   8           2HE      LYS   8  -1.572   0.582 -12.458
   22    HZ1  LYS   8           3HZ      LYS   8  -2.023   2.096 -14.949
   23    HZ2  LYS   8           1HZ      LYS   8  -0.511   1.827 -14.286
   24    HZ3  LYS   8           2HZ      LYS   8  -1.665   2.691 -13.478
   25    H    THR   9           H        THR   9   0.626  -4.994 -12.592
   26    HA   THR   9           HA       THR   9   0.553  -4.734  -9.634
   27    HB   THR   9           HB       THR   9   2.613  -5.993 -11.486
   28    HG1  THR   9           1HG      THR   9   0.548  -7.127  -9.887
   29   HG21  THR   9          3HG2      THR   9   2.219  -6.168  -8.458
   30   HG22  THR   9          1HG2      THR   9   3.637  -5.526  -9.322
   31   HG23  THR   9          2HG2      THR   9   3.263  -7.249  -9.411
   32    H    GLN  10           H        GLN  10   2.091  -3.486  -8.449
   33    HA   GLN  10           HA       GLN  10   4.124  -1.951  -9.759
   34    HB3  GLN  10           2HB      GLN  10   2.132  -0.564 -10.381
   35    HG3  GLN  10           2HG      GLN  10   1.817  -0.155  -7.372
   36   HE21  GLN  10          1HE2      GLN  10  -0.631   0.523  -9.823
   37   HE22  GLN  10          2HE2      GLN  10  -0.438   2.280  -9.778
   38    H    GLN  11           H        GLN  11   5.231  -0.524  -8.134
   39    HA   GLN  11           HA       GLN  11   4.795  -1.311  -5.322
   40    HB3  GLN  11           2HB      GLN  11   6.410  -2.952  -6.128
   41    HG3  GLN  11           2HG      GLN  11   8.127  -0.579  -6.930
   42   HE21  GLN  11          1HE2      GLN  11  10.344  -0.812  -6.664
   43   HE22  GLN  11          2HE2      GLN  11  11.123  -2.341  -6.313
   44    H    MET  12           H        MET  12   5.855   0.018  -3.762
   45    HA   MET  12           HA       MET  12   6.803   2.675  -4.558
   46    HB3  MET  12           2HB      MET  12   4.380   2.870  -4.914
   47    HG3  MET  12           2HG      MET  12   2.981   3.036  -2.759
   48    HE1  MET  12           3HE      MET  12   1.144   0.804  -5.258
   49    HE2  MET  12           1HE      MET  12   1.311   2.402  -4.512
   50    HE3  MET  12           2HE      MET  12   2.522   1.828  -5.686
   51    H    GLN  13           H        GLN  13   6.968   4.120  -2.581
   52    HA   GLN  13           HA       GLN  13   8.218   2.567  -0.360
   53    HB3  GLN  13           2HB      GLN  13   9.166   5.013   0.047
   54    HG3  GLN  13           2HG      GLN  13  10.035   3.358  -2.360
   55   HE21  GLN  13          1HE2      GLN  13  11.986   4.683   0.342
   56   HE22  GLN  13          2HE2      GLN  13  12.776   5.916  -0.635
   57    H    VAL  14           H        VAL  14   8.092   3.756   1.852
   58    HA   VAL  14           HA       VAL  14   5.496   5.015   2.361
   59    HB   VAL  14           HB       VAL  14   4.893   2.624   1.960
   60   HG11  VAL  14          1HG1      VAL  14   6.491   1.960   4.417
   61   HG12  VAL  14          2HG1      VAL  14   5.373   0.883   3.544
   62   HG13  VAL  14          3HG1      VAL  14   6.829   1.456   2.747
   63   HG21  VAL  14          3HG2      VAL  14   4.351   3.524   4.784
   64   HG22  VAL  14          1HG2      VAL  14   3.503   4.066   3.326
   65   HG23  VAL  14          2HG2      VAL  14   3.416   2.366   3.828
   66    H    GLY  15           H        GLY  15   5.363   6.050   4.269
   67    HA2  GLY  15           2HA      GLY  15   7.672   6.217   6.045
   68    HA3  GLY  15           3HA      GLY  15   6.093   6.991   6.277
   69    H    GLY  16           H        GLY  16   7.897   5.455   8.101
   70    HA2  GLY  16           2HA      GLY  16   7.540   4.341  10.048
   71    HA3  GLY  16           3HA      GLY  16   5.822   4.254   9.615
   72    H    MET  17           H        MET  17   6.597   2.455   7.126
   73    HA   MET  17           HA       MET  17   6.053   0.107   8.691
   74    HB3  MET  17           2HB      MET  17   5.719  -1.053   6.629
   75    HG3  MET  17           2HG      MET  17   4.162   0.418   5.454
   76    HE1  MET  17           3HE      MET  17   1.535   2.040   7.980
   77    HE2  MET  17           1HE      MET  17   2.974   2.929   7.428
   78    HE3  MET  17           2HE      MET  17   2.045   1.946   6.275
   79    H    ARG  18           H        ARG  18   9.045   1.239   8.649
   80    HA   ARG  18           HA       ARG  18  10.438  -1.335   8.153
   81    HB3  ARG  18           2HB      ARG  18  12.476  -0.097   8.782
   82    HG3  ARG  18           2HG      ARG  18  10.775   1.394   6.737
   83    HD3  ARG  18           2HD      ARG  18  13.793   1.168   7.172
   84    HE   ARG  18           HE       ARG  18  12.498   1.764   4.726
   85   HH11  ARG  18          1HH1      ARG  18  15.047   3.083   6.771
   86   HH12  ARG  18          2HH1      ARG  18  15.781   3.971   5.453
   87   HH21  ARG  18          1HH2      ARG  18  13.460   2.938   3.072
   88   HH22  ARG  18          2HH2      ARG  18  14.832   3.956   3.400
   89    H    CYS  19           H        CYS  19  11.768  -2.302   9.802
   90    HA   CYS  19           HA       CYS  19  12.385  -3.108  11.815
   91    HB3  CYS  19           2HB      CYS  19  11.281  -0.435  12.827
   92    HG   CYS  19           HG       CYS  19  13.378  -2.626  14.167
   93    H    ALA  20           H        ALA  20   9.346  -1.568  12.764
   94    HA   ALA  20           HA       ALA  20   8.567  -3.709  14.543
   95    HB1  ALA  20           1HB      ALA  20   6.669  -2.111  14.951
   96    HB2  ALA  20           2HB      ALA  20   8.244  -1.313  14.997
   97    HB3  ALA  20           3HB      ALA  20   7.208  -1.152  13.564
   98    H    ALA  21           H        ALA  21   6.031  -4.166  14.497
   99    HA   ALA  21           HA       ALA  21   5.407  -5.733  12.112
  100    HB1  ALA  21           1HB      ALA  21   5.027  -6.508  14.443
  101    HB2  ALA  21           2HB      ALA  21   3.824  -5.216  14.667
  102    HB3  ALA  21           3HB      ALA  21   3.538  -6.515  13.485
  103    H    CYS  22           H        CYS  22   5.194  -2.526  12.261
  104    HA   CYS  22           HA       CYS  22   2.570  -1.698  11.951
  105    HB3  CYS  22           2HB      CYS  22   3.641   0.265  10.721
  106    HG   CYS  22           HG       CYS  22   5.118   1.274  12.579
  107    H    ALA  23           H        ALA  23   4.657  -2.848   9.308
  108    HA   ALA  23           HA       ALA  23   3.053  -2.480   7.065
  109    HB1  ALA  23           1HB      ALA  23   4.297  -4.358   6.187
  110    HB2  ALA  23           2HB      ALA  23   5.358  -3.337   7.151
  111    HB3  ALA  23           3HB      ALA  23   4.766  -4.880   7.818
  112    H    SER  24           H        SER  24   2.519  -4.812   9.743
  113    HA   SER  24           HA       SER  24   0.673  -6.491   8.196
  114    HB3  SER  24           2HB      SER  24   0.326  -7.694  10.246
  115    HG   SER  24           HG       SER  24   2.399  -7.820   9.093
  116    H    SER  25           H        SER  25   0.318  -3.602  10.204
  117    HA   SER  25           HA       SER  25  -2.590  -3.828  10.460
  118    HB3  SER  25           2HB      SER  25  -2.512  -1.617  11.365
  119    HG   SER  25           HG       SER  25  -0.560  -1.846  12.837
  120    H    ILE  26           H        ILE  26  -0.508  -3.026   7.934
  121    HA   ILE  26           HA       ILE  26  -2.684  -1.717   6.341
  122    HB   ILE  26           HB       ILE  26   0.189  -2.354   5.614
  123   HG13  ILE  26          2HG1      ILE  26   0.702   0.040   5.806
  124   HG21  ILE  26          1HG2      ILE  26  -1.130  -2.212   3.631
  125   HG22  ILE  26          2HG2      ILE  26  -1.864  -0.679   4.154
  126   HG23  ILE  26          3HG2      ILE  26  -0.129  -0.763   3.771
  127   HD11  ILE  26          3HD1      ILE  26  -1.913   0.252   7.355
  128   HD12  ILE  26          1HD1      ILE  26  -0.666   1.505   7.200
  129   HD13  ILE  26          2HD1      ILE  26  -1.598   1.018   5.776
  130    H    GLU  27           H        GLU  27  -0.462  -4.551   6.231
  131    HA   GLU  27           HA       GLU  27  -1.557  -5.701   3.930
  132    HB3  GLU  27           2HB      GLU  27  -0.245  -7.237   6.189
  133    HG3  GLU  27           2HG      GLU  27  -0.108  -7.511   3.147
  134    H    ARG  28           H        ARG  28  -2.456  -6.341   7.363
  135    HA   ARG  28           HA       ARG  28  -4.253  -8.475   6.958
  136    HB3  ARG  28           2HB      ARG  28  -4.336  -6.208   8.993
  137    HG3  ARG  28           2HG      ARG  28  -5.489  -9.029   9.175
  138    HD3  ARG  28           2HD      ARG  28  -5.305  -6.744  11.177
  139    HE   ARG  28           HE       ARG  28  -7.122  -9.008  11.137
  140   HH11  ARG  28          1HH1      ARG  28  -5.148  -7.143  13.400
  141   HH12  ARG  28          2HH1      ARG  28  -6.337  -7.265  14.679
  142   HH21  ARG  28          1HH2      ARG  28  -8.564  -9.206  12.863
  143   HH22  ARG  28          2HH2      ARG  28  -8.078  -8.620  14.434
  144    H    ALA  29           H        ALA  29  -4.769  -5.038   6.372
  145    HA   ALA  29           HA       ALA  29  -7.660  -5.403   5.767
  146    HB1  ALA  29           1HB      ALA  29  -5.859  -2.937   5.734
  147    HB2  ALA  29           2HB      ALA  29  -7.621  -2.958   5.487
  148    HB3  ALA  29           3HB      ALA  29  -6.944  -3.419   7.061
  149    H    LEU  30           H        LEU  30  -4.535  -4.819   4.122
  150    HA   LEU  30           HA       LEU  30  -5.635  -4.148   1.588
  151    HB3  LEU  30           2HB      LEU  30  -2.896  -5.265   2.279
  152    HG   LEU  30           HG       LEU  30  -3.124  -5.026  -0.153
  153   HD11  LEU  30          1HD1      LEU  30  -3.897  -2.129   0.429
  154   HD12  LEU  30          2HD1      LEU  30  -4.924  -3.371  -0.327
  155   HD13  LEU  30          3HD1      LEU  30  -3.493  -2.790  -1.173
  156   HD21  LEU  30          3HD2      LEU  30  -1.499  -2.774   1.118
  157   HD22  LEU  30          1HD2      LEU  30  -1.236  -3.471  -0.494
  158   HD23  LEU  30          2HD2      LEU  30  -0.981  -4.465   0.952
  159    H    GLU  31           H        GLU  31  -5.140  -7.353   2.986
  160    HA   GLU  31           HA       GLU  31  -5.691  -8.625   0.394
  161    HB3  GLU  31           2HB      GLU  31  -4.354  -9.871   1.874
  162    HG3  GLU  31           2HG      GLU  31  -6.697 -10.079   3.803
  163    H    ARG  32           H        ARG  32  -7.633  -6.823   2.462
  164    HA   ARG  32           HA       ARG  32 -10.088  -8.334   1.743
  165    HB3  ARG  32           2HB      ARG  32 -11.122  -7.386   3.753
  166    HG3  ARG  32           2HG      ARG  32  -9.700  -8.185   5.624
  167    HD3  ARG  32           2HD      ARG  32 -11.156  -9.828   4.472
  168    HE   ARG  32           HE       ARG  32  -9.106  -9.860   2.492
  169   HH11  ARG  32          1HH1      ARG  32 -11.146 -12.296   4.092
  170   HH12  ARG  32          2HH1      ARG  32 -11.309 -13.195   2.614
  171   HH21  ARG  32          1HH2      ARG  32  -9.233 -11.070   0.775
  172   HH22  ARG  32          2HH2      ARG  32 -10.126 -12.583   0.783
  173    H    LEU  33           H        LEU  33  -8.604  -5.166   1.372
  174    HA   LEU  33           HA       LEU  33 -10.888  -3.540   0.961
  175    HB3  LEU  33           2HB      LEU  33  -9.437  -2.103  -0.420
  176    HG   LEU  33           HG       LEU  33  -7.726  -3.150   1.846
  177   HD11  LEU  33          1HD1      LEU  33  -7.744  -0.442   0.473
  178   HD12  LEU  33          2HD1      LEU  33  -6.576  -1.737   0.151
  179   HD13  LEU  33          3HD1      LEU  33  -6.640  -0.983   1.753
  180   HD21  LEU  33          3HD2      LEU  33  -9.759  -0.884   1.912
  181   HD22  LEU  33          1HD2      LEU  33  -8.621  -1.300   3.206
  182   HD23  LEU  33          2HD2      LEU  33  -9.908  -2.439   2.773
  183    H    LYS  34           H        LYS  34 -11.760  -2.611  -0.971
  184    HA   LYS  34           HA       LYS  34 -12.461  -4.531  -3.090
  185    HB3  LYS  34           2HB      LYS  34 -13.367  -2.216  -4.059
  186    HG3  LYS  34           2HG      LYS  34 -14.767  -4.110  -3.272
  187    HD3  LYS  34           2HD      LYS  34 -14.161  -4.177  -0.837
  188    HE3  LYS  34           2HE      LYS  34 -15.770  -1.573  -0.827
  189    HZ1  LYS  34           3HZ      LYS  34 -15.491  -1.703   1.568
  190    HZ2  LYS  34           1HZ      LYS  34 -14.823  -3.211   1.449
  191    HZ3  LYS  34           2HZ      LYS  34 -16.408  -2.955   1.018
  192    H    GLY  35           H        GLY  35 -12.034  -4.191  -5.357
  193    HA2  GLY  35           2HA      GLY  35 -10.883  -3.579  -7.246
  194    HA3  GLY  35           3HA      GLY  35 -10.172  -2.234  -6.335
  195    H    VAL  36           H        VAL  36  -8.715  -3.697  -4.432
  196    HA   VAL  36           HA       VAL  36  -6.367  -4.590  -5.852
  197    HB   VAL  36           HB       VAL  36  -5.509  -5.302  -3.649
  198   HG11  VAL  36          1HG1      VAL  36  -6.834  -2.547  -3.634
  199   HG12  VAL  36          2HG1      VAL  36  -5.514  -3.069  -2.577
  200   HG13  VAL  36          3HG1      VAL  36  -5.241  -2.957  -4.312
  201   HG21  VAL  36          3HG2      VAL  36  -8.244  -4.456  -2.596
  202   HG22  VAL  36          1HG2      VAL  36  -7.592  -6.107  -2.573
  203   HG23  VAL  36          2HG2      VAL  36  -6.833  -4.841  -1.604
  204    H    ALA  37           H        ALA  37  -5.483  -6.615  -6.101
  205    HA   ALA  37           HA       ALA  37  -7.197  -9.024  -5.569
  206    HB1  ALA  37           1HB      ALA  37  -5.744  -8.286  -8.152
  207    HB2  ALA  37           2HB      ALA  37  -6.646  -9.792  -7.862
  208    HB3  ALA  37           3HB      ALA  37  -7.503  -8.239  -7.899
  209    H    GLU  38           H        GLU  38  -3.997  -7.660  -5.409
  210    HA   GLU  38           HA       GLU  38  -3.063  -9.957  -3.996
  211    HB3  GLU  38           2HB      GLU  38  -1.240  -9.287  -6.298
  212    HG3  GLU  38           2HG      GLU  38  -1.827 -11.976  -5.008
  213    H    ALA  39           H        ALA  39  -1.201  -9.359  -2.703
  214    HA   ALA  39           HA       ALA  39   0.291  -6.942  -3.205
  215    HB1  ALA  39           1HB      ALA  39  -1.611  -6.962  -0.814
  216    HB2  ALA  39           2HB      ALA  39  -0.423  -5.696  -1.220
  217    HB3  ALA  39           3HB      ALA  39  -1.824  -5.970  -2.268
  218    H    SER  40           H        SER  40   2.027  -6.621  -1.640
  219    HA   SER  40           HA       SER  40   2.363  -8.392   0.648
  220    HB3  SER  40           2HB      SER  40   4.559  -9.349  -0.229
  221    HG   SER  40           HG       SER  40   1.976 -10.077  -1.035
  222    H    VAL  41           H        VAL  41   3.960  -7.746   2.052
  223    HA   VAL  41           HA       VAL  41   4.926  -4.955   1.601
  224    HB   VAL  41           HB       VAL  41   5.144  -4.810   4.042
  225   HG11  VAL  41          1HG1      VAL  41   2.387  -5.802   3.166
  226   HG12  VAL  41          2HG1      VAL  41   2.736  -4.806   4.585
  227   HG13  VAL  41          3HG1      VAL  41   3.018  -4.157   2.970
  228   HG21  VAL  41          3HG2      VAL  41   4.280  -6.518   5.556
  229   HG22  VAL  41          1HG2      VAL  41   3.862  -7.569   4.211
  230   HG23  VAL  41          2HG2      VAL  41   5.569  -7.221   4.579
  231    H    THR  42           H        THR  42   7.056  -4.335   2.193
  232    HA   THR  42           HA       THR  42   9.030  -6.507   2.790
  233    HB   THR  42           HB       THR  42   9.437  -4.301   0.741
  234    HG1  THR  42           1HG      THR  42   8.336  -6.034  -0.124
  235   HG21  THR  42          3HG2      THR  42  11.527  -4.815   2.074
  236   HG22  THR  42          1HG2      THR  42  11.636  -5.333   0.391
  237   HG23  THR  42          2HG2      THR  42  11.323  -6.529   1.652
  238    H    VAL  43           H        VAL  43   9.055  -6.044   4.884
  239    HA   VAL  43           HA       VAL  43   9.079  -3.414   6.045
  240    HB   VAL  43           HB       VAL  43   9.772  -6.157   7.151
  241   HG11  VAL  43          1HG1      VAL  43   9.516  -5.166   9.435
  242   HG12  VAL  43          2HG1      VAL  43  10.956  -4.582   8.608
  243   HG13  VAL  43          3HG1      VAL  43   9.518  -3.547   8.718
  244   HG21  VAL  43          3HG2      VAL  43   7.381  -5.713   6.497
  245   HG22  VAL  43          1HG2      VAL  43   7.565  -5.929   8.243
  246   HG23  VAL  43          2HG2      VAL  43   7.390  -4.299   7.563
  247    H    ALA  44           H        ALA  44  11.721  -5.597   4.953
  248    HA   ALA  44           HA       ALA  44  13.887  -4.570   6.414
  249    HB1  ALA  44           1HB      ALA  44  13.933  -6.629   5.078
  250    HB2  ALA  44           2HB      ALA  44  13.833  -5.690   3.573
  251    HB3  ALA  44           3HB      ALA  44  15.267  -5.560   4.616
  252    H    THR  45           H        THR  45  12.516  -3.293   3.407
  253    HA   THR  45           HA       THR  45  14.351  -0.919   3.468
  254    HB   THR  45           HB       THR  45  13.693  -0.706   1.054
  255    HG1  THR  45           1HG      THR  45  12.799  -2.666   0.174
  256   HG21  THR  45          3HG2      THR  45  15.806  -1.856   1.751
  257   HG22  THR  45          1HG2      THR  45  15.141  -2.474   0.233
  258   HG23  THR  45          2HG2      THR  45  14.945  -3.409   1.733
  259    H    GLY  46           H        GLY  46  11.036  -1.883   3.903
  260    HA2  GLY  46           2HA      GLY  46   9.193  -0.599   4.448
  261    HA3  GLY  46           3HA      GLY  46  10.176   0.884   4.351
  262    H    ARG  47           H        ARG  47   9.082  -1.736   2.179
  263    HA   ARG  47           HA       ARG  47   7.932   0.310   0.320
  264    HB3  ARG  47           2HB      ARG  47   8.376  -1.202  -1.563
  265    HG3  ARG  47           2HG      ARG  47  11.057  -0.727  -0.239
  266    HD3  ARG  47           2HD      ARG  47  11.829  -0.613  -2.567
  267    HE   ARG  47           HE       ARG  47  10.031  -3.005  -2.601
  268   HH11  ARG  47          1HH1      ARG  47  13.376  -1.868  -2.099
  269   HH12  ARG  47          2HH1      ARG  47  13.928  -3.516  -1.842
  270   HH21  ARG  47          1HH2      ARG  47  10.911  -5.041  -2.427
  271   HH22  ARG  47          2HH2      ARG  47  12.608  -5.210  -2.051
  272    H    LEU  48           H        LEU  48   6.248  -0.556  -1.037
  273    HA   LEU  48           HA       LEU  48   4.906  -3.043  -0.131
  274    HB3  LEU  48           2HB      LEU  48   2.949  -1.061  -1.067
  275    HG   LEU  48           HG       LEU  48   3.417  -2.460   1.595
  276   HD11  LEU  48          1HD1      LEU  48   1.099  -0.736   0.661
  277   HD12  LEU  48          2HD1      LEU  48   2.215  -0.393   2.001
  278   HD13  LEU  48          3HD1      LEU  48   1.085  -1.759   2.117
  279   HD21  LEU  48          3HD2      LEU  48   1.373  -2.972  -0.630
  280   HD22  LEU  48          1HD2      LEU  48   1.437  -3.823   0.931
  281   HD23  LEU  48          2HD2      LEU  48   2.751  -4.010  -0.223
  282    H    THR  49           H        THR  49   3.845  -4.157  -1.750
  283    HA   THR  49           HA       THR  49   4.037  -3.252  -4.597
  284    HB   THR  49           HB       THR  49   4.753  -6.038  -3.602
  285    HG1  THR  49           1HG      THR  49   6.800  -5.371  -4.590
  286   HG21  THR  49          3HG2      THR  49   3.695  -6.069  -5.846
  287   HG22  THR  49          1HG2      THR  49   5.425  -6.395  -5.977
  288   HG23  THR  49          2HG2      THR  49   4.800  -4.791  -6.400
  289    H    VAL  50           H        VAL  50   2.228  -3.594  -5.649
  290    HA   VAL  50           HA       VAL  50   0.023  -5.186  -4.460
  291    HB   VAL  50           HB       VAL  50  -0.044  -3.044  -3.275
  292   HG11  VAL  50          1HG1      VAL  50  -0.555  -0.929  -4.383
  293   HG12  VAL  50          2HG1      VAL  50   0.984  -1.567  -4.975
  294   HG13  VAL  50          3HG1      VAL  50  -0.475  -1.698  -5.978
  295   HG21  VAL  50          3HG2      VAL  50  -2.374  -2.449  -3.647
  296   HG22  VAL  50          1HG2      VAL  50  -2.379  -3.268  -5.216
  297   HG23  VAL  50          2HG2      VAL  50  -2.177  -4.207  -3.726
  298    H    THR  51           H        THR  51  -1.536  -5.787  -5.815
  299    HA   THR  51           HA       THR  51  -1.458  -4.956  -8.687
  300    HB   THR  51           HB       THR  51  -2.229  -7.660  -7.500
  301    HG1  THR  51           1HG      THR  51  -0.016  -7.521  -7.575
  302   HG21  THR  51          3HG2      THR  51  -2.362  -8.365  -9.884
  303   HG22  THR  51          1HG2      THR  51  -2.049  -6.697 -10.410
  304   HG23  THR  51          2HG2      THR  51  -3.544  -7.094  -9.546
  305    H    TYR  52           H        TYR  52  -3.164  -3.717  -9.127
  306    HA   TYR  52           HA       TYR  52  -5.813  -4.388  -7.999
  307    HB3  TYR  52           2HB      TYR  52  -4.760  -2.785  -6.443
  308    HD1  TYR  52           1HD      TYR  52  -6.208  -0.464  -9.005
  309    HD2  TYR  52           2HD      TYR  52  -2.797  -1.434  -6.560
  310    HE1  TYR  52           1HE      TYR  52  -5.214   1.753  -9.510
  311    HE2  TYR  52           2HE      TYR  52  -1.817   0.801  -7.032
  312    HH   TYR  52           HH       TYR  52  -2.146   2.904  -8.052
  313    H    ASP  53           H        ASP  53  -7.635  -3.318  -9.016
  314    HA   ASP  53           HA       ASP  53  -7.277  -3.097 -11.898
  315    HB3  ASP  53           2HB      ASP  53  -9.714  -3.245 -10.107
  316    HA   PRO  54           HA       PRO  54  -7.182   1.353 -11.287
  317    HB3  PRO  54           2HB      PRO  54  -5.483   1.263 -12.871
  318    HG3  PRO  54           2HG      PRO  54  -5.665  -0.119 -14.824
  319    HD3  PRO  54           2HD      PRO  54  -5.890  -1.545 -12.964
  320    H    LYS  55           H        LYS  55  -9.825  -0.236 -12.180
  321    HA   LYS  55           HA       LYS  55 -11.371   2.190 -13.106
  322    HB3  LYS  55           2HB      LYS  55 -12.984   0.678 -14.146
  323    HG3  LYS  55           2HG      LYS  55 -10.181   0.026 -15.157
  324    HD3  LYS  55           2HD      LYS  55 -12.888  -0.047 -16.573
  325    HE3  LYS  55           2HE      LYS  55 -11.604  -1.202 -18.367
  326    HZ1  LYS  55           3HZ      LYS  55 -10.399   1.432 -17.787
  327    HZ2  LYS  55           1HZ      LYS  55 -11.906   1.248 -18.467
  328    HZ3  LYS  55           2HZ      LYS  55 -10.555   0.741 -19.244
  329    H    GLN  56           H        GLN  56 -11.467  -0.854 -11.223
  330    HA   GLN  56           HA       GLN  56 -13.670  -0.090  -9.518
  331    HB3  GLN  56           2HB      GLN  56 -12.701  -1.757  -7.948
  332    HG3  GLN  56           2HG      GLN  56 -12.667  -2.874 -10.786
  333   HE21  GLN  56          1HE2      GLN  56 -14.846  -3.983  -8.328
  334   HE22  GLN  56          2HE2      GLN  56 -13.832  -5.273  -7.679
  335    H    VAL  57           H        VAL  57 -10.110   0.588  -9.273
  336    HA   VAL  57           HA       VAL  57 -10.717   2.695  -7.264
  337    HB   VAL  57           HB       VAL  57  -9.088   1.939  -5.639
  338   HG11  VAL  57          1HG1      VAL  57 -10.323   0.122  -4.593
  339   HG12  VAL  57          2HG1      VAL  57 -11.428   1.326  -5.266
  340   HG13  VAL  57          3HG1      VAL  57 -11.171  -0.229  -6.095
  341   HG21  VAL  57          3HG2      VAL  57  -8.850  -0.621  -7.297
  342   HG22  VAL  57          1HG2      VAL  57  -7.579   0.590  -7.034
  343   HG23  VAL  57          2HG2      VAL  57  -8.169  -0.373  -5.676
  344    H    SER  58           H        SER  58  -8.441   3.671  -6.477
  345    HA   SER  58           HA       SER  58  -6.306   3.472  -8.469
  346    HB3  SER  58           2HB      SER  58  -7.741   5.442  -9.190
  347    HG   SER  58           HG       SER  58  -6.447   6.981  -7.238
  348    H    GLU  59           H        GLU  59  -4.424   5.048  -7.455
  349    HA   GLU  59           HA       GLU  59  -3.418   3.996  -5.142
  350    HB3  GLU  59           2HB      GLU  59  -1.794   5.265  -5.909
  351    HG3  GLU  59           2HG      GLU  59  -3.020   6.223  -7.876
  352    H    ILE  60           H        ILE  60  -5.734   6.676  -5.207
  353    HA   ILE  60           HA       ILE  60  -5.962   7.547  -2.594
  354    HB   ILE  60           HB       ILE  60  -8.000   6.789  -4.694
  355   HG13  ILE  60          2HG1      ILE  60  -8.366   9.120  -4.947
  356   HG21  ILE  60          1HG2      ILE  60  -8.699   7.717  -1.900
  357   HG22  ILE  60          2HG2      ILE  60  -9.779   7.938  -3.300
  358   HG23  ILE  60          3HG2      ILE  60  -9.320   6.308  -2.807
  359   HD11  ILE  60          3HD1      ILE  60  -8.204   9.972  -2.620
  360   HD12  ILE  60          1HD1      ILE  60  -6.449   9.679  -2.636
  361   HD13  ILE  60          2HD1      ILE  60  -7.166  10.873  -3.729
  362    H    THR  61           H        THR  61  -7.220   4.381  -3.708
  363    HA   THR  61           HA       THR  61  -8.559   3.761  -1.252
  364    HB   THR  61           HB       THR  61  -7.705   2.254  -3.712
  365    HG1  THR  61           1HG      THR  61  -9.524   3.358  -3.869
  366   HG21  THR  61          3HG2      THR  61  -8.851   0.916  -1.222
  367   HG22  THR  61          1HG2      THR  61  -7.375   0.484  -2.104
  368   HG23  THR  61          2HG2      THR  61  -8.946   0.230  -2.855
  369    H    ILE  62           H        ILE  62  -5.218   3.220  -2.205
  370    HA   ILE  62           HA       ILE  62  -4.736   1.691   0.320
  371    HB   ILE  62           HB       ILE  62  -3.959   0.648  -1.718
  372   HG13  ILE  62          2HG1      ILE  62  -2.738   0.361   0.432
  373   HG21  ILE  62          1HG2      ILE  62  -2.172   3.075  -2.176
  374   HG22  ILE  62          2HG2      ILE  62  -2.125   1.560  -3.101
  375   HG23  ILE  62          3HG2      ILE  62  -3.557   2.563  -3.172
  376   HD11  ILE  62          3HD1      ILE  62  -2.108  -0.933  -1.688
  377   HD12  ILE  62          1HD1      ILE  62  -0.758   0.213  -1.870
  378   HD13  ILE  62          2HD1      ILE  62  -0.867  -0.812  -0.433
  379    H    GLN  63           H        GLN  63  -3.919   4.756  -1.262
  380    HA   GLN  63           HA       GLN  63  -2.089   5.886   0.584
  381    HB3  GLN  63           2HB      GLN  63  -3.494   8.039  -0.065
  382    HG3  GLN  63           2HG      GLN  63  -2.091   6.349  -2.176
  383   HE21  GLN  63          1HE2      GLN  63  -0.544   8.358  -3.218
  384   HE22  GLN  63          2HE2      GLN  63  -1.597   9.444  -4.128
  385    H    GLU  64           H        GLU  64  -5.682   5.934   0.698
  386    HA   GLU  64           HA       GLU  64  -5.986   7.155   3.242
  387    HB3  GLU  64           2HB      GLU  64  -8.216   5.717   3.081
  388    HG3  GLU  64           2HG      GLU  64  -8.912   7.213   1.043
  389    H    ARG  65           H        ARG  65  -5.188   3.738   2.526
  390    HA   ARG  65           HA       ARG  65  -5.808   2.928   5.283
  391    HB3  ARG  65           2HB      ARG  65  -4.322   1.459   3.059
  392    HG3  ARG  65           2HG      ARG  65  -3.821   0.280   5.079
  393    HD3  ARG  65           2HD      ARG  65  -5.304   1.022   6.769
  394    HE   ARG  65           HE       ARG  65  -7.369   1.027   4.943
  395   HH11  ARG  65          1HH1      ARG  65  -7.187  -0.482   8.185
  396   HH12  ARG  65          2HH1      ARG  65  -8.842  -0.030   8.505
  397   HH21  ARG  65          1HH2      ARG  65  -9.389   1.409   5.395
  398   HH22  ARG  65          2HH2      ARG  65 -10.138   0.924   6.897
  399    H    ILE  66           H        ILE  66  -2.816   3.732   3.463
  400    HA   ILE  66           HA       ILE  66  -1.129   3.363   5.850
  401    HB   ILE  66           HB       ILE  66  -0.657   4.774   3.195
  402   HG13  ILE  66          2HG1      ILE  66   0.424   2.224   4.511
  403   HG21  ILE  66          1HG2      ILE  66   1.276   4.478   5.533
  404   HG22  ILE  66          2HG2      ILE  66   1.674   5.103   3.918
  405   HG23  ILE  66          3HG2      ILE  66   0.591   6.017   4.939
  406   HD11  ILE  66          3HD1      ILE  66  -0.773   2.720   1.759
  407   HD12  ILE  66          1HD1      ILE  66  -0.014   1.208   2.270
  408   HD13  ILE  66          2HD1      ILE  66  -1.511   1.741   3.059
  409    H    ALA  67           H        ALA  67  -2.798   6.212   4.456
  410    HA   ALA  67           HA       ALA  67  -1.797   8.055   6.374
  411    HB1  ALA  67           1HB      ALA  67  -2.836   8.723   4.247
  412    HB2  ALA  67           2HB      ALA  67  -4.403   8.070   4.774
  413    HB3  ALA  67           3HB      ALA  67  -3.692   9.467   5.606
  414    H    ALA  68           H        ALA  68  -4.634   5.811   6.529
  415    HA   ALA  68           HA       ALA  68  -5.700   6.970   8.950
  416    HB1  ALA  68           1HB      ALA  68  -6.235   4.315   7.556
  417    HB2  ALA  68           2HB      ALA  68  -7.204   5.006   8.878
  418    HB3  ALA  68           3HB      ALA  68  -7.113   5.849   7.324
  419    H    LEU  69           H        LEU  69  -3.222   4.560   8.337
  420    HA   LEU  69           HA       LEU  69  -2.954   3.975  11.219
  421    HB3  LEU  69           2HB      LEU  69  -0.639   3.083  10.238
  422    HG   LEU  69           HG       LEU  69  -1.558   0.926   9.794
  423   HD11  LEU  69          1HD1      LEU  69  -1.447   1.783  12.169
  424   HD12  LEU  69          2HD1      LEU  69  -2.615   0.475  11.910
  425   HD13  LEU  69          3HD1      LEU  69  -3.194   2.123  12.066
  426   HD21  LEU  69          3HD2      LEU  69  -3.939   0.423   9.738
  427   HD22  LEU  69          1HD2      LEU  69  -3.534   1.537   8.429
  428   HD23  LEU  69          2HD2      LEU  69  -4.356   2.138   9.881
  429    H    GLY  70           H        GLY  70  -2.403   6.756   9.522
  430    HA2  GLY  70           2HA      GLY  70  -1.767   8.730  10.552
  431    HA3  GLY  70           3HA      GLY  70  -0.843   7.832  11.779
  432    H    TYR  71           H        TYR  71   0.016   6.692   8.737
  433    HA   TYR  71           HA       TYR  71   2.558   8.252   8.773
  434    HB3  TYR  71           2HB      TYR  71   3.453   6.358   7.511
  435    HD1  TYR  71           2HD      TYR  71   4.433   6.809   9.884
  436    HD2  TYR  71           1HD      TYR  71   1.208   4.074   9.074
  437    HE1  TYR  71           2HE      TYR  71   4.949   5.590  11.969
  438    HE2  TYR  71           1HE      TYR  71   1.736   2.820  11.158
  439    HH   TYR  71           HH       TYR  71   4.336   3.901  13.398
  440    H    THR  72           H        THR  72   3.220   7.488   6.006
  441    HA   THR  72           HA       THR  72   1.125   8.559   4.292
  442    HB   THR  72           HB       THR  72   3.443  10.104   3.528
  443    HG1  THR  72           1HG      THR  72   3.593  11.474   5.298
  444   HG21  THR  72          3HG2      THR  72   1.840  11.971   3.823
  445   HG22  THR  72          1HG2      THR  72   0.731  10.882   4.678
  446   HG23  THR  72          2HG2      THR  72   1.130  10.601   2.968
  447    H    LEU  73           H        LEU  73   1.180   7.702   2.320
  448    HA   LEU  73           HA       LEU  73   3.307   5.836   1.576
  449    HB3  LEU  73           2HB      LEU  73   0.792   6.686   0.078
  450    HG   LEU  73           HG       LEU  73   2.441   5.173  -1.185
  451   HD11  LEU  73          1HD1      LEU  73   3.187   3.786   0.747
  452   HD12  LEU  73          2HD1      LEU  73   2.468   2.779  -0.513
  453   HD13  LEU  73          3HD1      LEU  73   1.537   3.165   0.932
  454   HD21  LEU  73          3HD2      LEU  73   0.072   5.298  -1.789
  455   HD22  LEU  73          1HD2      LEU  73  -0.342   4.101  -0.540
  456   HD23  LEU  73          2HD2      LEU  73   0.646   3.631  -1.941
  457    H    ALA  74           H        ALA  74   4.772   6.011  -0.100
  458    HA   ALA  74           HA       ALA  74   4.974   8.643  -1.525
  459    HB1  ALA  74           1HB      ALA  74   7.414   8.081  -1.574
  460    HB2  ALA  74           2HB      ALA  74   6.763   8.348   0.056
  461    HB3  ALA  74           3HB      ALA  74   7.079   6.698  -0.518
  462    H    GLU  75           H        GLU  75   3.667   8.063  -3.253
  463    HA   GLU  75           HA       GLU  75   4.912   6.253  -5.260
  464    HB3  GLU  75           2HB      GLU  75   1.906   6.584  -4.856
  465    HG3  GLU  75           2HG      GLU  75   1.993   4.297  -6.051
  466    HA   PRO  76           HA       PRO  76   4.394  10.414  -7.088
  467    HB3  PRO  76           2HB      PRO  76   6.658  10.659  -6.629
  468    HG3  PRO  76           2HG      PRO  76   8.202   8.889  -6.971
  469    HD3  PRO  76           2HD      PRO  76   6.652   7.888  -5.557
  Start of MODEL   26
    1    H2   PRO   6           2H       PRO   6  -7.245  -2.340 -16.621
    2    HA   PRO   6           HA       PRO   6  -8.305  -4.881 -15.643
    3    HB3  PRO   6           2HB      PRO   6  -7.043  -6.053 -17.215
    4    HG3  PRO   6           2HG      PRO   6  -8.354  -5.131 -18.923
    5    HD3  PRO   6           2HD      PRO   6  -9.635  -3.791 -17.544
    6    H    LEU   7           H        LEU   7  -6.616  -6.085 -14.358
    7    HA   LEU   7           HA       LEU   7  -5.435  -4.265 -12.487
    8    HB3  LEU   7           2HB      LEU   7  -6.599  -6.290 -11.836
    9    HG   LEU   7           HG       LEU   7  -5.409  -7.761 -13.763
   10   HD11  LEU   7          1HD1      LEU   7  -3.651  -9.186 -12.912
   11   HD12  LEU   7          2HD1      LEU   7  -3.752  -8.445 -11.306
   12   HD13  LEU   7          3HD1      LEU   7  -3.103  -7.520 -12.670
   13   HD21  LEU   7          3HD2      LEU   7  -6.148  -8.793 -10.991
   14   HD22  LEU   7          1HD2      LEU   7  -6.041  -9.779 -12.469
   15   HD23  LEU   7          2HD2      LEU   7  -7.265  -8.507 -12.340
   16    H    LYS   8           H        LYS   8  -3.373  -3.960 -11.906
   17    HA   LYS   8           HA       LYS   8  -1.140  -5.221 -13.337
   18    HB3  LYS   8           2HB      LYS   8  -1.511  -3.360 -14.822
   19    HG3  LYS   8           2HG      LYS   8  -1.786  -1.686 -12.307
   20    HD3  LYS   8           2HD      LYS   8  -1.438   0.318 -13.847
   21    HE3  LYS   8           2HE      LYS   8   0.836  -1.426 -12.865
   22    HZ1  LYS   8           3HZ      LYS   8   1.731  -0.074 -14.606
   23    HZ2  LYS   8           1HZ      LYS   8   2.232   0.526 -13.150
   24    HZ3  LYS   8           2HZ      LYS   8   1.045   1.285 -14.038
   25    H    THR   9           H        THR   9   0.819  -5.170 -12.226
   26    HA   THR   9           HA       THR   9   0.629  -4.474  -9.355
   27    HB   THR   9           HB       THR   9   1.602  -6.650 -10.108
   28    HG1  THR   9           1HG      THR   9   3.125  -6.481  -8.479
   29   HG21  THR   9          3HG2      THR   9   3.868  -6.758 -10.867
   30   HG22  THR   9          1HG2      THR   9   4.102  -5.004 -10.694
   31   HG23  THR   9          2HG2      THR   9   3.061  -5.642 -11.977
   32    H    GLN  10           H        GLN  10   2.239  -3.227  -8.307
   33    HA   GLN  10           HA       GLN  10   3.875  -1.379  -9.836
   34    HB3  GLN  10           2HB      GLN  10   1.620  -0.269  -8.120
   35    HG3  GLN  10           2HG      GLN  10   3.620   1.264  -8.556
   36   HE21  GLN  10          1HE2      GLN  10   3.678   3.363 -10.251
   37   HE22  GLN  10          2HE2      GLN  10   4.064   2.843 -11.885
   38    H    GLN  11           H        GLN  11   5.622  -0.732  -8.593
   39    HA   GLN  11           HA       GLN  11   5.736  -1.520  -5.721
   40    HB3  GLN  11           2HB      GLN  11   8.118  -0.458  -6.039
   41    HG3  GLN  11           2HG      GLN  11   7.650  -2.887  -5.682
   42   HE21  GLN  11          1HE2      GLN  11   6.643  -4.709  -6.520
   43   HE22  GLN  11          2HE2      GLN  11   6.553  -5.099  -8.243
   44    H    MET  12           H        MET  12   6.427  -0.012  -4.110
   45    HA   MET  12           HA       MET  12   5.651   2.823  -4.492
   46    HB3  MET  12           2HB      MET  12   4.127   0.644  -3.011
   47    HG3  MET  12           2HG      MET  12   3.532   3.628  -2.933
   48    HE1  MET  12           3HE      MET  12   1.139   3.479  -3.945
   49    HE2  MET  12           1HE      MET  12   1.362   1.766  -4.391
   50    HE3  MET  12           2HE      MET  12  -0.077   2.274  -3.498
   51    H    GLN  13           H        GLN  13   6.358   4.139  -2.922
   52    HA   GLN  13           HA       GLN  13   8.241   3.122  -0.868
   53    HB3  GLN  13           2HB      GLN  13   7.679   5.892  -2.024
   54    HG3  GLN  13           2HG      GLN  13  10.075   5.122  -0.324
   55   HE21  GLN  13          1HE2      GLN  13  11.174   6.251  -2.291
   56   HE22  GLN  13          2HE2      GLN  13  11.205   8.018  -2.239
   57    H    VAL  14           H        VAL  14   7.954   3.960   1.332
   58    HA   VAL  14           HA       VAL  14   5.570   5.512   1.986
   59    HB   VAL  14           HB       VAL  14   4.472   3.427   2.138
   60   HG11  VAL  14          1HG1      VAL  14   6.771   2.323   3.779
   61   HG12  VAL  14          2HG1      VAL  14   5.235   1.496   3.433
   62   HG13  VAL  14          3HG1      VAL  14   6.345   1.862   2.114
   63   HG21  VAL  14          3HG2      VAL  14   3.798   3.232   4.431
   64   HG22  VAL  14          1HG2      VAL  14   5.258   4.058   4.995
   65   HG23  VAL  14          2HG2      VAL  14   4.043   4.942   4.043
   66    H    GLY  15           H        GLY  15   5.788   6.763   3.686
   67    HA2  GLY  15           2HA      GLY  15   8.427   6.957   5.016
   68    HA3  GLY  15           3HA      GLY  15   7.081   8.114   5.115
   69    H    GLY  16           H        GLY  16   8.827   6.287   6.989
   70    HA2  GLY  16           2HA      GLY  16   8.620   5.834   9.206
   71    HA3  GLY  16           3HA      GLY  16   6.887   6.195   9.129
   72    H    MET  17           H        MET  17   6.680   3.919   6.930
   73    HA   MET  17           HA       MET  17   6.255   1.745   8.868
   74    HB3  MET  17           2HB      MET  17   5.966   1.702   5.847
   75    HG3  MET  17           2HG      MET  17   4.262   0.167   7.787
   76    HE1  MET  17           3HE      MET  17   6.556  -0.225   4.576
   77    HE2  MET  17           1HE      MET  17   6.479  -1.821   5.354
   78    HE3  MET  17           2HE      MET  17   5.721  -1.568   3.769
   79    H    ARG  18           H        ARG  18   7.914   0.478   9.486
   80    HA   ARG  18           HA       ARG  18   9.471  -1.097   7.664
   81    HB3  ARG  18           2HB      ARG  18  10.813   0.861   7.317
   82    HG3  ARG  18           2HG      ARG  18  11.271   0.967  10.327
   83    HD3  ARG  18           2HD      ARG  18  12.272   2.673   7.994
   84    HE   ARG  18           HE       ARG  18  13.137   3.074  10.802
   85   HH11  ARG  18          1HH1      ARG  18  11.109   4.347   8.160
   86   HH12  ARG  18          2HH1      ARG  18  11.220   5.977   8.742
   87   HH21  ARG  18          1HH2      ARG  18  13.082   5.160  11.588
   88   HH22  ARG  18          2HH2      ARG  18  12.125   6.381  10.766
   89    H    CYS  19           H        CYS  19   7.913  -1.055  10.412
   90    HA   CYS  19           HA       CYS  19   9.511  -3.362  11.441
   91    HB3  CYS  19           2HB      CYS  19   9.313  -1.450  13.060
   92    HG   CYS  19           HG       CYS  19   7.116  -0.292  12.422
   93    H    ALA  20           H        ALA  20   8.304  -5.218  12.123
   94    HA   ALA  20           HA       ALA  20   6.387  -6.008  10.166
   95    HB1  ALA  20           1HB      ALA  20   8.005  -7.525  11.237
   96    HB2  ALA  20           2HB      ALA  20   7.183  -7.327  12.797
   97    HB3  ALA  20           3HB      ALA  20   6.344  -8.116  11.444
   98    H    ALA  21           H        ALA  21   5.874  -4.907  13.542
   99    HA   ALA  21           HA       ALA  21   3.142  -5.481  13.811
  100    HB1  ALA  21           1HB      ALA  21   4.721  -3.059  14.813
  101    HB2  ALA  21           2HB      ALA  21   3.149  -3.603  15.432
  102    HB3  ALA  21           3HB      ALA  21   4.577  -4.636  15.622
  103    H    CYS  22           H        CYS  22   4.470  -2.333  12.572
  104    HA   CYS  22           HA       CYS  22   1.874  -1.460  11.783
  105    HB3  CYS  22           2HB      CYS  22   3.811   0.043  12.306
  106    HG   CYS  22           HG       CYS  22   5.684  -1.496  11.016
  107    H    ALA  23           H        ALA  23   4.433  -2.976   9.753
  108    HA   ALA  23           HA       ALA  23   3.107  -3.066   7.311
  109    HB1  ALA  23           1HB      ALA  23   4.814  -5.204   8.644
  110    HB2  ALA  23           2HB      ALA  23   4.552  -4.972   6.906
  111    HB3  ALA  23           3HB      ALA  23   5.431  -3.748   7.825
  112    H    SER  24           H        SER  24   2.338  -4.914  10.271
  113    HA   SER  24           HA       SER  24   0.630  -6.877   8.893
  114    HB3  SER  24           2HB      SER  24  -0.015  -7.562  11.137
  115    HG   SER  24           HG       SER  24   2.794  -7.047  11.065
  116    H    SER  25           H        SER  25   0.123  -3.685  10.313
  117    HA   SER  25           HA       SER  25  -2.815  -3.932  10.321
  118    HB3  SER  25           2HB      SER  25  -2.835  -1.650  11.092
  119    HG   SER  25           HG       SER  25  -1.791  -1.912  13.016
  120    H    ILE  26           H        ILE  26  -0.306  -2.766   8.142
  121    HA   ILE  26           HA       ILE  26  -2.281  -1.836   6.135
  122    HB   ILE  26           HB       ILE  26   0.674  -2.586   5.853
  123   HG13  ILE  26          2HG1      ILE  26  -0.811   0.080   5.765
  124   HG21  ILE  26          1HG2      ILE  26  -0.477  -3.182   3.757
  125   HG22  ILE  26          2HG2      ILE  26  -1.292  -1.601   3.730
  126   HG23  ILE  26          3HG2      ILE  26   0.466  -1.727   3.514
  127   HD11  ILE  26          3HD1      ILE  26   1.759  -0.732   7.199
  128   HD12  ILE  26          1HD1      ILE  26   1.034   0.888   7.189
  129   HD13  ILE  26          2HD1      ILE  26   0.194  -0.449   7.989
  130    H    GLU  27           H        GLU  27  -0.192  -4.765   6.391
  131    HA   GLU  27           HA       GLU  27  -1.269  -5.708   3.988
  132    HB3  GLU  27           2HB      GLU  27   0.212  -7.414   6.020
  133    HG3  GLU  27           2HG      GLU  27   0.073  -7.340   2.969
  134    H    ARG  28           H        ARG  28  -2.150  -6.717   7.350
  135    HA   ARG  28           HA       ARG  28  -3.802  -8.868   6.311
  136    HB3  ARG  28           2HB      ARG  28  -4.053  -7.817   9.132
  137    HG3  ARG  28           2HG      ARG  28  -4.119 -10.539   7.745
  138    HD3  ARG  28           2HD      ARG  28  -4.243 -10.060  10.745
  139    HE   ARG  28           HE       ARG  28  -5.115 -12.241   9.223
  140   HH11  ARG  28          1HH1      ARG  28  -2.676 -11.869  11.787
  141   HH12  ARG  28          2HH1      ARG  28  -2.830 -13.555  12.247
  142   HH21  ARG  28          1HH2      ARG  28  -5.371 -14.299  10.014
  143   HH22  ARG  28          2HH2      ARG  28  -4.304 -14.901  11.250
  144    H    ALA  29           H        ALA  29  -4.373  -5.509   6.550
  145    HA   ALA  29           HA       ALA  29  -7.328  -5.825   6.257
  146    HB1  ALA  29           1HB      ALA  29  -6.517  -3.998   7.694
  147    HB2  ALA  29           2HB      ALA  29  -5.541  -3.353   6.350
  148    HB3  ALA  29           3HB      ALA  29  -7.316  -3.365   6.235
  149    H    LEU  30           H        LEU  30  -4.404  -5.010   4.359
  150    HA   LEU  30           HA       LEU  30  -5.685  -4.162   1.991
  151    HB3  LEU  30           2HB      LEU  30  -2.994  -5.513   2.459
  152    HG   LEU  30           HG       LEU  30  -3.257  -5.316   0.043
  153   HD11  LEU  30          1HD1      LEU  30  -3.877  -2.368   0.547
  154   HD12  LEU  30          2HD1      LEU  30  -4.994  -3.584  -0.128
  155   HD13  LEU  30          3HD1      LEU  30  -3.562  -3.102  -1.040
  156   HD21  LEU  30          3HD2      LEU  30  -1.330  -3.772  -0.363
  157   HD22  LEU  30          1HD2      LEU  30  -1.060  -4.823   1.043
  158   HD23  LEU  30          2HD2      LEU  30  -1.517  -3.120   1.272
  159    H    GLU  31           H        GLU  31  -5.499  -7.393   3.228
  160    HA   GLU  31           HA       GLU  31  -6.294  -8.643   0.678
  161    HB3  GLU  31           2HB      GLU  31  -4.918 -10.005   2.038
  162    HG3  GLU  31           2HG      GLU  31  -6.916  -9.549   4.292
  163    H    ARG  32           H        ARG  32  -7.934  -6.782   2.951
  164    HA   ARG  32           HA       ARG  32 -10.535  -8.031   2.231
  165    HB3  ARG  32           2HB      ARG  32 -11.488  -6.963   4.213
  166    HG3  ARG  32           2HG      ARG  32  -9.023  -8.474   5.150
  167    HD3  ARG  32           2HD      ARG  32 -11.951  -8.506   5.988
  168    HE   ARG  32           HE       ARG  32  -9.764 -10.238   6.723
  169   HH11  ARG  32          1HH1      ARG  32 -12.454  -8.508   8.277
  170   HH12  ARG  32          2HH1      ARG  32 -12.466  -9.652   9.611
  171   HH21  ARG  32          1HH2      ARG  32 -10.164 -11.812   8.245
  172   HH22  ARG  32          2HH2      ARG  32 -11.219 -11.438   9.604
  173    H    LEU  33           H        LEU  33  -8.627  -5.100   1.951
  174    HA   LEU  33           HA       LEU  33 -10.706  -3.325   1.018
  175    HB3  LEU  33           2HB      LEU  33  -8.920  -2.193  -0.208
  176    HG   LEU  33           HG       LEU  33  -7.715  -3.118   2.428
  177   HD11  LEU  33          1HD1      LEU  33  -6.201  -1.885   0.888
  178   HD12  LEU  33          2HD1      LEU  33  -6.529  -0.992   2.381
  179   HD13  LEU  33          3HD1      LEU  33  -7.346  -0.538   0.871
  180   HD21  LEU  33          3HD2      LEU  33  -8.734  -1.096   3.432
  181   HD22  LEU  33          1HD2      LEU  33  -9.949  -2.275   2.928
  182   HD23  LEU  33          2HD2      LEU  33  -9.651  -0.827   1.932
  183    H    LYS  34           H        LYS  34 -11.627  -2.962  -0.940
  184    HA   LYS  34           HA       LYS  34 -11.820  -5.309  -2.729
  185    HB3  LYS  34           2HB      LYS  34 -13.654  -3.970  -3.771
  186    HG3  LYS  34           2HG      LYS  34 -13.956  -4.061  -0.740
  187    HD3  LYS  34           2HD      LYS  34 -16.226  -4.840  -1.213
  188    HE3  LYS  34           2HE      LYS  34 -15.792  -2.285  -2.809
  189    HZ1  LYS  34           3HZ      LYS  34 -18.090  -3.068  -2.633
  190    HZ2  LYS  34           1HZ      LYS  34 -17.894  -1.712  -1.733
  191    HZ3  LYS  34           2HZ      LYS  34 -17.979  -3.188  -1.011
  192    H    GLY  35           H        GLY  35 -11.878  -4.822  -5.185
  193    HA2  GLY  35           2HA      GLY  35 -10.896  -4.033  -7.135
  194    HA3  GLY  35           3HA      GLY  35 -10.303  -2.641  -6.222
  195    H    VAL  36           H        VAL  36  -8.662  -3.963  -4.388
  196    HA   VAL  36           HA       VAL  36  -6.229  -4.596  -5.760
  197    HB   VAL  36           HB       VAL  36  -7.128  -5.117  -2.898
  198   HG11  VAL  36          1HG1      VAL  36  -5.222  -6.614  -3.344
  199   HG12  VAL  36          2HG1      VAL  36  -4.291  -5.260  -4.026
  200   HG13  VAL  36          3HG1      VAL  36  -4.717  -5.286  -2.304
  201   HG21  VAL  36          3HG2      VAL  36  -5.798  -3.125  -2.348
  202   HG22  VAL  36          1HG2      VAL  36  -5.384  -2.905  -4.061
  203   HG23  VAL  36          2HG2      VAL  36  -7.063  -2.722  -3.506
  204    H    ALA  37           H        ALA  37  -5.280  -6.510  -6.275
  205    HA   ALA  37           HA       ALA  37  -6.900  -9.039  -6.071
  206    HB1  ALA  37           1HB      ALA  37  -6.654  -8.114  -8.344
  207    HB2  ALA  37           2HB      ALA  37  -4.884  -8.126  -8.175
  208    HB3  ALA  37           3HB      ALA  37  -5.790  -9.654  -8.187
  209    H    GLU  38           H        GLU  38  -3.632  -7.702  -5.621
  210    HA   GLU  38           HA       GLU  38  -2.743  -9.883  -3.964
  211    HB3  GLU  38           2HB      GLU  38  -1.580  -9.646  -6.772
  212    HG3  GLU  38           2HG      GLU  38  -0.758 -11.474  -4.475
  213    H    ALA  39           H        ALA  39  -1.242  -9.017  -2.526
  214    HA   ALA  39           HA       ALA  39   0.563  -6.837  -3.408
  215    HB1  ALA  39           1HB      ALA  39  -1.595  -5.787  -2.683
  216    HB2  ALA  39           2HB      ALA  39  -1.395  -6.549  -1.091
  217    HB3  ALA  39           3HB      ALA  39  -0.217  -5.339  -1.660
  218    H    SER  40           H        SER  40   2.129  -6.196  -1.668
  219    HA   SER  40           HA       SER  40   2.605  -8.132   0.492
  220    HB3  SER  40           2HB      SER  40   4.538  -7.945  -1.828
  221    HG   SER  40           HG       SER  40   5.653  -9.554  -0.665
  222    H    VAL  41           H        VAL  41   3.625  -7.198   2.157
  223    HA   VAL  41           HA       VAL  41   5.022  -4.588   1.932
  224    HB   VAL  41           HB       VAL  41   5.293  -4.691   4.373
  225   HG11  VAL  41          1HG1      VAL  41   2.479  -5.400   3.477
  226   HG12  VAL  41          2HG1      VAL  41   2.937  -4.647   5.020
  227   HG13  VAL  41          3HG1      VAL  41   3.232  -3.793   3.508
  228   HG21  VAL  41          3HG2      VAL  41   4.072  -6.673   5.573
  229   HG22  VAL  41          1HG2      VAL  41   4.414  -7.567   4.090
  230   HG23  VAL  41          2HG2      VAL  41   5.739  -6.870   5.012
  231    H    THR  42           H        THR  42   7.180  -4.215   2.174
  232    HA   THR  42           HA       THR  42   9.032  -6.516   2.734
  233    HB   THR  42           HB       THR  42   9.526  -4.100   0.954
  234    HG1  THR  42           1HG      THR  42   8.396  -5.638  -0.125
  235   HG21  THR  42          3HG2      THR  42  11.600  -4.691   2.141
  236   HG22  THR  42          1HG2      THR  42  11.695  -5.261   0.471
  237   HG23  THR  42          2HG2      THR  42  11.355  -6.412   1.781
  238    H    VAL  43           H        VAL  43   9.354  -6.259   4.852
  239    HA   VAL  43           HA       VAL  43   9.044  -3.746   6.194
  240    HB   VAL  43           HB       VAL  43  10.084  -6.422   7.208
  241   HG11  VAL  43          1HG1      VAL  43   9.473  -5.571   9.477
  242   HG12  VAL  43          2HG1      VAL  43  10.826  -4.675   8.784
  243   HG13  VAL  43          3HG1      VAL  43   9.190  -3.967   8.774
  244   HG21  VAL  43          3HG2      VAL  43   7.374  -5.026   7.359
  245   HG22  VAL  43          1HG2      VAL  43   7.744  -6.457   6.380
  246   HG23  VAL  43          2HG2      VAL  43   7.766  -6.574   8.143
  247    H    ALA  44           H        ALA  44  12.051  -5.662   5.518
  248    HA   ALA  44           HA       ALA  44  13.768  -4.156   7.118
  249    HB1  ALA  44           1HB      ALA  44  15.553  -5.284   5.814
  250    HB2  ALA  44           2HB      ALA  44  14.238  -6.397   6.219
  251    HB3  ALA  44           3HB      ALA  44  14.364  -5.728   4.573
  252    H    THR  45           H        THR  45  12.868  -3.374   3.794
  253    HA   THR  45           HA       THR  45  14.463  -0.837   3.944
  254    HB   THR  45           HB       THR  45  13.987  -0.733   1.443
  255    HG1  THR  45           1HG      THR  45  13.909  -3.348   1.064
  256   HG21  THR  45          3HG2      THR  45  15.858  -2.162   0.867
  257   HG22  THR  45          1HG2      THR  45  15.698  -3.073   2.383
  258   HG23  THR  45          2HG2      THR  45  16.201  -1.369   2.411
  259    H    GLY  46           H        GLY  46  11.415  -2.015   4.524
  260    HA2  GLY  46           2HA      GLY  46   9.480  -0.991   5.109
  261    HA3  GLY  46           3HA      GLY  46  10.395   0.528   5.118
  262    H    ARG  47           H        ARG  47   9.107  -1.758   2.673
  263    HA   ARG  47           HA       ARG  47   7.875   0.475   1.151
  264    HB3  ARG  47           2HB      ARG  47  10.206   0.371   0.418
  265    HG3  ARG  47           2HG      ARG  47   9.566  -2.425  -0.620
  266    HD3  ARG  47           2HD      ARG  47  12.082  -0.713  -0.724
  267    HE   ARG  47           HE       ARG  47  12.883  -2.902  -0.622
  268   HH11  ARG  47          1HH1      ARG  47  10.427  -2.823  -3.205
  269   HH12  ARG  47          2HH1      ARG  47  11.076  -4.268  -3.940
  270   HH21  ARG  47          1HH2      ARG  47  13.649  -4.661  -1.626
  271   HH22  ARG  47          2HH2      ARG  47  13.004  -5.171  -3.178
  272    H    LEU  48           H        LEU  48   6.935  -0.496  -1.008
  273    HA   LEU  48           HA       LEU  48   5.332  -2.925  -0.302
  274    HB3  LEU  48           2HB      LEU  48   3.446  -1.274  -1.357
  275    HG   LEU  48           HG       LEU  48   4.407  -1.207   1.532
  276   HD11  LEU  48          1HD1      LEU  48   1.918  -0.000   0.265
  277   HD12  LEU  48          2HD1      LEU  48   3.275   0.911   0.967
  278   HD13  LEU  48          3HD1      LEU  48   2.254  -0.094   2.014
  279   HD21  LEU  48          3HD2      LEU  48   2.278  -2.515   1.863
  280   HD22  LEU  48          1HD2      LEU  48   3.438  -3.368   0.839
  281   HD23  LEU  48          2HD2      LEU  48   2.045  -2.550   0.108
  282    H    THR  49           H        THR  49   4.092  -3.800  -1.860
  283    HA   THR  49           HA       THR  49   4.337  -3.069  -4.720
  284    HB   THR  49           HB       THR  49   4.669  -5.891  -3.619
  285    HG1  THR  49           1HG      THR  49   6.646  -5.575  -4.012
  286   HG21  THR  49          3HG2      THR  49   4.285  -4.910  -6.480
  287   HG22  THR  49          1HG2      THR  49   3.285  -6.084  -5.595
  288   HG23  THR  49          2HG2      THR  49   4.936  -6.509  -6.051
  289    H    VAL  50           H        VAL  50   2.305  -3.065  -5.610
  290    HA   VAL  50           HA       VAL  50   0.130  -4.654  -4.339
  291    HB   VAL  50           HB       VAL  50   0.094  -2.522  -3.160
  292   HG11  VAL  50          1HG1      VAL  50  -0.458  -0.400  -4.222
  293   HG12  VAL  50          2HG1      VAL  50   1.063  -1.018  -4.874
  294   HG13  VAL  50          3HG1      VAL  50  -0.433  -1.142  -5.826
  295   HG21  VAL  50          3HG2      VAL  50  -2.296  -2.762  -5.033
  296   HG22  VAL  50          1HG2      VAL  50  -2.039  -3.699  -3.550
  297   HG23  VAL  50          2HG2      VAL  50  -2.256  -1.946  -3.462
  298    H    THR  51           H        THR  51  -1.309  -5.478  -5.678
  299    HA   THR  51           HA       THR  51  -1.368  -4.673  -8.548
  300    HB   THR  51           HB       THR  51  -2.401  -7.287  -7.379
  301    HG1  THR  51           1HG      THR  51  -0.304  -7.188  -6.925
  302   HG21  THR  51          3HG2      THR  51  -2.161  -8.086  -9.681
  303   HG22  THR  51          1HG2      THR  51  -1.517  -6.526 -10.208
  304   HG23  THR  51          2HG2      THR  51  -3.204  -6.655  -9.683
  305    H    TYR  52           H        TYR  52  -3.128  -3.588  -9.181
  306    HA   TYR  52           HA       TYR  52  -5.797  -4.227  -8.121
  307    HB3  TYR  52           2HB      TYR  52  -4.840  -2.593  -6.492
  308    HD1  TYR  52           1HD      TYR  52  -2.634  -1.506  -6.975
  309    HD2  TYR  52           2HD      TYR  52  -6.269  -0.153  -8.843
  310    HE1  TYR  52           1HE      TYR  52  -1.524   0.641  -7.565
  311    HE2  TYR  52           2HE      TYR  52  -5.134   1.953  -9.518
  312    HH   TYR  52           HH       TYR  52  -1.818   2.779  -8.488
  313    H    ASP  53           H        ASP  53  -7.553  -3.059  -9.300
  314    HA   ASP  53           HA       ASP  53  -6.891  -2.484 -12.122
  315    HB3  ASP  53           2HB      ASP  53  -9.552  -2.847 -10.723
  316    HA   PRO  54           HA       PRO  54  -6.935   1.829 -10.726
  317    HB3  PRO  54           2HB      PRO  54  -5.538   2.991 -12.191
  318    HG3  PRO  54           2HG      PRO  54  -4.377   0.919 -11.936
  319    HD3  PRO  54           2HD      PRO  54  -5.413  -1.113 -12.462
  320    H    LYS  55           H        LYS  55  -9.444   0.419 -12.154
  321    HA   LYS  55           HA       LYS  55 -10.894   3.011 -12.557
  322    HB3  LYS  55           2HB      LYS  55 -11.366   0.458 -14.148
  323    HG3  LYS  55           2HG      LYS  55 -13.414   1.747 -14.039
  324    HD3  LYS  55           2HD      LYS  55 -12.665   3.995 -13.476
  325    HE3  LYS  55           2HE      LYS  55 -11.576   4.162 -16.328
  326    HZ1  LYS  55           3HZ      LYS  55 -11.267   6.026 -14.047
  327    HZ2  LYS  55           1HZ      LYS  55 -12.350   6.236 -15.264
  328    HZ3  LYS  55           2HZ      LYS  55 -10.730   6.254 -15.587
  329    H    GLN  56           H        GLN  56 -11.114  -0.395 -11.499
  330    HA   GLN  56           HA       GLN  56 -13.631   0.118 -10.068
  331    HB3  GLN  56           2HB      GLN  56 -13.293  -2.034  -9.017
  332    HG3  GLN  56           2HG      GLN  56 -13.218  -3.559 -10.853
  333   HE21  GLN  56          1HE2      GLN  56 -15.555  -3.130 -10.548
  334   HE22  GLN  56          2HE2      GLN  56 -16.380  -2.115 -11.727
  335    H    VAL  57           H        VAL  57 -10.181   0.519  -9.274
  336    HA   VAL  57           HA       VAL  57 -11.010   2.275  -7.081
  337    HB   VAL  57           HB       VAL  57  -9.356   1.454  -5.457
  338   HG11  VAL  57          1HG1      VAL  57 -11.712   0.813  -5.187
  339   HG12  VAL  57          2HG1      VAL  57 -11.406  -0.700  -6.072
  340   HG13  VAL  57          3HG1      VAL  57 -10.596  -0.389  -4.527
  341   HG21  VAL  57          3HG2      VAL  57  -9.091  -1.001  -7.267
  342   HG22  VAL  57          1HG2      VAL  57  -7.826   0.193  -6.926
  343   HG23  VAL  57          2HG2      VAL  57  -8.426  -0.843  -5.627
  344    H    SER  58           H        SER  58  -8.308   2.784  -6.139
  345    HA   SER  58           HA       SER  58  -6.535   3.305  -8.381
  346    HB3  SER  58           2HB      SER  58  -8.241   5.160  -8.564
  347    HG   SER  58           HG       SER  58  -7.982   6.799  -6.914
  348    H    GLU  59           H        GLU  59  -4.785   5.067  -7.272
  349    HA   GLU  59           HA       GLU  59  -3.434   3.858  -5.143
  350    HB3  GLU  59           2HB      GLU  59  -2.392   5.541  -6.543
  351    HG3  GLU  59           2HG      GLU  59  -2.734   7.986  -6.044
  352    H    ILE  60           H        ILE  60  -6.274   5.918  -4.937
  353    HA   ILE  60           HA       ILE  60  -5.999   6.895  -2.274
  354    HB   ILE  60           HB       ILE  60  -8.202   6.500  -4.256
  355   HG13  ILE  60          2HG1      ILE  60  -8.494   8.846  -4.086
  356   HG21  ILE  60          1HG2      ILE  60  -9.414   5.682  -2.402
  357   HG22  ILE  60          2HG2      ILE  60  -8.878   7.042  -1.375
  358   HG23  ILE  60          3HG2      ILE  60  -9.951   7.314  -2.775
  359   HD11  ILE  60          3HD1      ILE  60  -7.157  10.333  -2.705
  360   HD12  ILE  60          1HD1      ILE  60  -8.095   9.265  -1.653
  361   HD13  ILE  60          2HD1      ILE  60  -6.359   8.974  -1.904
  362    H    THR  61           H        THR  61  -7.392   3.815  -3.373
  363    HA   THR  61           HA       THR  61  -8.522   3.031  -0.910
  364    HB   THR  61           HB       THR  61  -7.549   1.573  -3.377
  365    HG1  THR  61           1HG      THR  61  -9.418   2.718  -3.517
  366   HG21  THR  61          3HG2      THR  61  -8.751   0.242  -0.914
  367   HG22  THR  61          1HG2      THR  61  -7.241  -0.174  -1.747
  368   HG23  THR  61          2HG2      THR  61  -8.792  -0.449  -2.551
  369    H    ILE  62           H        ILE  62  -5.201   2.588  -2.007
  370    HA   ILE  62           HA       ILE  62  -4.445   1.332   0.592
  371    HB   ILE  62           HB       ILE  62  -3.648   0.296  -1.422
  372   HG13  ILE  62          2HG1      ILE  62  -2.300   0.385   0.739
  373   HG21  ILE  62          1HG2      ILE  62  -2.140   2.865  -2.062
  374   HG22  ILE  62          2HG2      ILE  62  -2.025   1.322  -2.937
  375   HG23  ILE  62          3HG2      ILE  62  -3.530   2.218  -2.962
  376   HD11  ILE  62          3HD1      ILE  62  -0.608  -0.038  -1.757
  377   HD12  ILE  62          1HD1      ILE  62  -0.362  -0.730  -0.147
  378   HD13  ILE  62          2HD1      ILE  62  -1.764  -1.230  -1.109
  379    H    GLN  63           H        GLN  63  -4.145   4.473  -1.044
  380    HA   GLN  63           HA       GLN  63  -2.320   5.663   0.769
  381    HB3  GLN  63           2HB      GLN  63  -4.676   7.112  -0.495
  382    HG3  GLN  63           2HG      GLN  63  -1.798   7.910   0.111
  383   HE21  GLN  63          1HE2      GLN  63  -3.997  10.423   0.535
  384   HE22  GLN  63          2HE2      GLN  63  -3.617  11.249  -0.970
  385    H    GLU  64           H        GLU  64  -5.921   5.611   1.004
  386    HA   GLU  64           HA       GLU  64  -5.931   7.068   3.489
  387    HB3  GLU  64           2HB      GLU  64  -8.317   6.408   3.566
  388    HG3  GLU  64           2HG      GLU  64  -7.445   7.236   0.755
  389    H    ARG  65           H        ARG  65  -5.519   3.641   2.832
  390    HA   ARG  65           HA       ARG  65  -5.878   2.760   5.603
  391    HB3  ARG  65           2HB      ARG  65  -4.590   1.564   3.119
  392    HG3  ARG  65           2HG      ARG  65  -3.422   0.378   4.763
  393    HD3  ARG  65           2HD      ARG  65  -4.532   0.893   6.861
  394    HE   ARG  65           HE       ARG  65  -6.984   0.325   5.906
  395   HH11  ARG  65          1HH1      ARG  65  -5.083  -1.458   8.381
  396   HH12  ARG  65          2HH1      ARG  65  -6.488  -1.622   9.396
  397   HH21  ARG  65          1HH2      ARG  65  -8.748  -0.162   7.269
  398   HH22  ARG  65          2HH2      ARG  65  -8.423  -0.745   8.878
  399    H    ILE  66           H        ILE  66  -2.996   3.603   3.605
  400    HA   ILE  66           HA       ILE  66  -1.163   3.229   5.854
  401    HB   ILE  66           HB       ILE  66  -0.914   4.515   3.112
  402   HG13  ILE  66          2HG1      ILE  66  -1.298   1.969   3.408
  403   HG21  ILE  66          1HG2      ILE  66   1.528   4.531   3.406
  404   HG22  ILE  66          2HG2      ILE  66   0.794   5.533   4.645
  405   HG23  ILE  66          3HG2      ILE  66   1.361   3.892   5.049
  406   HD11  ILE  66          3HD1      ILE  66   1.353   2.639   2.107
  407   HD12  ILE  66          1HD1      ILE  66   0.253   1.283   1.777
  408   HD13  ILE  66          2HD1      ILE  66  -0.249   2.927   1.375
  409    H    ALA  67           H        ALA  67  -2.822   6.086   4.547
  410    HA   ALA  67           HA       ALA  67  -1.493   8.010   6.151
  411    HB1  ALA  67           1HB      ALA  67  -3.253   9.495   5.370
  412    HB2  ALA  67           2HB      ALA  67  -2.734   8.462   4.051
  413    HB3  ALA  67           3HB      ALA  67  -4.265   8.116   4.889
  414    H    ALA  68           H        ALA  68  -4.622   6.304   6.711
  415    HA   ALA  68           HA       ALA  68  -5.219   7.544   9.211
  416    HB1  ALA  68           1HB      ALA  68  -6.843   5.698   9.407
  417    HB2  ALA  68           2HB      ALA  68  -6.853   6.383   7.768
  418    HB3  ALA  68           3HB      ALA  68  -6.042   4.832   8.079
  419    H    LEU  69           H        LEU  69  -3.262   4.653   8.463
  420    HA   LEU  69           HA       LEU  69  -2.826   3.915  11.238
  421    HB3  LEU  69           2HB      LEU  69  -0.974   2.536  10.230
  422    HG   LEU  69           HG       LEU  69  -3.771   2.282   9.031
  423   HD11  LEU  69          1HD1      LEU  69  -2.035   1.100   7.703
  424   HD12  LEU  69          2HD1      LEU  69  -3.138  -0.010   8.531
  425   HD13  LEU  69          3HD1      LEU  69  -1.512   0.259   9.185
  426   HD21  LEU  69          3HD2      LEU  69  -3.857   2.060  11.473
  427   HD22  LEU  69          1HD2      LEU  69  -2.485   0.930  11.445
  428   HD23  LEU  69          2HD2      LEU  69  -4.045   0.477  10.727
  429    H    GLY  70           H        GLY  70  -1.641   6.602   9.554
  430    HA2  GLY  70           2HA      GLY  70  -0.594   8.340  10.799
  431    HA3  GLY  70           3HA      GLY  70   0.279   7.139  11.780
  432    H    TYR  71           H        TYR  71   0.378   6.341   8.495
  433    HA   TYR  71           HA       TYR  71   3.179   7.339   8.162
  434    HB3  TYR  71           2HB      TYR  71   3.405   5.322   6.753
  435    HD1  TYR  71           1HD      TYR  71   4.785   5.504   9.009
  436    HD2  TYR  71           2HD      TYR  71   0.943   3.606   8.696
  437    HE1  TYR  71           1HE      TYR  71   5.174   4.384  11.199
  438    HE2  TYR  71           2HE      TYR  71   1.294   2.522  10.909
  439    HH   TYR  71           HH       TYR  71   2.603   2.415  12.756
  440    H    THR  72           H        THR  72   3.625   7.273   5.509
  441    HA   THR  72           HA       THR  72   1.268   8.140   3.953
  442    HB   THR  72           HB       THR  72   2.589  10.073   2.933
  443    HG1  THR  72           1HG      THR  72   4.093  11.026   4.235
  444   HG21  THR  72          3HG2      THR  72   0.590  10.356   4.476
  445   HG22  THR  72          1HG2      THR  72   1.727  11.709   4.403
  446   HG23  THR  72          2HG2      THR  72   1.754  10.615   5.797
  447    H    LEU  73           H        LEU  73   1.302   7.072   2.071
  448    HA   LEU  73           HA       LEU  73   3.745   5.834   1.097
  449    HB3  LEU  73           2HB      LEU  73   1.470   4.856   0.888
  450    HG   LEU  73           HG       LEU  73   0.349   6.926  -0.236
  451   HD11  LEU  73          1HD1      LEU  73   0.289   6.705  -2.781
  452   HD12  LEU  73          2HD1      LEU  73   1.761   5.721  -2.661
  453   HD13  LEU  73          3HD1      LEU  73   1.752   7.426  -2.155
  454   HD21  LEU  73          3HD2      LEU  73   0.030   4.185  -1.535
  455   HD22  LEU  73          1HD2      LEU  73  -1.191   5.457  -1.449
  456   HD23  LEU  73          2HD2      LEU  73  -0.649   4.639   0.028
  457    H    ALA  74           H        ALA  74   4.708   6.111  -0.955
  458    HA   ALA  74           HA       ALA  74   3.856   8.452  -2.520
  459    HB1  ALA  74           1HB      ALA  74   6.790   7.906  -1.908
  460    HB2  ALA  74           2HB      ALA  74   6.183   9.081  -3.088
  461    HB3  ALA  74           3HB      ALA  74   5.834   9.290  -1.360
  462    H    GLU  75           H        GLU  75   3.438   7.942  -4.512
  463    HA   GLU  75           HA       GLU  75   4.849   5.789  -5.968
  464    HB3  GLU  75           2HB      GLU  75   1.805   5.824  -5.897
  465    HG3  GLU  75           2HG      GLU  75   2.098   3.453  -6.597
  466    HA   PRO  76           HA       PRO  76   4.296  10.057  -7.492
  467    HB3  PRO  76           2HB      PRO  76   6.372  10.951  -7.941
  468    HG3  PRO  76           2HG      PRO  76   6.728   9.755  -5.918
  469    HD3  PRO  76           2HD      PRO  76   6.284   7.456  -5.775
  Start of MODEL   27
    1    H2   PRO   6           2H       PRO   6  -9.189  -6.131 -15.635
    2    HA   PRO   6           HA       PRO   6  -6.529  -6.824 -16.399
    3    HB3  PRO   6           2HB      PRO   6  -5.978  -5.030 -17.815
    4    HG3  PRO   6           2HG      PRO   6  -7.425  -6.597 -18.980
    5    HD3  PRO   6           2HD      PRO   6  -9.647  -6.980 -18.167
    6    H    LEU   7           H        LEU   7  -5.090  -6.142 -14.891
    7    HA   LEU   7           HA       LEU   7  -5.609  -3.979 -13.035
    8    HB3  LEU   7           2HB      LEU   7  -7.072  -5.778 -12.110
    9    HG   LEU   7           HG       LEU   7  -4.466  -7.195 -11.376
   10   HD11  LEU   7          1HD1      LEU   7  -6.121  -6.975  -9.542
   11   HD12  LEU   7          2HD1      LEU   7  -5.918  -8.657 -10.057
   12   HD13  LEU   7          3HD1      LEU   7  -7.355  -7.744 -10.565
   13   HD21  LEU   7          3HD2      LEU   7  -5.118  -7.989 -13.586
   14   HD22  LEU   7          1HD2      LEU   7  -6.812  -8.153 -13.066
   15   HD23  LEU   7          2HD2      LEU   7  -5.556  -9.218 -12.399
   16    H    LYS   8           H        LYS   8  -3.761  -3.297 -11.968
   17    HA   LYS   8           HA       LYS   8  -1.297  -4.465 -13.192
   18    HB3  LYS   8           2HB      LYS   8  -1.938  -2.379 -14.216
   19    HG3  LYS   8           2HG      LYS   8  -1.616  -1.101 -11.457
   20    HD3  LYS   8           2HD      LYS   8  -2.007   0.151 -14.212
   21    HE3  LYS   8           2HE      LYS   8  -1.734   1.322 -11.411
   22    HZ1  LYS   8           3HZ      LYS   8  -1.614   2.666 -14.047
   23    HZ2  LYS   8           1HZ      LYS   8  -0.439   2.621 -12.924
   24    HZ3  LYS   8           2HZ      LYS   8  -1.809   3.463 -12.608
   25    H    THR   9           H        THR   9   0.584  -4.613 -12.118
   26    HA   THR   9           HA       THR   9   0.537  -4.516  -9.137
   27    HB   THR   9           HB       THR   9   2.506  -5.852 -11.037
   28    HG1  THR   9           1HG      THR   9   0.417  -6.983  -9.481
   29   HG21  THR   9          3HG2      THR   9   3.542  -5.499  -8.858
   30   HG22  THR   9          1HG2      THR   9   3.087  -7.199  -8.999
   31   HG23  THR   9          2HG2      THR   9   2.094  -6.096  -8.018
   32    H    GLN  10           H        GLN  10   2.048  -3.198  -7.995
   33    HA   GLN  10           HA       GLN  10   4.154  -1.794  -9.462
   34    HB3  GLN  10           2HB      GLN  10   1.854  -0.270  -8.176
   35    HG3  GLN  10           2HG      GLN  10   3.985   1.022  -8.169
   36   HE21  GLN  10          1HE2      GLN  10   4.792   2.933  -9.896
   37   HE22  GLN  10          2HE2      GLN  10   5.564   2.244 -11.312
   38    H    GLN  11           H        GLN  11   5.798  -1.229  -8.162
   39    HA   GLN  11           HA       GLN  11   5.702  -1.687  -5.261
   40    HB3  GLN  11           2HB      GLN  11   7.977  -0.615  -6.988
   41    HG3  GLN  11           2HG      GLN  11   7.954  -2.229  -4.411
   42   HE21  GLN  11          1HE2      GLN  11   9.429  -3.704  -5.754
   43   HE22  GLN  11          2HE2      GLN  11  11.111  -3.228  -5.898
   44    H    MET  12           H        MET  12   5.999  -0.014  -3.678
   45    HA   MET  12           HA       MET  12   6.264   2.765  -4.576
   46    HB3  MET  12           2HB      MET  12   3.841   2.417  -4.704
   47    HG3  MET  12           2HG      MET  12   4.069   1.784  -1.741
   48    HE1  MET  12           3HE      MET  12   0.070   2.553  -3.945
   49    HE2  MET  12           1HE      MET  12   1.614   3.084  -4.630
   50    HE3  MET  12           2HE      MET  12   1.273   1.347  -4.454
   51    H    GLN  13           H        GLN  13   6.408   4.284  -2.768
   52    HA   GLN  13           HA       GLN  13   7.991   3.127  -0.528
   53    HB3  GLN  13           2HB      GLN  13   8.675   5.593  -0.275
   54    HG3  GLN  13           2HG      GLN  13   9.373   4.137  -2.862
   55   HE21  GLN  13          1HE2      GLN  13   9.386   6.115  -4.129
   56   HE22  GLN  13          2HE2      GLN  13  10.596   7.365  -3.783
   57    H    VAL  14           H        VAL  14   7.727   4.128   1.563
   58    HA   VAL  14           HA       VAL  14   5.144   5.312   2.266
   59    HB   VAL  14           HB       VAL  14   4.415   3.042   1.985
   60   HG11  VAL  14          1HG1      VAL  14   5.307   1.126   3.182
   61   HG12  VAL  14          2HG1      VAL  14   6.530   1.819   2.124
   62   HG13  VAL  14          3HG1      VAL  14   6.599   2.133   3.875
   63   HG21  VAL  14          3HG2      VAL  14   3.452   2.556   4.112
   64   HG22  VAL  14          1HG2      VAL  14   4.718   3.459   4.974
   65   HG23  VAL  14          2HG2      VAL  14   3.546   4.313   3.956
   66    H    GLY  15           H        GLY  15   5.133   6.291   4.180
   67    HA2  GLY  15           2HA      GLY  15   7.740   6.857   5.359
   68    HA3  GLY  15           3HA      GLY  15   6.209   7.702   5.656
   69    H    GLY  16           H        GLY  16   6.833   4.206   6.289
   70    HA2  GLY  16           2HA      GLY  16   7.594   4.326   8.923
   71    HA3  GLY  16           3HA      GLY  16   5.871   4.563   9.058
   72    H    MET  17           H        MET  17   6.927   2.270   6.583
   73    HA   MET  17           HA       MET  17   5.734   0.074   8.211
   74    HB3  MET  17           2HB      MET  17   5.780  -1.163   6.030
   75    HG3  MET  17           2HG      MET  17   4.025   0.184   4.921
   76    HE1  MET  17           3HE      MET  17   2.584   1.781   7.888
   77    HE2  MET  17           1HE      MET  17   2.241   0.503   9.075
   78    HE3  MET  17           2HE      MET  17   3.905   1.051   8.823
   79    H    ARG  18           H        ARG  18   8.876   1.145   7.931
   80    HA   ARG  18           HA       ARG  18  10.251  -1.288   7.492
   81    HB3  ARG  18           2HB      ARG  18  11.255   0.856   7.130
   82    HG3  ARG  18           2HG      ARG  18  11.632   1.192  10.129
   83    HD3  ARG  18           2HD      ARG  18  12.154   3.531   9.486
   84    HE   ARG  18           HE       ARG  18  14.173   2.350   9.598
   85   HH11  ARG  18          1HH1      ARG  18  12.996   2.436   6.238
   86   HH12  ARG  18          2HH1      ARG  18  14.568   2.003   5.620
   87   HH21  ARG  18          1HH2      ARG  18  16.111   1.745   8.688
   88   HH22  ARG  18          2HH2      ARG  18  16.249   1.494   6.961
   89    H    CYS  19           H        CYS  19   8.227  -1.692   9.521
   90    HA   CYS  19           HA       CYS  19   9.750  -3.269  11.481
   91    HB3  CYS  19           2HB      CYS  19   7.608  -1.236  12.285
   92    HG   CYS  19           HG       CYS  19   7.951  -1.809  14.782
   93    H    ALA  20           H        ALA  20   8.847  -5.270  11.529
   94    HA   ALA  20           HA       ALA  20   6.739  -5.987   9.771
   95    HB1  ALA  20           1HB      ALA  20   7.040  -8.233  10.726
   96    HB2  ALA  20           2HB      ALA  20   8.612  -7.488  10.420
   97    HB3  ALA  20           3HB      ALA  20   7.973  -7.571  12.074
   98    H    ALA  21           H        ALA  21   6.699  -5.506  13.308
   99    HA   ALA  21           HA       ALA  21   4.022  -6.247  13.835
  100    HB1  ALA  21           1HB      ALA  21   5.738  -4.040  15.075
  101    HB2  ALA  21           2HB      ALA  21   4.292  -4.765  15.801
  102    HB3  ALA  21           3HB      ALA  21   5.738  -5.756  15.549
  103    H    CYS  22           H        CYS  22   5.186  -3.365  12.138
  104    HA   CYS  22           HA       CYS  22   2.457  -2.179  12.207
  105    HB3  CYS  22           2HB      CYS  22   3.598  -0.183  11.230
  106    HG   CYS  22           HG       CYS  22   5.236   0.637  13.134
  107    H    ALA  23           H        ALA  23   4.754  -3.565   9.902
  108    HA   ALA  23           HA       ALA  23   3.476  -3.205   7.466
  109    HB1  ALA  23           1HB      ALA  23   5.607  -4.366   7.849
  110    HB2  ALA  23           2HB      ALA  23   4.744  -5.741   8.580
  111    HB3  ALA  23           3HB      ALA  23   4.499  -5.364   6.880
  112    H    SER  24           H        SER  24   2.487  -5.439  10.096
  113    HA   SER  24           HA       SER  24   0.582  -6.968   8.579
  114    HB3  SER  24           2HB      SER  24  -0.255  -7.739  10.691
  115    HG   SER  24           HG       SER  24   1.862  -7.709  11.998
  116    H    SER  25           H        SER  25   0.249  -3.844  10.273
  117    HA   SER  25           HA       SER  25  -2.639  -3.918  10.343
  118    HB3  SER  25           2HB      SER  25  -2.499  -1.720  11.307
  119    HG   SER  25           HG       SER  25  -1.391  -2.312  13.033
  120    H    ILE  26           H        ILE  26  -0.337  -2.954   8.006
  121    HA   ILE  26           HA       ILE  26  -2.386  -1.786   6.180
  122    HB   ILE  26           HB       ILE  26   0.620  -2.114   6.090
  123   HG13  ILE  26          2HG1      ILE  26  -1.137   0.168   5.081
  124   HG21  ILE  26          1HG2      ILE  26   0.626  -1.511   3.669
  125   HG22  ILE  26          2HG2      ILE  26   0.035  -3.134   3.953
  126   HG23  ILE  26          3HG2      ILE  26  -1.122  -1.824   3.607
  127   HD11  ILE  26          3HD1      ILE  26   0.235  -0.071   7.781
  128   HD12  ILE  26          1HD1      ILE  26  -0.327   1.453   7.059
  129   HD13  ILE  26          2HD1      ILE  26  -1.496   0.179   7.466
  130    H    GLU  27           H        GLU  27  -0.192  -4.656   6.286
  131    HA   GLU  27           HA       GLU  27  -1.216  -5.520   3.812
  132    HB3  GLU  27           2HB      GLU  27   0.247  -7.382   5.705
  133    HG3  GLU  27           2HG      GLU  27   0.557  -6.778   2.721
  134    H    ARG  28           H        ARG  28  -2.279  -6.444   7.099
  135    HA   ARG  28           HA       ARG  28  -3.742  -8.780   6.338
  136    HB3  ARG  28           2HB      ARG  28  -4.382  -6.862   8.613
  137    HG3  ARG  28           2HG      ARG  28  -4.818  -9.866   8.268
  138    HD3  ARG  28           2HD      ARG  28  -5.719  -7.940  10.440
  139    HE   ARG  28           HE       ARG  28  -6.529 -10.694   9.783
  140   HH11  ARG  28          1HH1      ARG  28  -6.435  -8.277  12.363
  141   HH12  ARG  28          2HH1      ARG  28  -7.768  -9.019  13.221
  142   HH21  ARG  28          1HH2      ARG  28  -8.191 -11.641  10.964
  143   HH22  ARG  28          2HH2      ARG  28  -8.670 -10.954  12.487
  144    H    ALA  29           H        ALA  29  -4.826  -5.352   6.556
  145    HA   ALA  29           HA       ALA  29  -7.468  -5.985   5.444
  146    HB1  ALA  29           1HB      ALA  29  -7.321  -4.154   7.008
  147    HB2  ALA  29           2HB      ALA  29  -6.019  -3.391   6.074
  148    HB3  ALA  29           3HB      ALA  29  -7.669  -3.467   5.407
  149    H    LEU  30           H        LEU  30  -4.382  -4.751   4.104
  150    HA   LEU  30           HA       LEU  30  -5.444  -3.504   1.841
  151    HB3  LEU  30           2HB      LEU  30  -2.736  -4.825   2.244
  152    HG   LEU  30           HG       LEU  30  -2.974  -4.285  -0.136
  153   HD11  LEU  30          1HD1      LEU  30  -3.731  -1.480   0.802
  154   HD12  LEU  30          2HD1      LEU  30  -4.753  -2.614  -0.109
  155   HD13  LEU  30          3HD1      LEU  30  -3.333  -1.933  -0.876
  156   HD21  LEU  30          3HD2      LEU  30  -1.310  -2.151   1.269
  157   HD22  LEU  30          1HD2      LEU  30  -1.038  -2.844  -0.342
  158   HD23  LEU  30          2HD2      LEU  30  -0.820  -3.849   1.099
  159    H    GLU  31           H        GLU  31  -4.587  -6.973   2.147
  160    HA   GLU  31           HA       GLU  31  -5.058  -7.527  -0.657
  161    HB3  GLU  31           2HB      GLU  31  -3.668  -8.950   0.881
  162    HG3  GLU  31           2HG      GLU  31  -6.364 -10.037   1.804
  163    H    ARG  32           H        ARG  32  -7.183  -6.751   1.864
  164    HA   ARG  32           HA       ARG  32  -9.439  -8.291   0.760
  165    HB3  ARG  32           2HB      ARG  32 -10.539  -7.800   2.970
  166    HG3  ARG  32           2HG      ARG  32  -7.849  -9.186   3.227
  167    HD3  ARG  32           2HD      ARG  32 -10.422  -9.403   4.830
  168    HE   ARG  32           HE       ARG  32  -8.028 -11.098   5.315
  169   HH11  ARG  32          1HH1      ARG  32 -11.419 -11.061   4.263
  170   HH12  ARG  32          2HH1      ARG  32 -11.617 -12.767   4.537
  171   HH21  ARG  32          1HH2      ARG  32  -8.347 -13.325   5.585
  172   HH22  ARG  32          2HH2      ARG  32  -9.922 -14.002   5.250
  173    H    LEU  33           H        LEU  33  -8.265  -5.023   0.897
  174    HA   LEU  33           HA       LEU  33 -10.744  -3.562   0.695
  175    HB3  LEU  33           2HB      LEU  33  -9.385  -1.849  -0.477
  176    HG   LEU  33           HG       LEU  33  -7.706  -3.010   1.775
  177   HD11  LEU  33          1HD1      LEU  33  -6.686  -0.831   1.938
  178   HD12  LEU  33          2HD1      LEU  33  -7.790  -0.158   0.723
  179   HD13  LEU  33          3HD1      LEU  33  -6.570  -1.348   0.245
  180   HD21  LEU  33          3HD2      LEU  33  -9.872  -0.867   1.874
  181   HD22  LEU  33          1HD2      LEU  33  -8.787  -1.301   3.210
  182   HD23  LEU  33          2HD2      LEU  33  -9.964  -2.484   2.612
  183    H    LYS  34           H        LYS  34 -12.336  -3.802  -0.739
  184    HA   LYS  34           HA       LYS  34 -12.012  -5.507  -3.034
  185    HB3  LYS  34           2HB      LYS  34 -14.384  -4.806  -3.494
  186    HG3  LYS  34           2HG      LYS  34 -15.423  -5.720  -1.508
  187    HD3  LYS  34           2HD      LYS  34 -12.742  -7.156  -1.749
  188    HE3  LYS  34           2HE      LYS  34 -15.573  -8.081  -1.096
  189    HZ1  LYS  34           3HZ      LYS  34 -14.402 -10.255  -0.801
  190    HZ2  LYS  34           1HZ      LYS  34 -13.092  -9.638  -1.548
  191    HZ3  LYS  34           2HZ      LYS  34 -14.527  -9.783  -2.363
  192    H    GLY  35           H        GLY  35 -11.313  -5.156  -4.974
  193    HA2  GLY  35           2HA      GLY  35 -10.896  -3.863  -6.966
  194    HA3  GLY  35           3HA      GLY  35 -10.872  -2.371  -5.998
  195    H    VAL  36           H        VAL  36  -9.163  -4.124  -3.959
  196    HA   VAL  36           HA       VAL  36  -6.560  -4.080  -5.432
  197    HB   VAL  36           HB       VAL  36  -7.031  -4.082  -2.420
  198   HG11  VAL  36          1HG1      VAL  36  -4.560  -3.661  -2.337
  199   HG12  VAL  36          2HG1      VAL  36  -4.952  -5.244  -3.004
  200   HG13  VAL  36          3HG1      VAL  36  -4.490  -3.916  -4.090
  201   HG21  VAL  36          3HG2      VAL  36  -6.071  -1.790  -2.461
  202   HG22  VAL  36          1HG2      VAL  36  -6.063  -1.828  -4.238
  203   HG23  VAL  36          2HG2      VAL  36  -7.598  -1.868  -3.342
  204    H    ALA  37           H        ALA  37  -5.571  -6.010  -5.700
  205    HA   ALA  37           HA       ALA  37  -7.195  -8.415  -4.958
  206    HB1  ALA  37           1HB      ALA  37  -5.340  -7.917  -7.321
  207    HB2  ALA  37           2HB      ALA  37  -6.445  -9.290  -7.075
  208    HB3  ALA  37           3HB      ALA  37  -7.107  -7.674  -7.323
  209    H    GLU  38           H        GLU  38  -3.799  -7.243  -4.920
  210    HA   GLU  38           HA       GLU  38  -3.055  -9.423  -3.156
  211    HB3  GLU  38           2HB      GLU  38  -1.627  -9.307  -5.823
  212    HG3  GLU  38           2HG      GLU  38  -1.737 -11.514  -3.726
  213    H    ALA  39           H        ALA  39  -1.287  -8.820  -1.826
  214    HA   ALA  39           HA       ALA  39   0.513  -6.652  -2.698
  215    HB1  ALA  39           1HB      ALA  39  -1.435  -6.256  -0.391
  216    HB2  ALA  39           2HB      ALA  39  -0.179  -5.114  -0.928
  217    HB3  ALA  39           3HB      ALA  39  -1.555  -5.472  -1.984
  218    H    SER  40           H        SER  40   2.137  -6.032  -1.139
  219    HA   SER  40           HA       SER  40   2.630  -7.748   1.188
  220    HB3  SER  40           2HB      SER  40   4.316  -8.000  -1.309
  221    HG   SER  40           HG       SER  40   5.862  -8.468  -0.029
  222    H    VAL  41           H        VAL  41   3.936  -6.774   2.685
  223    HA   VAL  41           HA       VAL  41   5.351  -4.241   1.968
  224    HB   VAL  41           HB       VAL  41   4.809  -5.543   4.663
  225   HG11  VAL  41          1HG1      VAL  41   6.853  -4.173   4.802
  226   HG12  VAL  41          2HG1      VAL  41   6.022  -2.817   4.003
  227   HG13  VAL  41          3HG1      VAL  41   5.525  -3.358   5.619
  228   HG21  VAL  41          3HG2      VAL  41   3.208  -3.711   5.024
  229   HG22  VAL  41          1HG2      VAL  41   3.542  -3.073   3.406
  230   HG23  VAL  41          2HG2      VAL  41   2.740  -4.647   3.602
  231    H    THR  42           H        THR  42   7.497  -4.142   1.743
  232    HA   THR  42           HA       THR  42   9.293  -6.405   2.488
  233    HB   THR  42           HB       THR  42   9.897  -3.834   0.969
  234    HG1  THR  42           1HG      THR  42  10.008  -5.273  -0.774
  235   HG21  THR  42          3HG2      THR  42  11.518  -6.397   1.363
  236   HG22  THR  42          1HG2      THR  42  11.893  -4.820   2.100
  237   HG23  THR  42          2HG2      THR  42  11.978  -5.012   0.350
  238    H    VAL  43           H        VAL  43   9.628  -6.297   4.653
  239    HA   VAL  43           HA       VAL  43   9.366  -3.836   6.139
  240    HB   VAL  43           HB       VAL  43  10.275  -6.602   7.010
  241   HG11  VAL  43          1HG1      VAL  43  11.063  -4.949   8.663
  242   HG12  VAL  43          2HG1      VAL  43   9.440  -4.224   8.716
  243   HG13  VAL  43          3HG1      VAL  43   9.725  -5.880   9.303
  244   HG21  VAL  43          3HG2      VAL  43   7.593  -5.179   7.193
  245   HG22  VAL  43          1HG2      VAL  43   7.964  -6.557   6.139
  246   HG23  VAL  43          2HG2      VAL  43   7.957  -6.774   7.891
  247    H    ALA  44           H        ALA  44  12.252  -5.766   5.146
  248    HA   ALA  44           HA       ALA  44  14.099  -4.445   6.871
  249    HB1  ALA  44           1HB      ALA  44  15.803  -5.533   5.448
  250    HB2  ALA  44           2HB      ALA  44  14.502  -6.650   5.863
  251    HB3  ALA  44           3HB      ALA  44  14.559  -5.917   4.243
  252    H    THR  45           H        THR  45  12.644  -3.228   4.018
  253    HA   THR  45           HA       THR  45  14.524  -0.898   3.969
  254    HB   THR  45           HB       THR  45  13.735  -0.560   1.619
  255    HG1  THR  45           1HG      THR  45  12.654  -2.395   0.684
  256   HG21  THR  45          3HG2      THR  45  15.854  -1.816   2.135
  257   HG22  THR  45          1HG2      THR  45  15.085  -2.285   0.618
  258   HG23  THR  45          2HG2      THR  45  14.933  -3.338   2.036
  259    H    GLY  46           H        GLY  46  11.220  -1.996   4.306
  260    HA2  GLY  46           2HA      GLY  46   9.304  -0.930   4.927
  261    HA3  GLY  46           3HA      GLY  46  10.181   0.604   5.101
  262    H    ARG  47           H        ARG  47   9.639  -1.632   2.334
  263    HA   ARG  47           HA       ARG  47   8.260   0.590   0.853
  264    HB3  ARG  47           2HB      ARG  47   8.895  -0.503  -1.246
  265    HG3  ARG  47           2HG      ARG  47  11.443   0.110   0.266
  266    HD3  ARG  47           2HD      ARG  47  10.445   0.390  -2.603
  267    HE   ARG  47           HE       ARG  47  12.555   1.929  -1.256
  268   HH11  ARG  47          1HH1      ARG  47  11.418   0.855  -4.456
  269   HH12  ARG  47          2HH1      ARG  47  12.066   2.275  -5.238
  270   HH21  ARG  47          1HH2      ARG  47  13.580   3.521  -2.333
  271   HH22  ARG  47          2HH2      ARG  47  13.456   3.671  -4.063
  272    H    LEU  48           H        LEU  48   6.711  -0.225  -0.781
  273    HA   LEU  48           HA       LEU  48   5.160  -2.614   0.166
  274    HB3  LEU  48           2HB      LEU  48   3.384  -0.789  -1.087
  275    HG   LEU  48           HG       LEU  48   3.937  -1.227   1.874
  276   HD11  LEU  48          1HD1      LEU  48   2.945   0.992   1.512
  277   HD12  LEU  48          2HD1      LEU  48   1.733  -0.101   2.200
  278   HD13  LEU  48          3HD1      LEU  48   1.700   0.282   0.461
  279   HD21  LEU  48          3HD2      LEU  48   1.749  -2.249  -0.021
  280   HD22  LEU  48          1HD2      LEU  48   1.782  -2.515   1.733
  281   HD23  LEU  48          2HD2      LEU  48   3.035  -3.223   0.716
  282    H    THR  49           H        THR  49   3.844  -3.630  -1.411
  283    HA   THR  49           HA       THR  49   4.147  -2.979  -4.294
  284    HB   THR  49           HB       THR  49   4.482  -5.816  -3.222
  285    HG1  THR  49           1HG      THR  49   6.358  -4.851  -2.878
  286   HG21  THR  49          3HG2      THR  49   4.675  -4.628  -6.038
  287   HG22  THR  49          1HG2      THR  49   3.422  -5.750  -5.452
  288   HG23  THR  49          2HG2      THR  49   5.094  -6.297  -5.593
  289    H    VAL  50           H        VAL  50   2.235  -3.102  -5.258
  290    HA   VAL  50           HA       VAL  50  -0.002  -4.610  -3.992
  291    HB   VAL  50           HB       VAL  50  -0.049  -2.382  -2.977
  292   HG11  VAL  50          1HG1      VAL  50  -0.544  -0.354  -4.257
  293   HG12  VAL  50          2HG1      VAL  50   1.019  -1.030  -4.739
  294   HG13  VAL  50          3HG1      VAL  50  -0.402  -1.239  -5.783
  295   HG21  VAL  50          3HG2      VAL  50  -2.165  -3.586  -3.401
  296   HG22  VAL  50          1HG2      VAL  50  -2.384  -1.828  -3.441
  297   HG23  VAL  50          2HG2      VAL  50  -2.344  -2.736  -4.954
  298    H    THR  51           H        THR  51  -1.489  -5.390  -5.338
  299    HA   THR  51           HA       THR  51  -1.432  -4.735  -8.253
  300    HB   THR  51           HB       THR  51  -2.269  -7.323  -6.859
  301    HG1  THR  51           1HG      THR  51  -0.045  -7.157  -7.034
  302   HG21  THR  51          3HG2      THR  51  -2.471  -8.175  -9.217
  303   HG22  THR  51          1HG2      THR  51  -2.192  -6.533  -9.832
  304   HG23  THR  51          2HG2      THR  51  -3.646  -6.902  -8.889
  305    H    TYR  52           H        TYR  52  -3.138  -3.547  -8.871
  306    HA   TYR  52           HA       TYR  52  -5.776  -3.905  -7.554
  307    HB3  TYR  52           2HB      TYR  52  -4.532  -2.162  -6.299
  308    HD1  TYR  52           2HD      TYR  52  -2.328  -1.369  -7.179
  309    HD2  TYR  52           1HD      TYR  52  -6.049   0.086  -8.793
  310    HE1  TYR  52           2HE      TYR  52  -1.140   0.608  -8.119
  311    HE2  TYR  52           1HE      TYR  52  -4.863   2.050  -9.755
  312    HH   TYR  52           HH       TYR  52  -1.348   2.623  -9.307
  313    H    ASP  53           H        ASP  53  -7.596  -2.963  -8.641
  314    HA   ASP  53           HA       ASP  53  -7.367  -3.097 -11.560
  315    HB3  ASP  53           2HB      ASP  53  -9.755  -2.970  -9.687
  316    HA   PRO  54           HA       PRO  54  -7.027   1.394 -11.164
  317    HB3  PRO  54           2HB      PRO  54  -5.216   1.128 -12.578
  318    HG3  PRO  54           2HG      PRO  54  -5.323  -0.330 -14.492
  319    HD3  PRO  54           2HD      PRO  54  -5.714  -1.600 -12.543
  320    H    LYS  55           H        LYS  55  -9.663  -0.053 -12.012
  321    HA   LYS  55           HA       LYS  55 -11.068   2.401 -13.052
  322    HB3  LYS  55           2HB      LYS  55 -12.724   0.761 -14.106
  323    HG3  LYS  55           2HG      LYS  55 -11.232   0.078 -16.054
  324    HD3  LYS  55           2HD      LYS  55 -11.236   3.000 -15.186
  325    HE3  LYS  55           2HE      LYS  55 -11.175   3.443 -17.652
  326    HZ1  LYS  55           3HZ      LYS  55  -8.734   1.990 -16.846
  327    HZ2  LYS  55           1HZ      LYS  55  -9.100   3.518 -16.290
  328    HZ3  LYS  55           2HZ      LYS  55  -8.873   3.241 -17.892
  329    H    GLN  56           H        GLN  56 -11.219  -0.535 -11.040
  330    HA   GLN  56           HA       GLN  56 -13.544   0.398  -9.523
  331    HB3  GLN  56           2HB      GLN  56 -12.790  -1.323  -7.878
  332    HG3  GLN  56           2HG      GLN  56 -12.812  -2.320 -10.763
  333   HE21  GLN  56          1HE2      GLN  56 -14.179  -3.234  -7.521
  334   HE22  GLN  56          2HE2      GLN  56 -13.802  -4.942  -7.730
  335    H    VAL  57           H        VAL  57  -9.962   0.747  -9.141
  336    HA   VAL  57           HA       VAL  57 -10.445   2.873  -7.132
  337    HB   VAL  57           HB       VAL  57  -8.921   1.962  -5.497
  338   HG11  VAL  57          1HG1      VAL  57 -10.194   0.070  -4.588
  339   HG12  VAL  57          2HG1      VAL  57 -11.273   1.339  -5.170
  340   HG13  VAL  57          3HG1      VAL  57 -11.036  -0.140  -6.124
  341   HG21  VAL  57          3HG2      VAL  57  -7.410   0.632  -6.906
  342   HG22  VAL  57          1HG2      VAL  57  -8.061  -0.370  -5.610
  343   HG23  VAL  57          2HG2      VAL  57  -8.710  -0.529  -7.255
  344    H    SER  58           H        SER  58  -8.307   3.825  -6.387
  345    HA   SER  58           HA       SER  58  -6.080   3.611  -8.337
  346    HB3  SER  58           2HB      SER  58  -5.809   6.154  -8.151
  347    HG   SER  58           HG       SER  58  -7.217   6.534  -9.847
  348    H    GLU  59           H        GLU  59  -4.198   5.113  -7.215
  349    HA   GLU  59           HA       GLU  59  -3.453   3.860  -4.847
  350    HB3  GLU  59           2HB      GLU  59  -1.768   4.767  -6.045
  351    HG3  GLU  59           2HG      GLU  59  -3.021   6.658  -7.223
  352    H    ILE  60           H        ILE  60  -5.630   6.519  -5.050
  353    HA   ILE  60           HA       ILE  60  -5.971   7.534  -2.487
  354    HB   ILE  60           HB       ILE  60  -7.896   6.606  -4.651
  355   HG13  ILE  60          2HG1      ILE  60  -6.409   8.524  -5.099
  356   HG21  ILE  60          1HG2      ILE  60  -9.226   6.360  -2.681
  357   HG22  ILE  60          2HG2      ILE  60  -8.657   7.916  -2.020
  358   HG23  ILE  60          3HG2      ILE  60  -9.716   7.854  -3.447
  359   HD11  ILE  60          3HD1      ILE  60  -8.714   8.584  -6.080
  360   HD12  ILE  60          1HD1      ILE  60  -9.198   9.629  -4.717
  361   HD13  ILE  60          2HD1      ILE  60  -7.949  10.166  -5.843
  362    H    THR  61           H        THR  61  -7.040   4.264  -3.546
  363    HA   THR  61           HA       THR  61  -8.446   3.721  -1.060
  364    HB   THR  61           HB       THR  61  -7.672   2.139  -3.513
  365    HG1  THR  61           1HG      THR  61  -9.484   3.411  -3.654
  366   HG21  THR  61          3HG2      THR  61  -7.520   0.415  -1.789
  367   HG22  THR  61          1HG2      THR  61  -9.082   0.255  -2.592
  368   HG23  THR  61          2HG2      THR  61  -8.991   1.018  -0.992
  369    H    ILE  62           H        ILE  62  -5.231   2.706  -2.215
  370    HA   ILE  62           HA       ILE  62  -4.613   1.311   0.312
  371    HB   ILE  62           HB       ILE  62  -3.613   0.542  -1.740
  372   HG13  ILE  62          2HG1      ILE  62  -2.346   0.450   0.465
  373   HG21  ILE  62          1HG2      ILE  62  -2.296   3.280  -1.985
  374   HG22  ILE  62          2HG2      ILE  62  -1.980   1.878  -3.033
  375   HG23  ILE  62          3HG2      ILE  62  -3.570   2.623  -3.032
  376   HD11  ILE  62          3HD1      ILE  62  -1.538  -0.797  -1.593
  377   HD12  ILE  62          1HD1      ILE  62  -0.459   0.572  -1.918
  378   HD13  ILE  62          2HD1      ILE  62  -0.287  -0.366  -0.425
  379    H    GLN  63           H        GLN  63  -4.202   4.613  -0.920
  380    HA   GLN  63           HA       GLN  63  -2.683   5.570   1.291
  381    HB3  GLN  63           2HB      GLN  63  -4.797   7.126  -0.239
  382    HG3  GLN  63           2HG      GLN  63  -2.154   7.886   1.065
  383   HE21  GLN  63          1HE2      GLN  63  -5.126   9.525  -0.223
  384   HE22  GLN  63          2HE2      GLN  63  -4.248  10.676  -1.192
  385    H    GLU  64           H        GLU  64  -6.280   5.198   0.964
  386    HA   GLU  64           HA       GLU  64  -6.960   6.430   3.387
  387    HB3  GLU  64           2HB      GLU  64  -8.849   4.471   3.292
  388    HG3  GLU  64           2HG      GLU  64 -10.001   5.835   1.491
  389    H    ARG  65           H        ARG  65  -5.559   3.233   2.995
  390    HA   ARG  65           HA       ARG  65  -5.852   2.482   5.826
  391    HB3  ARG  65           2HB      ARG  65  -4.115   1.376   3.565
  392    HG3  ARG  65           2HG      ARG  65  -3.632   0.670   6.108
  393    HD3  ARG  65           2HD      ARG  65  -4.763  -1.425   6.668
  394    HE   ARG  65           HE       ARG  65  -6.947   0.551   6.126
  395   HH11  ARG  65          1HH1      ARG  65  -5.045  -1.084   8.693
  396   HH12  ARG  65          2HH1      ARG  65  -6.057  -0.340   9.918
  397   HH21  ARG  65          1HH2      ARG  65  -8.024   1.408   7.649
  398   HH22  ARG  65          2HH2      ARG  65  -7.658   1.185   9.344
  399    H    ILE  66           H        ILE  66  -3.106   3.472   3.739
  400    HA   ILE  66           HA       ILE  66  -1.178   3.403   5.896
  401    HB   ILE  66           HB       ILE  66  -1.146   4.753   3.168
  402   HG13  ILE  66          2HG1      ILE  66  -1.330   2.142   3.424
  403   HG21  ILE  66          1HG2      ILE  66   1.169   4.253   5.094
  404   HG22  ILE  66          2HG2      ILE  66   1.330   4.828   3.418
  405   HG23  ILE  66          3HG2      ILE  66   0.536   5.845   4.609
  406   HD11  ILE  66          3HD1      ILE  66  -0.635   3.292   1.345
  407   HD12  ILE  66          1HD1      ILE  66   1.067   3.154   1.871
  408   HD13  ILE  66          2HD1      ILE  66   0.085   1.699   1.594
  409    H    ALA  67           H        ALA  67  -3.075   6.109   4.550
  410    HA   ALA  67           HA       ALA  67  -1.850   8.118   6.127
  411    HB1  ALA  67           1HB      ALA  67  -3.802   9.476   5.448
  412    HB2  ALA  67           2HB      ALA  67  -3.117   8.583   4.081
  413    HB3  ALA  67           3HB      ALA  67  -4.616   8.018   4.853
  414    H    ALA  68           H        ALA  68  -4.425   5.783   6.847
  415    HA   ALA  68           HA       ALA  68  -5.391   7.150   9.255
  416    HB1  ALA  68           1HB      ALA  68  -6.067   4.447   8.003
  417    HB2  ALA  68           2HB      ALA  68  -6.923   5.209   9.360
  418    HB3  ALA  68           3HB      ALA  68  -6.952   5.974   7.769
  419    H    LEU  69           H        LEU  69  -3.139   4.478   8.518
  420    HA   LEU  69           HA       LEU  69  -2.563   3.942  11.334
  421    HB3  LEU  69           2HB      LEU  69  -0.240   3.336  10.132
  422    HG   LEU  69           HG       LEU  69  -0.972   1.106   9.705
  423   HD11  LEU  69          1HD1      LEU  69  -0.692   1.882  12.075
  424   HD12  LEU  69          2HD1      LEU  69  -1.738   0.467  11.875
  425   HD13  LEU  69          3HD1      LEU  69  -2.462   2.042  12.179
  426   HD21  LEU  69          3HD2      LEU  69  -3.123   1.575   8.547
  427   HD22  LEU  69          1HD2      LEU  69  -3.855   2.015  10.105
  428   HD23  LEU  69          2HD2      LEU  69  -3.279   0.360   9.827
  429    H    GLY  70           H        GLY  70  -1.966   6.673   9.352
  430    HA2  GLY  70           2HA      GLY  70  -1.449   8.763  10.362
  431    HA3  GLY  70           3HA      GLY  70  -0.376   7.970  11.522
  432    H    TYR  71           H        TYR  71   0.168   6.728   8.427
  433    HA   TYR  71           HA       TYR  71   2.639   8.364   8.101
  434    HB3  TYR  71           2HB      TYR  71   3.490   6.437   6.902
  435    HD1  TYR  71           2HD      TYR  71   4.314   7.252   9.366
  436    HD2  TYR  71           1HD      TYR  71   1.604   3.996   8.576
  437    HE1  TYR  71           2HE      TYR  71   4.802   6.321  11.597
  438    HE2  TYR  71           1HE      TYR  71   2.092   3.051  10.836
  439    HH   TYR  71           HH       TYR  71   4.384   4.639  13.087
  440    H    THR  72           H        THR  72   3.185   7.812   5.428
  441    HA   THR  72           HA       THR  72   0.885   8.641   3.769
  442    HB   THR  72           HB       THR  72   2.323  10.300   2.560
  443    HG1  THR  72           1HG      THR  72   4.016  10.111   4.834
  444   HG21  THR  72          3HG2      THR  72   2.179  12.147   4.110
  445   HG22  THR  72          1HG2      THR  72   2.034  11.052   5.497
  446   HG23  THR  72          2HG2      THR  72   0.738  11.129   4.283
  447    H    LEU  73           H        LEU  73   1.593   8.457   1.376
  448    HA   LEU  73           HA       LEU  73   3.808   6.486   0.991
  449    HB3  LEU  73           2HB      LEU  73   1.554   5.398   0.962
  450    HG   LEU  73           HG       LEU  73   0.512   7.319  -0.616
  451   HD11  LEU  73          1HD1      LEU  73   0.340   6.419  -2.981
  452   HD12  LEU  73          2HD1      LEU  73   1.663   5.302  -2.610
  453   HD13  LEU  73          3HD1      LEU  73   1.929   7.056  -2.587
  454   HD21  LEU  73          3HD2      LEU  73  -0.710   5.430   0.354
  455   HD22  LEU  73          1HD2      LEU  73  -0.080   4.339  -0.900
  456   HD23  LEU  73          2HD2      LEU  73  -1.183   5.660  -1.337
  457    H    ALA  74           H        ALA  74   4.647   6.368  -1.192
  458    HA   ALA  74           HA       ALA  74   4.028   8.685  -2.943
  459    HB1  ALA  74           1HB      ALA  74   5.970   9.418  -1.645
  460    HB2  ALA  74           2HB      ALA  74   6.865   7.957  -2.102
  461    HB3  ALA  74           3HB      ALA  74   6.422   9.153  -3.338
  462    H    GLU  75           H        GLU  75   3.473   7.990  -4.818
  463    HA   GLU  75           HA       GLU  75   4.983   5.848  -6.233
  464    HB3  GLU  75           2HB      GLU  75   1.981   6.157  -6.573
  465    HG3  GLU  75           2HG      GLU  75   2.068   3.761  -7.032
  466    HA   PRO  76           HA       PRO  76   5.076   9.953  -8.156
  467    HB3  PRO  76           2HB      PRO  76   7.344   9.907  -7.831
  468    HG3  PRO  76           2HG      PRO  76   8.609   7.909  -8.116
  469    HD3  PRO  76           2HD      PRO  76   6.883   7.383  -6.598
  Start of MODEL   28
    1    H2   PRO   6           2H       PRO   6  -7.310  -2.458 -17.020
    2    HA   PRO   6           HA       PRO   6  -6.983  -5.282 -17.134
    3    HB3  PRO   6           2HB      PRO   6  -5.517  -5.286 -18.867
    4    HG3  PRO   6           2HG      PRO   6  -5.115  -3.260 -20.059
    5    HD3  PRO   6           2HD      PRO   6  -7.461  -3.588 -19.708
    6    H    LEU   7           H        LEU   7  -5.281  -5.974 -15.514
    7    HA   LEU   7           HA       LEU   7  -5.129  -4.079 -13.262
    8    HB3  LEU   7           2HB      LEU   7  -3.869  -6.232 -12.344
    9    HG   LEU   7           HG       LEU   7  -5.967  -5.371 -11.459
   10   HD11  LEU   7          1HD1      LEU   7  -8.151  -6.397 -12.275
   11   HD12  LEU   7          2HD1      LEU   7  -7.277  -6.954 -13.714
   12   HD13  LEU   7          3HD1      LEU   7  -7.441  -5.216 -13.376
   13   HD21  LEU   7          3HD2      LEU   7  -6.809  -7.493 -10.581
   14   HD22  LEU   7          1HD2      LEU   7  -5.045  -7.566 -10.704
   15   HD23  LEU   7          2HD2      LEU   7  -6.051  -8.390 -11.912
   16    H    LYS   8           H        LYS   8  -3.284  -3.447 -12.300
   17    HA   LYS   8           HA       LYS   8  -0.717  -3.720 -13.818
   18    HB3  LYS   8           2HB      LYS   8  -1.607  -1.614 -14.412
   19    HG3  LYS   8           2HG      LYS   8  -2.002  -1.004 -11.465
   20    HD3  LYS   8           2HD      LYS   8  -2.267   0.909 -13.815
   21    HE3  LYS   8           2HE      LYS   8  -2.059   1.282 -10.795
   22    HZ1  LYS   8           3HZ      LYS   8  -2.477   3.638 -11.360
   23    HZ2  LYS   8           1HZ      LYS   8  -2.338   3.293 -12.949
   24    HZ3  LYS   8           2HZ      LYS   8  -1.039   3.127 -11.964
   25    H    THR   9           H        THR   9   0.929  -4.370 -12.631
   26    HA   THR   9           HA       THR   9   0.831  -4.275  -9.652
   27    HB   THR   9           HB       THR   9   1.345  -6.427 -10.753
   28    HG1  THR   9           1HG      THR   9   2.866  -6.848  -9.269
   29   HG21  THR   9          3HG2      THR   9   4.012  -5.128 -11.480
   30   HG22  THR   9          1HG2      THR   9   2.765  -5.622 -12.649
   31   HG23  THR   9          2HG2      THR   9   3.575  -6.838 -11.652
   32    H    GLN  10           H        GLN  10   2.710  -3.418  -8.496
   33    HA   GLN  10           HA       GLN  10   4.765  -1.935  -9.706
   34    HB3  GLN  10           2HB      GLN  10   3.185  -0.257 -10.456
   35    HG3  GLN  10           2HG      GLN  10   2.132   1.165  -8.467
   36   HE21  GLN  10          1HE2      GLN  10   0.362  -1.842  -8.436
   37   HE22  GLN  10          2HE2      GLN  10  -0.695  -1.437  -9.773
   38    H    GLN  11           H        GLN  11   6.175  -0.967  -8.213
   39    HA   GLN  11           HA       GLN  11   5.651  -1.438  -5.335
   40    HB3  GLN  11           2HB      GLN  11   8.003  -0.497  -5.117
   41    HG3  GLN  11           2HG      GLN  11   7.596  -2.985  -6.821
   42   HE21  GLN  11          1HE2      GLN  11   9.415  -4.573  -6.593
   43   HE22  GLN  11          2HE2      GLN  11  11.037  -3.893  -6.701
   44    H    MET  12           H        MET  12   5.689   0.239  -3.819
   45    HA   MET  12           HA       MET  12   5.579   3.065  -4.774
   46    HB3  MET  12           2HB      MET  12   3.288   2.439  -4.247
   47    HG3  MET  12           2HG      MET  12   4.409   1.612  -1.530
   48    HE1  MET  12           3HE      MET  12   1.194   3.074  -3.410
   49    HE2  MET  12           1HE      MET  12   0.905   1.316  -3.351
   50    HE3  MET  12           2HE      MET  12  -0.079   2.425  -2.369
   51    H    GLN  13           H        GLN  13   6.329   4.584  -3.276
   52    HA   GLN  13           HA       GLN  13   8.391   3.523  -1.426
   53    HB3  GLN  13           2HB      GLN  13   7.846   6.356  -2.424
   54    HG3  GLN  13           2HG      GLN  13  10.349   5.263  -1.073
   55   HE21  GLN  13          1HE2      GLN  13  11.759   6.438  -2.520
   56   HE22  GLN  13          2HE2      GLN  13  11.757   8.192  -2.530
   57    H    VAL  14           H        VAL  14   8.046   3.614   0.749
   58    HA   VAL  14           HA       VAL  14   5.696   5.098   1.860
   59    HB   VAL  14           HB       VAL  14   6.299   2.128   2.014
   60   HG11  VAL  14          1HG1      VAL  14   5.912   2.746   4.359
   61   HG12  VAL  14          2HG1      VAL  14   4.467   3.682   3.903
   62   HG13  VAL  14          3HG1      VAL  14   4.493   1.918   3.719
   63   HG21  VAL  14          3HG2      VAL  14   3.963   1.893   1.378
   64   HG22  VAL  14          1HG2      VAL  14   3.741   3.653   1.429
   65   HG23  VAL  14          2HG2      VAL  14   4.809   2.922   0.217
   66    H    GLY  15           H        GLY  15   5.828   5.637   4.028
   67    HA2  GLY  15           2HA      GLY  15   8.506   6.265   4.985
   68    HA3  GLY  15           3HA      GLY  15   6.961   6.710   5.719
   69    H    GLY  16           H        GLY  16   6.996   6.101   7.746
   70    HA2  GLY  16           2HA      GLY  16   8.821   4.311   8.897
   71    HA3  GLY  16           3HA      GLY  16   7.449   5.073   9.718
   72    H    MET  17           H        MET  17   6.537   2.969   7.151
   73    HA   MET  17           HA       MET  17   5.130   1.130   8.841
   74    HB3  MET  17           2HB      MET  17   5.975   0.818   5.931
   75    HG3  MET  17           2HG      MET  17   3.536  -0.198   7.442
   76    HE1  MET  17           3HE      MET  17   5.331  -2.037   4.578
   77    HE2  MET  17           1HE      MET  17   4.527  -1.453   3.109
   78    HE3  MET  17           2HE      MET  17   5.600  -0.373   4.007
   79    H    ARG  18           H        ARG  18   8.428   1.233   8.106
   80    HA   ARG  18           HA       ARG  18   9.241  -1.475   7.960
   81    HB3  ARG  18           2HB      ARG  18  10.670   0.170   7.103
   82    HG3  ARG  18           2HG      ARG  18  10.462   1.537   9.805
   83    HD3  ARG  18           2HD      ARG  18  12.813   1.504   9.355
   84    HE   ARG  18           HE       ARG  18  12.163   2.486   6.588
   85   HH11  ARG  18          1HH1      ARG  18  14.553   0.861   8.728
   86   HH12  ARG  18          2HH1      ARG  18  15.574   0.537   7.335
   87   HH21  ARG  18          1HH2      ARG  18  13.525   1.811   4.941
   88   HH22  ARG  18          2HH2      ARG  18  15.069   1.095   5.370
   89    H    CYS  19           H        CYS  19   7.593  -1.925   9.888
   90    HA   CYS  19           HA       CYS  19   9.332  -3.226  11.789
   91    HB3  CYS  19           2HB      CYS  19   7.167  -1.453  12.995
   92    HG   CYS  19           HG       CYS  19   8.373  -1.736  15.289
   93    H    ALA  20           H        ALA  20   8.359  -5.119  12.569
   94    HA   ALA  20           HA       ALA  20   6.720  -6.373  10.740
   95    HB1  ALA  20           1HB      ALA  20   6.652  -8.237  12.309
   96    HB2  ALA  20           2HB      ALA  20   8.247  -7.464  12.363
   97    HB3  ALA  20           3HB      ALA  20   7.072  -7.166  13.661
   98    H    ALA  21           H        ALA  21   5.513  -5.242  13.964
   99    HA   ALA  21           HA       ALA  21   2.791  -5.976  13.467
  100    HB1  ALA  21           1HB      ALA  21   2.296  -4.502  15.363
  101    HB2  ALA  21           2HB      ALA  21   3.740  -5.470  15.710
  102    HB3  ALA  21           3HB      ALA  21   3.900  -3.758  15.242
  103    H    CYS  22           H        CYS  22   4.565  -2.953  12.712
  104    HA   CYS  22           HA       CYS  22   2.227  -1.458  12.037
  105    HB3  CYS  22           2HB      CYS  22   3.899   0.188  11.156
  106    HG   CYS  22           HG       CYS  22   3.230   0.215  13.662
  107    H    ALA  23           H        ALA  23   4.596  -3.070   9.828
  108    HA   ALA  23           HA       ALA  23   3.080  -2.653   7.444
  109    HB1  ALA  23           1HB      ALA  23   5.440  -3.438   7.581
  110    HB2  ALA  23           2HB      ALA  23   4.878  -4.970   8.299
  111    HB3  ALA  23           3HB      ALA  23   4.432  -4.539   6.638
  112    H    SER  24           H        SER  24   2.498  -4.799  10.177
  113    HA   SER  24           HA       SER  24   0.661  -6.549   8.640
  114    HB3  SER  24           2HB      SER  24   0.244  -7.674  10.713
  115    HG   SER  24           HG       SER  24   3.031  -7.039  10.662
  116    H    SER  25           H        SER  25   0.339  -3.830  10.987
  117    HA   SER  25           HA       SER  25  -2.487  -3.778  11.005
  118    HB3  SER  25           2HB      SER  25  -2.302  -1.519  11.875
  119    HG   SER  25           HG       SER  25  -0.565  -1.889  13.492
  120    H    ILE  26           H        ILE  26  -0.287  -2.657   8.546
  121    HA   ILE  26           HA       ILE  26  -2.469  -1.495   6.893
  122    HB   ILE  26           HB       ILE  26   0.487  -1.996   6.363
  123   HG13  ILE  26          2HG1      ILE  26  -1.282   0.501   6.352
  124   HG21  ILE  26          1HG2      ILE  26  -1.636  -1.175   4.324
  125   HG22  ILE  26          2HG2      ILE  26   0.119  -1.072   4.069
  126   HG23  ILE  26          3HG2      ILE  26  -0.629  -2.642   4.275
  127   HD11  ILE  26          3HD1      ILE  26  -0.307   0.016   8.594
  128   HD12  ILE  26          1HD1      ILE  26   1.306  -0.074   7.848
  129   HD13  ILE  26          2HD1      ILE  26   0.414   1.454   7.847
  130    H    GLU  27           H        GLU  27  -0.401  -4.478   6.716
  131    HA   GLU  27           HA       GLU  27  -1.785  -5.179   4.352
  132    HB3  GLU  27           2HB      GLU  27  -0.258  -7.303   5.825
  133    HG3  GLU  27           2HG      GLU  27  -0.274  -6.303   2.927
  134    H    ARG  28           H        ARG  28  -2.381  -6.158   7.695
  135    HA   ARG  28           HA       ARG  28  -4.182  -8.295   7.350
  136    HB3  ARG  28           2HB      ARG  28  -4.149  -5.995   9.343
  137    HG3  ARG  28           2HG      ARG  28  -5.494  -8.716   9.602
  138    HD3  ARG  28           2HD      ARG  28  -6.215  -7.681  11.838
  139    HE   ARG  28           HE       ARG  28  -4.090  -9.308  11.328
  140   HH11  ARG  28          1HH1      ARG  28  -4.212  -6.599  13.606
  141   HH12  ARG  28          2HH1      ARG  28  -3.720  -7.606  14.946
  142   HH21  ARG  28          1HH2      ARG  28  -3.246 -10.459  13.044
  143   HH22  ARG  28          2HH2      ARG  28  -2.726  -9.623  14.490
  144    H    ALA  29           H        ALA  29  -4.728  -4.825   6.794
  145    HA   ALA  29           HA       ALA  29  -7.592  -5.241   6.114
  146    HB1  ALA  29           1HB      ALA  29  -5.801  -2.771   6.055
  147    HB2  ALA  29           2HB      ALA  29  -7.539  -2.805   5.695
  148    HB3  ALA  29           3HB      ALA  29  -6.967  -3.201   7.326
  149    H    LEU  30           H        LEU  30  -4.464  -4.515   4.474
  150    HA   LEU  30           HA       LEU  30  -5.553  -3.960   1.940
  151    HB3  LEU  30           2HB      LEU  30  -2.840  -5.172   2.553
  152    HG   LEU  30           HG       LEU  30  -3.102  -4.929   0.154
  153   HD11  LEU  30          1HD1      LEU  30  -3.471  -2.708  -0.887
  154   HD12  LEU  30          2HD1      LEU  30  -3.819  -2.014   0.716
  155   HD13  LEU  30          3HD1      LEU  30  -4.882  -3.249   0.002
  156   HD21  LEU  30          3HD2      LEU  30  -1.198  -3.403  -0.251
  157   HD22  LEU  30          1HD2      LEU  30  -0.921  -4.404   1.185
  158   HD23  LEU  30          2HD2      LEU  30  -1.401  -2.703   1.368
  159    H    GLU  31           H        GLU  31  -4.948  -7.152   3.337
  160    HA   GLU  31           HA       GLU  31  -5.389  -8.552   0.808
  161    HB3  GLU  31           2HB      GLU  31  -4.031  -9.588   2.480
  162    HG3  GLU  31           2HG      GLU  31  -6.522  -9.780   4.212
  163    H    ARG  32           H        ARG  32  -7.491  -6.899   2.942
  164    HA   ARG  32           HA       ARG  32  -9.835  -8.495   2.086
  165    HB3  ARG  32           2HB      ARG  32 -10.993  -7.357   3.997
  166    HG3  ARG  32           2HG      ARG  32  -8.480  -8.830   4.863
  167    HD3  ARG  32           2HD      ARG  32 -11.234  -8.436   6.098
  168    HE   ARG  32           HE       ARG  32  -9.294 -10.538   6.539
  169   HH11  ARG  32          1HH1      ARG  32 -11.673  -8.526   8.283
  170   HH12  ARG  32          2HH1      ARG  32 -11.784  -9.670   9.583
  171   HH21  ARG  32          1HH2      ARG  32  -9.491 -11.930   8.291
  172   HH22  ARG  32          2HH2      ARG  32 -10.517 -11.503   9.637
  173    H    LEU  33           H        LEU  33  -8.470  -5.268   1.721
  174    HA   LEU  33           HA       LEU  33 -10.754  -3.700   1.533
  175    HB3  LEU  33           2HB      LEU  33  -9.377  -2.198   0.012
  176    HG   LEU  33           HG       LEU  33  -7.708  -3.165   2.341
  177   HD11  LEU  33          1HD1      LEU  33  -6.662  -0.985   2.236
  178   HD12  LEU  33          2HD1      LEU  33  -7.749  -0.485   0.927
  179   HD13  LEU  33          3HD1      LEU  33  -6.544  -1.754   0.643
  180   HD21  LEU  33          3HD2      LEU  33  -9.901  -2.506   3.211
  181   HD22  LEU  33          1HD2      LEU  33  -9.845  -0.998   2.263
  182   HD23  LEU  33          2HD2      LEU  33  -8.698  -1.268   3.590
  183    H    LYS  34           H        LYS  34  -9.819  -5.919  -0.992
  184    HA   LYS  34           HA       LYS  34 -10.659  -6.436  -3.020
  185    HB3  LYS  34           2HB      LYS  34 -12.962  -5.640  -3.684
  186    HG3  LYS  34           2HG      LYS  34 -12.706  -6.956  -0.948
  187    HD3  LYS  34           2HD      LYS  34 -14.992  -6.698  -2.952
  188    HE3  LYS  34           2HE      LYS  34 -14.894  -9.031  -2.167
  189    HZ1  LYS  34           3HZ      LYS  34 -15.374  -9.430   0.169
  190    HZ2  LYS  34           1HZ      LYS  34 -15.121  -7.842   0.551
  191    HZ3  LYS  34           2HZ      LYS  34 -13.887  -8.785   0.009
  192    H    GLY  35           H        GLY  35 -11.052  -5.658  -5.225
  193    HA2  GLY  35           2HA      GLY  35 -10.639  -4.248  -7.046
  194    HA3  GLY  35           3HA      GLY  35 -10.571  -2.863  -5.934
  195    H    VAL  36           H        VAL  36  -8.511  -3.504  -4.297
  196    HA   VAL  36           HA       VAL  36  -6.017  -4.029  -5.745
  197    HB   VAL  36           HB       VAL  36  -5.837  -2.988  -3.588
  198   HG11  VAL  36          1HG1      VAL  36  -7.788  -3.726  -2.405
  199   HG12  VAL  36          2HG1      VAL  36  -7.254  -5.417  -2.422
  200   HG13  VAL  36          3HG1      VAL  36  -6.376  -4.207  -1.473
  201   HG21  VAL  36          3HG2      VAL  36  -4.029  -4.547  -4.286
  202   HG22  VAL  36          1HG2      VAL  36  -4.165  -4.383  -2.530
  203   HG23  VAL  36          2HG2      VAL  36  -4.784  -5.836  -3.327
  204    H    ALA  37           H        ALA  37  -5.075  -5.986  -6.100
  205    HA   ALA  37           HA       ALA  37  -6.890  -8.380  -6.013
  206    HB1  ALA  37           1HB      ALA  37  -4.864  -7.437  -8.095
  207    HB2  ALA  37           2HB      ALA  37  -5.869  -8.894  -8.200
  208    HB3  ALA  37           3HB      ALA  37  -6.633  -7.297  -8.207
  209    H    GLU  38           H        GLU  38  -3.454  -7.382  -5.827
  210    HA   GLU  38           HA       GLU  38  -2.778  -9.735  -4.221
  211    HB3  GLU  38           2HB      GLU  38  -0.699 -10.122  -5.622
  212    HG3  GLU  38           2HG      GLU  38  -3.351 -10.768  -6.942
  213    H    ALA  39           H        ALA  39  -1.161  -9.142  -2.661
  214    HA   ALA  39           HA       ALA  39   0.453  -6.736  -3.147
  215    HB1  ALA  39           1HB      ALA  39  -1.650  -6.775  -0.941
  216    HB2  ALA  39           2HB      ALA  39  -0.449  -5.495  -1.240
  217    HB3  ALA  39           3HB      ALA  39  -1.728  -5.802  -2.427
  218    H    SER  40           H        SER  40   2.164  -6.431  -1.805
  219    HA   SER  40           HA       SER  40   2.701  -8.373   0.405
  220    HB3  SER  40           2HB      SER  40   4.897  -8.933  -0.548
  221    HG   SER  40           HG       SER  40   3.041  -9.409  -2.624
  222    H    VAL  41           H        VAL  41   3.000  -6.922   2.061
  223    HA   VAL  41           HA       VAL  41   4.582  -4.485   1.870
  224    HB   VAL  41           HB       VAL  41   4.678  -4.498   4.325
  225   HG11  VAL  41          1HG1      VAL  41   2.697  -3.604   3.225
  226   HG12  VAL  41          2HG1      VAL  41   1.918  -5.194   3.261
  227   HG13  VAL  41          3HG1      VAL  41   2.292  -4.333   4.771
  228   HG21  VAL  41          3HG2      VAL  41   5.028  -6.756   4.954
  229   HG22  VAL  41          1HG2      VAL  41   3.432  -6.330   5.585
  230   HG23  VAL  41          2HG2      VAL  41   3.575  -7.326   4.132
  231    H    THR  42           H        THR  42   6.698  -4.041   2.658
  232    HA   THR  42           HA       THR  42   8.529  -6.353   3.189
  233    HB   THR  42           HB       THR  42   9.021  -3.998   1.320
  234    HG1  THR  42           1HG      THR  42   8.906  -6.809   0.886
  235   HG21  THR  42          3HG2      THR  42  11.166  -5.122   0.806
  236   HG22  THR  42          1HG2      THR  42  10.861  -6.302   2.099
  237   HG23  THR  42          2HG2      THR  42  11.110  -4.594   2.492
  238    H    VAL  43           H        VAL  43   8.886  -6.053   5.271
  239    HA   VAL  43           HA       VAL  43   8.969  -3.488   6.609
  240    HB   VAL  43           HB       VAL  43   9.623  -6.333   7.446
  241   HG11  VAL  43          1HG1      VAL  43   9.640  -5.516   9.825
  242   HG12  VAL  43          2HG1      VAL  43  11.048  -5.002   8.894
  243   HG13  VAL  43          3HG1      VAL  43   9.738  -3.852   9.209
  244   HG21  VAL  43          3HG2      VAL  43   7.208  -5.598   7.071
  245   HG22  VAL  43          1HG2      VAL  43   7.562  -6.157   8.709
  246   HG23  VAL  43          2HG2      VAL  43   7.440  -4.415   8.373
  247    H    ALA  44           H        ALA  44  11.558  -5.712   5.469
  248    HA   ALA  44           HA       ALA  44  13.688  -4.689   6.949
  249    HB1  ALA  44           1HB      ALA  44  13.709  -5.847   4.118
  250    HB2  ALA  44           2HB      ALA  44  15.096  -5.773   5.227
  251    HB3  ALA  44           3HB      ALA  44  13.690  -6.777   5.630
  252    H    THR  45           H        THR  45  12.372  -3.342   3.990
  253    HA   THR  45           HA       THR  45  14.261  -1.020   4.078
  254    HB   THR  45           HB       THR  45  13.689  -0.796   1.635
  255    HG1  THR  45           1HG      THR  45  12.929  -2.940   0.796
  256   HG21  THR  45          3HG2      THR  45  15.196  -2.539   0.888
  257   HG22  THR  45          1HG2      THR  45  14.955  -3.476   2.377
  258   HG23  THR  45          2HG2      THR  45  15.790  -1.905   2.427
  259    H    GLY  46           H        GLY  46  10.951  -1.968   4.430
  260    HA2  GLY  46           2HA      GLY  46   9.120  -0.699   5.008
  261    HA3  GLY  46           3HA      GLY  46  10.138   0.769   4.972
  262    H    ARG  47           H        ARG  47   8.880  -1.656   2.627
  263    HA   ARG  47           HA       ARG  47   7.704   0.540   1.032
  264    HB3  ARG  47           2HB      ARG  47  10.016   0.195   0.149
  265    HG3  ARG  47           2HG      ARG  47   8.914  -2.465  -0.868
  266    HD3  ARG  47           2HD      ARG  47  11.597  -1.135  -1.416
  267    HE   ARG  47           HE       ARG  47  10.504  -3.724  -2.129
  268   HH11  ARG  47          1HH1      ARG  47  12.466  -1.177  -3.619
  269   HH12  ARG  47          2HH1      ARG  47  13.326  -2.316  -4.614
  270   HH21  ARG  47          1HH2      ARG  47  11.517  -5.047  -3.431
  271   HH22  ARG  47          2HH2      ARG  47  12.881  -4.534  -4.434
  272    H    LEU  48           H        LEU  48   6.471  -0.449  -0.952
  273    HA   LEU  48           HA       LEU  48   5.139  -3.003  -0.169
  274    HB3  LEU  48           2HB      LEU  48   3.196  -1.075  -1.217
  275    HG   LEU  48           HG       LEU  48   3.490  -2.534   1.428
  276   HD11  LEU  48          1HD1      LEU  48   1.155  -1.796   1.879
  277   HD12  LEU  48          2HD1      LEU  48   1.237  -0.761   0.432
  278   HD13  LEU  48          3HD1      LEU  48   2.298  -0.440   1.822
  279   HD21  LEU  48          3HD2      LEU  48   2.900  -3.994  -0.487
  280   HD22  LEU  48          1HD2      LEU  48   1.541  -2.931  -0.894
  281   HD23  LEU  48          2HD2      LEU  48   1.549  -3.848   0.630
  282    H    THR  49           H        THR  49   4.240  -4.158  -1.772
  283    HA   THR  49           HA       THR  49   4.520  -3.327  -4.651
  284    HB   THR  49           HB       THR  49   4.748  -6.148  -3.504
  285    HG1  THR  49           1HG      THR  49   6.633  -5.096  -3.164
  286   HG21  THR  49          3HG2      THR  49   5.345  -6.753  -5.839
  287   HG22  THR  49          1HG2      THR  49   4.995  -5.089  -6.364
  288   HG23  THR  49          2HG2      THR  49   3.698  -6.137  -5.743
  289    H    VAL  50           H        VAL  50   2.601  -3.312  -5.659
  290    HA   VAL  50           HA       VAL  50   0.306  -4.827  -4.532
  291    HB   VAL  50           HB       VAL  50   0.294  -2.697  -3.329
  292   HG11  VAL  50          1HG1      VAL  50  -0.149  -0.558  -4.397
  293   HG12  VAL  50          2HG1      VAL  50   1.378  -1.213  -5.003
  294   HG13  VAL  50          3HG1      VAL  50  -0.090  -1.288  -6.006
  295   HG21  VAL  50          3HG2      VAL  50  -2.028  -2.075  -3.741
  296   HG22  VAL  50          1HG2      VAL  50  -2.003  -2.857  -5.324
  297   HG23  VAL  50          2HG2      VAL  50  -1.831  -3.831  -3.845
  298    H    THR  51           H        THR  51  -1.153  -5.474  -5.933
  299    HA   THR  51           HA       THR  51  -1.135  -4.534  -8.763
  300    HB   THR  51           HB       THR  51  -2.145  -7.208  -7.699
  301    HG1  THR  51           1HG      THR  51  -0.305  -7.965  -8.928
  302   HG21  THR  51          3HG2      THR  51  -3.219  -6.311  -9.841
  303   HG22  THR  51          1HG2      THR  51  -2.303  -7.781 -10.107
  304   HG23  THR  51          2HG2      THR  51  -1.609  -6.214 -10.567
  305    H    TYR  52           H        TYR  52  -2.986  -3.491  -9.373
  306    HA   TYR  52           HA       TYR  52  -5.541  -4.148  -8.080
  307    HB3  TYR  52           2HB      TYR  52  -4.511  -2.453  -6.584
  308    HD1  TYR  52           1HD      TYR  52  -2.383  -1.360  -7.441
  309    HD2  TYR  52           2HD      TYR  52  -6.313  -0.030  -8.609
  310    HE1  TYR  52           1HE      TYR  52  -1.437   0.864  -8.069
  311    HE2  TYR  52           2HE      TYR  52  -5.380   2.194  -9.212
  312    HH   TYR  52           HH       TYR  52  -1.913   3.004  -8.801
  313    H    ASP  53           H        ASP  53  -7.418  -3.003  -9.007
  314    HA   ASP  53           HA       ASP  53  -7.161  -2.667 -11.936
  315    HB3  ASP  53           2HB      ASP  53  -9.541  -3.243 -10.148
  316    HA   PRO  54           HA       PRO  54  -7.625   1.653 -10.623
  317    HB3  PRO  54           2HB      PRO  54  -5.680   1.984 -11.825
  318    HG3  PRO  54           2HG      PRO  54  -5.322   0.952 -13.941
  319    HD3  PRO  54           2HD      PRO  54  -5.691  -0.805 -12.420
  320    H    LYS  55           H        LYS  55  -9.882  -0.041 -12.020
  321    HA   LYS  55           HA       LYS  55 -11.639   2.343 -12.495
  322    HB3  LYS  55           2HB      LYS  55 -12.924   1.041 -14.161
  323    HG3  LYS  55           2HG      LYS  55 -10.026   1.312 -15.060
  324    HD3  LYS  55           2HD      LYS  55 -11.066   2.143 -17.149
  325    HE3  LYS  55           2HE      LYS  55 -12.092  -0.614 -16.345
  326    HZ1  LYS  55           3HZ      LYS  55 -12.110  -1.014 -18.722
  327    HZ2  LYS  55           1HZ      LYS  55 -11.636   0.528 -19.046
  328    HZ3  LYS  55           2HZ      LYS  55 -13.100   0.255 -18.381
  329    H    GLN  56           H        GLN  56 -11.315  -0.972 -11.239
  330    HA   GLN  56           HA       GLN  56 -13.838  -0.778  -9.731
  331    HB3  GLN  56           2HB      GLN  56 -12.840  -2.533  -8.286
  332    HG3  GLN  56           2HG      GLN  56 -12.577  -3.174 -11.258
  333   HE21  GLN  56          1HE2      GLN  56 -14.587  -5.354 -10.682
  334   HE22  GLN  56          2HE2      GLN  56 -13.588  -6.636 -10.003
  335    H    VAL  57           H        VAL  57 -10.419   0.182  -9.093
  336    HA   VAL  57           HA       VAL  57 -11.400   2.034  -6.987
  337    HB   VAL  57           HB       VAL  57  -9.633   1.454  -5.409
  338   HG11  VAL  57          1HG1      VAL  57 -11.493  -0.884  -5.993
  339   HG12  VAL  57          2HG1      VAL  57 -10.666  -0.543  -4.463
  340   HG13  VAL  57          3HG1      VAL  57 -11.894   0.579  -5.075
  341   HG21  VAL  57          3HG2      VAL  57  -8.439  -0.698  -5.547
  342   HG22  VAL  57          1HG2      VAL  57  -9.160  -1.031  -7.135
  343   HG23  VAL  57          2HG2      VAL  57  -8.026   0.319  -6.933
  344    H    SER  58           H        SER  58  -8.898   2.975  -6.136
  345    HA   SER  58           HA       SER  58  -7.146   3.533  -8.401
  346    HB3  SER  58           2HB      SER  58  -8.889   5.263  -8.685
  347    HG   SER  58           HG       SER  58  -9.721   5.670  -6.763
  348    H    GLU  59           H        GLU  59  -5.487   5.391  -7.352
  349    HA   GLU  59           HA       GLU  59  -3.949   4.238  -5.353
  350    HB3  GLU  59           2HB      GLU  59  -2.940   6.379  -4.976
  351    HG3  GLU  59           2HG      GLU  59  -2.793   5.401  -7.417
  352    H    ILE  60           H        ILE  60  -6.822   6.198  -4.920
  353    HA   ILE  60           HA       ILE  60  -6.719   7.053  -2.251
  354    HB   ILE  60           HB       ILE  60  -8.910   6.209  -4.167
  355   HG13  ILE  60          2HG1      ILE  60  -9.453   8.555  -4.278
  356   HG21  ILE  60          1HG2      ILE  60  -9.967   5.623  -2.199
  357   HG22  ILE  60          2HG2      ILE  60  -9.353   7.047  -1.314
  358   HG23  ILE  60          3HG2      ILE  60 -10.593   7.223  -2.595
  359   HD11  ILE  60          3HD1      ILE  60  -8.757   9.344  -1.999
  360   HD12  ILE  60          1HD1      ILE  60  -7.055   9.171  -2.497
  361   HD13  ILE  60          2HD1      ILE  60  -8.108  10.322  -3.323
  362    H    THR  61           H        THR  61  -7.864   3.865  -3.397
  363    HA   THR  61           HA       THR  61  -8.958   3.024  -0.922
  364    HB   THR  61           HB       THR  61  -7.951   1.544  -3.362
  365    HG1  THR  61           1HG      THR  61  -9.912   2.655  -3.502
  366   HG21  THR  61          3HG2      THR  61  -9.125  -0.481  -2.472
  367   HG22  THR  61          1HG2      THR  61  -9.259   0.313  -0.889
  368   HG23  THR  61          2HG2      THR  61  -7.661  -0.105  -1.557
  369    H    ILE  62           H        ILE  62  -5.638   2.669  -2.110
  370    HA   ILE  62           HA       ILE  62  -4.793   1.348   0.427
  371    HB   ILE  62           HB       ILE  62  -4.082   0.423  -1.729
  372   HG13  ILE  62          2HG1      ILE  62  -2.780   0.197   0.413
  373   HG21  ILE  62          1HG2      ILE  62  -2.461   2.982  -2.104
  374   HG22  ILE  62          2HG2      ILE  62  -2.355   1.526  -3.109
  375   HG23  ILE  62          3HG2      ILE  62  -3.845   2.456  -3.094
  376   HD11  ILE  62          3HD1      ILE  62  -0.924   0.152  -1.999
  377   HD12  ILE  62          1HD1      ILE  62  -0.841  -0.822  -0.526
  378   HD13  ILE  62          2HD1      ILE  62  -2.150  -1.090  -1.684
  379    H    GLN  63           H        GLN  63  -4.532   4.521  -1.128
  380    HA   GLN  63           HA       GLN  63  -2.582   5.689   0.539
  381    HB3  GLN  63           2HB      GLN  63  -5.123   7.031  -0.503
  382    HG3  GLN  63           2HG      GLN  63  -2.307   8.133  -0.126
  383   HE21  GLN  63          1HE2      GLN  63  -2.214   9.159  -2.244
  384   HE22  GLN  63          2HE2      GLN  63  -3.366  10.429  -2.636
  385    H    GLU  64           H        GLU  64  -6.136   5.498   1.086
  386    HA   GLU  64           HA       GLU  64  -6.266   6.917   3.508
  387    HB3  GLU  64           2HB      GLU  64  -8.287   5.399   3.969
  388    HG3  GLU  64           2HG      GLU  64  -8.197   6.720   1.226
  389    H    ARG  65           H        ARG  65  -5.715   3.368   3.190
  390    HA   ARG  65           HA       ARG  65  -5.636   2.966   6.046
  391    HB3  ARG  65           2HB      ARG  65  -4.832   1.276   3.655
  392    HG3  ARG  65           2HG      ARG  65  -3.535   0.325   5.427
  393    HD3  ARG  65           2HD      ARG  65  -4.719   1.230   7.444
  394    HE   ARG  65           HE       ARG  65  -7.070   0.238   6.630
  395   HH11  ARG  65          1HH1      ARG  65  -5.073  -1.040   9.299
  396   HH12  ARG  65          2HH1      ARG  65  -6.481  -1.217  10.316
  397   HH21  ARG  65          1HH2      ARG  65  -8.736  -0.067   7.941
  398   HH22  ARG  65          2HH2      ARG  65  -8.562  -0.759   9.529
  399    H    ILE  66           H        ILE  66  -3.009   3.553   3.651
  400    HA   ILE  66           HA       ILE  66  -0.923   3.036   5.669
  401    HB   ILE  66           HB       ILE  66  -0.805   4.371   2.944
  402   HG13  ILE  66          2HG1      ILE  66  -1.403   1.842   3.144
  403   HG21  ILE  66          1HG2      ILE  66   1.694   4.012   3.154
  404   HG22  ILE  66          2HG2      ILE  66   1.087   5.167   4.328
  405   HG23  ILE  66          3HG2      ILE  66   1.448   3.502   4.836
  406   HD11  ILE  66          3HD1      ILE  66   1.137   2.487   1.609
  407   HD12  ILE  66          1HD1      ILE  66  -0.007   1.162   1.331
  408   HD13  ILE  66          2HD1      ILE  66  -0.529   2.834   1.070
  409    H    ALA  67           H        ALA  67  -2.523   6.015   4.457
  410    HA   ALA  67           HA       ALA  67  -0.987   7.800   6.100
  411    HB1  ALA  67           1HB      ALA  67  -2.845   9.369   5.604
  412    HB2  ALA  67           2HB      ALA  67  -2.318   8.506   4.146
  413    HB3  ALA  67           3HB      ALA  67  -3.820   8.027   4.966
  414    H    ALA  68           H        ALA  68  -4.052   5.986   6.723
  415    HA   ALA  68           HA       ALA  68  -4.784   7.259   9.122
  416    HB1  ALA  68           1HB      ALA  68  -6.235   5.259   9.432
  417    HB2  ALA  68           2HB      ALA  68  -6.292   5.890   7.782
  418    HB3  ALA  68           3HB      ALA  68  -5.351   4.426   8.134
  419    H    LEU  69           H        LEU  69  -2.659   4.378   8.762
  420    HA   LEU  69           HA       LEU  69  -2.252   4.104  11.646
  421    HB3  LEU  69           2HB      LEU  69  -0.182   2.794  10.836
  422    HG   LEU  69           HG       LEU  69  -1.255   0.796  10.483
  423   HD11  LEU  69          1HD1      LEU  69  -2.917   0.594  12.212
  424   HD12  LEU  69          2HD1      LEU  69  -3.270   2.318  12.165
  425   HD13  LEU  69          3HD1      LEU  69  -1.679   1.748  12.736
  426   HD21  LEU  69          3HD2      LEU  69  -3.789   2.243   9.641
  427   HD22  LEU  69          1HD2      LEU  69  -3.591   0.492   9.830
  428   HD23  LEU  69          2HD2      LEU  69  -2.660   1.346   8.591
  429    H    GLY  70           H        GLY  70  -1.276   6.613   9.640
  430    HA2  GLY  70           2HA      GLY  70  -0.358   8.526  10.639
  431    HA3  GLY  70           3HA      GLY  70   0.569   7.529  11.784
  432    H    TYR  71           H        TYR  71   0.887   6.376   8.576
  433    HA   TYR  71           HA       TYR  71   3.590   7.619   8.330
  434    HB3  TYR  71           2HB      TYR  71   4.140   5.738   6.945
  435    HD1  TYR  71           2HD      TYR  71   5.012   5.994   9.517
  436    HD2  TYR  71           1HD      TYR  71   1.778   3.462   8.201
  437    HE1  TYR  71           2HE      TYR  71   5.176   4.691  11.628
  438    HE2  TYR  71           1HE      TYR  71   1.955   2.143  10.307
  439    HH   TYR  71           HH       TYR  71   2.882   2.039  12.402
  440    H    THR  72           H        THR  72   3.983   7.294   5.581
  441    HA   THR  72           HA       THR  72   1.874   8.683   4.081
  442    HB   THR  72           HB       THR  72   3.573  10.304   3.116
  443    HG1  THR  72           1HG      THR  72   5.404  10.697   4.339
  444   HG21  THR  72          3HG2      THR  72   1.906  11.002   4.873
  445   HG22  THR  72          1HG2      THR  72   3.389  11.967   4.816
  446   HG23  THR  72          2HG2      THR  72   3.180  10.748   6.090
  447    H    LEU  73           H        LEU  73   2.644   8.886   1.714
  448    HA   LEU  73           HA       LEU  73   4.431   6.727   0.837
  449    HB3  LEU  73           2HB      LEU  73   2.378   5.508   1.294
  450    HG   LEU  73           HG       LEU  73   1.038   7.557  -0.516
  451   HD11  LEU  73          1HD1      LEU  73   0.744   5.361  -1.599
  452   HD12  LEU  73          2HD1      LEU  73  -0.776   5.963  -0.932
  453   HD13  LEU  73          3HD1      LEU  73   0.124   4.688  -0.078
  454   HD21  LEU  73          3HD2      LEU  73   0.297   6.194   2.114
  455   HD22  LEU  73          1HD2      LEU  73  -0.843   7.160   1.176
  456   HD23  LEU  73          2HD2      LEU  73   0.592   7.919   1.845
  457    H    ALA  74           H        ALA  74   4.571   6.545  -1.567
  458    HA   ALA  74           HA       ALA  74   3.479   8.708  -3.222
  459    HB1  ALA  74           1HB      ALA  74   5.489   9.800  -2.340
  460    HB2  ALA  74           2HB      ALA  74   6.492   8.418  -2.831
  461    HB3  ALA  74           3HB      ALA  74   5.703   9.435  -4.056
  462    H    GLU  75           H        GLU  75   3.323   8.217  -5.338
  463    HA   GLU  75           HA       GLU  75   4.640   5.914  -6.542
  464    HB3  GLU  75           2HB      GLU  75   1.640   5.765  -6.768
  465    HG3  GLU  75           2HG      GLU  75   2.052   3.367  -6.837
  466    HA   PRO  76           HA       PRO  76   3.826   9.988  -8.429
  467    HB3  PRO  76           2HB      PRO  76   5.896  10.680  -7.789
  468    HG3  PRO  76           2HG      PRO  76   7.764   9.182  -7.788
  469    HD3  PRO  76           2HD      PRO  76   6.041   8.180  -6.505
  Start of MODEL   29
    1    H2   PRO   6           2H       PRO   6  -6.633  -3.666 -18.824
    2    HA   PRO   6           HA       PRO   6  -6.903  -6.282 -17.557
    3    HB3  PRO   6           2HB      PRO   6  -4.564  -6.763 -17.667
    4    HG3  PRO   6           2HG      PRO   6  -5.701  -7.282 -19.708
    5    HD3  PRO   6           2HD      PRO   6  -7.055  -5.705 -20.721
    6    H    LEU   7           H        LEU   7  -4.865  -5.876 -15.598
    7    HA   LEU   7           HA       LEU   7  -5.724  -3.463 -14.114
    8    HB3  LEU   7           2HB      LEU   7  -6.397  -5.488 -13.024
    9    HG   LEU   7           HG       LEU   7  -4.818  -7.100 -14.064
   10   HD11  LEU   7          1HD1      LEU   7  -2.776  -5.878 -12.224
   11   HD12  LEU   7          2HD1      LEU   7  -2.644  -6.234 -13.956
   12   HD13  LEU   7          3HD1      LEU   7  -2.643  -7.554 -12.797
   13   HD21  LEU   7          3HD2      LEU   7  -4.658  -8.538 -12.041
   14   HD22  LEU   7          1HD2      LEU   7  -6.209  -7.692 -12.112
   15   HD23  LEU   7          2HD2      LEU   7  -4.937  -7.112 -11.017
   16    H    LYS   8           H        LYS   8  -3.766  -3.230 -12.339
   17    HA   LYS   8           HA       LYS   8  -1.160  -3.147 -13.752
   18    HB3  LYS   8           2HB      LYS   8  -2.282  -1.111 -14.336
   19    HG3  LYS   8           2HG      LYS   8  -2.667  -0.681 -11.343
   20    HD3  LYS   8           2HD      LYS   8  -3.621   1.528 -11.947
   21    HE3  LYS   8           2HE      LYS   8  -0.675   1.321 -12.714
   22    HZ1  LYS   8           3HZ      LYS   8  -1.681   3.551 -12.919
   23    HZ2  LYS   8           1HZ      LYS   8  -0.571   3.504 -11.721
   24    HZ3  LYS   8           2HZ      LYS   8  -2.164   3.496 -11.349
   25    H    THR   9           H        THR   9   0.658  -3.005 -12.447
   26    HA   THR   9           HA       THR   9   0.247  -3.416  -9.508
   27    HB   THR   9           HB       THR   9   1.130  -5.410 -10.801
   28    HG1  THR   9           1HG      THR   9   1.349  -5.322  -8.663
   29   HG21  THR   9          3HG2      THR   9   2.750  -4.197 -12.285
   30   HG22  THR   9          1HG2      THR   9   3.493  -5.489 -11.336
   31   HG23  THR   9          2HG2      THR   9   3.725  -3.798 -10.854
   32    H    GLN  10           H        GLN  10   2.218  -2.702  -8.201
   33    HA   GLN  10           HA       GLN  10   3.807  -0.542  -9.252
   34    HB3  GLN  10           2HB      GLN  10   1.475   0.072  -7.378
   35    HG3  GLN  10           2HG      GLN  10   3.333   1.505  -6.677
   36   HE21  GLN  10          1HE2      GLN  10   2.996   4.089  -8.717
   37   HE22  GLN  10          2HE2      GLN  10   4.424   3.843  -9.733
   38    H    GLN  11           H        GLN  11   5.419   0.065  -7.799
   39    HA   GLN  11           HA       GLN  11   5.558  -1.304  -5.192
   40    HB3  GLN  11           2HB      GLN  11   7.784  -1.235  -7.263
   41    HG3  GLN  11           2HG      GLN  11   7.634  -3.002  -4.784
   42   HE21  GLN  11          1HE2      GLN  11  10.205  -1.037  -6.293
   43   HE22  GLN  11          2HE2      GLN  11  11.150  -2.384  -6.894
   44    H    MET  12           H        MET  12   6.602  -0.007  -3.586
   45    HA   MET  12           HA       MET  12   7.417   2.752  -4.279
   46    HB3  MET  12           2HB      MET  12   4.987   2.782  -4.533
   47    HG3  MET  12           2HG      MET  12   4.829   1.800  -1.645
   48    HE1  MET  12           3HE      MET  12   1.834   3.966  -1.187
   49    HE2  MET  12           1HE      MET  12   3.160   3.058  -0.426
   50    HE3  MET  12           2HE      MET  12   3.527   4.322  -1.620
   51    H    GLN  13           H        GLN  13   8.071   4.015  -2.481
   52    HA   GLN  13           HA       GLN  13   8.969   2.565  -0.087
   53    HB3  GLN  13           2HB      GLN  13   9.764   4.954   0.519
   54    HG3  GLN  13           2HG      GLN  13  11.388   5.195  -1.454
   55   HE21  GLN  13          1HE2      GLN  13  13.196   3.315  -1.817
   56   HE22  GLN  13          2HE2      GLN  13  13.581   2.502  -0.274
   57    H    VAL  14           H        VAL  14   8.185   2.901   2.037
   58    HA   VAL  14           HA       VAL  14   5.752   4.623   2.345
   59    HB   VAL  14           HB       VAL  14   5.205   2.173   2.295
   60   HG11  VAL  14          1HG1      VAL  14   7.052   1.153   3.415
   61   HG12  VAL  14          2HG1      VAL  14   6.685   2.027   4.922
   62   HG13  VAL  14          3HG1      VAL  14   5.566   0.803   4.275
   63   HG21  VAL  14          3HG2      VAL  14   3.749   3.866   3.341
   64   HG22  VAL  14          1HG2      VAL  14   3.600   2.266   4.078
   65   HG23  VAL  14          2HG2      VAL  14   4.512   3.542   4.910
   66    H    GLY  15           H        GLY  15   5.475   5.623   4.390
   67    HA2  GLY  15           2HA      GLY  15   8.035   6.295   5.734
   68    HA3  GLY  15           3HA      GLY  15   6.510   7.196   5.797
   69    H    GLY  16           H        GLY  16   8.362   4.618   7.119
   70    HA2  GLY  16           2HA      GLY  16   8.301   4.744   9.601
   71    HA3  GLY  16           3HA      GLY  16   6.567   4.425   9.519
   72    H    MET  17           H        MET  17   7.293   2.292   7.257
   73    HA   MET  17           HA       MET  17   7.065   0.183   9.177
   74    HB3  MET  17           2HB      MET  17   7.159  -1.289   7.088
   75    HG3  MET  17           2HG      MET  17   4.999  -0.648   7.893
   76    HE1  MET  17           3HE      MET  17   2.621   0.636   7.757
   77    HE2  MET  17           1HE      MET  17   2.434   2.215   6.973
   78    HE3  MET  17           2HE      MET  17   2.855   0.799   5.994
   79    H    ARG  18           H        ARG  18   9.922   1.272   7.452
   80    HA   ARG  18           HA       ARG  18  11.473  -0.929   7.394
   81    HB3  ARG  18           2HB      ARG  18  12.307   1.008   6.449
   82    HG3  ARG  18           2HG      ARG  18  12.521   2.265   9.224
   83    HD3  ARG  18           2HD      ARG  18  13.694   2.969   6.510
   84    HE   ARG  18           HE       ARG  18  13.158   5.108   6.978
   85   HH11  ARG  18          1HH1      ARG  18  14.205   3.711  10.090
   86   HH12  ARG  18          2HH1      ARG  18  14.082   5.241  10.906
   87   HH21  ARG  18          1HH2      ARG  18  13.091   7.031   8.073
   88   HH22  ARG  18          2HH2      ARG  18  13.485   7.101   9.766
   89    H    CYS  19           H        CYS  19  11.935  -2.464   8.705
   90    HA   CYS  19           HA       CYS  19  12.532  -3.727  10.501
   91    HB3  CYS  19           2HB      CYS  19  14.464  -2.710  11.809
   92    HG   CYS  19           HG       CYS  19  14.834  -4.207   9.748
   93    H    ALA  20           H        ALA  20  10.066  -2.065  10.930
   94    HA   ALA  20           HA       ALA  20   9.964  -2.083  13.923
   95    HB1  ALA  20           1HB      ALA  20   8.960   0.162  13.798
   96    HB2  ALA  20           2HB      ALA  20  10.549   0.157  13.026
   97    HB3  ALA  20           3HB      ALA  20   9.077   0.140  12.025
   98    H    ALA  21           H        ALA  21   8.706  -3.961  11.921
   99    HA   ALA  21           HA       ALA  21   6.842  -5.180  11.692
  100    HB1  ALA  21           1HB      ALA  21   7.328  -5.331  14.101
  101    HB2  ALA  21           2HB      ALA  21   6.191  -4.005  14.425
  102    HB3  ALA  21           3HB      ALA  21   5.607  -5.542  13.760
  103    H    CYS  22           H        CYS  22   6.191  -1.853  11.568
  104    HA   CYS  22           HA       CYS  22   3.432  -1.718  11.674
  105    HB3  CYS  22           2HB      CYS  22   3.680   0.431  10.469
  106    HG   CYS  22           HG       CYS  22   5.467   1.719  12.015
  107    H    ALA  23           H        ALA  23   4.638  -3.772   9.448
  108    HA   ALA  23           HA       ALA  23   2.901  -3.235   7.169
  109    HB1  ALA  23           1HB      ALA  23   3.300  -5.702   6.741
  110    HB2  ALA  23           2HB      ALA  23   4.767  -4.742   6.870
  111    HB3  ALA  23           3HB      ALA  23   4.248  -5.756   8.232
  112    H    SER  24           H        SER  24   2.472  -4.746  10.349
  113    HA   SER  24           HA       SER  24   0.523  -6.611   9.797
  114    HB3  SER  24           2HB      SER  24  -0.106  -6.364  12.232
  115    HG   SER  24           HG       SER  24   1.638  -7.629  11.619
  116    H    SER  25           H        SER  25  -0.182  -3.199  10.676
  117    HA   SER  25           HA       SER  25  -3.040  -3.390  10.597
  118    HB3  SER  25           2HB      SER  25  -2.038  -1.490  11.688
  119    HG   SER  25           HG       SER  25  -0.092  -1.163  10.792
  120    H    ILE  26           H        ILE  26  -0.712  -2.405   8.136
  121    HA   ILE  26           HA       ILE  26  -2.524  -1.749   6.042
  122    HB   ILE  26           HB       ILE  26   0.321  -2.817   5.773
  123   HG13  ILE  26          2HG1      ILE  26   1.091  -0.474   5.792
  124   HG21  ILE  26          1HG2      ILE  26   0.415  -1.365   3.750
  125   HG22  ILE  26          2HG2      ILE  26  -0.747  -2.679   3.618
  126   HG23  ILE  26          3HG2      ILE  26  -1.316  -1.024   3.939
  127   HD11  ILE  26          3HD1      ILE  26  -1.125   0.710   5.543
  128   HD12  ILE  26          1HD1      ILE  26  -1.527   0.181   7.198
  129   HD13  ILE  26          2HD1      ILE  26  -0.156   1.261   6.925
  130    H    GLU  27           H        GLU  27  -0.756  -4.787   6.658
  131    HA   GLU  27           HA       GLU  27  -1.945  -6.165   4.392
  132    HB3  GLU  27           2HB      GLU  27  -0.801  -8.170   5.384
  133    HG3  GLU  27           2HG      GLU  27   1.562  -7.204   5.726
  134    H    ARG  28           H        ARG  28  -2.976  -5.570   7.710
  135    HA   ARG  28           HA       ARG  28  -4.899  -7.783   7.830
  136    HB3  ARG  28           2HB      ARG  28  -4.435  -5.318   9.528
  137    HG3  ARG  28           2HG      ARG  28  -6.332  -7.649  10.045
  138    HD3  ARG  28           2HD      ARG  28  -5.254  -5.421  11.838
  139    HE   ARG  28           HE       ARG  28  -7.127  -7.504  12.799
  140   HH11  ARG  28          1HH1      ARG  28  -6.801  -4.056  11.980
  141   HH12  ARG  28          2HH1      ARG  28  -8.119  -3.608  13.026
  142   HH21  ARG  28          1HH2      ARG  28  -8.816  -6.826  14.118
  143   HH22  ARG  28          2HH2      ARG  28  -9.229  -5.121  14.161
  144    H    ALA  29           H        ALA  29  -5.055  -4.293   6.949
  145    HA   ALA  29           HA       ALA  29  -7.926  -4.397   6.449
  146    HB1  ALA  29           1HB      ALA  29  -6.895  -2.301   7.005
  147    HB2  ALA  29           2HB      ALA  29  -5.750  -2.431   5.656
  148    HB3  ALA  29           3HB      ALA  29  -7.492  -2.201   5.337
  149    H    LEU  30           H        LEU  30  -5.179  -5.383   4.492
  150    HA   LEU  30           HA       LEU  30  -6.020  -4.951   1.901
  151    HB3  LEU  30           2HB      LEU  30  -4.576  -7.347   3.093
  152    HG   LEU  30           HG       LEU  30  -5.245  -7.890   0.763
  153   HD11  LEU  30          1HD1      LEU  30  -5.436  -5.647  -0.209
  154   HD12  LEU  30          2HD1      LEU  30  -4.239  -6.587  -1.105
  155   HD13  LEU  30          3HD1      LEU  30  -3.702  -5.352   0.053
  156   HD21  LEU  30          3HD2      LEU  30  -2.293  -7.248   1.125
  157   HD22  LEU  30          1HD2      LEU  30  -2.980  -8.397  -0.048
  158   HD23  LEU  30          2HD2      LEU  30  -3.128  -8.705   1.688
  159    H    GLU  31           H        GLU  31  -7.068  -7.755   3.882
  160    HA   GLU  31           HA       GLU  31  -8.556  -8.983   1.786
  161    HB3  GLU  31           2HB      GLU  31  -7.688 -10.305   3.598
  162    HG3  GLU  31           2HG      GLU  31  -9.632  -9.035   5.563
  163    H    ARG  32           H        ARG  32  -9.319  -6.224   3.690
  164    HA   ARG  32           HA       ARG  32 -12.214  -6.642   3.587
  165    HB3  ARG  32           2HB      ARG  32 -12.367  -4.487   4.733
  166    HG3  ARG  32           2HG      ARG  32 -11.131  -4.897   6.802
  167    HD3  ARG  32           2HD      ARG  32 -12.134  -7.504   5.594
  168    HE   ARG  32           HE       ARG  32 -10.946  -7.722   7.796
  169   HH11  ARG  32          1HH1      ARG  32 -14.220  -6.361   8.014
  170   HH12  ARG  32          2HH1      ARG  32 -14.557  -7.309   9.454
  171   HH21  ARG  32          1HH2      ARG  32 -11.459  -8.663   9.776
  172   HH22  ARG  32          2HH2      ARG  32 -13.077  -8.464  10.407
  173    H    LEU  33           H        LEU  33  -9.768  -4.672   1.974
  174    HA   LEU  33           HA       LEU  33 -11.257  -2.844   0.509
  175    HB3  LEU  33           2HB      LEU  33  -9.397  -2.847  -1.112
  176    HG   LEU  33           HG       LEU  33  -8.260  -3.535   1.621
  177   HD11  LEU  33          1HD1      LEU  33  -6.829  -2.038  -0.572
  178   HD12  LEU  33          2HD1      LEU  33  -6.792  -3.812  -0.506
  179   HD13  LEU  33          3HD1      LEU  33  -6.195  -2.885   0.856
  180   HD21  LEU  33          3HD2      LEU  33  -9.644  -1.496   1.725
  181   HD22  LEU  33          1HD2      LEU  33  -8.801  -0.830   0.307
  182   HD23  LEU  33          2HD2      LEU  33  -7.927  -1.073   1.830
  183    H    LYS  34           H        LYS  34 -11.937  -2.616  -1.541
  184    HA   LYS  34           HA       LYS  34 -12.627  -5.020  -3.163
  185    HB3  LYS  34           2HB      LYS  34 -14.517  -3.608  -2.547
  186    HG3  LYS  34           2HG      LYS  34 -13.008  -1.364  -3.945
  187    HD3  LYS  34           2HD      LYS  34 -15.976  -1.574  -3.283
  188    HE3  LYS  34           2HE      LYS  34 -14.228   0.769  -4.146
  189    HZ1  LYS  34           3HZ      LYS  34 -16.330   1.971  -4.296
  190    HZ2  LYS  34           1HZ      LYS  34 -17.189   0.588  -4.071
  191    HZ3  LYS  34           2HZ      LYS  34 -16.265   0.750  -5.407
  192    H    GLY  35           H        GLY  35 -12.433  -4.673  -5.548
  193    HA2  GLY  35           2HA      GLY  35 -11.290  -4.217  -7.465
  194    HA3  GLY  35           3HA      GLY  35 -10.806  -2.690  -6.721
  195    H    VAL  36           H        VAL  36  -9.674  -5.517  -5.067
  196    HA   VAL  36           HA       VAL  36  -6.897  -4.799  -5.933
  197    HB   VAL  36           HB       VAL  36  -7.460  -4.271  -3.607
  198   HG11  VAL  36          1HG1      VAL  36  -7.822  -7.265  -3.191
  199   HG12  VAL  36          2HG1      VAL  36  -7.693  -6.052  -1.908
  200   HG13  VAL  36          3HG1      VAL  36  -9.063  -5.998  -3.019
  201   HG21  VAL  36          3HG2      VAL  36  -5.109  -4.825  -4.244
  202   HG22  VAL  36          1HG2      VAL  36  -5.507  -5.122  -2.551
  203   HG23  VAL  36          2HG2      VAL  36  -5.391  -6.491  -3.666
  204    H    ALA  37           H        ALA  37  -5.348  -6.461  -6.259
  205    HA   ALA  37           HA       ALA  37  -6.465  -9.219  -6.746
  206    HB1  ALA  37           1HB      ALA  37  -6.072  -7.937  -8.816
  207    HB2  ALA  37           2HB      ALA  37  -4.388  -7.647  -8.332
  208    HB3  ALA  37           3HB      ALA  37  -4.943  -9.297  -8.683
  209    H    GLU  38           H        GLU  38  -3.407  -7.456  -5.964
  210    HA   GLU  38           HA       GLU  38  -2.503  -9.619  -4.249
  211    HB3  GLU  38           2HB      GLU  38  -0.237  -9.645  -5.418
  212    HG3  GLU  38           2HG      GLU  38  -2.474 -10.899  -7.044
  213    H    ALA  39           H        ALA  39  -0.815  -8.898  -2.831
  214    HA   ALA  39           HA       ALA  39   0.515  -6.397  -3.143
  215    HB1  ALA  39           1HB      ALA  39  -0.560  -5.044  -1.442
  216    HB2  ALA  39           2HB      ALA  39  -1.823  -5.556  -2.574
  217    HB3  ALA  39           3HB      ALA  39  -1.664  -6.373  -1.016
  218    H    SER  40           H        SER  40   2.156  -6.084  -1.644
  219    HA   SER  40           HA       SER  40   2.313  -7.727   0.816
  220    HB3  SER  40           2HB      SER  40   4.420  -8.747   0.348
  221    HG   SER  40           HG       SER  40   3.032  -9.113  -2.087
  222    H    VAL  41           H        VAL  41   3.079  -6.431   2.386
  223    HA   VAL  41           HA       VAL  41   4.714  -4.022   1.807
  224    HB   VAL  41           HB       VAL  41   3.958  -5.251   4.484
  225   HG11  VAL  41          1HG1      VAL  41   5.853  -3.745   4.787
  226   HG12  VAL  41          2HG1      VAL  41   5.106  -2.514   3.742
  227   HG13  VAL  41          3HG1      VAL  41   4.415  -2.887   5.329
  228   HG21  VAL  41          3HG2      VAL  41   2.224  -3.573   4.689
  229   HG22  VAL  41          1HG2      VAL  41   2.625  -2.877   3.116
  230   HG23  VAL  41          2HG2      VAL  41   1.918  -4.497   3.219
  231    H    THR  42           H        THR  42   6.907  -3.812   2.511
  232    HA   THR  42           HA       THR  42   8.351  -6.303   3.345
  233    HB   THR  42           HB       THR  42   9.390  -4.205   1.396
  234    HG1  THR  42           1HG      THR  42   9.343  -6.124   0.011
  235   HG21  THR  42          3HG2      THR  42  10.548  -6.887   2.305
  236   HG22  THR  42          1HG2      THR  42  11.166  -5.287   2.770
  237   HG23  THR  42          2HG2      THR  42  11.253  -5.795   1.087
  238    H    VAL  43           H        VAL  43   8.120  -5.645   5.488
  239    HA   VAL  43           HA       VAL  43   8.939  -3.122   6.573
  240    HB   VAL  43           HB       VAL  43   8.624  -5.906   7.672
  241   HG11  VAL  43          1HG1      VAL  43   9.801  -3.613   9.292
  242   HG12  VAL  43          2HG1      VAL  43   9.088  -5.084   9.977
  243   HG13  VAL  43          3HG1      VAL  43  10.549  -5.191   8.988
  244   HG21  VAL  43          3HG2      VAL  43   7.440  -3.249   8.601
  245   HG22  VAL  43          1HG2      VAL  43   6.757  -4.186   7.276
  246   HG23  VAL  43          2HG2      VAL  43   6.830  -4.888   8.908
  247    H    ALA  44           H        ALA  44  10.913  -5.909   5.515
  248    HA   ALA  44           HA       ALA  44  13.275  -5.370   6.927
  249    HB1  ALA  44           1HB      ALA  44  14.346  -6.750   5.193
  250    HB2  ALA  44           2HB      ALA  44  12.755  -7.403   5.627
  251    HB3  ALA  44           3HB      ALA  44  12.958  -6.504   4.107
  252    H    THR  45           H        THR  45  12.115  -3.705   4.047
  253    HA   THR  45           HA       THR  45  14.454  -1.836   4.142
  254    HB   THR  45           HB       THR  45  14.195  -1.672   1.623
  255    HG1  THR  45           1HG      THR  45  13.350  -3.868   0.886
  256   HG21  THR  45          3HG2      THR  45  15.592  -3.587   1.191
  257   HG22  THR  45          1HG2      THR  45  15.028  -4.416   2.659
  258   HG23  THR  45          2HG2      THR  45  16.024  -2.948   2.779
  259    H    GLY  46           H        GLY  46  11.092  -2.010   4.472
  260    HA2  GLY  46           2HA      GLY  46   9.692  -0.225   5.010
  261    HA3  GLY  46           3HA      GLY  46  10.969   0.920   4.537
  262    H    ARG  47           H        ARG  47   9.651  -1.687   2.567
  263    HA   ARG  47           HA       ARG  47   8.662   0.296   0.554
  264    HB3  ARG  47           2HB      ARG  47   9.525  -1.197  -1.187
  265    HG3  ARG  47           2HG      ARG  47  11.714  -0.565   0.839
  266    HD3  ARG  47           2HD      ARG  47  11.759  -0.875  -2.176
  267    HE   ARG  47           HE       ARG  47  13.781   0.170  -0.272
  268   HH11  ARG  47          1HH1      ARG  47  13.073  -0.703  -3.608
  269   HH12  ARG  47          2HH1      ARG  47  14.656  -0.234  -4.164
  270   HH21  ARG  47          1HH2      ARG  47  15.779   0.857  -1.079
  271   HH22  ARG  47          2HH2      ARG  47  16.075   0.782  -2.805
  272    H    LEU  48           H        LEU  48   7.281  -0.862  -1.154
  273    HA   LEU  48           HA       LEU  48   5.419  -2.894  -0.050
  274    HB3  LEU  48           2HB      LEU  48   4.013  -0.540  -1.136
  275    HG   LEU  48           HG       LEU  48   3.983  -1.835   1.615
  276   HD11  LEU  48          1HD1      LEU  48   2.205   0.298   0.381
  277   HD12  LEU  48          2HD1      LEU  48   3.341   0.529   1.731
  278   HD13  LEU  48          3HD1      LEU  48   1.910  -0.494   1.949
  279   HD21  LEU  48          3HD2      LEU  48   2.034  -2.011  -0.748
  280   HD22  LEU  48          1HD2      LEU  48   1.707  -2.653   0.875
  281   HD23  LEU  48          2HD2      LEU  48   3.015  -3.334  -0.087
  282    H    THR  49           H        THR  49   4.083  -3.837  -1.582
  283    HA   THR  49           HA       THR  49   4.295  -3.148  -4.491
  284    HB   THR  49           HB       THR  49   4.312  -5.969  -3.320
  285    HG1  THR  49           1HG      THR  49   6.328  -5.047  -3.095
  286   HG21  THR  49          3HG2      THR  49   3.180  -5.876  -5.508
  287   HG22  THR  49          1HG2      THR  49   4.762  -6.628  -5.683
  288   HG23  THR  49          2HG2      THR  49   4.531  -4.940  -6.192
  289    H    VAL  50           H        VAL  50   2.296  -3.105  -5.436
  290    HA   VAL  50           HA       VAL  50  -0.007  -4.492  -4.220
  291    HB   VAL  50           HB       VAL  50   0.116  -2.401  -2.927
  292   HG11  VAL  50          1HG1      VAL  50  -0.312  -0.219  -3.898
  293   HG12  VAL  50          2HG1      VAL  50   1.131  -0.907  -4.651
  294   HG13  VAL  50          3HG1      VAL  50  -0.415  -0.904  -5.528
  295   HG21  VAL  50          3HG2      VAL  50  -2.194  -1.608  -3.236
  296   HG22  VAL  50          1HG2      VAL  50  -2.315  -2.570  -4.718
  297   HG23  VAL  50          2HG2      VAL  50  -2.062  -3.370  -3.162
  298    H    THR  51           H        THR  51  -1.591  -5.008  -5.637
  299    HA   THR  51           HA       THR  51  -1.550  -3.963  -8.432
  300    HB   THR  51           HB       THR  51  -1.969  -6.857  -7.538
  301    HG1  THR  51           1HG      THR  51   0.038  -7.162  -8.568
  302   HG21  THR  51          3HG2      THR  51  -1.534  -5.687 -10.344
  303   HG22  THR  51          1HG2      THR  51  -3.130  -6.130  -9.732
  304   HG23  THR  51          2HG2      THR  51  -1.898  -7.370  -9.946
  305    H    TYR  52           H        TYR  52  -3.460  -3.318  -9.178
  306    HA   TYR  52           HA       TYR  52  -6.028  -4.201  -8.044
  307    HB3  TYR  52           2HB      TYR  52  -5.362  -2.572  -6.408
  308    HD1  TYR  52           1HD      TYR  52  -6.073  -0.264  -9.297
  309    HD2  TYR  52           2HD      TYR  52  -3.369  -1.305  -6.104
  310    HE1  TYR  52           1HE      TYR  52  -4.722   1.761  -9.774
  311    HE2  TYR  52           2HE      TYR  52  -2.045   0.744  -6.551
  312    HH   TYR  52           HH       TYR  52  -2.943   3.077  -9.115
  313    H    ASP  53           H        ASP  53  -7.951  -3.198  -9.169
  314    HA   ASP  53           HA       ASP  53  -7.282  -2.968 -12.014
  315    HB3  ASP  53           2HB      ASP  53  -8.929  -4.672 -11.147
  316    HA   PRO  54           HA       PRO  54  -7.805   1.430 -11.666
  317    HB3  PRO  54           2HB      PRO  54  -6.061   1.457 -13.205
  318    HG3  PRO  54           2HG      PRO  54  -6.060   0.005 -15.120
  319    HD3  PRO  54           2HD      PRO  54  -6.142  -1.349 -13.192
  320    H    LYS  55           H        LYS  55 -10.240  -0.486 -12.495
  321    HA   LYS  55           HA       LYS  55 -11.886   1.551 -13.990
  322    HB3  LYS  55           2HB      LYS  55 -12.053  -1.488 -13.925
  323    HG3  LYS  55           2HG      LYS  55 -13.812   0.579 -15.327
  324    HD3  LYS  55           2HD      LYS  55 -14.979  -1.574 -16.150
  325    HE3  LYS  55           2HE      LYS  55 -12.264  -0.819 -17.313
  326    HZ1  LYS  55           3HZ      LYS  55 -13.282  -1.702 -19.347
  327    HZ2  LYS  55           1HZ      LYS  55 -14.560  -2.275 -18.495
  328    HZ3  LYS  55           2HZ      LYS  55 -13.042  -2.875 -18.217
  329    H    GLN  56           H        GLN  56 -11.955  -0.828 -11.324
  330    HA   GLN  56           HA       GLN  56 -14.300   0.536 -10.109
  331    HB3  GLN  56           2HB      GLN  56 -14.141  -1.271  -8.440
  332    HG3  GLN  56           2HG      GLN  56 -13.944  -2.318 -11.297
  333   HE21  GLN  56          1HE2      GLN  56 -12.883  -4.206  -9.760
  334   HE22  GLN  56          2HE2      GLN  56 -14.135  -5.418  -9.420
  335    H    VAL  57           H        VAL  57 -10.730   0.397  -9.652
  336    HA   VAL  57           HA       VAL  57 -11.028   2.411  -7.474
  337    HB   VAL  57           HB       VAL  57  -9.551   1.217  -5.975
  338   HG11  VAL  57          1HG1      VAL  57 -11.972   0.895  -5.686
  339   HG12  VAL  57          2HG1      VAL  57 -11.911  -0.562  -6.709
  340   HG13  VAL  57          3HG1      VAL  57 -11.050  -0.521  -5.176
  341   HG21  VAL  57          3HG2      VAL  57  -9.690  -1.128  -7.927
  342   HG22  VAL  57          1HG2      VAL  57  -8.256  -0.136  -7.598
  343   HG23  VAL  57          2HG2      VAL  57  -8.939  -1.147  -6.319
  344    H    SER  58           H        SER  58  -8.333   2.545  -6.643
  345    HA   SER  58           HA       SER  58  -6.544   2.824  -8.870
  346    HB3  SER  58           2HB      SER  58  -8.089   4.769  -9.307
  347    HG   SER  58           HG       SER  58  -8.620   5.400  -7.205
  348    H    GLU  59           H        GLU  59  -5.026   4.985  -7.545
  349    HA   GLU  59           HA       GLU  59  -3.544   3.674  -5.550
  350    HB3  GLU  59           2HB      GLU  59  -2.829   5.646  -6.848
  351    HG3  GLU  59           2HG      GLU  59  -4.460   7.328  -4.886
  352    H    ILE  60           H        ILE  60  -6.683   5.194  -5.187
  353    HA   ILE  60           HA       ILE  60  -6.738   5.761  -2.402
  354    HB   ILE  60           HB       ILE  60  -8.959   4.679  -4.157
  355   HG13  ILE  60          2HG1      ILE  60  -9.629   7.052  -4.426
  356   HG21  ILE  60          1HG2      ILE  60  -9.057   6.197  -1.527
  357   HG22  ILE  60          2HG2      ILE  60 -10.461   5.834  -2.552
  358   HG23  ILE  60          3HG2      ILE  60  -9.563   4.518  -1.798
  359   HD11  ILE  60          3HD1      ILE  60  -8.449   8.157  -2.515
  360   HD12  ILE  60          1HD1      ILE  60  -6.892   7.822  -3.312
  361   HD13  ILE  60          2HD1      ILE  60  -8.073   8.889  -4.079
  362    H    THR  61           H        THR  61  -6.764   2.658  -4.002
  363    HA   THR  61           HA       THR  61  -7.443   0.879  -1.892
  364    HB   THR  61           HB       THR  61  -5.382   0.467  -4.123
  365    HG1  THR  61           1HG      THR  61  -6.958   1.014  -5.295
  366   HG21  THR  61          3HG2      THR  61  -5.488  -1.511  -2.704
  367   HG22  THR  61          1HG2      THR  61  -6.314  -1.844  -4.229
  368   HG23  THR  61          2HG2      THR  61  -7.266  -1.512  -2.771
  369    H    ILE  62           H        ILE  62  -4.566   2.722  -2.415
  370    HA   ILE  62           HA       ILE  62  -3.272   1.318  -0.082
  371    HB   ILE  62           HB       ILE  62  -2.260   0.843  -2.362
  372   HG13  ILE  62          2HG1      ILE  62  -0.561   1.931  -0.120
  373   HG21  ILE  62          1HG2      ILE  62  -1.180   3.677  -2.148
  374   HG22  ILE  62          2HG2      ILE  62  -0.667   2.428  -3.300
  375   HG23  ILE  62          3HG2      ILE  62  -2.307   3.047  -3.380
  376   HD11  ILE  62          3HD1      ILE  62  -0.050  -0.504   0.214
  377   HD12  ILE  62          1HD1      ILE  62  -1.758  -0.157   0.468
  378   HD13  ILE  62          2HD1      ILE  62  -1.207  -0.898  -1.062
  379    H    GLN  63           H        GLN  63  -3.706   4.487  -1.585
  380    HA   GLN  63           HA       GLN  63  -2.444   6.216   0.201
  381    HB3  GLN  63           2HB      GLN  63  -5.068   6.336  -1.316
  382    HG3  GLN  63           2HG      GLN  63  -5.346   8.112   0.259
  383   HE21  GLN  63          1HE2      GLN  63  -2.323   9.031  -1.600
  384   HE22  GLN  63          2HE2      GLN  63  -1.678   9.950  -0.244
  385    H    GLU  64           H        GLU  64  -5.941   5.334   0.499
  386    HA   GLU  64           HA       GLU  64  -6.236   6.620   3.018
  387    HB3  GLU  64           2HB      GLU  64  -8.400   5.369   3.105
  388    HG3  GLU  64           2HG      GLU  64  -9.379   6.035   0.929
  389    H    ARG  65           H        ARG  65  -5.255   3.369   2.190
  390    HA   ARG  65           HA       ARG  65  -5.701   2.201   4.815
  391    HB3  ARG  65           2HB      ARG  65  -4.195   1.253   2.337
  392    HG3  ARG  65           2HG      ARG  65  -5.081  -0.195   4.859
  393    HD3  ARG  65           2HD      ARG  65  -6.034  -1.446   3.028
  394    HE   ARG  65           HE       ARG  65  -4.775  -0.822   1.078
  395   HH11  ARG  65          1HH1      ARG  65  -3.097  -3.297   3.043
  396   HH12  ARG  65          2HH1      ARG  65  -2.240  -3.907   1.662
  397   HH21  ARG  65          1HH2      ARG  65  -3.815  -1.772  -0.621
  398   HH22  ARG  65          2HH2      ARG  65  -2.717  -3.123  -0.402
  399    H    ILE  66           H        ILE  66  -2.908   3.693   3.186
  400    HA   ILE  66           HA       ILE  66  -1.117   3.076   5.484
  401    HB   ILE  66           HB       ILE  66  -0.821   4.776   2.979
  402   HG13  ILE  66          2HG1      ILE  66  -0.848   2.241   2.728
  403   HG21  ILE  66          1HG2      ILE  66   0.562   5.718   4.868
  404   HG22  ILE  66          2HG2      ILE  66   1.334   4.118   5.037
  405   HG23  ILE  66          3HG2      ILE  66   1.537   5.073   3.571
  406   HD11  ILE  66          3HD1      ILE  66   0.454   3.678   1.143
  407   HD12  ILE  66          1HD1      ILE  66   1.902   3.392   2.141
  408   HD13  ILE  66          2HD1      ILE  66   1.095   2.041   1.363
  409    H    ALA  67           H        ALA  67  -2.801   5.984   4.184
  410    HA   ALA  67           HA       ALA  67  -1.700   7.748   6.079
  411    HB1  ALA  67           1HB      ALA  67  -2.720   8.430   3.948
  412    HB2  ALA  67           2HB      ALA  67  -4.322   7.917   4.514
  413    HB3  ALA  67           3HB      ALA  67  -3.495   9.280   5.297
  414    H    ALA  68           H        ALA  68  -5.013   6.231   6.136
  415    HA   ALA  68           HA       ALA  68  -5.741   7.514   8.586
  416    HB1  ALA  68           1HB      ALA  68  -7.306   6.780   6.769
  417    HB2  ALA  68           2HB      ALA  68  -7.027   5.090   7.255
  418    HB3  ALA  68           3HB      ALA  68  -7.791   6.226   8.381
  419    H    LEU  69           H        LEU  69  -4.082   4.464   8.055
  420    HA   LEU  69           HA       LEU  69  -4.495   3.558  10.850
  421    HB3  LEU  69           2HB      LEU  69  -3.204   1.624  10.191
  422    HG   LEU  69           HG       LEU  69  -5.151   2.293   7.934
  423   HD11  LEU  69          1HD1      LEU  69  -5.486  -0.044   7.661
  424   HD12  LEU  69          2HD1      LEU  69  -4.565  -0.436   9.118
  425   HD13  LEU  69          3HD1      LEU  69  -3.736   0.204   7.680
  426   HD21  LEU  69          3HD2      LEU  69  -6.370   2.674  10.012
  427   HD22  LEU  69          1HD2      LEU  69  -5.778   1.137  10.683
  428   HD23  LEU  69          2HD2      LEU  69  -6.899   1.149   9.305
  429    H    GLY  70           H        GLY  70  -2.465   5.789   9.335
  430    HA2  GLY  70           2HA      GLY  70  -1.751   7.369  11.012
  431    HA3  GLY  70           3HA      GLY  70  -0.982   6.073  11.919
  432    H    TYR  71           H        TYR  71  -0.419   5.876   8.521
  433    HA   TYR  71           HA       TYR  71   2.393   6.817   8.969
  434    HB3  TYR  71           2HB      TYR  71   3.010   4.997   7.471
  435    HD1  TYR  71           2HD      TYR  71   3.883   4.661   9.876
  436    HD2  TYR  71           1HD      TYR  71   0.043   3.217   8.549
  437    HE1  TYR  71           2HE      TYR  71   3.765   3.157  11.852
  438    HE2  TYR  71           1HE      TYR  71  -0.062   1.686  10.508
  439    HH   TYR  71           HH       TYR  71   2.557   1.525  12.940
  440    H    THR  72           H        THR  72   3.410   6.855   6.465
  441    HA   THR  72           HA       THR  72   1.635   8.504   4.741
  442    HB   THR  72           HB       THR  72   3.485  10.101   4.290
  443    HG1  THR  72           1HG      THR  72   5.335   9.224   4.797
  444   HG21  THR  72          3HG2      THR  72   3.436  11.389   6.333
  445   HG22  THR  72          1HG2      THR  72   2.916   9.983   7.280
  446   HG23  THR  72          2HG2      THR  72   1.834  10.684   6.054
  447    H    LEU  73           H        LEU  73   2.815   8.828   2.495
  448    HA   LEU  73           HA       LEU  73   4.369   6.401   1.760
  449    HB3  LEU  73           2HB      LEU  73   2.077   5.682   1.537
  450    HG   LEU  73           HG       LEU  73   1.605   8.208  -0.095
  451   HD11  LEU  73          1HD1      LEU  73   0.053   5.594  -0.311
  452   HD12  LEU  73          2HD1      LEU  73   1.092   6.306  -1.567
  453   HD13  LEU  73          3HD1      LEU  73  -0.384   7.138  -1.073
  454   HD21  LEU  73          3HD2      LEU  73   0.737   8.298   2.228
  455   HD22  LEU  73          1HD2      LEU  73  -0.085   6.743   1.995
  456   HD23  LEU  73          2HD2      LEU  73  -0.598   8.178   1.097
  457    H    ALA  74           H        ALA  74   5.314   6.354  -0.310
  458    HA   ALA  74           HA       ALA  74   5.272   8.895  -1.902
  459    HB1  ALA  74           1HB      ALA  74   7.387   8.721  -0.643
  460    HB2  ALA  74           2HB      ALA  74   7.661   7.104  -1.321
  461    HB3  ALA  74           3HB      ALA  74   7.654   8.525  -2.386
  462    H    GLU  75           H        GLU  75   3.415   7.568  -2.807
  463    HA   GLU  75           HA       GLU  75   4.279   5.682  -4.934
  464    HB3  GLU  75           2HB      GLU  75   1.465   6.687  -4.344
  465    HG3  GLU  75           2HG      GLU  75   0.859   4.449  -5.358
  466    HA   PRO  76           HA       PRO  76   5.531   9.357  -6.492
  467    HB3  PRO  76           2HB      PRO  76   7.100   8.311  -7.735
  468    HG3  PRO  76           2HG      PRO  76   6.603   6.227  -8.760
  469    HD3  PRO  76           2HD      PRO  76   5.837   6.074  -6.525
  Start of MODEL   30
    1    H2   PRO   6           2H       PRO   6  -9.274  -4.011 -15.877
    2    HA   PRO   6           HA       PRO   6  -7.758  -6.484 -16.209
    3    HB3  PRO   6           2HB      PRO   6  -6.570  -5.720 -17.965
    4    HG3  PRO   6           2HG      PRO   6  -8.167  -4.828 -19.395
    5    HD3  PRO   6           2HD      PRO   6  -9.682  -5.995 -18.012
    6    H    LEU   7           H        LEU   7  -5.501  -6.197 -15.246
    7    HA   LEU   7           HA       LEU   7  -5.220  -4.121 -13.200
    8    HB3  LEU   7           2HB      LEU   7  -6.674  -5.550 -12.041
    9    HG   LEU   7           HG       LEU   7  -6.010  -7.734 -13.461
   10   HD11  LEU   7          1HD1      LEU   7  -4.456  -8.156 -10.883
   11   HD12  LEU   7          2HD1      LEU   7  -3.692  -7.887 -12.469
   12   HD13  LEU   7          3HD1      LEU   7  -4.693  -9.319 -12.186
   13   HD21  LEU   7          3HD2      LEU   7  -7.138  -9.079 -11.741
   14   HD22  LEU   7          1HD2      LEU   7  -7.937  -7.511 -11.941
   15   HD23  LEU   7          2HD2      LEU   7  -6.882  -7.786 -10.545
   16    H    LYS   8           H        LYS   8  -3.206  -4.051 -12.185
   17    HA   LYS   8           HA       LYS   8  -0.956  -5.534 -13.408
   18    HB3  LYS   8           2HB      LYS   8  -1.479  -3.706 -14.999
   19    HG3  LYS   8           2HG      LYS   8  -0.713  -1.790 -12.735
   20    HD3  LYS   8           2HD      LYS   8  -1.580  -1.331 -15.612
   21    HE3  LYS   8           2HE      LYS   8  -2.437   0.272 -13.736
   22    HZ1  LYS   8           3HZ      LYS   8  -0.097   0.602 -12.790
   23    HZ2  LYS   8           1HZ      LYS   8  -0.926   1.995 -13.158
   24    HZ3  LYS   8           2HZ      LYS   8   0.258   1.447 -14.122
   25    H    THR   9           H        THR   9   1.038  -5.313 -12.266
   26    HA   THR   9           HA       THR   9   0.680  -4.520  -9.455
   27    HB   THR   9           HB       THR   9   1.894  -6.665 -10.461
   28    HG1  THR   9           1HG      THR   9   1.342  -6.354  -8.436
   29   HG21  THR   9          3HG2      THR   9   3.813  -5.363 -11.460
   30   HG22  THR   9          1HG2      THR   9   4.278  -6.584 -10.261
   31   HG23  THR   9          2HG2      THR   9   4.271  -4.872  -9.811
   32    H    GLN  10           H        GLN  10   2.385  -3.377  -8.294
   33    HA   GLN  10           HA       GLN  10   3.771  -1.192  -9.665
   34    HB3  GLN  10           2HB      GLN  10   1.219  -0.742  -8.040
   35    HG3  GLN  10           2HG      GLN  10   2.780   1.086  -7.566
   36   HE21  GLN  10          1HE2      GLN  10   4.669   2.094  -8.226
   37   HE22  GLN  10          2HE2      GLN  10   5.033   2.499  -9.902
   38    H    GLN  11           H        GLN  11   5.406  -0.488  -8.391
   39    HA   GLN  11           HA       GLN  11   5.594  -1.282  -5.552
   40    HB3  GLN  11           2HB      GLN  11   7.495   0.309  -7.320
   41    HG3  GLN  11           2HG      GLN  11   8.090  -1.322  -4.805
   42   HE21  GLN  11          1HE2      GLN  11   9.939   1.314  -4.558
   43   HE22  GLN  11          2HE2      GLN  11  11.336   0.817  -5.494
   44    H    MET  12           H        MET  12   5.357   0.092  -3.868
   45    HA   MET  12           HA       MET  12   4.824   3.000  -4.334
   46    HB3  MET  12           2HB      MET  12   3.267   0.974  -2.695
   47    HG3  MET  12           2HG      MET  12   3.252   4.001  -2.407
   48    HE1  MET  12           3HE      MET  12   0.676   3.270  -3.847
   49    HE2  MET  12           1HE      MET  12  -0.553   3.936  -2.757
   50    HE3  MET  12           2HE      MET  12   0.953   4.827  -3.023
   51    H    GLN  13           H        GLN  13   5.887   4.344  -2.998
   52    HA   GLN  13           HA       GLN  13   7.832   3.164  -1.073
   53    HB3  GLN  13           2HB      GLN  13   8.864   5.374  -1.090
   54    HG3  GLN  13           2HG      GLN  13   9.623   5.602  -3.390
   55   HE21  GLN  13          1HE2      GLN  13  11.386   4.532  -2.123
   56   HE22  GLN  13          2HE2      GLN  13  11.559   2.787  -2.288
   57    H    VAL  14           H        VAL  14   7.766   3.706   1.126
   58    HA   VAL  14           HA       VAL  14   5.495   5.291   2.169
   59    HB   VAL  14           HB       VAL  14   5.644   2.280   2.293
   60   HG11  VAL  14          1HG1      VAL  14   4.287   3.965   4.460
   61   HG12  VAL  14          2HG1      VAL  14   4.073   2.226   4.221
   62   HG13  VAL  14          3HG1      VAL  14   5.654   2.854   4.697
   63   HG21  VAL  14          3HG2      VAL  14   3.337   4.228   2.046
   64   HG22  VAL  14          1HG2      VAL  14   4.073   3.266   0.756
   65   HG23  VAL  14          2HG2      VAL  14   3.201   2.455   2.051
   66    H    GLY  15           H        GLY  15   5.785   6.033   4.210
   67    HA2  GLY  15           2HA      GLY  15   8.518   5.672   5.404
   68    HA3  GLY  15           3HA      GLY  15   7.479   7.090   5.573
   69    H    GLY  16           H        GLY  16   8.441   4.180   6.972
   70    HA2  GLY  16           2HA      GLY  16   8.372   4.378   9.386
   71    HA3  GLY  16           3HA      GLY  16   6.649   4.698   9.316
   72    H    MET  17           H        MET  17   7.297   2.099   7.181
   73    HA   MET  17           HA       MET  17   5.969   0.239   8.993
   74    HB3  MET  17           2HB      MET  17   6.289  -1.405   7.134
   75    HG3  MET  17           2HG      MET  17   5.235   1.265   6.165
   76    HE1  MET  17           3HE      MET  17   6.151   0.528   3.767
   77    HE2  MET  17           1HE      MET  17   6.652  -1.134   4.154
   78    HE3  MET  17           2HE      MET  17   5.505  -0.844   2.836
   79    H    ARG  18           H        ARG  18   9.284   1.059   8.765
   80    HA   ARG  18           HA       ARG  18  10.019  -1.519  10.086
   81    HB3  ARG  18           2HB      ARG  18  12.335  -1.015   9.585
   82    HG3  ARG  18           2HG      ARG  18  10.723  -0.513   7.044
   83    HD3  ARG  18           2HD      ARG  18  12.497  -1.916   6.020
   84    HE   ARG  18           HE       ARG  18  12.923   0.478   5.848
   85   HH11  ARG  18          1HH1      ARG  18  14.964  -1.077   8.359
   86   HH12  ARG  18          2HH1      ARG  18  16.295  -0.035   7.905
   87   HH21  ARG  18          1HH2      ARG  18  14.627   1.754   5.520
   88   HH22  ARG  18          2HH2      ARG  18  16.129   1.498   6.414
   89    H    CYS  19           H        CYS  19   9.350   1.739  10.801
   90    HA   CYS  19           HA       CYS  19  10.936   2.074  13.181
   91    HB3  CYS  19           2HB      CYS  19   9.137   3.797  13.647
   92    HG   CYS  19           HG       CYS  19  10.348   3.698  10.542
   93    H    ALA  20           H        ALA  20   8.076   0.166  12.611
   94    HA   ALA  20           HA       ALA  20   8.283  -1.136  15.173
   95    HB1  ALA  20           1HB      ALA  20   6.875   0.817  15.842
   96    HB2  ALA  20           2HB      ALA  20   5.742   0.449  14.533
   97    HB3  ALA  20           3HB      ALA  20   5.942  -0.689  15.882
   98    H    ALA  21           H        ALA  21   7.044  -3.200  15.088
   99    HA   ALA  21           HA       ALA  21   6.766  -4.281  12.451
  100    HB1  ALA  21           1HB      ALA  21   7.362  -5.656  14.379
  101    HB2  ALA  21           2HB      ALA  21   5.783  -5.331  15.134
  102    HB3  ALA  21           3HB      ALA  21   5.877  -6.263  13.626
  103    H    CYS  22           H        CYS  22   5.371  -3.442  11.105
  104    HA   CYS  22           HA       CYS  22   2.464  -3.179  11.779
  105    HB3  CYS  22           2HB      CYS  22   2.535  -0.981  10.560
  106    HG   CYS  22           HG       CYS  22   4.820  -1.179  12.917
  107    H    ALA  23           H        ALA  23   4.650  -4.513   9.558
  108    HA   ALA  23           HA       ALA  23   3.474  -4.293   7.035
  109    HB1  ALA  23           1HB      ALA  23   4.585  -6.768   8.440
  110    HB2  ALA  23           2HB      ALA  23   4.340  -6.593   6.690
  111    HB3  ALA  23           3HB      ALA  23   5.507  -5.553   7.526
  112    H    SER  24           H        SER  24   2.332  -6.358   9.779
  113    HA   SER  24           HA       SER  24   0.133  -7.505   8.232
  114    HB3  SER  24           2HB      SER  24  -0.577  -8.487  10.310
  115    HG   SER  24           HG       SER  24   1.505  -9.162   9.255
  116    H    SER  25           H        SER  25   0.439  -4.501  10.117
  117    HA   SER  25           HA       SER  25  -2.433  -4.104  10.355
  118    HB3  SER  25           2HB      SER  25  -1.949  -2.087  11.411
  119    HG   SER  25           HG       SER  25  -0.105  -2.455  12.738
  120    H    ILE  26           H        ILE  26  -0.117  -3.650   7.861
  121    HA   ILE  26           HA       ILE  26  -2.070  -2.271   6.070
  122    HB   ILE  26           HB       ILE  26   0.778  -3.296   5.689
  123   HG13  ILE  26          2HG1      ILE  26  -0.519  -0.550   5.688
  124   HG21  ILE  26          1HG2      ILE  26  -0.389  -3.896   3.636
  125   HG22  ILE  26          2HG2      ILE  26  -1.082  -2.256   3.519
  126   HG23  ILE  26          3HG2      ILE  26   0.670  -2.533   3.355
  127   HD11  ILE  26          3HD1      ILE  26   0.718  -1.218   7.758
  128   HD12  ILE  26          1HD1      ILE  26   2.153  -1.560   6.776
  129   HD13  ILE  26          2HD1      ILE  26   1.534   0.102   6.895
  130    H    GLU  27           H        GLU  27  -0.414  -5.481   6.205
  131    HA   GLU  27           HA       GLU  27  -1.855  -6.343   3.904
  132    HB3  GLU  27           2HB      GLU  27  -0.842  -8.592   4.433
  133    HG3  GLU  27           2HG      GLU  27   1.073  -6.235   4.493
  134    H    ARG  28           H        ARG  28  -2.773  -6.581   7.269
  135    HA   ARG  28           HA       ARG  28  -4.850  -8.592   6.847
  136    HB3  ARG  28           2HB      ARG  28  -4.528  -6.725   9.218
  137    HG3  ARG  28           2HG      ARG  28  -5.504  -9.612   8.997
  138    HD3  ARG  28           2HD      ARG  28  -6.116  -9.421  11.353
  139    HE   ARG  28           HE       ARG  28  -3.481  -8.414  11.880
  140   HH11  ARG  28          1HH1      ARG  28  -4.953 -11.219  10.220
  141   HH12  ARG  28          2HH1      ARG  28  -3.483 -12.147  10.479
  142   HH21  ARG  28          1HH2      ARG  28  -1.791  -9.838  12.295
  143   HH22  ARG  28          2HH2      ARG  28  -1.846 -11.440  11.577
  144    H    ALA  29           H        ALA  29  -4.614  -5.271   6.112
  145    HA   ALA  29           HA       ALA  29  -7.598  -5.063   5.842
  146    HB1  ALA  29           1HB      ALA  29  -5.415  -2.947   5.709
  147    HB2  ALA  29           2HB      ALA  29  -7.153  -2.665   5.438
  148    HB3  ALA  29           3HB      ALA  29  -6.577  -3.187   7.034
  149    H    LEU  30           H        LEU  30  -4.531  -5.060   4.034
  150    HA   LEU  30           HA       LEU  30  -5.523  -4.080   1.625
  151    HB3  LEU  30           2HB      LEU  30  -3.087  -5.841   2.078
  152    HG   LEU  30           HG       LEU  30  -3.091  -5.336  -0.263
  153   HD11  LEU  30          1HD1      LEU  30  -3.773  -2.462   0.483
  154   HD12  LEU  30          2HD1      LEU  30  -4.776  -3.592  -0.457
  155   HD13  LEU  30          3HD1      LEU  30  -3.267  -2.997  -1.139
  156   HD21  LEU  30          3HD2      LEU  30  -1.402  -3.268   1.215
  157   HD22  LEU  30          1HD2      LEU  30  -1.126  -3.828  -0.438
  158   HD23  LEU  30          2HD2      LEU  30  -0.955  -4.964   0.918
  159    H    GLU  31           H        GLU  31  -6.479  -7.092   2.704
  160    HA   GLU  31           HA       GLU  31  -7.313  -7.769  -0.103
  161    HB3  GLU  31           2HB      GLU  31  -7.582 -10.008   0.539
  162    HG3  GLU  31           2HG      GLU  31  -5.052  -9.396   2.078
  163    H    ARG  32           H        ARG  32  -8.407  -6.666   2.994
  164    HA   ARG  32           HA       ARG  32 -11.235  -7.334   2.663
  165    HB3  ARG  32           2HB      ARG  32 -11.580  -5.693   4.459
  166    HG3  ARG  32           2HG      ARG  32  -9.220  -7.529   5.073
  167    HD3  ARG  32           2HD      ARG  32 -11.293  -6.225   6.883
  168    HE   ARG  32           HE       ARG  32  -9.921  -8.635   7.295
  169   HH11  ARG  32          1HH1      ARG  32  -9.639  -5.513   9.000
  170   HH12  ARG  32          2HH1      ARG  32  -9.224  -6.353  10.483
  171   HH21  ARG  32          1HH2      ARG  32  -9.817  -9.513   9.369
  172   HH22  ARG  32          2HH2      ARG  32  -9.246  -8.457  10.661
  173    H    LEU  33           H        LEU  33  -9.005  -4.798   1.622
  174    HA   LEU  33           HA       LEU  33 -10.910  -2.833   0.790
  175    HB3  LEU  33           2HB      LEU  33  -9.137  -1.925  -0.603
  176    HG   LEU  33           HG       LEU  33  -7.692  -3.046   1.804
  177   HD11  LEU  33          1HD1      LEU  33  -7.262  -0.453   0.313
  178   HD12  LEU  33          2HD1      LEU  33  -6.326  -1.932   0.048
  179   HD13  LEU  33          3HD1      LEU  33  -6.268  -1.116   1.623
  180   HD21  LEU  33          3HD2      LEU  33  -9.427  -0.550   1.675
  181   HD22  LEU  33          1HD2      LEU  33  -8.331  -0.981   3.009
  182   HD23  LEU  33          2HD2      LEU  33  -9.732  -1.999   2.665
  183    H    LYS  34           H        LYS  34 -11.642  -2.221  -1.265
  184    HA   LYS  34           HA       LYS  34 -12.445  -4.391  -3.074
  185    HB3  LYS  34           2HB      LYS  34 -13.499  -2.380  -4.287
  186    HG3  LYS  34           2HG      LYS  34 -14.265  -2.922  -1.381
  187    HD3  LYS  34           2HD      LYS  34 -15.743  -1.533  -3.646
  188    HE3  LYS  34           2HE      LYS  34 -16.778  -2.499  -0.951
  189    HZ1  LYS  34           3HZ      LYS  34 -17.690  -0.354  -1.364
  190    HZ2  LYS  34           1HZ      LYS  34 -18.863  -1.428  -1.857
  191    HZ3  LYS  34           2HZ      LYS  34 -17.933  -0.638  -2.951
  192    H    GLY  35           H        GLY  35 -12.090  -4.206  -5.445
  193    HA2  GLY  35           2HA      GLY  35 -10.958  -3.826  -7.390
  194    HA3  GLY  35           3HA      GLY  35 -10.282  -2.380  -6.627
  195    H    VAL  36           H        VAL  36  -8.703  -3.655  -4.649
  196    HA   VAL  36           HA       VAL  36  -6.297  -4.362  -5.996
  197    HB   VAL  36           HB       VAL  36  -5.446  -5.048  -3.778
  198   HG11  VAL  36          1HG1      VAL  36  -7.028  -2.438  -3.709
  199   HG12  VAL  36          2HG1      VAL  36  -5.639  -2.858  -2.690
  200   HG13  VAL  36          3HG1      VAL  36  -5.421  -2.668  -4.433
  201   HG21  VAL  36          3HG2      VAL  36  -8.290  -4.503  -2.794
  202   HG22  VAL  36          1HG2      VAL  36  -7.474  -6.079  -2.809
  203   HG23  VAL  36          2HG2      VAL  36  -6.875  -4.778  -1.775
  204    H    ALA  37           H        ALA  37  -5.090  -6.346  -5.970
  205    HA   ALA  37           HA       ALA  37  -6.769  -8.839  -5.997
  206    HB1  ALA  37           1HB      ALA  37  -4.931  -7.789  -8.194
  207    HB2  ALA  37           2HB      ALA  37  -5.834  -9.317  -8.233
  208    HB3  ALA  37           3HB      ALA  37  -6.710  -7.775  -8.219
  209    H    GLU  38           H        GLU  38  -3.428  -7.589  -5.626
  210    HA   GLU  38           HA       GLU  38  -2.630  -9.928  -4.160
  211    HB3  GLU  38           2HB      GLU  38  -1.464  -9.650  -6.955
  212    HG3  GLU  38           2HG      GLU  38  -0.870 -11.636  -4.725
  213    H    ALA  39           H        ALA  39  -1.346  -9.013  -2.606
  214    HA   ALA  39           HA       ALA  39   0.702  -7.006  -3.437
  215    HB1  ALA  39           1HB      ALA  39  -0.135  -5.415  -1.808
  216    HB2  ALA  39           2HB      ALA  39  -1.455  -5.862  -2.906
  217    HB3  ALA  39           3HB      ALA  39  -1.390  -6.563  -1.277
  218    H    SER  40           H        SER  40   2.272  -6.432  -1.916
  219    HA   SER  40           HA       SER  40   2.727  -8.216   0.436
  220    HB3  SER  40           2HB      SER  40   4.995  -8.748  -0.364
  221    HG   SER  40           HG       SER  40   3.449  -9.511  -2.561
  222    H    VAL  41           H        VAL  41   3.407  -6.966   2.103
  223    HA   VAL  41           HA       VAL  41   5.011  -4.488   1.668
  224    HB   VAL  41           HB       VAL  41   4.205  -5.980   4.204
  225   HG11  VAL  41          1HG1      VAL  41   6.344  -4.923   4.664
  226   HG12  VAL  41          2HG1      VAL  41   5.834  -3.426   3.858
  227   HG13  VAL  41          3HG1      VAL  41   5.090  -3.921   5.391
  228   HG21  VAL  41          3HG2      VAL  41   2.786  -4.041   4.655
  229   HG22  VAL  41          1HG2      VAL  41   3.325  -3.255   3.160
  230   HG23  VAL  41          2HG2      VAL  41   2.346  -4.737   3.089
  231    H    THR  42           H        THR  42   7.223  -4.516   1.639
  232    HA   THR  42           HA       THR  42   8.662  -7.067   2.309
  233    HB   THR  42           HB       THR  42   9.571  -4.739   0.600
  234    HG1  THR  42           1HG      THR  42   9.247  -7.372  -0.288
  235   HG21  THR  42          3HG2      THR  42  11.406  -6.403   0.011
  236   HG22  THR  42          1HG2      THR  42  10.874  -7.402   1.368
  237   HG23  THR  42          2HG2      THR  42  11.508  -5.777   1.660
  238    H    VAL  43           H        VAL  43   9.211  -7.032   4.402
  239    HA   VAL  43           HA       VAL  43   9.491  -4.578   5.919
  240    HB   VAL  43           HB       VAL  43   9.926  -7.505   6.590
  241   HG11  VAL  43          1HG1      VAL  43   9.973  -6.802   9.002
  242   HG12  VAL  43          2HG1      VAL  43  11.422  -6.323   8.123
  243   HG13  VAL  43          3HG1      VAL  43  10.164  -5.114   8.481
  244   HG21  VAL  43          3HG2      VAL  43   7.586  -6.727   6.231
  245   HG22  VAL  43          1HG2      VAL  43   7.866  -7.121   7.931
  246   HG23  VAL  43          2HG2      VAL  43   7.845  -5.425   7.410
  247    H    ALA  44           H        ALA  44  11.792  -6.757   4.294
  248    HA   ALA  44           HA       ALA  44  14.206  -5.857   5.501
  249    HB1  ALA  44           1HB      ALA  44  15.242  -6.917   3.516
  250    HB2  ALA  44           2HB      ALA  44  13.958  -7.929   4.199
  251    HB3  ALA  44           3HB      ALA  44  13.656  -6.991   2.720
  252    H    THR  45           H        THR  45  12.206  -4.194   3.160
  253    HA   THR  45           HA       THR  45  14.309  -2.071   2.816
  254    HB   THR  45           HB       THR  45  12.994  -1.474   0.732
  255    HG1  THR  45           1HG      THR  45  11.972  -3.582  -0.051
  256   HG21  THR  45          3HG2      THR  45  14.227  -4.262   0.654
  257   HG22  THR  45          1HG2      THR  45  15.176  -2.763   0.727
  258   HG23  THR  45          2HG2      THR  45  14.136  -3.050  -0.653
  259    H    GLY  46           H        GLY  46  10.857  -2.689   3.436
  260    HA2  GLY  46           2HA      GLY  46   9.464  -1.359   4.804
  261    HA3  GLY  46           3HA      GLY  46  10.632  -0.009   4.721
  262    H    ARG  47           H        ARG  47   9.262  -1.912   2.024
  263    HA   ARG  47           HA       ARG  47   7.656   0.423   1.143
  264    HB3  ARG  47           2HB      ARG  47   9.969   0.380   0.057
  265    HG3  ARG  47           2HG      ARG  47   8.719  -1.693  -1.764
  266    HD3  ARG  47           2HD      ARG  47  11.589  -0.703  -1.491
  267    HE   ARG  47           HE       ARG  47  10.428  -2.842  -2.975
  268   HH11  ARG  47          1HH1      ARG  47  12.779  -0.233  -3.441
  269   HH12  ARG  47          2HH1      ARG  47  13.595  -1.086  -4.721
  270   HH21  ARG  47          1HH2      ARG  47  11.488  -3.838  -4.703
  271   HH22  ARG  47          2HH2      ARG  47  12.806  -3.005  -5.495
  272    H    LEU  48           H        LEU  48   6.282  -0.205  -0.809
  273    HA   LEU  48           HA       LEU  48   4.989  -2.844  -0.230
  274    HB3  LEU  48           2HB      LEU  48   3.108  -1.167  -1.491
  275    HG   LEU  48           HG       LEU  48   3.540  -1.626   1.485
  276   HD11  LEU  48          1HD1      LEU  48   1.183  -0.456  -0.047
  277   HD12  LEU  48          2HD1      LEU  48   2.242   0.429   1.072
  278   HD13  LEU  48          3HD1      LEU  48   1.179  -0.850   1.689
  279   HD21  LEU  48          3HD2      LEU  48   1.651  -2.904  -0.572
  280   HD22  LEU  48          1HD2      LEU  48   1.595  -3.203   1.175
  281   HD23  LEU  48          2HD2      LEU  48   3.006  -3.703   0.247
  282    H    THR  49           H        THR  49   4.068  -3.969  -1.865
  283    HA   THR  49           HA       THR  49   4.280  -2.966  -4.632
  284    HB   THR  49           HB       THR  49   4.857  -5.881  -3.991
  285    HG1  THR  49           1HG      THR  49   6.611  -4.717  -3.416
  286   HG21  THR  49          3HG2      THR  49   5.009  -4.223  -6.564
  287   HG22  THR  49          1HG2      THR  49   3.811  -5.494  -6.212
  288   HG23  THR  49          2HG2      THR  49   5.514  -5.914  -6.395
  289    H    VAL  50           H        VAL  50   2.337  -3.085  -5.572
  290    HA   VAL  50           HA       VAL  50   0.190  -4.805  -4.411
  291    HB   VAL  50           HB       VAL  50   0.106  -2.765  -3.141
  292   HG11  VAL  50          1HG1      VAL  50  -0.294  -0.549  -4.057
  293   HG12  VAL  50          2HG1      VAL  50   1.234  -1.180  -4.673
  294   HG13  VAL  50          3HG1      VAL  50  -0.207  -1.164  -5.714
  295   HG21  VAL  50          3HG2      VAL  50  -2.062  -3.774  -3.691
  296   HG22  VAL  50          1HG2      VAL  50  -2.191  -2.011  -3.567
  297   HG23  VAL  50          2HG2      VAL  50  -2.177  -2.785  -5.158
  298    H    THR  51           H        THR  51  -0.995  -5.758  -5.876
  299    HA   THR  51           HA       THR  51  -1.221  -4.673  -8.641
  300    HB   THR  51           HB       THR  51  -2.029  -7.397  -7.540
  301    HG1  THR  51           1HG      THR  51  -0.214  -8.066  -8.751
  302   HG21  THR  51          3HG2      THR  51  -1.747  -6.447 -10.442
  303   HG22  THR  51          1HG2      THR  51  -3.295  -6.635  -9.612
  304   HG23  THR  51          2HG2      THR  51  -2.267  -8.043  -9.889
  305    H    TYR  52           H        TYR  52  -2.971  -3.703  -9.270
  306    HA   TYR  52           HA       TYR  52  -5.589  -4.222  -8.050
  307    HB3  TYR  52           2HB      TYR  52  -4.576  -2.522  -6.584
  308    HD1  TYR  52           2HD      TYR  52  -2.308  -1.630  -7.157
  309    HD2  TYR  52           1HD      TYR  52  -5.895  -0.067  -8.961
  310    HE1  TYR  52           2HE      TYR  52  -1.073   0.418  -7.824
  311    HE2  TYR  52           1HE      TYR  52  -4.668   1.987  -9.618
  312    HH   TYR  52           HH       TYR  52  -1.220   2.539  -8.846
  313    H    ASP  53           H        ASP  53  -7.367  -3.041  -9.170
  314    HA   ASP  53           HA       ASP  53  -6.956  -2.935 -12.079
  315    HB3  ASP  53           2HB      ASP  53  -9.414  -2.892 -10.292
  316    HA   PRO  54           HA       PRO  54  -6.278   1.400 -10.979
  317    HB3  PRO  54           2HB      PRO  54  -4.371   1.197 -12.310
  318    HG3  PRO  54           2HG      PRO  54  -4.455   0.045 -14.426
  319    HD3  PRO  54           2HD      PRO  54  -5.095  -1.478 -12.742
  320    H    LYS  55           H        LYS  55  -8.845   0.229 -12.542
  321    HA   LYS  55           HA       LYS  55  -9.947   2.897 -13.427
  322    HB3  LYS  55           2HB      LYS  55 -11.198   1.768 -15.138
  323    HG3  LYS  55           2HG      LYS  55  -9.579   0.776 -16.644
  324    HD3  LYS  55           2HD      LYS  55  -7.772   2.369 -16.768
  325    HE3  LYS  55           2HE      LYS  55  -8.882   4.563 -16.526
  326    HZ1  LYS  55           3HZ      LYS  55 -10.793   4.097 -17.897
  327    HZ2  LYS  55           1HZ      LYS  55 -10.775   2.516 -17.535
  328    HZ3  LYS  55           2HZ      LYS  55  -9.534   3.159 -18.409
  329    H    GLN  56           H        GLN  56 -10.568  -0.235 -11.870
  330    HA   GLN  56           HA       GLN  56 -13.102   0.715 -10.682
  331    HB3  GLN  56           2HB      GLN  56 -12.864  -1.291  -9.241
  332    HG3  GLN  56           2HG      GLN  56 -12.470  -1.960 -12.194
  333   HE21  GLN  56          1HE2      GLN  56 -11.927  -4.226 -11.800
  334   HE22  GLN  56          2HE2      GLN  56 -13.024  -5.268 -10.888
  335    H    VAL  57           H        VAL  57  -9.609   0.701  -9.663
  336    HA   VAL  57           HA       VAL  57 -10.410   2.645  -7.561
  337    HB   VAL  57           HB       VAL  57  -9.052   1.628  -5.823
  338   HG11  VAL  57          1HG1      VAL  57 -11.443   1.179  -5.819
  339   HG12  VAL  57          2HG1      VAL  57 -11.204  -0.294  -6.787
  340   HG13  VAL  57          3HG1      VAL  57 -10.536  -0.180  -5.146
  341   HG21  VAL  57          3HG2      VAL  57  -7.472   0.287  -7.173
  342   HG22  VAL  57          1HG2      VAL  57  -8.273  -0.715  -5.959
  343   HG23  VAL  57          2HG2      VAL  57  -8.785  -0.808  -7.655
  344    H    SER  58           H        SER  58  -8.375   3.490  -6.405
  345    HA   SER  58           HA       SER  58  -6.041   3.833  -8.214
  346    HB3  SER  58           2HB      SER  58  -7.674   5.602  -8.807
  347    HG   SER  58           HG       SER  58  -8.833   6.095  -7.069
  348    H    GLU  59           H        GLU  59  -4.533   5.573  -6.851
  349    HA   GLU  59           HA       GLU  59  -3.648   4.336  -4.517
  350    HB3  GLU  59           2HB      GLU  59  -2.268   5.992  -5.606
  351    HG3  GLU  59           2HG      GLU  59  -4.448   7.950  -4.888
  352    H    ILE  60           H        ILE  60  -6.421   6.444  -4.766
  353    HA   ILE  60           HA       ILE  60  -6.936   7.299  -2.123
  354    HB   ILE  60           HB       ILE  60  -8.624   6.435  -4.481
  355   HG13  ILE  60          2HG1      ILE  60  -7.333   8.591  -4.487
  356   HG21  ILE  60          1HG2      ILE  60  -9.745   7.291  -1.807
  357   HG22  ILE  60          2HG2      ILE  60 -10.670   7.251  -3.333
  358   HG23  ILE  60          3HG2      ILE  60 -10.023   5.757  -2.694
  359   HD11  ILE  60          3HD1      ILE  60 -10.314   9.175  -4.432
  360   HD12  ILE  60          1HD1      ILE  60  -9.041  10.029  -5.311
  361   HD13  ILE  60          2HD1      ILE  60  -9.484   8.384  -5.794
  362    H    THR  61           H        THR  61  -7.492   4.048  -3.504
  363    HA   THR  61           HA       THR  61  -8.984   3.057  -1.238
  364    HB   THR  61           HB       THR  61  -7.624   1.817  -3.635
  365    HG1  THR  61           1HG      THR  61  -9.600   2.712  -3.958
  366   HG21  THR  61          3HG2      THR  61  -8.934   0.311  -1.337
  367   HG22  THR  61          1HG2      THR  61  -7.303   0.056  -2.010
  368   HG23  THR  61          2HG2      THR  61  -8.725  -0.343  -2.979
  369    H    ILE  62           H        ILE  62  -5.494   3.019  -1.936
  370    HA   ILE  62           HA       ILE  62  -5.043   1.536   0.621
  371    HB   ILE  62           HB       ILE  62  -4.067   0.850  -1.625
  372   HG13  ILE  62          2HG1      ILE  62  -3.473  -0.144   0.487
  373   HG21  ILE  62          1HG2      ILE  62  -2.022   1.857  -2.388
  374   HG22  ILE  62          2HG2      ILE  62  -3.267   3.099  -2.325
  375   HG23  ILE  62          3HG2      ILE  62  -2.032   3.033  -1.049
  376   HD11  ILE  62          3HD1      ILE  62  -0.895   0.321  -1.082
  377   HD12  ILE  62          1HD1      ILE  62  -1.302  -1.054  -0.021
  378   HD13  ILE  62          2HD1      ILE  62  -2.160  -0.824  -1.558
  379    H    GLN  63           H        GLN  63  -4.666   4.733  -0.689
  380    HA   GLN  63           HA       GLN  63  -3.056   6.058   1.179
  381    HB3  GLN  63           2HB      GLN  63  -5.695   6.962  -0.073
  382    HG3  GLN  63           2HG      GLN  63  -3.305   8.703   0.608
  383   HE21  GLN  63          1HE2      GLN  63  -4.056   9.294  -1.881
  384   HE22  GLN  63          2HE2      GLN  63  -5.301  10.522  -1.892
  385    H    GLU  64           H        GLU  64  -6.616   5.541   1.416
  386    HA   GLU  64           HA       GLU  64  -6.742   6.658   4.057
  387    HB3  GLU  64           2HB      GLU  64  -9.113   5.879   3.972
  388    HG3  GLU  64           2HG      GLU  64  -8.230   7.275   1.412
  389    H    ARG  65           H        ARG  65  -5.381   3.795   3.312
  390    HA   ARG  65           HA       ARG  65  -5.904   2.776   6.068
  391    HB3  ARG  65           2HB      ARG  65  -4.249   1.154   4.160
  392    HG3  ARG  65           2HG      ARG  65  -5.344  -0.711   5.222
  393    HD3  ARG  65           2HD      ARG  65  -4.665   1.344   7.362
  394    HE   ARG  65           HE       ARG  65  -4.481  -1.378   8.207
  395   HH11  ARG  65          1HH1      ARG  65  -6.959   1.215   7.906
  396   HH12  ARG  65          2HH1      ARG  65  -7.502   0.936   9.535
  397   HH21  ARG  65          1HH2      ARG  65  -5.600  -1.864  10.155
  398   HH22  ARG  65          2HH2      ARG  65  -7.027  -0.942  10.526
  399    H    ILE  66           H        ILE  66  -3.172   3.410   3.734
  400    HA   ILE  66           HA       ILE  66  -1.197   3.045   5.820
  401    HB   ILE  66           HB       ILE  66  -0.905   4.522   3.183
  402   HG13  ILE  66          2HG1      ILE  66  -1.608   1.960   3.180
  403   HG21  ILE  66          1HG2      ILE  66   0.944   5.079   4.716
  404   HG22  ILE  66          2HG2      ILE  66   1.158   3.360   5.133
  405   HG23  ILE  66          3HG2      ILE  66   1.550   3.953   3.514
  406   HD11  ILE  66          3HD1      ILE  66  -0.104   1.503   1.281
  407   HD12  ILE  66          1HD1      ILE  66  -0.903   3.077   1.160
  408   HD13  ILE  66          2HD1      ILE  66   0.810   2.975   1.634
  409    H    ALA  67           H        ALA  67  -2.735   6.064   4.614
  410    HA   ALA  67           HA       ALA  67  -1.166   7.776   6.338
  411    HB1  ALA  67           1HB      ALA  67  -3.896   8.191   5.027
  412    HB2  ALA  67           2HB      ALA  67  -2.867   9.453   5.722
  413    HB3  ALA  67           3HB      ALA  67  -2.319   8.560   4.292
  414    H    ALA  68           H        ALA  68  -4.067   5.823   6.834
  415    HA   ALA  68           HA       ALA  68  -4.954   7.174   9.255
  416    HB1  ALA  68           1HB      ALA  68  -6.518   6.090   7.675
  417    HB2  ALA  68           2HB      ALA  68  -5.789   4.505   8.026
  418    HB3  ALA  68           3HB      ALA  68  -6.640   5.393   9.301
  419    H    LEU  69           H        LEU  69  -2.887   4.372   8.587
  420    HA   LEU  69           HA       LEU  69  -2.437   3.535  11.342
  421    HB3  LEU  69           2HB      LEU  69  -0.339   2.600  10.359
  422    HG   LEU  69           HG       LEU  69  -2.875   1.995   8.782
  423   HD11  LEU  69          1HD1      LEU  69  -0.829   1.330   7.578
  424   HD12  LEU  69          2HD1      LEU  69  -1.713  -0.088   8.162
  425   HD13  LEU  69          3HD1      LEU  69  -0.260   0.464   9.024
  426   HD21  LEU  69          3HD2      LEU  69  -3.196   1.484  11.158
  427   HD22  LEU  69          1HD2      LEU  69  -1.641   0.622  11.211
  428   HD23  LEU  69          2HD2      LEU  69  -2.993  -0.015  10.252
  429    H    GLY  70           H        GLY  70  -1.851   6.569  10.000
  430    HA2  GLY  70           2HA      GLY  70  -0.802   8.407  10.971
  431    HA3  GLY  70           3HA      GLY  70   0.109   7.337  12.067
  432    H    TYR  71           H        TYR  71   0.549   5.950   9.152
  433    HA   TYR  71           HA       TYR  71   3.216   7.149   8.779
  434    HB3  TYR  71           2HB      TYR  71   3.523   5.152   7.292
  435    HD1  TYR  71           1HD      TYR  71   4.645   5.949   9.869
  436    HD2  TYR  71           2HD      TYR  71   1.882   2.763   8.958
  437    HE1  TYR  71           1HE      TYR  71   5.415   4.727  11.868
  438    HE2  TYR  71           2HE      TYR  71   2.651   1.532  10.971
  439    HH   TYR  71           HH       TYR  71   4.104   1.512  12.752
  440    H    THR  72           H        THR  72   3.742   6.797   6.130
  441    HA   THR  72           HA       THR  72   1.928   8.682   4.706
  442    HB   THR  72           HB       THR  72   4.063   9.966   4.052
  443    HG1  THR  72           1HG      THR  72   5.692   8.789   4.679
  444   HG21  THR  72          3HG2      THR  72   2.471  10.909   5.696
  445   HG22  THR  72          1HG2      THR  72   4.147  11.334   6.059
  446   HG23  THR  72          2HG2      THR  72   3.333  10.080   7.011
  447    H    LEU  73           H        LEU  73   2.411   8.858   2.388
  448    HA   LEU  73           HA       LEU  73   3.773   6.481   1.249
  449    HB3  LEU  73           2HB      LEU  73   1.501   5.727   1.859
  450    HG   LEU  73           HG       LEU  73   0.586   8.023   0.091
  451   HD11  LEU  73          1HD1      LEU  73  -0.873   5.373   0.401
  452   HD12  LEU  73          2HD1      LEU  73  -0.128   5.997  -1.087
  453   HD13  LEU  73          3HD1      LEU  73  -1.505   6.844  -0.382
  454   HD21  LEU  73          3HD2      LEU  73  -0.639   6.727   2.572
  455   HD22  LEU  73          1HD2      LEU  73  -1.269   8.141   1.705
  456   HD23  LEU  73          2HD2      LEU  73   0.272   8.245   2.552
  457    H    ALA  74           H        ALA  74   3.983   6.382  -1.012
  458    HA   ALA  74           HA       ALA  74   3.178   8.624  -2.723
  459    HB1  ALA  74           1HB      ALA  74   5.520   9.086  -3.420
  460    HB2  ALA  74           2HB      ALA  74   5.226   9.516  -1.725
  461    HB3  ALA  74           3HB      ALA  74   6.105   8.021  -2.132
  462    H    GLU  75           H        GLU  75   2.667   7.924  -4.661
  463    HA   GLU  75           HA       GLU  75   4.252   5.812  -6.012
  464    HB3  GLU  75           2HB      GLU  75   1.202   5.930  -6.067
  465    HG3  GLU  75           2HG      GLU  75   1.608   3.406  -6.491
  466    HA   PRO  76           HA       PRO  76   4.084   9.648  -8.366
  467    HB3  PRO  76           2HB      PRO  76   6.375   9.558  -8.259
  468    HG3  PRO  76           2HG      PRO  76   7.561   7.512  -8.555
  469    HD3  PRO  76           2HD      PRO  76   6.030   7.037  -6.844